Mutagenicity download

10 files changed, 346080 insertions, 4 deletions

diff --git a/data/Mutagenicity-Salmonella_typhimurium.csv b/data/Mutagenicity-Salmonella_typhimurium.csv
new file mode 100644
index 0000000..0694a94
--- /dev/null
+++ b/data/Mutagenicity-Salmonella_typhimurium.csv
@@ -0,0 +1,8282 @@
+Canonical SMILES,Mutagenicity
+O=C1c2ccccc2C(=O)c2c1c1[nH]c3c(c1c1c2[nH]c2c1ccc1c2C(=O)c2ccccc2C1=O)ccc1c3C(=O)c2ccccc2C1=O,non-mutagenic
+NNC(=O)CNC(=O)/C=N#N,mutagenic
+N1C(=O)/C(=N#N)/C=NC1=O,mutagenic
+NC(=O)CNC(=O)/C=N#N,mutagenic
+CCCCN(CC(C1=C/C(=N#N)/C(=O)C=C1)O)N=O,mutagenic
+NC(C(=O)O)COC(=O)/C=N#N,mutagenic
+CCN(CC(C1=CC(=O)/C(=N#N)/C=C1)O)N=O,mutagenic
+O=C1OCC2(C(=C1)C(=CC1C2CCC2(C1CCC2(OC(=O)C)C(=O)C)C)Cl)C,non-mutagenic
+Nc1nc(N)nc(n1)N,non-mutagenic
+Cc1ccc(c(c1)[N+](=O)[O-])N=Nc1c(O)ccc2c1cccc2,mutagenic
+CC(CC(=O)Nc1snc2c1cccc2)C,non-mutagenic
+[O-][N+](=O)c1cccc(c1C)C,mutagenic
+CCCCCCC(=O)OC1(C#C)CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12,non-mutagenic
+[O-][N+](=O)CCC,non-mutagenic
+OC(=O)c1cc(cc2c1nccc2)[N+](=O)[O-],mutagenic
+OC1C=Cc2c(C1O)ccc1c2cc2ccccc2c1Br,mutagenic
+NC(=O)Nc1nc2c([nH]1)cccc2,mutagenic
+C[C@H](CCC(=O)c1cocc1)O,non-mutagenic
+Nc1ccc2c(c1)oc1c2cccc1,mutagenic
+Cc1ccc2c(c1)c1cc(C)ccc1cc2,mutagenic
+Cc1cc2c(c3c1nc(cn3)c1ccccc1)nc(n2C)N,mutagenic
+CCN(/C(=N/O)/C=O)N=O,mutagenic
+NNc1nnc(c2c1cccc2)NN,mutagenic
+C=CC(=O)NCNC(=O)C=C,mutagenic
+OCc1cc2cccc3-c4c(-c(c1)c23)cccc4,non-mutagenic
+Cc1ccccc1c1ccccc1,non-mutagenic
+Cc1cc(O)c2c(c1)C(=O)C13C4(C2=O)C(=O)C2C(C1C1C(C3C(=O)C34C(=O)c4c(O)cc(cc4C(=O)C213)C)C)C,non-mutagenic
+Cc1nc(N)nc(n1)N,non-mutagenic
+CCNc1nc(N)nc(n1)Cl,non-mutagenic
+C1CCC(CC1)N1C2C1c1ccccc1-c1c2cccc1,mutagenic
+CCCCB(CCCC)CCCC,mutagenic
+CC(=O)NC(C(=O)O)CSC(=C(Cl)Cl)Cl,mutagenic
+C[C@H]1CC[C@@H]2[C@@H](C1)[C@@H](CC[C@@H]2C)C(C)C,mutagenic
+CCNN=NCC,mutagenic
+Oc1cccc(c1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc2-c3c4c(-c2c1)cccc4ccc3,mutagenic
+OCc1ccco1,non-mutagenic
+c1ccc(cc1)c1ccc(cc1)CC[C@@H]1OC1,mutagenic
+Oc1cc2c(c3c1cccc3)ccc1c2cccc1,mutagenic
+Oc1ccc2c(c1N=Nc1ccccc1)cccc2,mutagenic
+N[C@@H]1CC[C@H](CC1)C[C@@H]1CC[C@H](CC1)N,non-mutagenic
+COC(=O)C12CC2(C=O)C(=CC2C1CC(C2)(C)C)C=O,mutagenic
+CCOC(=O)C(Br)C,mutagenic
+COC1(CCCC1)OC1CCC2C1(C)CCC1C2CCC2C1(C)CC1SC1C2,non-mutagenic
+ClCCN(CCCNc1c2CCCCc2nc2c1cccc2)CC,mutagenic
+OCCC1(O)NC(=O)C2(C1O2)C(=O)/C(=C/C=C/C(=C/C(=C/C1=CCOC1=O)/C)/C)/C,mutagenic
+CC[P@](=S)(Sc1ccccc1)OCC,non-mutagenic
+Nc1ccc(c(c1)N)[N+](=O)[O-],mutagenic
+CCSCCSP(=O)(OC)OC,non-mutagenic
+OC(=O)c1ccccc1C,non-mutagenic
+CC(=CC1C(C1(C)C)C(=O)OCc1cccc(c1)Oc1ccccc1)C,mutagenic
+Brc1ccccc1,non-mutagenic
+Cc1cc(N)c(cc1Cl)S(=O)(=O)O,non-mutagenic
+Oc1ccc2c(c1)ccc(c2)SSc1ccc2c(c1)ccc(c2)O,non-mutagenic
+CN(CCNC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C,mutagenic
+Clc1cc(Cl)c2c(c1)c(N)sn2,mutagenic
+ClCC1(C(Cl)Cl)C2CC(C1(CC2(Cl)Cl)C(Cl)Cl)(Cl)Cl,non-mutagenic
+Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1c1c(O)cc(c2c1C(=O)c1cc(C)cc(c1C2=O)O)O)O,non-mutagenic
+COCCl,non-mutagenic
+O=NN1CCOCC1,mutagenic
+Nc1ccc(cc1)Oc1cccc(c1)Oc1ccc(cc1)N,mutagenic
+Nc1ccc(cc1)Nc1ccccc1,non-mutagenic
+CCCCCOC(=O)C(=C)C,non-mutagenic
+OC(=O)c1ccccc1,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)Cn1cnc2c1ncnc2N,mutagenic
+c1cc2Cc3c4c2c(c1)ccc4ccc3,mutagenic
+Fc1ccccc1c1ccccc1,non-mutagenic
+Clc1ccc(cc1Cl)c1ccc(c(c1Cl)Cl)Cl,non-mutagenic
+CC(=CCc1ccc(c2c1oc1cc3OC4C(c3c(c1c2=O)O)(O)C=CO4)O)C,mutagenic
+CC1COCc2c1cc1c(c2)C(C(C1(C)C)C)(C)C,non-mutagenic
+OC(=O)CSc1nc(cc(n1)Cl)Nc1cccc(c1C)C,non-mutagenic
+Nc1ccc2c(c1N=Nc1ccc(cc1)[N+](=O)[O-])cccc2,mutagenic
+OCC(=O)C1(O)CC(OC2CC(N)C(C(O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC,mutagenic
+Oc1ccc(cc1)Cc1ccccc1O,non-mutagenic
+CC(OC)CCO,non-mutagenic
+CC(=O)N(c1ccc(cc1)Oc1ccccc1)O,mutagenic
+OP(Oc1ccc(cc1)C(c1ccc(cc1)OP(O)O)(C)C)O,non-mutagenic
+CCCCCCCC(=O)Cl,mutagenic
+BrC(C(C)(C)C)C(=O)Nc1ccccc1,non-mutagenic
+CCN(CCNc1ccc2c3c1c(=O)c1cc(O)ccc1n3c(n2)C)CC,mutagenic
+[O-][N+](=O)c1cnc(s1)NC(=O)NCC,mutagenic
+COc1ccc(c2c1oc1c3c(O[C@H]4[C@H]3C=CO4)cc(c1c2=O)OC)O,mutagenic
+Clc1cc2Oc3cc([N+](=O)[O-])c(cc3Oc2cc1Cl)Cl,mutagenic
+COC(=O)C(=C)C,non-mutagenic
+Oc1ccc2-c3ccc(c4c3[C@@]([C@H]3c2c1C(=O)[C@@H]1O[C@H]31)(O)C=CC4=O)O,mutagenic
+COC(=O)N,non-mutagenic
+NNc1n[nH]c(c2-c1c1ccccc1n2)n1nc(cc1C)C,non-mutagenic
+Fc1cnc2c(c1)c1ncccc1cc2,mutagenic
+O=C(NC(c1nc2c(s1)cccc2)S)NC(c1nc2c(s1)cccc2)S,mutagenic
+BrCc1c2ccccc2c(c2c1cccc2)C,mutagenic
+Nc1cccc2c1nc1CCCCc1c2,mutagenic
+COC(=O)C=C,non-mutagenic
+CC(=O)Nc1c(O)cc2-c3c(-c4c2c1ccc4)cccc3,mutagenic
+OC1C=Cc2c(C1)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+Oc1ccc2-c3c4c(-c2c1)ccc(c4ccc3)[N+](=O)[O-],mutagenic
+OC1C=Cc2c(C1O)c([N+](=O)[O-])c1c(c2)cccc1,non-mutagenic
+Cc1ccc(c(c1)S(=O)(=O)O)N=Nc1c(O)c(cc2c1cccc2)C(=O)O,non-mutagenic
+CN=C1C=CC(=C(c2ccc(cc2)N(C)C)c2ccc(cc2)N(C)C)C=C1,non-mutagenic
+CCCCN(COC(=O)C)N=O,mutagenic
+C1CCC2=C(C1)c1c3ccccc3cc3c1c2cc1c3cccc1,mutagenic
+ClCCN(P(=O)(OCCC(=O)O)N)CCCl,mutagenic
+Clc1cc(Cc2cc(O)c(c(c2)Cl)N)cc(c1N)OS(=O)(=O)O,non-mutagenic
+C1COCCS1,non-mutagenic
+Cc1ccccc1N,mutagenic
+O=C1c2ccccc2-c2c1cccc2,non-mutagenic
+C1CCCC2C(CC1)O2,non-mutagenic
+C1=Cc2c(CC1)c1cc3c(nc1cc2)ccc1c3cccc1,mutagenic
+N#N=Nc1ccc2c(c1)c(Nc1ccc(cc1)NS(=O)(=O)C)c1c(n2)cc(cc1)N=N#N,non-mutagenic
+CN(CCN(c1ccccn1)Cc1ccccc1)C,non-mutagenic
+C/C=C(/C1=CC(=O)C23C(C1=O)(O)OC(C3C2)(C)C)\Cl,mutagenic
+OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)N(Cc1cnc2c(n1)c(N)nc(n2)N)C,non-mutagenic
+CCNc1ccccc1,non-mutagenic
+Nc1ccccc1SCCSc1ccccc1N,mutagenic
+ONC(=O)c1ccccc1O,mutagenic
+[O-][N+](=O)c1cccc(c1N)O,non-mutagenic
+Nc1ccc(cc1)/C=C/c1ccc(cc1)C(C)(C)C,non-mutagenic
+OC(=O)[C@H]([C@H](C(=O)O)CC(=O)O)CC(=O)O,mutagenic
+c1cc2cccc3c2c(c1)CC3,non-mutagenic
+OCCN(c1ccc(c2c1nc1ccccc1c2NCCCN(C)C)[N+](=O)[O-])CCO,mutagenic
+CCCCOc1ccc(cc1)N=O,mutagenic
+Nc1cc(Cl)c(cc1S(=O)(=O)O)C,mutagenic
+COC(=O)C1=CCCN(C1)C,mutagenic
+CNC(=O)ON,mutagenic
+OC(=O)C=C,non-mutagenic
+OC(=O)CC(=O)O,non-mutagenic
+CCCCC=O,non-mutagenic
+O=Nc1ccccc1c1ccccc1,mutagenic
+Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(n1)O)C,non-mutagenic
+SCC(C(=O)O)NC(=O)C(SC)(C)C,non-mutagenic
+C[n+]1ccc(cc1)c1cc[n+](cc1)C,non-mutagenic
+N#N=NCC(C(C(C(C=O)O)O)O)O,mutagenic
+CCCCCNc1snc2c1cccc2,non-mutagenic
+CCCCCCCCCCCC(=O)OOC(=O)CCCCCCCCCCC,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)S(=O)(=O)O)C,non-mutagenic
+[O-][N+](=O)c1cccc(c1)S(=O)(=O)O,non-mutagenic
+COc1ccc(c(c1)C(C)(C)C)O,non-mutagenic
+ClCN1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-],mutagenic
+CC1CC(C)(C)c2c(C1(C)C)cc(c(c2)C(=O)C)C,non-mutagenic
+OCc1cc2ccc3c4c2c(c1)ccc4ccc3,mutagenic
+CCCCON(C(=O)c1ccc(cc1)c1ccccc1)OC(=O)C,mutagenic
+C#C[C@]1(O)CC[C@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=C1CCC(=O)C2,non-mutagenic
+N#Cc1ccccc1C#N,non-mutagenic
+CC(=O)Nc1cc(ccc1C)N=[N+](c1ccc(c(c1)NC(=O)C)C)[O-],non-mutagenic
+CC(OC(=O)C1=C(C)N=C(C(=C(OC2CN(C2)C(c2ccccc2)c2ccccc2)O)C1c1cccc(c1)[N+](=O)[O-])N)C,non-mutagenic
+C1CN=C(N1)c1ccc(cc1)c1[nH]c2c(c1)ccc(c2)C1=NCCN1,non-mutagenic
+CC1CN(C)C2C(C1)c1cccc3c1c(C2)c[nH]3,mutagenic
+CCCCCCOC(=O)C=C,non-mutagenic
+CN(N=Nc1ccc(cc1)C(=O)O)C,non-mutagenic
+ClC(c1ccccc1)(Cl)Cl,mutagenic
+CCCCCCCCCCCCCCCCCCNC(=O)CCCCCCCCCCC/C=C/CCCCCCCC,non-mutagenic
+O=c1ccc2c(o1)c(OCC1OC1(C)C)c1c(c2)cco1,non-mutagenic
+CCC([N+](=O)[O-])CC,non-mutagenic
+CCCC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)CCC,mutagenic
+N#Cc1ccc(cc1)C,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1c1ccccc1c1c3c(cc2)ccc1[N+](=O)[O-],non-mutagenic
+COc1nsc2c1ccc(c2)OCC1CO1,mutagenic
+Oc1c(Br)cc2c(c1Br)oc1c(c2=O)c(C(=O)O)c(c(c1Cl)Cl)Cl,non-mutagenic
+[O-][N+](=O)NC(=N)N(N=O)CCCC,mutagenic
+CCCON=O,mutagenic
+CN(S(=O)(=O)N(c1ccccc1)SC(Cl)(Cl)F)C,non-mutagenic
+OC1C2OC2C2=C(C1O)C=CC1C2c2cccc3c2c1ccc3,mutagenic
+O=C1OC(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl,non-mutagenic
+c1ccc2c(c1)ccc1c2c2CCCc2cc1,mutagenic
+NCCC#N,non-mutagenic
+Clc1cccc2c1c1ccccc1o2,non-mutagenic
+C[C@@H]1C=Cc2c1ccc1c2ccc2c1cccc2,mutagenic
+CCCCC,non-mutagenic
+Cc1cccc(c1)O,non-mutagenic
+CCCC(=O)OCc1ccccc1[N+](=O)[O-],non-mutagenic
+BrCc1ccccc1,mutagenic
+N#N=NCCC(C(=O)O)N,mutagenic
+ClCCN(c1c(OC)ccc2c1cc(o2)[N+](=O)[O-])CCCl,mutagenic
+CC(CCOC(=O)/C=C\c1ccccc1)C,non-mutagenic
+Clc1ccccc1C(F)(F)F,non-mutagenic
+NNS(=O)(=O)c1ccc(cc1)C,mutagenic
+FC(C(F)(F)F)F,non-mutagenic
+Cc1ccccc1S(=O)(=O)N,non-mutagenic
+Sc1ncc(c(n1)O)C,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])Cl,mutagenic
+c1cc2ccc3c4c2c(c1)ccc4cnc3,mutagenic
+ClC(=C1C(=O)NC(=O)C1(Cl)Cl)Cl,mutagenic
+c1ccc2c(c1)cc1c(c2)c2ncccc2cc1,mutagenic
+CC(N(C(=O)SCC(=C(Cl)Cl)Cl)C(C)C)C,mutagenic
+Cc1ccc(c(c1)C)N,mutagenic
+CN(N=O)C[C@@H](CO)O,mutagenic
+OC(c1cc(Cl)c(c(c1)C(F)(F)F)N)CNC(C)(C)C,non-mutagenic
+ClC1=C(Cl)C(=O)C(=C(C1=O)Cl)Cl,mutagenic
+C=CC(=O)OCC(COC(=O)C=C)(COC(=O)C=C)CC,mutagenic
+OC(=O)C1(C)CCCC2(C1CCC13C2CCC(C3)(C2(C1)OC2)O)C,non-mutagenic
+O[C@H]1C=Cc2c([C@@H]1O)ccc1-c3c4c(-c21)cccc4ccc3,mutagenic
+Cc1ccc2c(c1)C(C)C1C(=Nc3c1cccc3)N2C,mutagenic
+OC(=O)/C=C/c1ccc(cc1)Cl,non-mutagenic
+CCc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+NC(=O)CCCCC(=O)N,non-mutagenic
+[O-][N+](=O)c1cccc2c1ccc1c2c(ccc1)[N+](=O)[O-],mutagenic
+CCCCOC(=O)c1ccccc1C(=O)OCCCC,non-mutagenic
+OC(=O)C1NCc2c(C1)c1ccccc1[nH]2,non-mutagenic
+NCC(=O)NCC(=O)NC(C(=O)NC(C(=O)O)CC(C)C)Cc1ccccc1,non-mutagenic
+NC(C(=O)O)CS/C(=C(/C(Cl)(Cl)Cl)\Cl)/Cl,mutagenic
+O=C(c1ccc(cc1)[N+](=O)[O-])ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+COc1cccc(c1)N,mutagenic
+CCCNC(=O)/C=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+O=P1(OCc2c(O1)cccc2)Oc1ccccc1,mutagenic
+Cc1cc(ccc1N=Nc1c(O)c2c(O)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O)c1ccc(c(c1)C)N=Nc1c(O)c2c(O)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+O=Nc1ccc(cc1)N(C)C,mutagenic
+CN(N=Nc1ccc(cc1)Br)C,mutagenic
+CC(=C)C(=O)OC(C)(C)C,non-mutagenic
+CCc1ccccc1,non-mutagenic
+OCC1OC(C(C1O)O)n1c(O)nc2c1nc(N)nc2O,non-mutagenic
+Nc1ccc2-c3c(-c4c2c1ccc4)cccc3,mutagenic
+CNCc1ccc(o1)CSCCN=C(NS(=O)(=O)C)NC[C@@H](c1ccc(cc1)O)O,non-mutagenic
+N#Cc1cc(ccc1N)[N+](=O)[O-],mutagenic
+Nc1c(C)cccc1N,mutagenic
+CCOC(=O)C[C@@H](C(=O)OCC)SP(=S)(OC)OC,non-mutagenic
+Nc1cccc2c1nccc2,mutagenic
+Cc1ccc(c(c1)C)NC(=O)C(C(=O)C)N=Nc1ccc(cc1Cl)c1ccc(c(c1)Cl)N=NC(C(=O)Nc1ccc(cc1C)C)C(=O)C,non-mutagenic
+N#CCCNCCC#N,non-mutagenic
+O=CC(C)C,non-mutagenic
+Nc1sc2c(n1)cc(c(c2)Cl)Cl,non-mutagenic
+COc1ccc(cc1)C=C,non-mutagenic
+CCC(=O)OC1(C(C)CC2C1(C)CC(O)C1C2C(Cl)CC2=CC(=O)C=CC12C)C(=O)COC(=O)CC,non-mutagenic
+Clc1ccnc2c1cccc2,mutagenic
+COC1=CC(=O)c2c(C1=O)[nH]cc1-c2nc2c1cncc2,mutagenic
+ClCC1=C(Br)C(=O)OC1,mutagenic
+CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2,non-mutagenic
+COc1cc2Oc3c4c(CCN([C@H]4Cc4ccc(c(c4)Oc4ccc(C[C@H]5c2c(c1)CCN5C)cc4)OC)C)cc(c3OC)OC,mutagenic
+CN1CCN(CC1)c1ccc2c(c1)nc([nH]2)c1ccc2c(c1)nc([nH]2)c1ccc(cc1)O,non-mutagenic
+O=C1C(=O)C=C(c2c1cccc2)S(=O)(=O)O,mutagenic
+O=C(NS(=O)(=O)c1ccc(cc1)C)Nc1ncc(s1)[N+](=O)[O-],non-mutagenic
+NC(=N)S(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1C)cccc2,mutagenic
+CC(=O)ON(C(=O)c1ccccc1)OCc1ccc(cc1)Br,mutagenic
+CP1(C)NP(C)(C)NP(N1)(C)C,non-mutagenic
+C=CCOC(=O)COCCC(C)C,non-mutagenic
+Cl[C@@H]1[C@H](Cl)[C@H](Cl)[C@H]([C@H]([C@H]1Cl)Cl)Cl,non-mutagenic
+OC1C(O)C2OC2c2c1ccc1c2nc2c(c1)ccc1c2cccc1,mutagenic
+Oc1ccc2c(c1)CC[C@@H]1[C@H]2CC[C@]2([C@@H]1CC[C@@H]2O)C,non-mutagenic
+CC(Nc1nc(NC(C)C)nc(n1)Cl)C,non-mutagenic
+CNC(=O)CSP(=S)(OC)OC,mutagenic
+OCc1ccc(c2c1sc1ccccc1c2=O)NCC[N+](CC)(CC)[O-],mutagenic
+COc1cc2C(=O)CCc2c2c1c1ccccc1cc2C,mutagenic
+CCOc1ccccc1C(=O)N,non-mutagenic
+OS(=O)(=O)c1ccc2c(c1)ccc(c2)Oc1ccc2c(c1)ccc(c2)S(=O)(=O)O,non-mutagenic
+Clc1ccc(cc1)S(=O)C,non-mutagenic
+CCCCCCCC/C=C\CCCCCCCCN,mutagenic
+NCCCNCCCN,non-mutagenic
+NCCNCCO,mutagenic
+COC(=O)[C@@]12O[C@@]2(C)[C@](NC1=O)(O)C(C)C,mutagenic
+CCOS(=O)(=O)OCC,mutagenic
+COc1cc2Cc3cc(C)cc(c3C(=O)c2c(c1)O)O,mutagenic
+C#C[C@@]1(O)CC[C@@H]2[C@]1(CC)CC[C@H]1[C@H]2CCC2=CC(=O)CC[C@H]12,non-mutagenic
+Cc1ccc(cc1)OC[C@@H]1OC1,mutagenic
+[O-][N+](=O)c1cc2ccccc2c2c1cc(cc2)[N+](=O)[O-],mutagenic
+O=C1C=C(C)C(=O)c2c1cccc2,mutagenic
+CCCCCCCCc1ccc(cc1)Nc1ccc(cc1)CCCCCCCC,non-mutagenic
+Clc1ccc(c(c1)[N+](=O)[O-])C,non-mutagenic
+O=C(c1ccc2c(c1)OCO2)[C@@H]1CO1,mutagenic
+CCCC(=O)OC1CCCCC1,non-mutagenic
+CC1Cc2c(C1=O)c1C(=C)CCC3C(c1c(c2O)C)C3(C)C,non-mutagenic
+COC(=O)C1c2cc3c(c(c2C(CC1(O)CC)OC1OC(C)C(C(C1)N(C)C)OC1CC(O)C(C(O1)C)O)O)C(=O)c1c(C3=O)c(O)ccc1O,mutagenic
+CCCCCCCCC=O,non-mutagenic
+OC(=O)C(CCS(=O)(=N)C)N,non-mutagenic
+CSCNc1ccccc1OC,mutagenic
+O=Cc1cccc(c1)Cl,non-mutagenic
+CCC1=C(c2ccc(cc2)O)C(c2c1ccc(c2)O)C,non-mutagenic
+CCCCCCCCn1sccc1=O,non-mutagenic
+CC(CCCC1(C)CCc2c(O1)c(C)c(c(c2C)OC(=O)C)C)CCCC(CCCC(C)C)C,non-mutagenic
+OC[C@H]1O[C@@H](Oc2cc(O)c(c(c2)O)C(=O)CCc2ccc(c(c2)O)OC)[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O,non-mutagenic
+c1ccc2c(c1)cnnc2,non-mutagenic
+OS(=O)(=O)OCc1c2ccccc2c2c3c1ccc1c3c(cc2)ccc1,mutagenic
+O=CC(=O)c1ccccc1,mutagenic
+[O-][N+](=O)c1cc(ccc1O)c1ccc(c(c1)[N+](=O)[O-])O,non-mutagenic
+O=C(c1ccccc1)OCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+N#C/C(=C\c1ccccc1Br)/C(=O)OC,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)oc1c2cc(cc1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1cc(N=[N+](c2cc(cc(c2C)[N+](=O)[O-])[N+](=O)[O-])[O-])c(c(c1)[N+](=O)[O-])C,mutagenic
+C1NCCS1,mutagenic
+OCCc1cn(c2c1cccc2)N=O,mutagenic
+O=NN(Cc1cccc(c1)C)C,mutagenic
+OCC(CO)(C)C,non-mutagenic
+O=c1n(Cl)c(=O)[nH]c(=O)n1Cl,non-mutagenic
+N#C/C(=C\c1ccco1)/C(=O)OC,non-mutagenic
+COc1cc(c(c(c1)c1cc(OC)cc(c1O)C(C)(C)C)O)C(C)(C)C,non-mutagenic
+OC(=O)c1ccc(cc1)N,non-mutagenic
+COC(=O)Nc1cccc(c1)OC(=O)Nc1cccc(c1)C,mutagenic
+OC(=O)/C=C/c1ccccc1,non-mutagenic
+N#Cc1cccc(c1)[N+](=O)[O-],mutagenic
+COc1c(OC)cc2c3c1c1cc4OCOc4cc1cc3N(CC2)C,non-mutagenic
+N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)C(c1ccc(cc1)Cl)C(C)C,non-mutagenic
+CCN(c1ccc(cc1)[N+](=O)[O-])CC,mutagenic
+CCCCON(C(=O)c1ccc(cc1)C(C)(C)C)OC(=O)C,mutagenic
+C/C(=C\C)/CCl,mutagenic
+COc1cc(ccc1O)CC1CO1,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2cc2ccccc2c1C,mutagenic
+COCCO,non-mutagenic
+Fc1cc2ccccc2c2c1cccn2,mutagenic
+Cc1ccc2c3c1CCc3c1c(c2)c2ccccc2cc1,mutagenic
+N#Cc1ccc(cc1)C1(C)OC1,mutagenic
+OCCNc1ccc(c(c1)O)C,non-mutagenic
+O1Cc2c(C1)cccc2,mutagenic
+N#C/C(=C\C=C\c1ccccc1)/c1ccc(cc1)F,mutagenic
+COc1ccn(c(=O)n1)CC(CN=N#N)O,mutagenic
+S=C=Nc1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-],mutagenic
+CC(C(C)C)C,non-mutagenic
+c1ccc2c(c1)nc1c(c2)c2ccccc2c2c1cccc2,mutagenic
+OC[C@H]1O[C@H](C[C@@H]1O)n1cc(c(=O)[nH]c1=O)C(F)(F)F,mutagenic
+CNc1ccccc1,non-mutagenic
+O=C(C(=O)O)C(=O)O,non-mutagenic
+c1ccc2c(c1)c1ccc3c4c1c(c2)Cc4ccc3,mutagenic
+CC(=O)Oc1ccc2c(c1)OC1(C2(C)OO1)C,mutagenic
+CCOc1ccc(cc1[N+](=O)[O-])NC(=O)C,mutagenic
+C/C=C/1\C[C@H]2C[C@@H]1C=C2,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)c2c(c1)C=CCC2,mutagenic
+Nc1ncnc2c1nc(n2c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-],mutagenic
+ON=C1CCCCC1,mutagenic
+COC1=CC(=O)c2c(C1=O)[nH]cc1-c2nc2c1cccc2,mutagenic
+NC(=N)NNc1ccc(cc1)N=NC(=S)N,mutagenic
+CCc1c2ccc3c(c2cc2c1cccc2)cccc3,mutagenic
+Cc1cnc2c(n1)ccc1c2nc(n1C)N,mutagenic
+BrC(=C)C=O,mutagenic
+[O-][N+](=O)c1ccnc2c1cccc2,mutagenic
+Nc1nc2c(n1C)cc1c(n2)nccc1,non-mutagenic
+OC1C=CC2C34C1Oc1c4c(CC2N(CC3)C)ccc1O,non-mutagenic
+Oc1ccc2c(c1)c1c(cc2)[nH]c2c1c1ccccc1cc2,mutagenic
+CCCCCCCCCCO,non-mutagenic
+[O-][N+](=O)c1cc(ccc1c1ccccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Cc1cccc(c1)C(=O)Cl,mutagenic
+ClCCc1cn(C2CC(C(O2)CO)O)c(=O)[nH]c1=O,mutagenic
+Nc1cccc2c1snc2,mutagenic
+COc1c2ccccc2[n+](c2c1cco2)[O-],non-mutagenic
+COc1cc2O[C@H]3[C@H](c2c2c1c(=O)c1c(o2)cccc1O)C=CO3,mutagenic
+CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(C)C,non-mutagenic
+OCC1OC(OC2C(O)CC3(C(C2(C)C(=O)O)CCC2(C3CC=C3C2(C)CCC2(C3CC(C)(C)CC2)C(=O)O)C)C)C(C(C1O)O)O,non-mutagenic
+O=C(Nc1ccc(cc1)Cl)CCC(=O)O,non-mutagenic
+OC(c1ccc(cc1)CCc1ccccc1)Cn1cncc1,non-mutagenic
+CCCCOP(=O)(OCCCC)OCCCC,non-mutagenic
+COC(=O)/C(=C/c1ccc(o1)Br)/C#N,non-mutagenic
+OCC(C(C(=O)NCCC(=O)O)O)(C)C,non-mutagenic
+ClCc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)cc1c3c2ccc2c3c(cc1)c(cc2)[N+](=O)[O-],mutagenic
+c1ccc2c(c1)nccn2,mutagenic
+N#CC1=Cc2c3c1cccc3ccc2,mutagenic
+CN1CCc2c3C1Cc1ccccc1-c3c1c(c2)OCO1,mutagenic
+C=C1CCC2CC1C2(C)C,non-mutagenic
+NC(=N)NS(=O)(=O)c1ccc(cc1)N,non-mutagenic
+CN(c1ccc(cc1)N=Nc1ccc(cc1)N(C)C)C,non-mutagenic
+CC(CCCC(C1CCC2C1(C)CCC1C2CC2C3(C1(C)CCC(C3)O)O2)C)C,mutagenic
+Nc1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])c1ccccc1,mutagenic
+OCCBr,mutagenic
+OOC1C=C2CC(O)CCC2(C2C1C1CCC(C1(C)CC2)C(CCCC(C)C)C)C,mutagenic
+CN(c1ccc(nn1)NN)C[C@H](O)C,mutagenic
+Oc1ccc(cc1)c1ccccc1,mutagenic
+CC(=O)/C=C\C1=C(C)CCCC1(C)C,non-mutagenic
+COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)[C@@H](O[C@@H]1O[C@@H](C)[C@@H]([C@H](C1)N(C)C)O)C[C@](C2)(O)C(=O)C,mutagenic
+COc1cc(ccc1N)[N+](=O)[O-],mutagenic
+C/C=C\1/C[C@H](C)[C@](O)(CO)C(=O)OCC2=CC[N@@+]3([C@H]2[C@H](OC1=O)CC3)[O-],non-mutagenic
+COC1(NC(=O)CSCC(C(=O)O)N)C(=O)N2C1SCC(=C2C(=O)O)CSc1nnnn1C,non-mutagenic
+O/N=C/C1N(CCCN(C)C)C=CN1C,non-mutagenic
+CC12OOC2(C)c2c(O1)ccc1c2cccc1,non-mutagenic
+CN(CCNC(=O)c1cccc2c1oc(n2)c1ccccc1)C,non-mutagenic
+OCCCCl,mutagenic
+OC(=O)COc1ccc(c(c1Cl)Cl)C(=O)c1cccs1,non-mutagenic
+CC(=O)OC[C@@H](CO)O,mutagenic
+COCC(=O)O,non-mutagenic
+O=Nc1c(O)ccc2c1cccc2,non-mutagenic
+Cc1c(N)cccc1N=Nc1cccc(c1C)N,mutagenic
+[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])O,non-mutagenic
+Clc1ccc(cc1)C(Cl)(Cl)Cl,mutagenic
+CC(=O)c1ccc([nH]1)[N+](=O)[O-],mutagenic
+Nc1ncnc2c1cnn2CC(CN=N#N)O,mutagenic
+NC(=O)c1cnccn1,non-mutagenic
+OC1C2OC2c2c(C1O)ccc1c2cccc1,mutagenic
+C=CC(=O)OCCOCCOCCOCCOC(=O)C=C,non-mutagenic
+O=C1CCC(=O)N1c1cc(Cl)c(c(c1)Cl)Cl,non-mutagenic
+CSc1cc(SC)c(c(c1N)C)N,mutagenic
+CCN(c1ccccc1)N,mutagenic
+CCOCCOCCOCC,non-mutagenic
+COP(=S)(Oc1ccccc1C(=O)OC(C)C)NC(C)C,non-mutagenic
+CC(OOC(C)(C)C)(C)C,non-mutagenic
+CC(=O)Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)NC(=O)C,non-mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)ccc1c2cc(N)c2c1cccc2,mutagenic
+N/C(=N\OS(=O)(=O)O)/c1ccccc1,non-mutagenic
+ClCc1cc2cccc3c2c2c1cc1ccccc1c2cc3,mutagenic
+O[C@H]1CC(=C[C@H]([C@@H]1O)O)C(=O)O,non-mutagenic
+Cc1ccc2-c3c(C(c2c1)C)cc(cc3)C,non-mutagenic
+CC(=O)OC1Cc2c3c1cc1cccc4c1c3c(cc2)cc4,mutagenic
+CC(=O)Nc1ccc(cc1)N=Nc1cc(C)ccc1O,mutagenic
+CNC(=O)ONC(=O)NC,mutagenic
+O=S1(=O)CCCO1,mutagenic
+Nc1nc2c(n1C)ccc1c2cncc1,mutagenic
+ClC(C1=C(Cl)C(=O)OC1O)Br,mutagenic
+Cc1ccc(cc1)CN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+Nc1ccc(cc1)Sc1ccccc1,mutagenic
+CC(=O)N(c1ccc2c(c1)cccc2)O,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C/C(=O)NC,mutagenic
+[O-][N+](=O)c1c2ccccc2c2c3c1ccc1c3c(cc2)ccc1[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc2c(c1)oc1c2cccc1,mutagenic
+CCCCCC(=O)N,non-mutagenic
+Cc1c(NC)ccc2c1nccn2,mutagenic
+O=C(c1ccccc1)/C=C/c1ccc(cc1)c1ccccc1,non-mutagenic
+Clc1cnc2c(c1C)cccc2,non-mutagenic
+O=C(C(F)(F)F)Nc1scc(n1)c1ccc(o1)[N+](=O)[O-],mutagenic
+CS(=O)(=O)OCCCCOS(=O)(=O)C,mutagenic
+O=C(NC(C)(C)C)/C=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+CCOC[C@H]1CO1,mutagenic
+c1cc2ccc3c4c2c(c1)ccc4cc1c3C=C[C@@H]2[C@H]1O2,mutagenic
+Clc1ccc(cc1)S(=O)(=O)c1ccc(cc1)Cl,non-mutagenic
+COP(=O)(OC)OC,mutagenic
+OC1Cc2c3c1c(C)ccc3cc1c2ccc2c1cccc2,non-mutagenic
+ClC(C(=O)Nc1snc2c1cc(C)cc2)Cl,mutagenic
+ClCc1cccc(c1)CCl,non-mutagenic
+O=C(Nc1snc2c1cccc2)Nc1ccccc1,non-mutagenic
+CCC(c1cc(n2nc3c(n2)cccc3)c(c(c1)C(CC)(C)C)O)(C)C,non-mutagenic
+O1CCOCCOC2CCCCC2OCCOCCOCCOCCOC2C(OCCOCC1)CCCC2,non-mutagenic
+C/C=C/c1cc(OC)ccc1OC,non-mutagenic
+OC(=O)c1cc(N=Nc2ccc(cc2)S(=O)(=O)Nc2ccccn2)ccc1O,non-mutagenic
+n1ccc2c(c1)cnnc2,non-mutagenic
+CC/C=C/C,non-mutagenic
+Oc1ccc2c3c1ccc1c3c(cc2)cc2c1cccc2,mutagenic
+O=C(C(=C)C)OCCCCCCOC(=O)C(=C)C,non-mutagenic
+CC(=O)c1ccc2c(c1)cccc2,non-mutagenic
+ClCC(=O)c1ccccc1,non-mutagenic
+[O-][N+](=O)c1cccc2-c3c4c(-c12)cccc4c(cc3)[N+](=O)[O-],mutagenic
+O=C/C(=C(\C(=O)O)/Cl)/C(Cl)Cl,mutagenic
+Nc1cccc2c1c(O)nnc2O,non-mutagenic
+CCC(=O)Nc1snc2c1cc(C)cc2,non-mutagenic
+OCC1OC(C(C1O)O)n1cc(O)c(nc1=O)N,non-mutagenic
+Nc1ccc(c(c1)S(=O)(=O)O)/C=C\c1ccc(cc1S(=O)(=O)O)N,non-mutagenic
+COc1ccc(cc1)C(=C(c1ccc(cc1)OC)Cl)c1ccc(cc1)OC,non-mutagenic
+O=NN(C(=O)Oc1ccccc1OC(C)C)C,mutagenic
+Oc1ccc2c3c1-c1ccccc1-c3ccc2[N+](=O)[O-],mutagenic
+CC1=CC[C@H]2[C@H](C1)[C@@H](CC=C2C)C(C)C,non-mutagenic
+O=NN(c1ccccc1)C,mutagenic
+CN(CCNC(=O)c1cccc2c1nc(o2)c1ccccc1)C,non-mutagenic
+CCCC[C@H](COC(=O)c1ccc(c(c1)[N+](=O)[O-])N(C)C)CC,mutagenic
+O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(cc1)Cl,non-mutagenic
+ClCCNC(=O)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N,mutagenic
+c1cc2ccc3c4c2c(c1)ccc4cc1c3occ1,mutagenic
+Nc1ccc(cc1)c1ccc(cc1)c1ccc(cc1)N,mutagenic
+COc1cc(ccc1O)c1oc2cc(O)cc(c2c(=O)c1O)O,non-mutagenic
+C[Si](O[Si](C)(C)C)(C)C,non-mutagenic
+CCCCCCCCCCCCCCCCCC(=O)N,non-mutagenic
+OC(=O)C1OC(Nc2nc3c(n2C)ccc2c3nc(C)cn2)C(C(C1O)O)O,non-mutagenic
+CC[Si](CC)(Cl)Cl,non-mutagenic
+Cc1ccc(cc1)S(=O)(=O)OCc1ccccc1,non-mutagenic
+[O-][N+](=O)c1cc(O)c(c(c1)[N+](=O)[O-])C,non-mutagenic
+CC(=O)Nc1ccc(cc1)OC(=O)c1ccccc1OC(=O)C,non-mutagenic
+COc1cc2OC3C(c2c2c1c1CCOC(=O)c1c(=O)o2)C=CO3,mutagenic
+CC(CCCC(C1CCC2C1(C)CCC1C2CC2C3(C1(C)CCC(C3)Cl)N2N1C(=O)c2c(C1=O)cccc2)C)C,non-mutagenic
+O=CN1CCc2c3c1cc1ccccc1c3c(c(c2)OC)OC,mutagenic
+C1CCCCCC2C(CCCC1)O2,non-mutagenic
+OCCc1ccc(cc1)N(C)C,mutagenic
+Oc1c2c(OC3C2CCO3)cc2c1c(=O)c1c(o2)cccc1O,non-mutagenic
+ClCCN(c1ccc(cc1)OCCCCCNc1c2ccccc2nc2c1cccc2)CC,mutagenic
+CC(=O)OCc1c2ccccc2cc2c1c1ccccc1cc2,mutagenic
+OC(=O)c1cc(O)c2c(n1)c(O)ccc2,non-mutagenic
+O=C1CCCN1C,non-mutagenic
+Oc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+N#CC(O)(C)C,non-mutagenic
+CC(C[C@H](N)C)C,non-mutagenic
+NCCc1c[nH]cn1,non-mutagenic
+CN(NC(=O)CCC(=O)O)C,non-mutagenic
+Oc1ccc2c(c1)cccc2O,mutagenic
+Cc1cc(ccc1N=Nc1ccc2c(c1O)c(N)c(cc2S(=O)(=O)O)S(=O)(=O)O)c1ccc(c(c1)C)N=Nc1ccc2c(c1O)c(N)c(cc2S(=O)(=O)O)S(=O)(=O)O,mutagenic
+O=CCCN(C(=O)OCC)N=O,mutagenic
+CCOC(C(=O)C(O)O)C,mutagenic
+CC(COC(=O)C=C)O,non-mutagenic
+OC1C=Cc2c(C1O)cc1c(c2Br)ccc2c1cccc2,non-mutagenic
+Oc1ccc(cc1)Nc1ccc2c(c1)cccc2,non-mutagenic
+COc1ccc(c(c1)N=Nc1c(O)ccc2c1cccc2)OC,mutagenic
+O[C@H]1CCCCCc2cc(O)cc(c2C(=O)O[C@H](CCC1)C)O,non-mutagenic
+[O-][N+](=O)c1cccc2c1c(ccc2)[N+](=O)[O-],mutagenic
+CCC#C[C@H]([C@@]1(CC=C)C(=O)NC(=O)N(C1=O)C)C,non-mutagenic
+CC(=O)ON(C(=O)c1ccccc1)OCc1ccc(cc1)C,mutagenic
+[O-][N+](=O)c1nc2c(n1C)ccc1c2cccn1,mutagenic
+CC(=O)Nc1ccc2-c3c(Cc2c1O)cccc3,non-mutagenic
+CSCCC(C(=O)O)NC(=O)COc1ccc(cc1Cl)Cl,non-mutagenic
+COc1ccc(cc1)C(=C(C#N)CCC(=O)O)c1ccc(cc1)OC,non-mutagenic
+COc1cc(ccc1OC)CC1CO1,mutagenic
+Cl/C(=C(\C(=C(Cl)Cl)Cl)/Cl)/SSc1ccccc1[N+](=O)[O-],mutagenic
+CC(=O)c1ccc2c(c1)CN1C(=N2)c2c(C1=O)cccc2,mutagenic
+O=C(N1CC(=O)N2[C@H](C1)c1ccccc1CC2)C1CCCCC1,non-mutagenic
+Fc1ccc2-c3c(C(c2c1)C)cc(cc3)F,mutagenic
+Nc1ccc2c(c1)c1ccccc1cc2,mutagenic
+CC(=O)ON(C(=O)c1ccccc1)OCc1ccc(cc1)c1ccccc1,mutagenic
+c1ccc(cc1)O[Si](Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1,non-mutagenic
+COc1ccc(cc1[N+](=O)[O-])c1oc2ccccc2c(=O)c1[N+](=O)[O-],mutagenic
+CCCOS(=O)(=O)C,mutagenic
+[O-][N+](=O)c1cccc(c1C)N,mutagenic
+Nc1cnc2c(c1)cccc2,mutagenic
+OC(=O)CCCCC1SCC2C1NC(=O)N2,non-mutagenic
+O=C(c1ccccc1)OOC(C)(C)C,mutagenic
+CC(=O)C1(CCNCC1)c1ccccc1,non-mutagenic
+NCCCCC(C(=O)NC(C(=O)NC(C(=O)O)CCCCN)Cc1c[nH]c2c1cccc2)N,non-mutagenic
+O=c1n(Cl)c(=O)n(c(=O)n1Cl)Cl,non-mutagenic
+CC1CN(C)C2C(C1)c1cc(Br)cc3c1c(C2)cn3CC1CC1,non-mutagenic
+Cn1cnc2c1ccc1c2cccn1,mutagenic
+Clc1ccc(cc1)CN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+Nc1cc(ccc1c1ccc(cc1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+C=C,non-mutagenic
+Nc1ccc(cc1)c1nc2c(s1)c(c(cc2)C)S(=O)(=O)O,mutagenic
+OCN1[C@H](O)[C@H](N(C1=O)CO)O,mutagenic
+[O-][N+](=O)c1cccc(c1)c1ccc(c(c1)[N+](=O)[O-])O,mutagenic
+OC(=O)c1c(N)cccc1N,mutagenic
+Oc1ccc2c(c1)c1cc3ccccc3cc1c1c2cccc1,mutagenic
+Cc1ccc(cc1)Br,non-mutagenic
+CC(CN1CC(OC1=O)C)O,non-mutagenic
+CCNS(=O)(=O)c1ccccc1C,mutagenic
+Nc1ccc2c(c1N=Nc1ccccc1)cccc2,non-mutagenic
+Clc1ccc2c(c1)cccn2,mutagenic
+CC(=O)O[C@@H](c1ccc2c(c1)OCO2)[C@@H]1CO1,mutagenic
+CCCCOC(=O)C=C,non-mutagenic
+CCOP(=S)(Oc1nc(Cl)c(cc1Cl)Cl)OCC,non-mutagenic
+Oc1cc(O)c2c(c1)oc(=O)cc2C,non-mutagenic
+O=C1c2ccccc2C(=O)c2c1c(O)c(c(c2)O)C,mutagenic
+[O-][n+]1cnc2c(c1N)ncn2C(c1ccccc1)(c1ccccc1)c1ccccc1,mutagenic
+O=C1NC(=O)N(C1)/N=C/C=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+ONc1ccc(cc1)Sc1ccccc1,mutagenic
+O1CCOCCOCCOCC1,non-mutagenic
+BrCc1c2ccccc2cc2c1cccc2,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)ccc1[N+](=O)[O-],mutagenic
+C=CC(=O)NCCCN(C)C,non-mutagenic
+Nc1cccc2c1c(N)c1c(n2)cccc1,mutagenic
+O=Nc1ccc2c3c1ccc1c3c(cc2)c(cc1)[N+](=O)[O-],mutagenic
+Nc1ccc(cc1)[N+](=O)[O-],mutagenic
+COc1ccccc1NC(=O)C(C(=O)C)N=Nc1ccc(cc1Cl)c1ccc(c(c1)Cl)N=NC(C(=O)Nc1ccccc1OC)C(=O)C,non-mutagenic
+Clc1cccc(c1)Cl,non-mutagenic
+CCc1c2ccccc2cc2c1c1ccccc1cc2,non-mutagenic
+CC(=O)NCCc1ccc(c(c1)c1c(O)c(O)c2c(c1O)C(=O)c1c(C2=O)cc(c(c1C(=O)O)C(=O)O)O)O,non-mutagenic
+Nc1ccc(cc1O)c1ccc(c(c1)O)N,mutagenic
+CS(=O)(=O)OC1CN(C1)C(c1ccccc1)c1ccccc1,mutagenic
+NCCS,non-mutagenic
+CN(c1ccc(cc1)N=Nc1ccc(cc1)N(C(=O)C)C)C(=O)C,non-mutagenic
+C[n+]1c2ccccc2nc2c1cccc2,mutagenic
+O=NC([N+](=O)[O-])(C)C,mutagenic
+C1CCCCNC1,non-mutagenic
+Cc1cccc(c1)Br,non-mutagenic
+Clc1ccc(c(c1)Cc1ccccc1)O,non-mutagenic
+COc1ccc(cc1)N,mutagenic
+ClCCN(C(=O)N[C@@H](P(=O)(OCC)OCC)C)N=O,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1cccc(c1[nH]2)[N+](=O)[O-],mutagenic
+OC(=O)[C@H](O)C,non-mutagenic
+OC(=O)c1ccc(cc1)/C=N/n1nnc2-c(c1O)nc1c2cccc1,mutagenic
+CCCCCCCCCCCCCCCCCC1=NCCN1CCO,non-mutagenic
+Nc1cccc(c1)c1ccccc1,mutagenic
+ONC(=O)c1ccccc1,mutagenic
+NCCN1CCNCC1,non-mutagenic
+ClCCN(c1ccc(cc1)C)CCCl,non-mutagenic
+OC1C=Cc2c(C1O)c1ccccc1c1c2cc2ccccc2c1,mutagenic
+COC(=O)c1cc2c([nH]1)c1ncccc1cc2,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1c1CCCCc1c1c3c(cc2)ccc1,mutagenic
+Clc1cc(Cl)c(c(c1Cl)Cl)Cl,non-mutagenic
+Oc1ccc(cc1)C(=O)N/N=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+CC(=O)Nc1ccc(c(c1)N=[N+](c1cc(ccc1C)NC(=O)C)[O-])C,non-mutagenic
+O=C1O[C@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@]([C@]([C@H]1C)(C)O)(C)O,non-mutagenic
+O=Nc1ccc(cc1)Oc1ccc(cc1)NC(=O)C,mutagenic
+ClCC[N+](CCCl)(C)[O-],mutagenic
+Cc1ccc2c(c1)nn[nH]2,non-mutagenic
+ONc1cc(NO)c(c(c1)[N+](=O)[O-])C,mutagenic
+CCOC(=O)c1[nH]c2c(c1/N=C/c1ccc(cc1)C)cccc2,non-mutagenic
+c1ccc2-c3cc4ccc5c(c4cc3C3C(c2c1)N3)cccc5,mutagenic
+COC(=O)C1OC1c1ccccc1,mutagenic
+CN(C1CCCCC1)C,non-mutagenic
+CC(C(=O)Nc1ccccc1)Br,mutagenic
+OC(=O)C1CSC(N1C(=O)CCSSCCC(=O)N1C(CSC1c1ccccc1O)C(=O)O)c1ccccc1O,non-mutagenic
+O=C([C@H]1CN(C)[C@@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@@]1(C)O[C@]2(N(C1=O)[C@H](Cc1ccccc1)C(=O)N1[C@@H]2CCC1)O,non-mutagenic
+[O-][N+](=O)c1ccc2-c3c(Cc2c1)cccc3,mutagenic
+O=C1C(O)CC(N1C)c1cccnc1,non-mutagenic
+CC(=O)Nc1ccc(cc1)C(=O)/C=C/c1ccccc1,non-mutagenic
+[O-][N+](=O)c1ccc2-c3c(-c4c2c1ccc4)cccc3,mutagenic
+CCCCCCCCC,non-mutagenic
+CCN(C(=S)SSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)CC,non-mutagenic
+CC(=O)Oc1ccc(cc1)C(c1ccccn1)c1ccc(cc1)OC(=O)C,non-mutagenic
+Cc1ccc(c(c1)S(=O)(=O)O)N=Nc1c(O)ccc2c1cccc2,non-mutagenic
+CNCCN(c1ccccn1)Cc1ccc(cc1)OC,non-mutagenic
+CCCO/C=C/C=C/C=C/C=C/C=C/CC,mutagenic
+[O-][N+](=O)c1nccn1C[C@H](COC)O,mutagenic
+CCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCC,non-mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/OCC(CO)O,mutagenic
+CC(=C)C(Cl)C,mutagenic
+COc1c(C(=O)O)c(O)nc2c1cccc2,non-mutagenic
+CC(Cc1ccccc1)N,non-mutagenic
+O=C1CCC(=O)O1,non-mutagenic
+[O-][N+](=Nc1ccccc1)c1ccccc1,mutagenic
+COC(=O)[C@@H]1c2cc3c(c(c2[C@H](C[C@]1(O)CC)O[C@@H]1O[C@@H](C)[C@H]([C@H](C1)N(C)C)O[C@H]1C[C@H](O)[C@@H]([C@@H](O1)C)O[C@@H]1O[C@@H](C)C(=CC1=N)O)O)C(=O)c1c(C3=O)c(O)ccc1O,mutagenic
+O=C(/C=C/c1ccc(o1)[N+](=O)[O-])NCC(C)(C)C,mutagenic
+Cc1cccc2c1cccc2,non-mutagenic
+CCOC(=O)C(CS)N,mutagenic
+C1=C[C@H]2[C@@H](O1)Oc1c2cccc1,mutagenic
+ClC(C(c1ccc(cc1)Cl)c1ccc(cc1)Cl)(Cl)Cl,non-mutagenic
+CS(=O)(=O)Nc1ccc(cc1)Nc1c2ccccc2nc2c1cccc2,mutagenic
+NC(=S)N,non-mutagenic
+Clc1ccc(c(c1)N)N,mutagenic
+COc1c(OC)ccc2c1cc1N(C)CCc3c1c2c1OCOc1c3,mutagenic
+OCCOc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)OCCO)OCCO,non-mutagenic
+O=Nc1ccc(cc1)c1ccccc1,mutagenic
+C=CCN(CC=C)CC=C,non-mutagenic
+ClC(=O)C(Cl)Cl,mutagenic
+COc1cc(OC)c2c(c1)oc1c(c2=O)cc(cc1)OC,mutagenic
+CC(=O)c1ccccn1,non-mutagenic
+O=C(c1ccccc1)N(OC(=O)C)OCc1ccc(cc1)[N+](=O)[O-],mutagenic
+Nc1cc(N)c(cc1N=Nc1ccc(cc1)S(=O)(=O)N)N=Nc1ccc(cc1)S(=O)(=O)N,mutagenic
+CC(C(=O)OC)CN=N#N,mutagenic
+c1ccc2c(c1)ccc1c2cc([C@H]2OC2)c2c1cccc2,mutagenic
+O=NN1CCCCC1,mutagenic
+CSCCC(=O)N1C(CSC1c1ccccc1O)C(=O)O,non-mutagenic
+ClCCN(c1ccc2c(c1)ccc1c2cc(o1)[N+](=O)[O-])CCCl,mutagenic
+N#N=NCC1OC(O)C(C(C1O)O)O,mutagenic
+FC(OC(C(F)(F)F)Cl)F,non-mutagenic
+Nc1ccc(cc1)S(=O)(=O)O,non-mutagenic
+Clc1ccc(cc1)S(=O)(=O)n1ncc(c(c1=O)Cl)Cl,non-mutagenic
+CCCCCCCCCc1ccc(cc1)O,non-mutagenic
+O=NN1CCc2c(C1)cc(c(c2)OC)OC,mutagenic
+C/C=C/C(=O)OC1CC2C3(C1(C)C1(C)CC(=O)C(=CC1O2)C)CO3,non-mutagenic
+CC(=O)c1oc(c(c1c1ccccc1)c1ccccc1)[N+](=O)[O-],mutagenic
+OC1CC2(C)C(C(C1O)(C)C(=O)O)CCC1(C2CC=C2C1(C)CCC1(C2CC(C)(C)CC1)C(=O)O)C,non-mutagenic
+COc1ccc2c(c1)c(=O)c1c(o2)cc(cc1O)O,mutagenic
+CC/C(=C(\c1ccc(cc1)OC(=O)CC)/CC)/c1ccc(cc1)OC(=O)CC,non-mutagenic
+NC(=O)/C=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+OC1CCN(CC1)c1c(F)cc2c3c1CCC(n3cc(c2=O)C(=O)O)C,non-mutagenic
+C/C(=C/CC/C=C(\CC/C=C(\CCC=C(C)C)/C)/C)/CC/C=C(\CCC=C(C)C)/C,non-mutagenic
+CN(c1c(C)n(n(c1=O)c1ccccc1)C)C,mutagenic
+C/C(=N/O)/CC,mutagenic
+Nc1nc2c(s1)cccc2,non-mutagenic
+CCCCOO,mutagenic
+COc1cc(ccc1O)c1nc(c([nH]1)c1ccccc1)c1ccccc1,mutagenic
+Nc1nc(N)c2c(n1)nc(c(n2)c1ccccc1)N,non-mutagenic
+c1ccc2c(-c3ccccc3C3C2O3)c1,mutagenic
+OC[C@@H]1O[C@@H]1[C@@]12O[C@H]2[C@@]2(C(=CC1=O)CC[C@H]([C@H]2C)O)C,mutagenic
+BrCCOC(=O)C(=O)OCCBr,mutagenic
+Oc1cc2O[C@H]3[C@H](c2c2c1c(=O)c1c(o2)cccc1O)C=CO3,mutagenic
+C[n+]1ccc(cc1)c1ccccc1,non-mutagenic
+Brc1cc(Br)c(c(c1)Br)O,non-mutagenic
+COC(=O)c1cc(OC)c2c(c1c1c(cc(c3c1OCO3)OC)C(=O)OC)OCO2,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c(/C=N/OCc1cccc(c1)[N+](=O)[O-])c(n2Cc1ccccc1)C,mutagenic
+Cc1cc2c3c4c1cccc4ccc3cc1c2cccc1,mutagenic
+C1CN2CCN1CC2,non-mutagenic
+COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(c(c2)OC)O)ccc1O,non-mutagenic
+Nc1ccc2c(c1)nc(c(n2)C)C,mutagenic
+Cl[C@H]1C=C[C@@H]2[C@@H]1[C@@]1(Cl)C(=C([C@@]2(C1(Cl)Cl)Cl)Cl)Cl,non-mutagenic
+O=C(c1cccc(c1)[N+](=O)[O-])/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+Nc1ccc(c(c1)N)N=Nc1ccccc1,mutagenic
+OC[C@H](O)C,non-mutagenic
+CCC(COC(=O)c1ccccc1C(=O)O)CCCC(=O)O,non-mutagenic
+Cl/C=C(/SCC(C(=O)O)NC(=O)C)\Cl,mutagenic
+C=CC(=O)OCC(C)C,non-mutagenic
+CCc1ccc(cc1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+Nc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+OC(=O)C(Cl)(Cl)C,non-mutagenic
+ClC(SN1C(=O)c2c(C1=O)cccc2)(Cl)Cl,mutagenic
+CN(CCOC(c1ccccc1)c1ccccc1)C,non-mutagenic
+C1=Cc2c(C1)ccc1c2ccc2c1cccc2,mutagenic
+CC(=O)OCc1c2ccccc2cc2c1cccc2,mutagenic
+COCCOC(=O)C=C,non-mutagenic
+OCc1ccccc1N=Nc1ccc(cc1)N(C)C,mutagenic
+OCC=C,non-mutagenic
+Clc1c(O)cc(c(c1Cl)Cl)Cl,non-mutagenic
+CC(=O)Nc1ccc(cc1)S(=O)(=O)Cl,non-mutagenic
+Nc1ccc(c(c1C)N)N=Nc1ccccc1,mutagenic
+BrCCCCCBr,mutagenic
+CCN,non-mutagenic
+OCCCl,mutagenic
+CCCCCCCCCCCCO,non-mutagenic
+O=C1C=Cc2c3c1ccc1c3c(cc2)C(=O)C=C1,mutagenic
+BrC1=C(Br)C(=O)OC1,mutagenic
+Clc1cc(Cl)c(c(c1)Cl)N,non-mutagenic
+c1ccc2c(c1)c1c3ccccc3c3c4c1c(c2)ccc4ccc3,mutagenic
+CC(CNCC(C)C)C,non-mutagenic
+COc1ccc2c(-c3nccc4c3c(C2=O)c(O)c(c4)OC)c1,mutagenic
+Nc1n[nH]cn1,non-mutagenic
+CCOC(=O)CNC(=O)C(Br)C,mutagenic
+NCCCS(=O)(=O)Nc1ccc(cc1)Nc1c2cc(N=N#N)ccc2nc2c1ccc(c2)N=N#N,mutagenic
+ClCc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+OC[C@@H]1O[C@H](O[C@H]([C@@H](C(=O)N[C@H]([C@H]([C@H](C(=O)N[C@H](C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCCN[C@@H](c2ccccc2)C)[C@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)c2nc[nH]c2)[C@H]([C@@H]([C@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)OC(=O)N)O,mutagenic
+CCCCOC(=O)c1ccccc1N,non-mutagenic
+CCc1c2ccc3c(c2c(c2c1cccc2)C)cccc3,non-mutagenic
+c1ccc2c(c1)C1=C3OC3=C3C1C(=c1ccccc1=C3)C2,mutagenic
+CCCCCOC(=O)C=C,non-mutagenic
+CC(OS(=O)(=O)C)C,mutagenic
+Cc1c2ccccc2cc2c1c1ccccc1cc2,mutagenic
+O=C1c2ccc3c(c2-c2c1ccc1c2cccc1)cccc3,mutagenic
+OS(=O)(=O)CNc1ccc(cc1)N=Nc1cccnc1,non-mutagenic
+Nc1cc2c(cc1C)nc1c([n+]2c2ccccc2)cc(c(c1)C)N,mutagenic
+CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C,non-mutagenic
+COC(=C1C(=NC(=C([C@H]1c1cccc(c1Cl)Cl)C(=O)OC(C)C)COC(=O)N)C)O,non-mutagenic
+BrCc1c2ccc3c(c2c(c2c1cccc2)C)cccc3,mutagenic
+c1cc(/C=C/c2ccccc2)cc(c1)/C=C/c1ccccc1,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1ccccc1cc2,mutagenic
+Nc1cnc2c(c1C)nc1n2cccc1C,mutagenic
+O=C(NC(=O)c1c(F)cccc1F)Nc1cc(Cl)c(c(c1)Cl)Oc1ncc(cc1Cl)C(F)(F)F,non-mutagenic
+CCCCCCCCCCCCOC[C@@H]1OC1,non-mutagenic
+CN1C2=Nc3c(C2C(c2c1cccc2)C)cccc3,mutagenic
+Cc1cc2ccccc2c2c1c1ccccc1cc2,mutagenic
+Clc1cc(Cl)c(c(c1)S(=O)c1cc(Cl)cc(c1O)Cl)O,mutagenic
+O=C1C=C(C(=O)C(=C1)C1=CC(=O)C=C(C1=O)C(C)(C)C)C(C)(C)C,mutagenic
+OC(=O)Cc1ccccc1Cl,non-mutagenic
+C=CCCC(C=O)CC,non-mutagenic
+Nc1cnn(c(=O)c1Cl)c1ccccc1,non-mutagenic mutagenic
+COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)C(OC1CC(N)C(C(O1)C)O)CC(C2)(O)C(=O)C,mutagenic
+c1ccc2c(-c3ccccc3C3C2N3)c1,mutagenic
+c1ccc2c(c1)cc1c3c2[C@H]2O[C@H]2c3cc2c1cccc2,mutagenic
+C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](c1ccnc2c1cc(OC)cc2)O,non-mutagenic
+CC(C(=O)NCc1ccc(cc1)Cl)Br,mutagenic
+NNC(=O)CNc1ccc2c(c1)cccc2,non-mutagenic
+[O-][N+](=O)c1cc2ccc3c4c2c(c1)ccc4cc1c3cccc1,mutagenic
+O=C(C1(C)OC1)Nc1ccccc1,mutagenic
+Oc1ccnc(n1)O,non-mutagenic
+COC(=O)C1O/C(=N\O)/C(=C1Cl)Cl,non-mutagenic
+OCC(C(CO)O)NC(=O)C1CC([N+](=O)C1(C)C)(C)C,non-mutagenic
+N#N=NCC(Cn1cnc2c1ncnc2N)O,mutagenic
+ClCCN(c1ccc(cc1)OCC(=O)O)CCCl,mutagenic
+OC(=O)c1occc(=O)c1O,non-mutagenic
+[O-][N+](=O)c1c(C)cccc1[N+](=O)[O-],mutagenic
+CC(=O)Oc1ccc2c(c1)C1(C)OOC1(O2)C,mutagenic
+CCCCCN(C(=O)C(NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC,non-mutagenic
+C=CC(=O)c1ccc2c(c1)OCO2,non-mutagenic
+OCC1(O)C[C@@]23CC1CCC3[C@]1(C(CC2)c2ccoc2CC1)C,non-mutagenic
+COc1c2c(CC=C(C)C)c3OCOc3c(c2nc2c1cco2)O,non-mutagenic
+O/N=C/c1ccncc1,non-mutagenic
+C=C/C/1=C/C(C)C(C)(OC(=O)C)C(=O)OCC2=CC[N+]3(C2(C(OC1=O)CC3)O)C,mutagenic
+CCCNCCC,non-mutagenic
+O=C(N[C@@H](C(=O)NCC(=O)O)CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])CC[C@H](C(=O)O)N,mutagenic
+CCN(c1ccc2c(c1)[o+]c1c(n2)ccc(c1)N(CC)CC)CC,mutagenic
+ClCCN(c1ccc(c2c1cc(o2)[N+](=O)[O-])OC)CCCl,mutagenic
+CCCCCCCCON(C(=O)c1ccccc1)OC(=O)C,mutagenic
+COc1cc2OC3C(c2c2c1c(=O)c1c(o2)cccc1O)CCO3,non-mutagenic
+Nc1ccc(cc1)c1ccc(cc1)N,mutagenic
+Cc1ccc(o1)C,non-mutagenic
+CCCCCN(CCCC)N=O,mutagenic
+ONc1cnc2c(c1C)nc1n2cccc1C,mutagenic
+C[C@@H]1OC(=O)c2c(C1)c(Cl)cc(c2O)C(=O)N[C@@H](C(=O)O)Cc1ccccc1,non-mutagenic
+N1C2C1c1cscc1-c1c2csc1,mutagenic
+Clc1ccc(cc1)CC[C@@H]1OC1,mutagenic
+Cc1ccc(c(c1)C(=O)O)/N=C/c1cccc2c1nccc2,non-mutagenic
+CN(c1ccccc1)C,non-mutagenic
+c1ccc2c(n1)cnnc2,non-mutagenic
+OCC(=O)CO,mutagenic
+OC(=O)c1ccc(cc1)C(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1ccccc1o2,mutagenic
+CN(c1ccc2c(c1)nc1c(n2)cc(c(c1)N)C)C,mutagenic
+COc1cccc2-c3c(C(Cc12)[N+](=O)[O-])ccc1c3OCO1,mutagenic
+O=Cc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+CCN(c1ccc(cc1)[N+]#N)CC,mutagenic
+[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])C,mutagenic
+CCNc1nc(NC(C)C)nc(n1)Cl,non-mutagenic
+COc1nncc2c1cncc2,non-mutagenic
+OC(=O)[C@H](Cc1ccc(c(c1)[N+](=O)[O-])O)N,non-mutagenic
+O=NN(c1cccnc1)C,non-mutagenic
+CC(Nc1ccc(cc1)Nc1ccccc1)C,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2cc2C(O)C(O)c3c(-c2c1)cccc3,non-mutagenic
+ON1C(C)(C)CC(C1(C)C)C(=O)N,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)ccc1c2cc(cc1)[N+](=O)[O-],mutagenic
+ClC(C(Cl)(Cl)Cl)COCC(C(Cl)(Cl)Cl)Cl,mutagenic
+O=C(c1ccccc1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+c1cc2ccc3c4c2c(c1)cnc4ccc3,mutagenic
+OCc1cc2ccccc2c2c1c1ccccc1cc2,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c(/C=N/OCc1ccccc1)c(n2Cc1cccc(c1)[N+](=O)[O-])C,mutagenic
+c1cc(cc(c1)c1ccccc1)c1ccccc1,non-mutagenic
+NCCNCC,non-mutagenic
+Cc1c2ccccc2c(c2c1cccc2)COS(=O)(=O)O,mutagenic
+c1ccc2c(n1)c1c(cc2)CCC2C1O2,mutagenic
+CN(CCN(c1ccccc1)Cc1ccccc1)C,non-mutagenic
+CCCCCCCCCCCCCCCCCCO,non-mutagenic
+COc1ccc(cc1N)c1oc2ccccc2c(=O)c1N,mutagenic
+Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)c2c(c1)O[C@@H]1[C@H]2C=CO1,mutagenic
+CSCNc1ccccc1C(=O)C,non-mutagenic
+OC[C@H]1O[C@@H](Oc2cc3ccc(=O)oc3cc2O)[C@@H]([C@H]([C@@H]1O)O)O,non-mutagenic
+Nc1ccc2c(c1)C(=O)c1c(C2=O)cccc1,mutagenic
+Oc1ccc(cc1N)S(=O)(=O)C,non-mutagenic
+C/C(=C\C(=O)OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)C=CC12C)/CC/C=C(/CCC=C(C)C)\C,non-mutagenic
+COc1ccc(cc1)[C@H]1O[C@@H]1C(=O)c1ccccc1,mutagenic
+[O-][N+](=O)c1ccccc1C(F)(F)F,non-mutagenic
+Fc1ccc(c2c1nccc2)F,mutagenic
+CCN(CCn1nc2-c3ccc(cc3Sc3c2c1ccc3CO)Cl)CC,mutagenic
+[O-][n+]1c2ccc3c4c2c(c2c1cccc2)ccc4ccc3,mutagenic
+CN1C=CN(C1/C=N/O)CCOCC#C,non-mutagenic
+CC(=O)OCc1c2cccc3c2c2c4c1ccc1c4c(cc2cc3)ccc1,mutagenic
+CC(=O)N/N=C/C1=CN(O)c2c(N1O)cccc2,mutagenic
+Cl[C@@H]1CN(C[C@H]1Cl)N=O,mutagenic
+Nc1cccc2c1cccc2N,mutagenic
+OCC(C(=O)NNCc1ccc(c(c1O)O)O)N,mutagenic
+O=Nc1ccccc1C,mutagenic
+Oc1cccc(c1)/C=N/c1snc2c1cccc2,mutagenic
+Cc1ccc(cc1)c1nc2c(o1)cccc2,non-mutagenic
+CNc1ccc2c(c1N)cccn2,non-mutagenic
+ONc1ccc(cc1)[N+](=O)[O-],mutagenic
+CC(=O)Nc1ccc(cc1)N,mutagenic
+Clc1c2ccccc2cc2c1cccc2,mutagenic
+CCCCOC[C@H]1CO1,mutagenic
+CCN(C(=O)N(c1ccccc1)CC)c1ccccc1,non-mutagenic
+Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C,non-mutagenic
+O=C1CC2CCC3C(C2(CC1C)C)CCC1(C3CCC1O)C,non-mutagenic
+CC[C@H](N)C,non-mutagenic
+CCC(c1cccc(c1)OC(=O)N(N=O)C)CC,mutagenic
+CC(=O)c1cc(ccc1N)Cc1ccc(c(c1)C(=O)C)N,mutagenic
+Clc1cc(Sc2cc(Cl)cc(c2O)Cl)c(c(c1)Cl)O,non-mutagenic
+CCCCN(CCC)N=O,mutagenic
+O=Nc1nccn1C,mutagenic
+c1cnc2c(c1)C1OC1C=C2,non-mutagenic
+COc1ccc2-c3ccccc3C(=O)c3c2c1ccc3,mutagenic
+CCN(c1ccc(cc1)N=Nc1ccc(cc1C#N)[N+](=O)[O-])CC,mutagenic
+OCC1OC(OC2C(OC3C(O)C(O)C(C(C3N=C(N)N)O)N=C(N)N)OC(C2(O)C=O)C)C(C(C1O)O)NC,mutagenic
+Nc1ccc2c(c1)oc(=O)cc2C,non-mutagenic
+CC(=O)N(c1ccc2c3c1ccc1c3c(cc2)ccc1)O,mutagenic
+O=C(C1CSC(C(=O)N1)C)NC(C(=O)N1CCCC1C(=O)N)Cc1c[nH]cn1,non-mutagenic
+CC(=O)Nc1ccc(cc1)c1ccc(cc1)N,mutagenic
+NC(=NC(=N)N)NCCc1ccccc1,non-mutagenic
+Cc1c2C3OC3c3c(-c2cc2c1cccc2)cccc3,mutagenic
+OC1C=Cc2c(C1O)c1cc3ccccc3cc1c1c2cccc1,mutagenic
+CCCC[C@H](COC(=O)CCCCCCCCC(=O)OC[C@@H](CCCC)CC)CC,non-mutagenic
+Cc1ccc(c2c1n(C)c1c2cccc1)C,mutagenic
+O1C[C@H]1c1ccc(cc1)c1ccccc1,mutagenic
+CC1=C(C)C(=O)C(=C(C1=O)C)C,non-mutagenic
+Cc1ccc(cc1)C,non-mutagenic
+O=C1CN=C(c2c(N1)ccc(c2)[N+](=O)[O-])c1ccccc1,non-mutagenic
+ClCc1c2ccc3c(c2cc2c1cccc2)cccc3,mutagenic
+COc1cc(ccc1O)C(=O)C,non-mutagenic
+Cc1ccc(c(c1)O)C,non-mutagenic
+ClCc1c2ccc3c(c2c(c2c1cccc2)C)cccc3,mutagenic
+CCc1cc(cc(c1N)CC)c1ccccc1,non-mutagenic
+CC1=CC2CCCCC2c2c1cccc2,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2cc(C)c2c1cccc2,non-mutagenic
+CCCO,non-mutagenic
+COc1cc(O)c2c(c1)oc1c(c2=O)c(O)ccc1O,mutagenic
+Nc1cccc(c1)[N+](=O)[O-],mutagenic
+Cc1ccc2c3c1ccc1c3c(cc2)c2c(c1)cccc2,mutagenic
+COc1cc(/C=C/C(=O)OC2CCC34C(C2(C)C)CCC2C4(C3)CCC3(C2(C)CCC3C(CCC=C(C)C)C)C)ccc1O,non-mutagenic
+CC(=O)OC1Cc2c3c1c1ccc4c(c1cc3ccc2C)cccc4,mutagenic
+OC[C@H]1O[C@@H](O[C@H]([C@H](C(=O)N[C@@H]([C@@H]([C@@H](C(=O)N[C@H](C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCCCN=C(N)N)[C@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@H](C(=O)N)N)c2nc[nH]c2)[C@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)OC(=O)N)O,mutagenic
+CCOC(=O)CNC(=O)CCCCSc1[nH]cnc2-c1ncn2,non-mutagenic
+CCCCCCCCCCCCCC[C@@H]1OC1,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])F,mutagenic
+[O-][N+](=O)c1cc2c(cc1)ncn2C,mutagenic
+O=NN1CC[C@@H]([C@H](C1)Br)Br,mutagenic
+CCC(=O)Nc1snc2c1cccc2,non-mutagenic
+CCN(Cc1cc(ccc1O)Nc1ccnc2c1ccc(c2)Cl)CC,non-mutagenic
+O[C@H]1[C@@H](O[C@@H]([C@H]([C@@H]1O)O)C)Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)C,mutagenic
+ClC(Cl)Cl,non-mutagenic
+COc1ccc(cc1)CNC(=O)C(Br)C,mutagenic
+CNC1CCc2c(-c3c1cc(=O)c(cc3)OC)c(OC)c(c(c2)OC)OC,non-mutagenic
+Clc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl,non-mutagenic
+O=NN1CCOC(C1)O,mutagenic
+O=C1CCC(=O)N1c1ccc(cc1)Cl,non-mutagenic
+Clc1ccc(cc1)C(=O)ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+O=C1c2cc(ccc2C(=O)c2c1cccc2[N+](=O)[O-])S(=O)(=O)O,mutagenic
+C#CC(c1ccccc1)(c1ccccc1)OC(=O)NC1CCCCC1,mutagenic
+ClCc1c2ccccc2c(c2c1cccc2)CCl,mutagenic
+O=NN1C[C@H](C)N([C@@H](C1)C)N=O,mutagenic
+[O-][N+](=O)c1cccc(c1)C(F)(F)F,non-mutagenic
+OC1COC(C(C1O)O)NCCc1c[nH]c2c1cccc2,mutagenic
+O=C(O[C@@H]1C[C@@](O)(C[C@@H]([C@H]1O)O)C(=O)O)/C=C\c1ccc(c(c1)O)O,non-mutagenic
+[O-][N+](=O)c1c(C)c(cc2c1C(C)(C)CC2(C)C)[N+](=O)[O-],non-mutagenic
+COC(=O)c1oc(c(c1c1ccccc1)c1ccccc1)N(C(=O)C)O,non-mutagenic
+O[C@@H]1[C@H](O)[C@@H](O)CO[C@H]1N(c1ccc(cc1)[N+](=O)[O-])N=O,mutagenic
+OC(=O)C(CC(=O)c1cccc(c1N)O)N,non-mutagenic
+C=O,mutagenic
+O=NN1CC[C@H](C1)O,mutagenic
+Oc1ccccc1c1ccccc1,non-mutagenic mutagenic
+CC(=O)C1=C(O)C2N(C1=O)C(C1C2c2c[nH]c3c2c(C1)ccc3)(C)C,mutagenic
+[O-][N+](=O)C1=Cc2c3c1cccc3cc1c2c2ccccc2cc1,mutagenic
+c1cc2ccc3c4c2c(c1)ccc4nc1c3cccc1,mutagenic
+O=C[C@@H](c1c(O)cc2c(c1O)C(=O)c1c(C2=O)cc(cc1O)O)CCOC(=O)C,mutagenic
+COc1ccc(cc1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+O=C/C=C(\C=C/C=C(\C=C/C1=C(C)CCCC1(C)C)/C)/C,mutagenic
+CC(=CCC[C@]([C@H]1CCC=CC1=O)(O)C)C,mutagenic
+CCN(CCn1nc2c3c1Sc1cc(Cl)ccc1-c3c(cc2)CO)CC,mutagenic
+CCOc1ccc2c(c1)sc(n2)N,mutagenic
+OC[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)c1c(O)c2c(c(c1O)O)C(=O)c1c(C2=O)c(C)c(c(c1)O)C(=O)O,mutagenic
+COc1c(Cl)ccc(c1C(=O)O)Cl,non-mutagenic
+OC(COc1ccc(cc1C(=O)C)N)CNC(C)(C)C,non-mutagenic
+O=C1OC2(c3c1cccc3)c1cc(I)c(c(c1Oc1c2cc(I)c(c1I)O)I)O,non-mutagenic
+OCc1c2ccccc2cc2c1cccc2,mutagenic
+CS(=O)(=O)O,non-mutagenic
+CCCCCNCCCCC,non-mutagenic
+OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F,non-mutagenic
+Nc1ccc2c(c1)c(N)c1c(n2)cccc1,mutagenic
+[O-][Cl](=O)(=O)=O,non-mutagenic
+CC1=CCC(CC1)C(O)(C)C,non-mutagenic
+OC1CC(C)(C)N(C(C1)(C)C)O,mutagenic
+COc1ccc(cc1)CN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+O[C@@H](c1ccccc1)[C@H](N)C,non-mutagenic
+O=CCC(CCC=C(C)C)C,non-mutagenic
+Cn1cc2c(n1)cc(cc2)[N+](=O)[O-],mutagenic
+Fc1ccc(cc1)C(=O)[C@H]1O[C@@H]1c1ccccc1,mutagenic
+CCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC,non-mutagenic
+C[C@H]1CCCC(=O)CCC/C=C\c2c(C(=O)O1)c(O)cc(c2)O,non-mutagenic
+Oc1cc2ccc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+[O-][N+](=O)c1cccc2c1snc2,mutagenic
+Clc1cc(Sc2cc(Cl)cc(c2O)[N+](=O)[O-])c(c(c1)[N+](=O)[O-])O,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)cc2c1cccc2,mutagenic
+COC(=O)c1ccc(cc1)/C=N/n1nnc2-c(c1O)nc1c2cccc1,mutagenic
+CCCCCCC(=O)OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F,non-mutagenic
+[O-][N+](=O)c1cc2c(o1)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+CCN(N(N=O)O)CC,mutagenic
+O=Cc1ccc(c(c1)Cl)Cl,non-mutagenic
+COc1ccc2c(c1)ccc1c2cc(o1)[N+](=O)[O-],mutagenic
+O=NN1CCN(CC1)C,mutagenic
+CNc1ccc(cc1)N=Nc1ccc(cc1)NC,non-mutagenic
+Nc1ccc(cc1)Nc1ccc(cc1)[N+](=O)[O-],mutagenic
+OC(=O)CCCOc1ccc(cc1C)Cl,non-mutagenic
+OCCOCC,non-mutagenic
+O=C1OC(=O)c2c1c(Br)c(c(c2Br)Br)Br,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)nc[nH]2,mutagenic
+O=Cc1ccccc1[N+](=O)[O-],mutagenic
+Oc1ccc(cc1)C(=O)O,non-mutagenic
+C#CC1(O)CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12,non-mutagenic
+OC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Nc1ccc(cc1)NC(=O)c1ccc(cc1)C(=O)O,non-mutagenic
+C/C(=C\C)/C(=O)OC1CCN2C1C(=CC2)CO,non-mutagenic
+ClC=C(Cl)Cl,non-mutagenic
+N#Cc1cccc2c1cccc2[N+](=O)[O-],mutagenic
+O=C(c1ccc(cc1)[N+](=O)[O-])[C@H]1O[C@@H]1c1ccccc1,mutagenic
+OCC[N+](C)(C)C,non-mutagenic
+OCC1OC(C(C1O)O)n1cnc2c1ncnc2NCC(COc1cccc2c1cccc2)O,non-mutagenic
+Cc1cc2c(cc1C)nc1c(c2C)ccc2c1cccc2,mutagenic
+O=CC=C(C)C,non-mutagenic
+O=CC=C(Cl)Cl,mutagenic
+c1ccc(cc1)c1ccc(cc1)CC1CO1,mutagenic
+CCCCCCCCCCCCCCCC[C@H]1CO1,non-mutagenic
+OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](OC(=O)/C(=C/C=C/C(=C/C=C/C=C(\C=C\C=C(/C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@H]([C@@H]([C@H]4O)O)O)[C@H]([C@@H]([C@H]3O)O)O)\C)/C)/C)/C)[C@@H]([C@H]([C@@H]2O)O)O)[C@@H]([C@H]([C@@H]1O)O)O,non-mutagenic
+CC(CCC[C@H]([C@@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2C[C@H]2[C@@]3([C@]1(C)CC[C@@H](C3)OC(=O)C)N2N1C(=O)c2c(C1=O)cccc2)C)C,mutagenic
+Nc1ccc(c(c1)C(=O)O)O,non-mutagenic
+c1ccc(cc1)N(c1ccccc1)c1ccccc1,non-mutagenic
+OC1CC(O)C(=C)/C(=C/C=C/2\CCCC3(C2CCC3C(CCC(C(C)C)O)C)C)/C1,non-mutagenic
+Oc1cc(Cl)c(cc1Cl)O,non-mutagenic
+CCC(CO)(CO)CO,non-mutagenic
+CC(OC(=O)Cc1ccccc1)C,non-mutagenic
+CO/N=C(/c1csc(n1)N)\C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)CSC(=O)c1ccco1,non-mutagenic
+ClC([N+](=O)[O-])Cl,mutagenic
+CCOC(=O)c1ccccc1N,non-mutagenic
+ClCCNCCCNc1c2ccccc2nc2c1ccc1c2nccc1,mutagenic
+COc1cc2oc(c3ccc(cc3)O)c(c(=O)c2cc1OC)O,non-mutagenic
+CC(=O)Nc1ccccc1C,mutagenic
+COc1cc2N(C)C3C4(c2cc1C1(CC2CN(CCc5c1[nH]c1c5cccc1)CC(C2)(O)CC)C(=O)OC)CCN1C4C(C(C3(O)C(=O)OC)OC(=O)C)(CC)C=CC1,non-mutagenic
+N#N=Nc1ccc2c(c1)nc1c(c2Nc2ccc(cc2OC)NS(=O)(=O)C)cccc1C,mutagenic
+O=c1[nH]c(=O)n(cc1F)C1CCCO1,non-mutagenic
+N1CC1,mutagenic
+CCCCC(C(C(OC(=O)CC(C(=O)O)CC(=O)O)CC(CCCCCCC(CC(C(N)C)O)O)C)OC(=O)CC(C(=O)O)CC(=O)O)C,non-mutagenic
+Cc1cnc2c(n1)c1ncn(c1cc2)C,non-mutagenic
+OC1C=Cc2c(C1O)c(Cl)c1c(c2)c2ccccc2cc1,non-mutagenic
+c1ccc2c(c1)oc1c2cccc1,non-mutagenic
+ClC(=O)c1ccc(cc1)C,mutagenic
+C1CCCN1,non-mutagenic
+CC(=O)Nc1ccc(cc1)c1ccccc1,mutagenic
+CC1(OC1)c1ccccc1,mutagenic
+N#N=Nc1nc2c(n1C)ccc1c2cccc1,mutagenic
+NC(=N)c1ccc2c(c1)[nH]c(c2N)C(=N)N,non-mutagenic
+O=C1Nc2ccc(cc2C(=N[C@@H]1O)c1ccccc1)Cl,non-mutagenic
+COc1nsc2c1cccc2N,mutagenic
+CC(=O)OCN=[N+](C)[O-],non-mutagenic
+OC(COc1cccc2c1cccc2)CNC(=O)C,non-mutagenic
+Nc1cc2cccc3c2c2c1cccc2cc3,mutagenic
+CCCCCON=O,mutagenic
+CCCCOC(=O)CCC,non-mutagenic
+COc1ccc(cc1C(C)(C)C)O,non-mutagenic
+[O-][N+](=O)c1cccc2c1cc([N+](=O)[O-])c(c2)[N+](=O)[O-],mutagenic
+OCC(CBr)(Br)C,non-mutagenic
+C[N+](CC1OC1)(C)C,mutagenic
+O=C(Nc1ccc(cc1)Cl)OCC12OOC2(C)c2c(O1)cccc2,mutagenic
+CN1CCOCC1,non-mutagenic
+Cc1cc(ccc1C)N=Nc1c(O)ccc2c1cccc2,non-mutagenic
+O=c1ccc2c(o1)c1CCCN3c1c(c2)CCC3,mutagenic
+O=C1C=CC(=O)N1,mutagenic
+ClCc1cc2cccc3-c4c(-c(c1)c23)cccc4,mutagenic
+N#C/C(=C\C=C\c1ccccc1)/c1ccc(cc1)Cl,mutagenic
+Nc1ccc2c(c1N=Nc1ccc(cc1)c1ccc(cc1)N=Nc1c(N)ccc3c1c(O)cc(c3)S(=O)(=O)O)c(O)cc(c2)S(=O)(=O)O,mutagenic
+ClCC(=O)CCl,mutagenic
+Cc1ccc(cc1)C(=O)c1cc(O)c(c(c1)[N+](=O)[O-])O,non-mutagenic
+CC[n+]1c(c2ccccc2)c2cc(N)ccc2c2c1cc(N)cc2,mutagenic
+[O-][N+](=O)c1cc2cccc(c2c2c1cccc2)[N+](=O)[O-],mutagenic
+C/C(=C\C=C\C=C(\C=C\C=C(\C=C\C=C(\CCC=C(C)C)/C)/C)/C)/C=C/C=C(/C=C/C=C(/CCC=C(C)C)\C)\C,non-mutagenic
+Clc1ccc(c(c1)Nc1ccccc1C(=O)O)C(=O)O,non-mutagenic
+Oc1cc(O)cc(c1)O,non-mutagenic
+Nc1ccc(cc1)S(=O)(=O)Nc1nccs1,non-mutagenic
+C=CC(c1cc2cc3CC(Oc3cc2oc1=O)C(O)(C)C)(C)C,mutagenic
+Clc1cncc(c1)Cl,non-mutagenic
+CC(C(=O)N(Cc1ccccc1)C)Br,non-mutagenic
+COP(=O)(OC)C,non-mutagenic
+CC(=O)C,non-mutagenic
+OC[C@H]1O[C@H]2[C@H]([C@@H]1O)Oc1n2ccc(=N)n1,non-mutagenic
+OCCS,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+CC(=O)N(c1ccccc1C)O,mutagenic
+OS(=O)(=O)Oc1ccc2c3c1ccc1c3c(cc2)cc2c1cccc2,mutagenic
+N[C@@H](C(=O)OC(C)(C)C)CN=[N+]=[N-],mutagenic
+COc1cc(N)ccc1C,mutagenic
+n1ccc2c(c1)cc1c(c2)c2ccccc2c2c1cccc2,mutagenic
+CCC(=O)OCc1ccccc1[N+](=O)[O-],non-mutagenic
+Clc1ccccc1NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+Nc1ccc2c(c1)c(Cl)ns2,mutagenic
+OC(COc1nsnc1N1CCOCC1)CNC(C)(C)C,non-mutagenic
+O=Nc1c(nc2n1ccs2)c1ccc(cc1)Cl,mutagenic
+OCC12OOC2(CO)Oc2c1cccc2,non-mutagenic
+CC[C@H](NC(=O)/C=C/c1ccc(o1)[N+](=O)[O-])C,mutagenic
+O=C1c2ccccc2C(=O)c2c1cccc2,mutagenic
+OC(=O)[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)N(c1ccc(cc1)c1ccccc1)O,mutagenic
+COc1c2ccccc2nc2c1cco2,mutagenic
+OC(COc1ccccc1C1=CCCC1)CNC(C)(C)C,non-mutagenic
+C/C=C/CC#N,non-mutagenic
+OC[C@H]1O[C@@H](O[C@@]23CC[C@@H]4[C@@](C2)(CC3=C)CC[C@H]2[C@@]4(C)CCC[C@@]2(C)C(=O)O)[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O,non-mutagenic
+CCBr,mutagenic
+Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)c(c(c1)O)O,non-mutagenic
+C[C@H](CBr)O,mutagenic
+OCC1OC(C(C1O)O)n1cnc2c1nc(nc2N)c1cccc(c1)[N+](=O)[O-],mutagenic
+COc1nc2c(CBr)cccc2nc1OC,mutagenic
+CCCN(CCCCO)N=O,mutagenic
+Cc1ccc(cc1)[N+]#N,mutagenic
+OCC12C(C=C(C(=O)C1O)C)OC1C3(C2(C)C(O)C1O)OC3,non-mutagenic
+ClCc1ccccc1[N+](=O)[O-],mutagenic
+COc1cccc2c1C(=O)c1c(O)c3C(O)CC(Cc3c(c1C2=O)O)(O)C(=O)CO,mutagenic
+ClCCN(c1ccc(cc1)c1[nH]c2c(n1)cc(cc2)Cc1nc2c([nH]1)ccc(c2)N1CCN(CC1)C)CCCl,non-mutagenic
+CN=C=O,non-mutagenic
+OC(=O)CI,mutagenic
+Oc1ccc2c3c1ccc1c3c(cc2)c2c(c1)cccc2,mutagenic
+CCCC,non-mutagenic
+CNc1ccc2c(c1C)ncc(n2)C,mutagenic
+C1CC23C(C1)(O3)C=CC=C2,mutagenic
+[O-][N+](=O)c1ccc(cc1)/C=N/n1nnc2-c(c1O)nc1c2cccc1,mutagenic
+OC1CCC2(C(C1)CCC1C2CC(O)C2(C1CCC2C(CCC(=O)O)C)C)C,mutagenic
+Brc1ccc(cc1)c1ccccc1,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)snc2Cl,mutagenic
+CN[C@H](Cc1ccccc1)C,non-mutagenic
+Cc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+CCOCCOC(=O)c1cc(ccc1N)Cc1ccc(c(c1)C(=O)OCCOCC)N,non-mutagenic
+COc1cc(N)c(cc1N)[N+](=O)[O-],mutagenic
+Nc1c2C(=O)c3ccccc3C(=O)c2c(cc1S(=O)(=O)O)Nc1cccc(c1)S(=O)(=O)CCOS(=O)(=O)O,mutagenic
+CC(C#N)O,non-mutagenic
+C=CCn1cc2c3c1cccc3C1C(C2)N(C#N)CC(C1)C,mutagenic
+OC1C(O)c2cccc3c2c2c1cccc2cc3,non-mutagenic
+NC(=O)/C(=C\c1ccc(o1)[N+](=O)[O-])/c1ccco1,mutagenic
+BrCCOC(=O)C(C(C(=O)OCCBr)O)O,mutagenic
+OC[C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O,non-mutagenic
+c1cnc2c(c1)c1c(cc2)CCC2C1O2,mutagenic
+BrC(=C)C(=O)C,mutagenic
+S(Cc1ccccc1)Cc1ccccc1,non-mutagenic
+Fc1cnc2c(c1)cc(c1c2cccc1)F,non-mutagenic
+O=C/C=C/C(O)C,mutagenic
+Clc1ccc(cc1)CO/N=C/c1c(C)n(c2c1cc(cc2)[N+](=O)[O-])Cc1ccccc1,non-mutagenic
+Oc1cccc2c1c1ccc3c(c1cc2)cccc3,mutagenic
+ClCCN([P@]1(=O)NCCCO1)CCCl,mutagenic
+CC/C=C/C=C/C=C/C=C/C=O,non-mutagenic
+COc1ccccc1N,mutagenic
+C[C@H]1CS(=O)(=O)CCN1/N=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+Nc1ccc(c2c1C(=O)c1c(O)ccc(c1C2=O)N)O,mutagenic
+CCC1(C)CO1,non-mutagenic
+CCC(=C)C=O,mutagenic
+Oc1ccc(cc1)/C=N/c1snc2c1cc(Cl)cc2Cl,mutagenic
+O=C(c1ccccc1N)OC/C=C/c1ccccc1,non-mutagenic
+Cc1ccc2c(n1)cccc2,mutagenic
+ClC(Br)Br,non-mutagenic
+Cc1ccc2c(c1)cc(cc2)[N+](=O)[O-],mutagenic
+CC1(OC1)c1ccc(cc1)Br,non-mutagenic
+Oc1cc(C)c2c3c1C(=O)c1c(O)cc(c4c1c3c1c3c2c(C)cc(c3C(=O)c2c1c4c(O)cc2O)O)O,non-mutagenic
+CC(NC(C)C)C,non-mutagenic
+NC(=N)NC(=O)c1nc(Cl)c(nc1N)N,mutagenic
+C/C(=C/C)/C#N,non-mutagenic
+Cc1ccc(cc1)Cc1ccccc1,non-mutagenic
+O=NN(Cc1cccc(c1)Br)C,mutagenic
+CC(=O)N(c1ccc(cc1)Sc1ccccc1)OC(=O)C,mutagenic
+CCC[C@H]([C@H](CO)CC)O,non-mutagenic
+CNC(=O)N(c1ccccc1)c1ccccc1,non-mutagenic
+C1O[C@H]1[C@@H]1CC[C@H]2[C@@H](C1)O2,mutagenic
+Clc1ccccc1,non-mutagenic
+COc1ccc(cc1[N+](=O)[O-])C(=O)Nc1ccccc1,mutagenic
+[O-][N+](=O)c1c(C)cccc1C,non-mutagenic
+ClC(=C(SSc1ccccc1[N+](=O)[O-])Cl)Cl,mutagenic
+Nc1ccc(cc1C)NOS(=O)(=O)O,mutagenic
+OCC1OC(C(C1O)O)n1ccc(nc1=O)N,non-mutagenic
+CC(COS(=O)(=O)c1ccc(cc1)C)C,non-mutagenic
+CN(CCNC(=O)c1cccc2c1sc1ccccc1c2=O)C,mutagenic
+Oc1ccc(c2c1c(=O)c1c(o2)cc2c(c1O)C1(O)C=COC1O2)CCC(O)(C)C,mutagenic
+BrCc1ccccc1CBr,non-mutagenic
+COC(=O)c1ccccc1O,mutagenic
+BrCCCCBr,mutagenic
+c1ccc(cc1)Cn1cncc1,mutagenic
+CCC12OC2O1,mutagenic
+OCCc1sc[n+](c1C)Cc1cnc(nc1N)C,non-mutagenic
+OCC1OC(CC1O)n1cc(C)c(=O)[nH]c1=O,non-mutagenic
+[O-][N+](=O)c1c2ccccc2c2c(c1C)c1ccccc1cc2,mutagenic
+CC1CCc2c(C1)occ2C,non-mutagenic
+CN(C1Cc2cccc3c2c(C1)ccc3)C,mutagenic
+COCCOCCOP1(OCCOCCOC)NP(OCCOCCOC)(OCCOCCOC)NP(N1)(OCCOCCOC)OCCOCCOC,non-mutagenic
+O=Nc1c(CC)cccc1CC,mutagenic
+O=C(c1ccccc1O)Oc1ccccc1,non-mutagenic
+COc1ccc2c(c1)C1CCCCC1C1C2O1,non-mutagenic
+O=C/C=C/C=C/C=C/C=C/[C@@H](CC)O,mutagenic
+Nc1ccc2c(c1)cc1c(n2)cccc1,mutagenic
+[CH-]1Nc2c(C(=N)[N+]1=O)ncn2C,mutagenic
+Fc1cccc2c1nccc2,mutagenic
+OC1CC=Cc2c1nccc2,non-mutagenic
+Oc1ccc2c3c1ccc1c3c(c3c2cccc3)c(cc1)[N+](=O)[O-],mutagenic
+O=C(Cn1c(=O)sc2c1cccc2)OCc1ccccc1,non-mutagenic
+ON(c1ccccc1)C(=O)C,non-mutagenic
+Clc1c(Cl)c(Cl)c(c2c1cccc2)Cl,non-mutagenic
+COc1ccc2c(c1)nc(n2C)N,mutagenic
+CCOC(=O)c1[n+]([O-])nnc2c1n(C)c1c2cccc1,mutagenic
+c1ccc(cc1)CN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+O=C1c2ccccc2-c2c1ccc1c2cccc1,mutagenic
+CCCCCCCCCCC,non-mutagenic
+OCC1OC(CC1O)n1cc(I)c(nc1=O)N,non-mutagenic
+COC(=O)/C(=C(/c1cc(Cl)ccc1Cl)\OP(=O)(OC)OC)/Cl,non-mutagenic
+OCC1CC(C(O1)n1cnc2c1ncnc2N)O,mutagenic
+O=CC1=C(CC(C2=CCC(C2)(C)C)C)C(OC1)O,non-mutagenic
+OC[C@@H](CCl)Cl,mutagenic
+CCOC(=O)OC(=O)OCC,non-mutagenic
+NC(=N)c1ccc(cc1)c1cc2c(s1)cc(cc2)C(=N)N,non-mutagenic
+N#N=NC(c1ccccc1)c1ccccc1,mutagenic
+Cc1cncc(n1)C,mutagenic
+CCCCCCCCCC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)CCCCCCCCC,mutagenic
+FC[C@H]1CO1,mutagenic
+OC(=O)c1ccccc1c1c2cc(Br)c(c(c2oc2-c1cc(Br)c(=O)c2Br)Br)O,mutagenic
+CC1NCCN(C1)c1cc2n(cc(c(=O)c2cc1F)C(=O)O)c1ccc(cc1F)F,mutagenic
+Fc1cccc2c1ccc1c2cccn1,mutagenic
+CCCc1cc(O)nc(n1)S,non-mutagenic
+[O-][N+](=O)c1cc2cccc3c2c2c1cccc2c1c3CCCC1,mutagenic
+Cc1ccc(c(c1O)C)C,non-mutagenic
+COc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)OC)c1ccc(cc1C)C,mutagenic
+ClCC1=C(Cl)C(=O)OC1,mutagenic
+Clc1cc(NC(=O)c2c(O)c(Cl)cc(c2Cl)Cl)c(c(c1)Cl)O,non-mutagenic
+NC(=O)c1cccnc1,non-mutagenic
+O[C@H]1C=Cc2c([C@@H]1O)ccc1c2c(cc2c1CCC2=O)C(F)(F)F,mutagenic
+CCCCCCC(OC(=O)C)C/C=C/CCCCCCCC(=O)OC,non-mutagenic
+CCOP(=S)(OCC)SCSP(=S)(OCC)OCC,non-mutagenic
+CCCCCCCCBr,non-mutagenic
+CCO[C@@H]1O[C@H](OCC)C[C@H]2[C@@]1(C)C[C@H]1[C@@H](C[C@@H]2C)OC(=O)C1=C,mutagenic
+CCOO,mutagenic
+Cc1ccc2c(c1)cccc2C,non-mutagenic
+O=C(c1ccc(cc1)[N+](=O)[O-])/C=C/c1ccccc1,mutagenic
+CC(C(C)(C)C)OP(=O)(F)C,non-mutagenic
+CN([C@H](CN1c2ccccc2Sc2c1cccc2)C)C,non-mutagenic
+O=C1c2ccccc2-c2c3c1cccc3c(cc2)O,mutagenic
+[O-][N+](=O)c1cccc(c1)/C=N/c1snc2c1cccc2,mutagenic
+CC(=O)ON(C(=O)c1ccccc1)OCc1ccc(cc1)Oc1ccccc1,mutagenic
+FC(C(F)(F)F)(Cl)F,non-mutagenic
+Cc1cnc2c(n1)cc(c1c2nc(n1C)N)C,mutagenic
+O=C1c2c(-c3c1c1ccccc1cc3)ccc1c2cccc1,non-mutagenic
+ClCCNCCCNc1c2ccccc2nc2c1cccc2OC,mutagenic
+C/C=C\1/CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3[C@H]2[C@@H](OC1=O)CC3,mutagenic
+[O-][N+](=O)c1ccc2c(c1)oc(=O)c1c2cccc1,mutagenic
+COc1c2oc(=O)ccc2cc2c1occ2,mutagenic
+SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N,mutagenic
+Clc1ccc(c(c1Cl)O)Cl,non-mutagenic
+OS(=O)(=O)Oc1ccc2c(c1)c1ccc3c4c1c(c2)ccc4ccc3,non-mutagenic
+O1C[C@@H]1COc1cccc(c1)OC[C@@H]1OC1,mutagenic
+Clc1c(S)c(Cl)c(c(c1Cl)Cl)Cl,non-mutagenic
+c1cnc2c(c1)C=C[C@H]1[C@@H]2O1,mutagenic
+CC(=O)Oc1ccccc1C(=O)Oc1ccccc1C(=O)O,non-mutagenic
+CCP(=O)(OCC)OCC,non-mutagenic
+CC(c1ccc(cc1)O)(CC(C)(C)C)C,non-mutagenic
+Br/C=C(/c1ccc(cc1Cl)Cl)\OP(=O)(OC)OC,non-mutagenic
+Cc1cc(N)c(cc1C)C,mutagenic
+Brc1cc(Br)c(c2c1C(=O)c1ccccc1C2=O)N,mutagenic
+CCCCCCCC[C@H]1CO1,non-mutagenic
+O=S1(=O)CCCC1,non-mutagenic
+CCc1cc2ccccc2c2c1c1C3OC3C(C(c1cc2)O)O,mutagenic
+CC(=O)OCc1c(O)cc2c(c1O)C(=O)c1c(C2=O)cccc1,mutagenic
+CCc1ccccc1Nc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)Nc1ccccc1CC,mutagenic
+C1CCC2C(C1)c1ccccc1C1C2O1,non-mutagenic
+COc1cc(OC)c2c(c1)c(OC)c1c(n2)occ1,mutagenic
+Cc1ccc2c(c1)c1c(C)ccc(c1[nH]2)C,mutagenic
+Nc1ccc2c(c1N=Nc1ccc(cc1S(=O)(=O)O)[N+](=O)[O-])c(O)cc(c2)S(=O)(=O)O,non-mutagenic
+CN=NO,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c(cc1c2cccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Nc1ccc(cc1)Cc1ccc(cc1)N,mutagenic
+NCCCCCCN,non-mutagenic
+O=Cc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+NC(=S)NCC=C,non-mutagenic
+Oc1ccc(c2c1c(=O)c1c(o2)cc2c(c1O)C1C=COC1O2)CCC(O)(C)C,mutagenic
+CN(c1ccc(cc1)/C=C/C(=O)c1ccccc1)C,non-mutagenic
+CCOCc1c(O)cc2c(c1O)C(=O)c1c(C2=O)cccc1,mutagenic
+CCO[P@@](=O)(Oc1ccc(c(c1)C)SC)NC(C)C,non-mutagenic
+OC1C=Cc2c(C1O)cc1c(c2)c(C)cc2c1cccc2O,mutagenic
+O=Nc1c(C)n(n(c1=O)c1ccccc1)C,mutagenic
+O=C(C1=C(C)OCCS1)Nc1ccccc1,non-mutagenic
+Nc1cccc(c1C)N,mutagenic
+[N-]=[N+]=NCC(C(=O)O)(N)C,mutagenic
+Cc1c2cc(C)c(cc2c(c2c1cccc2)C)C,mutagenic
+COc1cc(OC)c2c(c1)oc1c(c2=O)c(O)ccc1OC,mutagenic
+O=CC1=C(O)C[C@H]2[C@@](C1)(C)[C@H]1CC[C@]3([C@@H]([C@@H]1CC2)CC[C@]3(C)O)C,non-mutagenic
+OCCNc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)NCCO,mutagenic
+[O-][N+](=O)c1cc2CCc3c4c2c(c1)ccc4ccc3,mutagenic
+O=NN(COC(=O)C)C,mutagenic
+COC(=O)/C(=C/c1ccc(o1)[N+](=O)[O-])/[N+](=O)[O-],mutagenic
+OC(=O)c1c(C(=O)O)c(Br)c(c(c1Br)Br)Br,non-mutagenic
+O=C(c1cccc2c1nccc2)OCc1ccccc1,non-mutagenic
+CN1CCN(CC1)C1=CC(=O)c2c(C1=O)c1-c(c([nH]2)C)c2c(n1)cccc2,mutagenic
+C1=C[C@@H]2[C@H](C=C1)O2,mutagenic
+OC(=O)C(CC(=O)c1ccccc1N)N,non-mutagenic
+Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C,non-mutagenic
+c1ccc2c(-c3ccc4c(c3C2)c2ccccc2cc4)c1,mutagenic
+Nc1ccc2c(c1)cccc2,mutagenic
+ONc1ccc2c(c1)cccc2,mutagenic
+BrC(C1=C(Cl)C(=O)OC1)Br,mutagenic
+COC(=O)c1ccc(cc1)O,non-mutagenic
+Cc1ccc(cc1)N(C(=O)C)O,non-mutagenic
+CCCCNCCCC,non-mutagenic
+OCCN(C(=O)OCC)N=O,mutagenic
+CCCOC(=O)c1cc(ccc1N)Cc1ccc(c(c1)C(=O)OCCC)N,non-mutagenic
+Oc1ccc2c(c1)cccc2,non-mutagenic
+Brc1c(Br)c(Br)c(c(c1Br)Br)Br,non-mutagenic
+CN(CCNC(=O)c1ccc2c(c1)nc1c(c2N)cccc1)C,non-mutagenic
+OC(CNC(C)(C)C)COc1ccc(cc1C(=O)C)NC(=O)NC(C)(C)C,non-mutagenic
+CN(C(c1ccccc1)(c1ccccc1)N(C)C)C,non-mutagenic
+Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C,non-mutagenic
+Oc1ccc2c(c1)nccc2,non-mutagenic
+OC(=O)C(Oc1ccc(cc1)[C@H]1CCCc2c1cccc2)(C)C,non-mutagenic
+CCCC/C=C/C=C/C=C/C=C/C=C/OCC(CO)O,mutagenic
+O=c1c2cccc3c2c2c(c1=O)cccc2cc3,non-mutagenic
+O=NN(CC(=O)C)C,mutagenic
+Cc1cccc(c1)OP(=O)(Oc1ccccc1)Oc1ccccc1,non-mutagenic
+[N-]=[N+]=NCCc1ccccc1,mutagenic
+Nc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-],mutagenic
+CN(CCNC(=O)c1cccc2c1Oc1ccccc1O2)C,mutagenic
+Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1,non-mutagenic
+OCCOc1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+O1CC1,mutagenic
+O=NN(Cc1ccc(cc1)Cl)C,mutagenic
+COP(=S)(OC)OC,non-mutagenic
+CC[C@@H](C(C)C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H](C2)O)C,non-mutagenic
+O=NN(C(=O)[C@@H]1CCCN1C(=O)C)CC(=O)O,mutagenic
+O=CC1=CC(C)C2C(C=C1C=O)CC(C2)(C)C,non-mutagenic
+Cc1cc2ccccc2c2c1c1ccccc1c(c2)[N+](=O)[O-],mutagenic
+COc1cccc(c1)CN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+CC(c1cccc(c1O)C(C)(C)C)(C)C,non-mutagenic
+COc1ccc(ccc1=O)[N+](=O)[O-],mutagenic
+C[C@@H]1O[C@H]1c1ccccc1,non-mutagenic
+c1ccc(cc1)CNc1[nH]cnc2-c1ncn2,non-mutagenic
+CC(Cc1ccc(cc1)C(=O)C)C,non-mutagenic
+CCN1CCN(C(=O)C1=O)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C2C(=O)O)(C)C)c1ccccc1,non-mutagenic
+Clc1ccc(c(c1)Cl)Oc1ccc(cc1)N(C(=O)C)O,mutagenic
+Nc1ccc2-c3c(Cc2c1)cc(cc3)N,mutagenic
+CCN(c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)N(CC)CC)CC,non-mutagenic
+CCC(=O)N(c1ccc(cc1)c1ccccc1)O,mutagenic
+COCc1c(O)cc2c(c1O)C(=O)c1c(C2=O)cccc1,mutagenic
+Nc1cnc2c(c1)c1ccccc1cc2,mutagenic
+CNc1ccc(cc1)O,mutagenic
+C/C=C\C=C/C=O,mutagenic
+O=C1C=Cc2c(C1=O)cccc2,mutagenic
+OC1C2OC2c2c(C1O)cc1c(c2)c2ccccc2c2c1cccc2,mutagenic
+CCCCCCCCCCCCCCCCCC(=O)NCCCC[C@@H](C(=O)O)NC(=O)CC[C@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@H](O[C@@H]1[C@H](NC(=O)C)[C@H](O)O[C@@H]([C@H]1O)CO)C)C,non-mutagenic
+S=c1scc(s1)c1ccccc1,non-mutagenic
+c1ccccc1,non-mutagenic
+CC(COC(=O)COc1cc(Cl)c(cc1Cl)Cl)C,non-mutagenic
+Clc1cc(O)c(c(c1)Cl)Cl,non-mutagenic
+O=NN(N(C(=O)/C(=N\O)/C(=O)C)c1ccccc1)C,mutagenic
+CSc1ccc(cc1C)OP(=S)(OC)OC,non-mutagenic
+C=CCOC(=O)c1ccccc1N,non-mutagenic
+COc1ccc(cc1O)C1CC(=O)c2c(O1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O,non-mutagenic
+C=C[C@H]1CCC=CC1,non-mutagenic
+C1CCC2C(C1)c1ccccc1C=C2,mutagenic
+Cc1cc2nc3-c(n(c2cc1C)C)nc(=O)[nH]c3=O,mutagenic
+NC(=O)CN1C[C@@H](CC1=O)O,non-mutagenic
+OC(=O)CCCC(=O)O,non-mutagenic
+C=CCc1ccc(c(c1)OC)O,non-mutagenic
+Clc1cc2c(c3c1cccc3)ccc1c2cccc1,mutagenic
+CC(C=O)CC,non-mutagenic
+CCOP(=S)(SCSC(C)(C)C)OCC,non-mutagenic
+Cc1ccc(cc1C)S(=O)(=O)O,non-mutagenic
+CC(=O)Nc1ccc(cc1)/C=C/C(=O)c1ccccc1,mutagenic
+C=CC(=O)OCC(COC(=O)C=C)(COC(=O)C=C)CO,non-mutagenic
+Oc1ccccc1O,non-mutagenic
+Cl/C=C/CSCC(C(=O)O)N,non-mutagenic
+CC(=O)O[C@@H]1Cc2c3c1c(C)ccc3cc1c2ccc2c1cccc2,mutagenic
+Brc1c2ccc3c(c2cc2c1cccc2)cccc3,mutagenic
+Clc1cc([N+](=O)[O-])c(c(c1Cl)Cl)Cl,non-mutagenic
+O1CC1COc1ccc(cc1)Cc1ccccc1,mutagenic
+O=NN1CCC=CC1,mutagenic
+O=Nc1ccc(cc1C(C)(C)C)c1ccccc1,mutagenic
+O=N#Cc1cc(C)cc(c1)C#N=O,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)ccc1c2cc2ccccc2c1,mutagenic
+ClCc1c2ccccc2c(c2c1cccc2)Cl,mutagenic
+O=NN(C(=O)N)CCC[C@H](C(=O)O)N,mutagenic
+O=CN(c1cccc(c1)Cl)O,non-mutagenic
+C1COCCOC2CCCCC2OCCOCCOCCOC2C(OCCO1)CCCC2,non-mutagenic
+CCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C,mutagenic
+CCCCN(CC(c1ccc(cc1)O)O)N=O,non-mutagenic
+CNc1ccc(cc1)N=Nc1ccc(cc1)N(C(=O)C)C,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C/C(=O)NCC,mutagenic
+CC(COC(=O)c1ccccc1C(=O)OCC(C)C)C,non-mutagenic
+COc1ccc2c(c1)c1c(C)c(N)cc(c1[nH]2)C,mutagenic
+Cc1cccc(c1)N=Nc1ccc(cc1)N(C)C,mutagenic
+CC(=O)OCc1cc(ccc1OC(=O)C)C(=O)C,mutagenic
+CCN(C(=O)Nc1ccc(c(c1)C(=O)C)OCC(CNC(C)(C)C)O)CC,non-mutagenic
+Nc1c2CCCCc2nc2c1cccc2,mutagenic
+C[n+]1cccc(c1)C(=O)O,non-mutagenic
+[O-][N+](=O)c1ccccc1c1ccccc1,non-mutagenic
+C#C[C@@]1(CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=CC(=O)CC[C@H]12)OC(=O)C,non-mutagenic
+OCC1OC(CC1O)n1c(O)nc2c1nc(N)nc2O,non-mutagenic
+N#Cc1cccc2c1nccc2,mutagenic
+O=C(c1ccc(cc1)[N+](=O)[O-])/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+ClC(C(=O)C(Cl)(Cl)Cl)Cl,mutagenic
+O=NN(C(=O)N)CCC(=O)O,mutagenic
+OCc1ccc(cc1)OC,non-mutagenic
+Oc1ccc2c(c1)cc1c(c2)c2ccccc2c2c1cccc2,mutagenic
+Brc1ccc(cc1)C(=O)/C=C/c1ccccc1,non-mutagenic
+Sc1ccc(cc1)[N+](=O)[O-],mutagenic
+N#Cc1ccc(cc1)/C=C/c1ccc(cc1)N,mutagenic
+COc1ccc(cc1N)[N+](=O)[O-],mutagenic
+O[C@@H]1[C@@H](O)C[C@@](C[C@H]1O)(O)C(=O)O,non-mutagenic
+BrC(=C)C(=O)O,non-mutagenic
+CN1CC(O)c2c3C1Cc1ccccc1-c3c1c(c2)OCO1,mutagenic
+Nc1cc(N)c(cc1N=Nc1cccnc1)C,mutagenic
+CCCCOP(=O)(Oc1ccccc1)OCCCC,non-mutagenic
+OCCC(C)C,non-mutagenic
+Nc1ccc(cc1)N=Nc1ccccc1,mutagenic
+OC(=O)CSc1ccc2-c3ccccc3C(=O)c3c2c1ccc3,mutagenic
+Nc1nc(N)c2c(n1)nc[nH]2,non-mutagenic
+N#Cc1ccccc1[N+](=O)[O-],non-mutagenic
+OC(=O)c1ccc(cc1)N=Nc1ccc(c(c1)C(=O)O)O,non-mutagenic
+OC(=O)/C=C/c1ccccc1[N+](=O)[O-],non-mutagenic
+Nc1ccc(c2c1cccc2)S(=O)(=O)O,non-mutagenic
+CCOC(=O)OC(c1ccnc2c1cc(OC)cc2)C1CC2CCN1CC2C=C,non-mutagenic
+CCOP(=O)(Oc1noc(c1)c1ccccc1)OCC,non-mutagenic
+CCCCON(C(=O)c1ccc(cc1)C)OC(=O)C,mutagenic
+C/C=C(/C=O)\Cl,mutagenic
+OC(=O)CCC(=O)Nc1ccc(c(c1Cl)Cl)Cl,non-mutagenic
+OC(=O)CCC(=O)CC(=O)C,non-mutagenic
+ClC(C1=C(Cl)C(=O)OC1)Cl,mutagenic
+O=C(C(=C)C)OCCCCOC(=O)C(=C)C,non-mutagenic
+CCOP(=O)(Oc1nc(Cl)c(cc1Cl)Cl)OCC,non-mutagenic
+CCN(c1ccc(cc1)C(=C1C=CC(=[N+](CC)CC)C=C1)c1ccccc1)CC,mutagenic
+NCCNCCN,non-mutagenic
+COc1ccc(cc1)S(=O)(=O)n1ncc(c(c1=O)Cl)Cl,non-mutagenic
+N=C1C=CC(=C(c2ccc(cc2)N)c2ccc(cc2)N)C=C1,mutagenic
+c1ccc2c(c1)[nH]nn2,mutagenic
+CC(=O)/C=C\c1ccc2c(c1)OCO2,non-mutagenic
+O=NN(C(=O)c1n(C)cnc1N(C(=O)OC(C)(C)C)C)C,mutagenic
+Cc1ccc2c(c1)c1cc3ccccc3cc1cc2,mutagenic
+Fc1ccc(cc1)C(=O)/C=C/c1ccccc1,non-mutagenic
+O[C@H]1Cc2c3c1c1ccc4c(c1cc3ccc2C)cccc4,mutagenic
+COC(=O)[C@H]1c2cc3C(=O)c4cccc(c4C(=O)c3c(c2[C@@H](C[C@@]1(O)CC)O)O)O,mutagenic
+C=Cc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl,non-mutagenic
+OCCc1ccccc1,non-mutagenic
+CCC=O,non-mutagenic
+O=C(C1CCC2C(C1)O2)OCC1CCC2C(C1)O2,mutagenic
+OC1C=Cc2c(C1O)ccc1c2cc2ccc3c(c2c1)cccc3,mutagenic
+ClCC[N+](C)(C)C,non-mutagenic
+COC(=O)c1ccccc1NC,non-mutagenic
+CCOc1cccc(c1)[N+](=O)[O-],non-mutagenic
+FCCn1cc(C(=O)O)c(=O)c2c1c(F)c(N1CCN(CC1)C)c(c2)F,mutagenic
+CC(COC(=O)C(=C)C)O,non-mutagenic
+ONc1ccc2c(n1)n1cccc(c1n2)C,mutagenic
+COc1cc(C=O)c(cc1OC)OC,non-mutagenic
+COc1nsc2c1cccc2OCC1CO1,mutagenic
+Clc1cc2NCNS(=O)(=O)c2cc1S(=O)(=O)N,non-mutagenic
+OC1C=Cc2c(C1O)c1cc3ccc4c(c3cc1cc2)cccc4,mutagenic
+Cc1cscc1,non-mutagenic
+CN(C#N)C,non-mutagenic
+CCCCCCNC(=O)n1cc(F)c(=O)[nH]c1=O,non-mutagenic
+COC(=O)c1cc2OCOc2c2c1ccc1c2cccc1OC,mutagenic
+CCOC1=CC(=O)C(=CC1=O)NC(=O)C,mutagenic
+BrC(C(Br)(Br)Br)Br,non-mutagenic
+CNC(=O)Nc1ccccc1,non-mutagenic
+Cc1cc(C)c(c(c1N)C)N,mutagenic
+CCNc1nc(NC(C)C)nc(n1)O,non-mutagenic
+C[C@H](CCl)O,mutagenic
+Nc1ccc2-c3c4c(-c2c1)cccc4ccc3,mutagenic
+[O-][N+](=O)CCO,mutagenic
+COc1ccc(c(c1)O)C(=O)c1ccccc1,non-mutagenic
+OC(=O)c1ccccc1C(=O)O,non-mutagenic
+CN(CCCNc1c2ccccc2nc2c1c(ccc2F)[N+](=O)[O-])C,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)cc2c1CCC=C2,mutagenic
+Nc1sc2c(-c3cccnc3CC2(C)C)n1,mutagenic
+CCCC[C@H](COC(=O)C=C)CC,non-mutagenic
+Oc1ccccc1/C=N/c1snc2c1cccc2,non-mutagenic
+CC(=O)N(c1ccc2-c3c(Cc2c1)cccc3)O,mutagenic
+Oc1cccc(c1)Nc1ccccc1,non-mutagenic
+CCN(C(=S)SCC(=C)Cl)CC,mutagenic
+Oc1c(Br)cc(cc1Br)C1(OS(=O)(=O)c2c1cccc2)c1cc(Br)c(c(c1)Br)O,non-mutagenic
+CCN(C#N)N=O,mutagenic
+OCOC(C)(C)C,non-mutagenic
+BrCC(COP(=O)(OCC(CBr)(Br)C)OCC(CBr)(Br)C)(Br)C,non-mutagenic
+CO[C@@]12[C@H]3N[C@H]3CN2C2=C([C@@H]1COC(=O)N)C(=O)C(=C(C2=O)C)N,mutagenic
+CCCCCCCC(=O)O,non-mutagenic
+Oc1ccc2c(c1)c1c(cc2)ccc2c1ccn2C,mutagenic
+CC(=O)OCc1c2ccccc2c(c2c1ccc1c2cccc1)C,mutagenic
+[O-][N+](=O)c1c(N)cccc1O,non-mutagenic
+c1ccc2c(n1)c1ccc3c(c1cc2)nccc3,mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(nc1=O)N)O)O)n1cnc2c1ncnc2N,non-mutagenic
+c1ccc2-c3c4c(-c2c1)cc1ccccc1c4ccc3,mutagenic
+O[C@H](COc1cccc(c1C)C)CNC(C)(C)C,non-mutagenic
+O=Cc1cc(OC(=O)C)c2c(c1)N1CC3C(C(C2COC(=O)N)(O1)OC(=O)C)N3C(=O)C,mutagenic
+OC1C2OC2c2c(C1O)c1cccnc1cc2,non-mutagenic
+CN(c1ccc(cc1)N(C)C)C,mutagenic
+CCCN(c1snc2c1cccc2)C(=O)CCCl,mutagenic
+ClCCN(CCCl)CCCC(Nc1c2cc(OC)ccc2nc2c1ccc(c2)Cl)C,mutagenic
+[O-][N+](=O)c1cnc(s1)N,mutagenic
+[O-][N+](=O)c1cc2CCc3c4-c2c(c1)CCc4cc1c3CCCC1,mutagenic
+CCCCCCCCCCCCCCCCCCN,non-mutagenic
+[O-][N+](=O)c1cc(N)c(c(c1)S(=O)(=O)O)O,non-mutagenic
+c1ccc2c(c1)cc1c(c2[C@@H]2CO2)ccc2c1cccc2,mutagenic
+Oc1ccc(cc1)CCC(=O)c1c(O)cc(cc1O)O,non-mutagenic
+CCCCCCC=O,non-mutagenic
+COc1cc(cc(c1O)OC)[C@H]1[C@@H]2C(=O)OC[C@@H]2[C@@H](c2c1cc1OCOc1c2)O[C@@H]1O[C@@H]2CO[C@H](O[C@H]2[C@@H]([C@@H]1O)O)c1cccs1,mutagenic
+ClC(Br)(Cl)Cl,mutagenic
+CC[C@@H]1NC(=O)c2c(N1)cc(c(c2)S(=O)(=O)N)Cl,non-mutagenic
+Oc1nc2c(C)cccc2nc1O,mutagenic
+[O-][N+](=O)c1cccc2c1nc1ccccc1n2,mutagenic
+[O-][N+](=O)c1cc(ccc1c1cccc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+O=NN(Cc1ccc(cc1)Br)C,mutagenic
+CNc1ncnc(c1)Oc1ccc(cc1)N,mutagenic
+CC(=O)Nc1ccc(cc1)c1ccc(cc1)NC(=O)C,mutagenic
+CC(=O)Nc1ccc(cc1)Oc1ccccc1,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1cc(ccc1[nH]2)[N+](=O)[O-],mutagenic
+COc1c(O)cc2c(c1O)c(=O)cc(o2)c1ccc(cc1)O,non-mutagenic
+CC(=O)ON(c1ccc(cc1)Oc1ccc(cc1)NC(=O)C)C(=O)C,mutagenic
+CCCCCCCCCCCCCCCC(=O)O,non-mutagenic
+OC(=O)Cc1ccc(cc1)NC(=O)C,non-mutagenic
+COc1ccccc1O,non-mutagenic
+Cc1ccc2c(c1)nc1-c3ccccc3C(C(c1c2C)O)O,non-mutagenic
+COC1=CC(=O)c2c(C1=O)nc(c1c2[nH]c2c1CCCC2)C,mutagenic
+O=C1CCCCCCCCCCCCCCO1,non-mutagenic
+OC[C@@H]1O[C@H](CN=[N+](C)[O-])[C@H]([C@@H]([C@H]1O)O)O,non-mutagenic
+ClCC=C,mutagenic
+NC(C(=O)O)CSC(C(F)F)(F)F,non-mutagenic
+C/C=C/c1cccc(c1OC)OC,mutagenic
+[O-][N+](=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1O)C,mutagenic
+NC(=O)c1ccccc1,non-mutagenic
+CCCCN(CCCC)CCCC,non-mutagenic
+Oc1ccc2c(c1)c1ccc3c(c1cc2)cccc3,mutagenic
+c1ccc2c(c1)nc1-c3cccc4c3c(-c1c2)ccc4,non-mutagenic
+CN(CCNC(=O)c1cccc2c1nc1ccccc1n2)C,mutagenic
+ClC[C@@]12[C@H](Cl)[C@@H]([C@H]([C@]2(CCl)C(Cl)Cl)CC1(Cl)Cl)Cl,mutagenic
+Oc1ccc2c(c1)nc([nH]2)N,mutagenic
+CCC/C=C(\C=O)/CC,non-mutagenic
+Nc1cccc(n1)N,mutagenic
+Cc1cc(ccc1N=Nc1cc(c2c(c1N)cccc2)S(=O)(=O)O)c1ccc(c(c1)C)N=Nc1cc(c2c(c1N)cccc2)S(=O)(=O)O,non-mutagenic
+[O-][N+](=O)c1cc(ccc1c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+OCc1cc(ccc1O)C(=O)CN(C(C)(C)C)Cc1ccccc1,mutagenic
+C/C(=C\C=O)/Cl,mutagenic
+CC(=O)NCc1onc(n1)c1ccc(o1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc2c(c1)nc(n2Cc1ccccc1)/C=N/OCc1ccccc1[N+](=O)[O-],mutagenic
+Nc1ccc(cc1)S(=O)(=O)Nc1cnc2c(n1)cccc2Cl,non-mutagenic
+[O-][N+](=O)c1cccc2c1n[nH]c2,mutagenic
+ClCCNCCCNc1c2ccc(cc2nc2c1nc(OC)cc2)Cl,mutagenic
+[O-][n+]1cnc2c(c1N)ncn2C(c1ccccc1)c1ccccc1,mutagenic
+CCCCCN,non-mutagenic
+CC/C=C/1\OC(=O)c2c1cccc2,mutagenic
+CN(CCNC(=O)c1cccc2c1nc(cn2)c1ccccc1)C,mutagenic
+COc1cc(ccc1Nc1c2ccccc2nc2c1cccc2)NS(=O)(=O)C,mutagenic
+CCCCCCCOc1ccccc1NC(=O)OC(CN(CC)CC)C,non-mutagenic
+O=C1C=CC(=N#N)C=C1,mutagenic
+OC(=O)c1ccc(c(c1)C)[N+](=O)[O-],mutagenic
+C=CCOC[C@H]1CO1,mutagenic
+CC[C@H](OC(=O)/C=C/c1ccc(o1)[N+](=O)[O-])C,mutagenic
+OC1C(O)C2OC2c2c1ccc1c2c2ccccc2cc1,mutagenic
+CCCCOCC(=O)O,non-mutagenic
+CN([P+](N(C)C)(N(C)C)On1nnc2c1cccc2)C,non-mutagenic
+COc1ccc2c(c1)C1CCCCC1C=C2,mutagenic
+Cc1ccccc1C,non-mutagenic
+Clc1ccc(c(c1)Cl)Cn1nc(c2c1cccc2)C(=O)O,non-mutagenic
+CC(c1cc(Cc2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)cc(c1O)C(C)(C)C)(C)C,non-mutagenic
+CC(=O)C(=C)C,non-mutagenic
+CCOc1ccc(cc1)NC(=O)C[C@H](O)C,mutagenic
+N#N=Nc1ccc2c(c1)nc1c(c2Nc2ccc(cc2)C(=O)O)cccc1,mutagenic
+ICC[C@@H]1OC[C@H](O1)CO,mutagenic
+O=C(c1csc(c1)[N+](=O)[O-])Nc1ccccc1,mutagenic
+CC(CCOC(=O)CC(C)C)C,non-mutagenic
+ClCc1ccncc1,non-mutagenic
+COc1c2C(=O)c3ccccc3C(=O)c2cc(c1CO)O,mutagenic
+Cc1ccc(cc1)COS(=O)(=O)c1ccc(cc1)C,non-mutagenic
+OC(=O)COc1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+ClC([N+](=O)[O-])(Cl)Cl,mutagenic
+Brc1ccc2c(c1)C1OC1C1C2CCCC1,non-mutagenic
+CCCCCCCCCCCCCCCC(=O)OCC1(O)CC23CC1CCC3C1(C(CC2)c2ccoc2C=C1)C,non-mutagenic
+O=Cc1ccc(o1)[N+](=O)[O-],mutagenic
+OCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+Oc1ccc(c(c1)C)C,non-mutagenic
+O=CC1=CCCC2(C1(C=O)C2)C,mutagenic
+CSc1ccc(cc1)Cl,non-mutagenic
+ONc1ccc(cc1)C(=O)C,mutagenic
+OC(=O)c1cc(O)c(c(c1)O)O,non-mutagenic
+C=CCN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+Oc1ccc2c(c1O)c(C)c1c(c2)c2ccccc2cc1,mutagenic
+CCC(COC(=O)CCCCC(=O)O)CCC(O)C,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)N)N,mutagenic
+OCc1c2ccccc2c(c2c1c1ccccc1cc2)COS(=O)(=O)O,mutagenic
+Nc1ccc2c(c1N=Nc1ccc(cc1)c1ccc(cc1)N=Nc1cc(c3c(c1N)cccc3)S(=O)(=O)O)c(O)cc(c2)S(=O)(=O)O,mutagenic
+Oc1cccc2c1C(=O)c1c(C2=O)cccc1O,mutagenic
+OCCCCCCCCCCCCCCCCCC(=O)O,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2sc2c1cccc2,mutagenic
+CN(c1ccc(cc1)c1ccc(cc1)N(C)C)C,non-mutagenic
+O/N=C(/c1ccc2c(c1)nc([nH]2)NC(=O)OC)\c1ccc(cc1)F,mutagenic
+COc1c(O)c2OC3C(c2c2c1c1CCC(=O)c1c(=O)o2)C=CO3,mutagenic
+Fc1ccc2c(c1)cc1-c3cccc4c3c(-c1c2)ccc4,mutagenic
+N#CC(N=NC(C#N)(C)C)(C)C,non-mutagenic
+C=CC(=O)NCCC[N+](C)(C)C,non-mutagenic
+OC(=O)C[N+](C)(C)C,non-mutagenic
+OCCNCCO,non-mutagenic
+Oc1ccc2c(c1)C(=O)c1c(C2=O)cc(cc1)O,non-mutagenic
+Nc1cc([N+](=O)[O-])c(cc1Cl)N,mutagenic
+COP(=O)([C@@H](C(Cl)(Cl)Cl)O)OC,mutagenic
+O=C1OCCN1/N=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+Clc1cc2Oc3c(Oc2cc1Cl)cc(c(c3Cl)[N+](=O)[O-])Cl,non-mutagenic
+CCCCOCC=O,non-mutagenic
+CCCC[C@H](COC(=O)/C=C/c1ccc(cc1)OC)CC,non-mutagenic
+CS(=O)CCC(=O)N1C(CSC1c1ccccc1O)C(=O)O,non-mutagenic
+CCCCOC(=O)c1ccc(cc1)O,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2cc2ccccc2c1[N+](=O)[O-],mutagenic
+O/N=C(/c1ccccc1)\N,mutagenic
+Clc1cc(N)c(c(c1)C(=O)O)Cl,mutagenic
+CCOP(=O)(O/C(=C\Cl)/c1ccc(cc1Cl)Cl)OCC,mutagenic non-mutagenic
+Nc1ccc(cc1)N=Nc1cccc(c1N)N,mutagenic
+CC1=C[C@]2(O[C@@H](C1)[C@@H](/C=C/[C@H]1CC[C@]3(O1)CC[C@@H]1[C@@H](O3)[C@H](O)C(=C)[C@H](O1)[C@H](C[C@@H]([C@H]1O[C@@]3(CCCCO3)CC[C@H]1C)C)O)C)O[C@@H](CC[C@@H]2O)C[C@](C(=O)O)(O)C,non-mutagenic
+OC(=O)C(Oc1ccc(cc1)[C@@H]1CC1(Cl)Cl)(C)C,non-mutagenic
+O=C(c1ccc(cc1)N)OCCCOC(=O)c1ccc(cc1)N,non-mutagenic
+CC(COC(=O)/C=C/c1ccc(o1)[N+](=O)[O-])C,mutagenic
+Oc1cnnc(n1)O,mutagenic
+C=Cc1ccccc1C=C,non-mutagenic
+Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)ccc(c1)O,non-mutagenic
+O=C(C(=C)C)OCCOC(=O)C(=C)C,non-mutagenic
+CCCCCCCCCCCC(=O)O,non-mutagenic
+Nc1ccc(cc1)c1ccccc1C,mutagenic
+OC(=O)C(Br)(Br)Br,mutagenic
+CN(c1c(C)n(n(c1=O)c1ccccc1)C)CS(=O)(=O)O,mutagenic
+Ic1cc2cccnc2c(c1)C(=O)O,non-mutagenic
+ClC([C@H]1OC1)(Cl)Cl,mutagenic
+O=S(=O)(N1C2C1c1ccccc1-c1c2cccc1)Cc1ccccc1,mutagenic
+OC1CCCc2c1c([N+](=O)[O-])c1c3c2ccc2c3c(cc1)ccc2,non-mutagenic
+OCc1c(CO)cnc(c1O)C,non-mutagenic
+CC(CCOS(=O)(=O)C)C,mutagenic
+BrC(c1ccccc1)C(=O)NCc1ccccc1,non-mutagenic
+ClC(=O)c1c(Cl)cccc1Cl,mutagenic
+O=C1C=C(N)c2c(C1=O)cccc2,mutagenic
+Cc1cc2ccccc2c(c1)[N+](=O)[O-],mutagenic
+COS(=O)(=O)F,mutagenic
+Clc1ccc(cc1)OC(C(=O)C(C)(C)C)n1cncc1,non-mutagenic
+OCC1OC(C(C1O)O)n1cnc2c1ncnc2N,non-mutagenic
+ClCC(Cl)(Cl)Cl,non-mutagenic
+O=C(c1csc(c1)[N+](=O)[O-])Nc1ccccc1[N+](=O)[O-],mutagenic
+CC(=C)C=O,mutagenic
+c1ccc2c(c1)cc1c(c2)c2Oc2c2c1cccc2,mutagenic
+Clc1cc(Cl)cc(c1Oc1ccc(cc1)[N+](=O)[O-])Cl,mutagenic non-mutagenic
+CC[C@H](c1ccccc1O)C,non-mutagenic
+c1ccc(cc1)Cc1ccccc1OCC1CO1,mutagenic
+CC[n+]1c2ccccc2nc2c1cccc2,mutagenic
+O=CC1=C2C=C(C)OC=C2[C@H]([C@@](C1=O)(C)O)O,mutagenic
+Nc1ccc2c(c1)[n+](C)c1c(c2)cccc1,mutagenic
+[O-][N+](=O)c1cccc2c1cccc2[N+](=O)[O-],mutagenic
+CC(=O)C1c2cccc(c2C(=O)c2c1cccc2O)O,mutagenic
+Clc1cc2Oc3cc(Cl)c(cc3Oc2cc1Cl)Cl,non-mutagenic
+OCC(C(C(C(C1SCC(N1N=O)C(=O)O)O)O)O)O,non-mutagenic
+CCCN(S(=O)(=O)c1ccc(cc1)C(=O)O)CCC,non-mutagenic
+[O-][N+](=O)c1cc(ccc1Cl)C(=O)O,mutagenic
+Clc1cccc(c1NC1=NCCN1)Cl,non-mutagenic
+N#CCCC#N,non-mutagenic
+OC(=O)CN=N#N,non-mutagenic
+C=COCC(F)(F)F,mutagenic
+[O-][N+](=O)c1ccc(cc1)Nc1[nH]cnc2-c1ncn2,non-mutagenic
+OC(=O)C[C@@H](C(=O)O)Cl,non-mutagenic
+Oc1ccc(cc1)C(=O)/C=C/c1ccccc1,non-mutagenic
+Clc1ccccn1,mutagenic
+OC1=C(C2=C(O)C(=C(C(=O)C2=O)C)O)C(=O)C(=O)C(=C1O)C,non-mutagenic
+COc1cc(N)c2c(c1N)C(=O)c1c(C2=O)cccc1,mutagenic
+C[C@H](OC(=O)C)CN(C[C@@H](OC(=O)C)C)N=O,mutagenic
+Oc1cc2ccc3c4c2c(n1)ccc4ccc3,mutagenic
+[O-][N+](=O)c1ccc2c3c1c1CCCCc1c1c3c(cc2)ccc1[N+](=O)[O-],mutagenic
+C[Si](N[Si](C)(C)C)(C)C,non-mutagenic
+Cc1ccc2c(c1)c(C)c1c(n2)c2ccccc2cc1,mutagenic
+ClCc1cnc(nc1Cl)Cl,mutagenic
+COc1cccc(c1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+Oc1ccc(c2c1C(=O)c1ccccc1C2=O)N,mutagenic
+c1ccc(cc1)c1ccccc1,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)Oc1c(O2)cc(cc1)[N+](=O)[O-],mutagenic
+OC1C(O)c2cc3c(cc2-c2c1cccc2)ccc1c3cccc1,mutagenic
+CCC1=C(O)C(=O)c2c(C1=O)c(O)c(c(c2O)O)O,mutagenic
+N1CCNCC1,non-mutagenic
+O=C1C=CC(=O)c2c1nc(C)c1c2[nH]c2c1cccc2,mutagenic
+Cc1ccc2c(c1)cccc2[N+](=O)[O-],mutagenic
+O1CCOCCOCCOCCOCC1,non-mutagenic
+C=CCc1ccccc1OCC(CNC(C)C)O,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1c1ccccc1c1c3c(cc2)ccc1,mutagenic
+CCOP(=S)(S[C@@H]1OCCO[C@H]1SP(=S)(OCC)OCC)OCC,mutagenic
+OC/C=C(/CCC=C(C)C)\C,non-mutagenic
+Clc1ccc(c(c1)[N+](=O)[O-])Cl,mutagenic
+Nc1cccc2c1-c1ccccc1C2,mutagenic
+OC1CCC2(C(C1)CCC1C2CCC2(C1CCC(=O)N2)C)C,non-mutagenic
+OCCCNP(=O)(N(CCCl)CCCl)O,mutagenic
+OCC(Cl)(Cl)Cl,mutagenic
+CCCCNc1snc2c1cccc2,non-mutagenic
+O=CNc1ccccc1,non-mutagenic
+CCCCOc1ccc(cc1)/C=N/c1ccc(cc1)CC,mutagenic
+CC(C1=CC(=O)C(=CC1=O)C)C,non-mutagenic
+OC1OC(=O)C(=C1Cl)Cl,mutagenic
+Fc1ccc2c(c1)cccn2,mutagenic
+C=Cc1ccc(cc1)[N+](=O)[O-],mutagenic
+COC(=O)c1occ(c1c1ccccc1)c1ccccc1,non-mutagenic
+CN=[N+](C)[O-],mutagenic
+CCC(=O)OCc1ccc(cc1)[N+](=O)[O-],mutagenic
+CCC(c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-])C,non-mutagenic
+CSCC[C@@H](C(=O)OCC)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)F)N)Cc1cccc(c1)N(CCCl)CCCl,mutagenic
+O1C2C1c1cscc1-c1c2csc1,mutagenic
+CC(OC(=O)c1cc(ccc1N)Cc1ccc(c(c1)C(=O)OC(C)C)N)C,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2nccc1,mutagenic
+c1ccc2c(c1)cc1c(c2)c2cnccc2cc1,mutagenic
+Oc1cccc2c1C(=O)c1c(C2)cccc1O,non-mutagenic
+Nc1cccc2c1c(N)ccc2,mutagenic
+CC(=O)c1cccn1[N+](=O)[O-],mutagenic
+SCc1ccccc1,non-mutagenic
+Nc1ccc(c(c1)[N+](=O)[O-])c1ccc(cc1N)[N+](=O)[O-],mutagenic
+Brc1cc2c(c(c1O)Br)Oc1c(C32OS(=O)(=O)c2c3cccc2)cc(c(c1Br)O)Br,mutagenic
+CC(=O)Nc1ccc(cc1)C,mutagenic
+Nc1ncnc2c1ncn2C(c1ccccc1)c1ccccc1,mutagenic
+Br/C=C/c1cn(C2CC(C(O2)CO)O)c(=O)[nH]c1=O,non-mutagenic
+N#Cc1ccc(cc1)C(=O)ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+OCC1C=CC(C1)n1cnc2c1nc(N)nc2O,non-mutagenic
+COC(=O)c1c2C=CC(Oc2c2c(c1O)cccc2)(C)C,mutagenic
+C=CC(=O)OC(C)(C)C,non-mutagenic
+Nc1c2C(=O)c3ccccc3C(=O)c2c(cc1S(=O)(=O)O)NC1CCCCC1,non-mutagenic
+CCCC[C@@H]1C(=O)N(N(C1=O)c1ccc(cc1)O)c1ccccc1,mutagenic
+BrC[C@H]([C@@H]([C@@H]([C@H](CBr)O)O)O)O,mutagenic
+CCc1nc2c(nc1CC)ccc(c2C)NC,mutagenic
+O=C(C(Br)(C)C)NCc1ccccc1,non-mutagenic
+COP(=O)OC,mutagenic
+NC(=O)NO,mutagenic
+CC(CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCC(C)C)C,non-mutagenic
+[O-][N+](=O)c1n(C)cnc1c1ccccc1,mutagenic
+CNc1ccc2c(c1)c1cc(O)ccc1cc2,mutagenic
+BrCC(=O)c1oc(c(c1c1ccccc1)c1ccccc1)[N+](=O)[O-],mutagenic
+CCN(c1ccc2c(c1)oc(=O)cc2C)CC,non-mutagenic
+Clc1cccc(c1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+O=C1c2ccccc2C(=O)c2c1c(O)c(c(c2)O)O,mutagenic
+Oc1cc(Cl)cc(c1)Cl,non-mutagenic
+ClCc1c2ccccc2cc2c1cccc2,mutagenic
+CC(=C)C1CCC(=C)C2C1C=C(C)C(=O)C1=C2C(=O)C(C1)(C)O,non-mutagenic
+CCCCBr,mutagenic
+Cc1cc(C)c(cc1C)C,non-mutagenic
+Nc1cc(N)c(c(c1)[N+](=O)[O-])c1ccccc1,mutagenic
+CCc1cccc(c1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+COc1ccc(cc1)[Se]c1ccc(cc1)OC,mutagenic
+c1cc2[C@@H]3N[C@@H]3c3c2c(c1)ccc3,mutagenic
+O=C1c2cc(ccc2-c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+CCOC(=O)COc1ccc2c(c1)oc(cc2=O)c1ccccc1,non-mutagenic
+Clc1ccc(cc1)CO[C@@H](c1ccc(cc1Cl)Cl)Cn1cncc1,non-mutagenic
+c1cccs1,non-mutagenic
+CC(F)(F)F,non-mutagenic
+CCCCOB(OCCCC)OCCCC,non-mutagenic
+O=C1CCCCCCCCCCCC(=O)OCCO1,non-mutagenic
+[O-][N+](=O)NC(=N)N(N=O)CCC,mutagenic
+OC=O,non-mutagenic
+OCC(COc1ccc(cc1)C(c1ccc(cc1)OCC1CO1)(C)C)O,mutagenic
+Oc1ccc(cc1Cc1cc(Cl)ccc1O)Cl,mutagenic
+CBr,mutagenic
+OCCCC1(O)CCC2C1(C)CC(c1ccc(cc1)N(C)C)C1=C3CCC(=O)C=C3CCC21,non-mutagenic
+ClCCCc1cn(C2CC(C(O2)CO)O)c(=O)[nH]c1=O,non-mutagenic
+CCCC=O,non-mutagenic
+CCCCCC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)CCCCC,mutagenic
+Cc1ccc2c(c1)ccc(c2)[N+](=O)[O-],mutagenic
+[O-][n+]1ccc(cc1)[N+](=O)[O-],mutagenic
+ClC(=C(Cl)Cl)C(=C(Cl)Cl)Cl,non-mutagenic
+n1ccc2c(c1)cc1c(c2)c2ccccc2cc1,mutagenic
+ClNc1ccc2-c3c(Cc2c1)cccc3,mutagenic
+[O-][N+](=O)c1cnc2c(c1)nc1n2cccc1,mutagenic
+Cc1ccc(c2c1c1ccccc1[nH]2)C,mutagenic
+Cc1cc2ncccc2c2c1n(C)cn2,non-mutagenic
+C/C=C\1/C[C@H](C)[C@@](O)(CO)C(=O)OCC2=CCN3[C@@H]2[C@H](OC1=O)CC3,mutagenic
+CC(CNc1snc2c1cccc2)C,non-mutagenic
+[O-][N+](=O)c1ccc2c(-c3ccccc3C2=O)c1,mutagenic
+Nc1ccc2-c3c(Cc2c1)cccc3,mutagenic
+CN(c1ccc(cc1)N=Nc1ccc2c(c1)cn[nH]2)C,mutagenic
+BrCc1c2ccc3c4c2c(c2c1cccc2)ccc4ccc3,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C(/C(=O)OC)\C#N,mutagenic
+Cc1cc(C)c2c(c1)ccc1c2cccc1,mutagenic
+OC(=O)c1ccc(cc1N)[N+](=O)[O-],mutagenic
+CC(C(O)C)O,non-mutagenic
+CCC1(OCCc2c1[nH]c1c2cccc1C)CC(=O)O,non-mutagenic
+Nc1cc(N)c(cc1N=Nc1ccc(cc1)c1ccc(cc1)N=Nc1ccc(c(c1)C(=O)O)O)N=Nc1ccc(cc1)S(=O)(=O)O,mutagenic
+[O-][N+]1(C)CCC(=CC1)c1ccccc1,non-mutagenic
+CC(=O)Nc1ccc(c2c1C(=O)c1c(C2=O)cccc1)NC(=O)C,mutagenic
+COc1cc2c(cc1OC)N1[C@@H]3[C@@]42CCN2[C@@H]4C[C@H]4[C@H]3[C@@H](CC1=O)OCC=C4C2,non-mutagenic
+CNc1c(C)cc2c(c1N)cccn2,non-mutagenic
+COc1nncc2c1cccc2,non-mutagenic
+CCC1OC(=O)C(C)C(OC2OC(C)C(C(C2)(C)OC)O)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(CC(CN(C(C(C1(C)O)O)C)C)C)(C)O,non-mutagenic
+Clc1ccc(c(c1)C(=O)O)O,non-mutagenic
+O=NN1C[C@H](C)C(=O)NC1=O,mutagenic
+ClCc1cc2c3ccccc3cc3c2c2c1cccc2cc3,mutagenic
+CC(c1ccc(c2-c(c1)c(C)cc2S(=O)(=O)O)C)C,non-mutagenic
+COc1ccc(cc1)[N+](=O)[O-],mutagenic
+c1cc2C=Cc3c2c(c1)cc1c3ccc2c1C=C[C@@H]1[C@H]2O1,mutagenic
+O=C1CCCc2c1ccc1c2ccc2c1cccc2,mutagenic
+Nc1cccc(c1)N,mutagenic
+O=NN1CCN(CC1)N=O,mutagenic
+C[N+](Cc1ccccc1)(C)C,non-mutagenic
+O=C=Nc1cccc2c1cccc2N=C=O,non-mutagenic
+CCCCCCCCCCCCS,non-mutagenic
+COc1cccc2c1cc1NC(=O)c3c1c2c1OCOc1c3,mutagenic
+S1CCSCC1,mutagenic
+O=C([C@@H]1OC1(C(=O)N)C(=O)N)c1ccccc1,mutagenic
+CCCCCn1cc2c3c1cccc3[C@@H]1[C@@H](C2)N(C)CC(=C1)C,mutagenic
+Nc1ccc(cc1C)Cc1ccc(c(c1)C)N,mutagenic
+O=CC(Cl)(Cl)Cl,mutagenic
+CCCCCC/C=C\CCCCCCOC(=O)C,non-mutagenic
+Oc1ccc2c(c1)cccc2S(=O)(=O)O,non-mutagenic
+CC1CCCC(=O)CCCCCc2c(C(=O)O1)c(O)cc(c2)O,non-mutagenic
+CC/C(=C(\c1ccc(cc1)O)/CC)/c1ccc(cc1)O,non-mutagenic
+CCN(c1ccc(cc1)N=Nc1ccc(cc1)[N+](=O)[O-])CC,mutagenic
+Nc1ccc2c(c1)cccn2,non-mutagenic
+OC(=S)c1ccccc1,non-mutagenic
+CCOP(=O)(Oc1cc(C)nc(n1)C(C)C)OCC,mutagenic
+COC(CCOC(=O)C)C,non-mutagenic
+OCC(C(C(C(C(=O)O)O)O)O)O,non-mutagenic
+CCOC(=O)c1[nH]c2c(c1/N=C/c1ccc(cc1)O)cccc2,mutagenic
+OC(=O)CNC(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+O=c1[nH]c(=O)[nH]c(=O)[nH]1,non-mutagenic
+Oc1ccc2c(c1N=Nc1ccc(cc1)S(=O)(=O)O)c(cc(c2)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+CCCCCC(=O)OC1(CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12)C(=O)C,non-mutagenic
+O=NN1CCC[C@@H](C1)O,mutagenic
+ClCC(=O)c1ccc(cc1Cl)Cl,mutagenic
+[O-][N+](=O)c1ccc(cc1)CNc1[nH]cnc2-c1ncn2,mutagenic non-mutagenic
+Nc1ccc2c3c1-c1ccccc1-c3ccc2,mutagenic
+CC(=O)OCc1ccc(cc1)N=Nc1ccc(cc1)COC(=O)C,mutagenic
+BrCC(C(OP(=O)(OC(C(CBr)Br)C)OC(C(CBr)Br)C)C)Br,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)c1ccc3c(c1cc2)cccc3,mutagenic
+O(CC1CCC2C(C1)O2)CC1CCC2C(C1)O2,mutagenic
+ON1c2ccccc2C(=O)C1(C)c1ccccc1,non-mutagenic
+c1ccc2c(c1)ccc1c2cc2c(c1)ccc1c2cccc1,mutagenic
+COc1cc(OC)c2c(c1)OC1C2C=CO1,mutagenic
+BrCC(Br)(Br)Br,mutagenic
+C[n+]1cccc2c1C=C[C@@H]1[C@H]2O1,mutagenic
+CNN=NC,mutagenic
+N#N=Nc1nc2c(n1C)c(C)cc1c2cccn1,mutagenic
+COC(=O)C1=C(C)N=C(C(=C(OCCc2ccc(cc2)N2CCN(CC2)C(c2ccccc2)c2ccccc2)O)C1c1cccc(c1)[N+](=O)[O-])C,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2cc2ccccc2c1Cl,mutagenic
+O=c1c2cc3ccccc3c3c2c2c(c1=O)cccc2cc3,mutagenic
+Cc1ccc2c(c1)ccc1c2c2c([nH]1)ccc1c2cccc1,mutagenic
+CN(C(=S)N(C)C)C,non-mutagenic
+CCCCCCCCCCCCCCN(c1ccc2-c3c(Cc2c1)cccc3)OC(=O)C,mutagenic
+C=C=O,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2ccc[n+]1[O-],non-mutagenic
+C=Cc1ccccc1Cl,non-mutagenic
+BrCc1cc2cccc3-c4c(-c(c1)c23)cccc4,mutagenic
+ClCCc1cn(C2CC(C(O2)CO)O)c(=O)nc1N,non-mutagenic
+NC(=S(=O)=O)N,mutagenic
+Fc1cnc2c(c1)ccc1c2cc(F)cn1,non-mutagenic
+O=CN(/C(=C(\SC(=O)c1ccccc1)/CCOC(=O)c1ccccc1)/C)Cc1cnc(nc1N)C,non-mutagenic
+OC[C@@H]1O[C@H](O[C@H]([C@@H](C(=O)N[C@@H]([C@H]([C@@H](C(=O)N[C@H](C(=O)NCCc2scc(n2)c2scc(n2)C(=O)O)[C@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)c2nc[nH]c2)[C@H]([C@H]([C@H]1O)O)O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)OC(=O)N)O,non-mutagenic
+Nc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+O=C1C=CC(=O)c2c1c(O)c(c(c2O)Cl)Cl,mutagenic
+OCCOCCOC1CCC2(C(=CCC3C2CCC2(C3CCC2C(CCCC(C)C)C)C)C1)C,non-mutagenic
+O=CN(c1ccc(cc1)Oc1ccc(cc1)NC(=O)C)O,mutagenic
+Brc1cccc(c1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+Fc1cnc2c(c1)cccc2,non-mutagenic
+[O-][N+](=O)c1c(C)cccc1C(=O)O,mutagenic
+O=C(/C=C/c1ccccc1)OC/C=C/c1ccccc1,mutagenic
+CCOP(=S)(OP(=S)(OCC)OCC)OCC,mutagenic
+O/N=C/c1cccc[n+]1COC[n+]1ccc(cc1)C(=O)N,non-mutagenic
+O[C@H]1[C@H](O)c2nc3ccc4c(c3cc2-c2c1cccc2)cccc4,non-mutagenic
+CC(CN(CC(C)C)CC(C)C)C,non-mutagenic
+[O-][N+](=O)c1c2[nH]c3c(c2cc(c1O)[N+](=O)[O-])cccc3,mutagenic
+BrCc1ccc(cc1)Br,non-mutagenic
+O=Cc1c(Cl)cccc1Cl,non-mutagenic
+CNc1nc2c(n1C)ccc1c2cccn1,mutagenic
+ClCC1(C(Cl)Cl)C2C(C(C1(C(Cl)Cl)C(C2Cl)Cl)Cl)Cl,non-mutagenic
+NCCN,mutagenic
+Nc1sc2c(n1)C1CCCNC1CC2,non-mutagenic
+O[C@@H]([C@@H](C(=O)O)O)C(=O)O,non-mutagenic
+OC[C@H]1O[C@@H](Oc2cc(O)cc3c2c(=O)c2c(o3)c(O)ccc2O)[C@@H]([C@H]([C@@H]1O)O)O,mutagenic
+c1scc(n1)c1nc2c([nH]1)cccc2,mutagenic non-mutagenic
+CCCCOc1ccc(cc1)CC(=O)NO,mutagenic
+[O-][N+](=O)c1nc2c([nH]1)cccc2,mutagenic
+Nc1ccc2c(n1)n1cccc(c1n2)C,mutagenic
+Nc1ccc(c(c1)[N+](=O)[O-])c1ccc(cc1[N+](=O)[O-])N,mutagenic
+[O-][N+](=O)c1ccc2c(c1)cc(c1c2cc(cc1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+NC(=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+Cc1ccc2c(c1)ccc(=O)o2,non-mutagenic
+OC1CCC2(C(=CCC3C2CCC2(C3CCC2=O)C)C1)C,non-mutagenic
+ONc1ccccc1,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1cc([N+](=O)[O-])c(c(c1[nH]2)[N+](=O)[O-])O,mutagenic
+ONc1ccc(cc1)C,mutagenic
+COc1ccccc1[N+](=O)[O-],mutagenic
+Oc1nncc2c1cccc2,non-mutagenic
+Cc1cc(C)c(c(c1)C)N,mutagenic
+CC(C1=CC(=CC=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C=C(C1=O)C(C)(C)C)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc(o1)/C=N/n1c(=O)cc(cc1c1ccccc1)c1ccccc1,mutagenic
+O=C1COC(=C1O)C,mutagenic
+[O-][N+](=O)[C@@H](CC)Cl,mutagenic
+COC(=O)c1cc(ccc1N)Cc1ccc(c(c1)C(=O)OC)N,mutagenic
+[O-][N+](=O)c1ccc(o1)CNCCO,mutagenic
+COc1cc(c(c(c1)C(C)(C)C)O)C(c1ncc(n1C)[N+](=O)[O-])O,mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])O,mutagenic
+Oc1ccc(cc1)C1CC(=O)c2c(O1)cc(cc2O)O,non-mutagenic
+COc1cc(CCC(=O)C)ccc1O,non-mutagenic
+CN[C@@H]([C@H](c1ccccc1)O)C,non-mutagenic
+NCCc1ccc(c(c1)O)O,mutagenic
+CCCC/C=C/C=O,mutagenic
+COC(=O)c1cccc2c1c(=O)c1c(o2)c2c(cc1OC)O[C@H]1[C@H]2C=CO1,mutagenic
+CC1=CC(O)C2CC1C2(C)C,non-mutagenic
+ICCc1ccc(cc1)OCc1ccccc1,mutagenic
+CCOC(=O)c1[nH]c2c(c1/N=C/c1cc(OC)c(c(c1)OC)OC)cccc2,mutagenic
+O=C1N[C@H](Nc2c1cccc2)c1ccc(s1)[N+](=O)[O-],mutagenic
+C=CC(=O)N1CCN(CC1)c1ccccc1,non-mutagenic
+CC(=O)c1ccc(s1)[N+](=O)[O-],mutagenic
+n1ccncc1,non-mutagenic
+CC1c2ccccc2-c2c1cccc2,mutagenic
+CC(c1cc(Br)c(c(c1)Br)O)(c1cc(Br)c(c(c1)Br)O)C,non-mutagenic
+COC=C,non-mutagenic
+OC1C(OC(C(C1O)O)COC1OCC(C(C1O)O)O)Oc1ccc2c(c1O)C(=O)c1c(C2=O)cccc1,non-mutagenic
+ClC(C(=O)O)Cl,mutagenic
+O=C1c2ccccc2-c2c3c1cccc3ccc2,mutagenic
+BrC(C(Br)C)COP(=O)(OCC(C(Br)C)Br)OCC(C(Br)C)Br,mutagenic
+CCOCN(c1c(C)cccc1CC)C(=O)CCl,non-mutagenic
+[O-][N+](=O)c1ccccc1S(=O)(=O)O,non-mutagenic
+CCCCCCC(=O)OCC,non-mutagenic
+CC(OC(Cl)(C)C)(Cl)C,mutagenic
+CCOc1ccc(cc1)N=[N+](c1ccc(cc1)OCC)[O-],non-mutagenic
+Oc1ccc2c(c1)ccc1c2c2c([nH]1)ccc1c2cccc1,mutagenic
+O=C1c2c(cccc2C(=O)c2c1cccc2S(=O)(=O)O)[N+](=O)[O-],mutagenic
+CC(=C)C(=O)OC[C@H]1CO1,mutagenic
+Cc1ccc2c(c1)C1C(=N2)N(C)c2c(C1C)cccc2,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=N/N1CC(NC1=O)C,mutagenic
+COC(=O)C(NC(=O)C)CSCC(c1ccccc1)Br,non-mutagenic
+Cc1cc(ccc1N=Nc1c(O)c2c(N)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O)c1ccc(c(c1)C)N=Nc1c(O)c2c(N)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,mutagenic
+ClCC(=O)c1ccc(cc1)NC(=O)C,mutagenic
+OCNC(=O)CCl,non-mutagenic
+ClCc1ccc(cc1)c1nc2-c(c1)c([nH]cn2)N[C@@H](c1ccccc1)C,mutagenic
+O=CC1=CC2(O)CC(CC2C(C=C1C=O)C)(C)C,mutagenic
+COc1cc(c(cc1N=Nc1c(O)ccc2c1ccc(c2)S(=O)(=O)O)C)S(=O)(=O)O,non-mutagenic
+c1ccc2c(c1)c1Cc3ccc4c(c3Cc1cc2)cccc4,mutagenic
+OCC1(C)C=C2C(=C(C)C3(C(C2=O)(C)O)CC3)C1O,mutagenic
+OCCI,mutagenic
+C=CC(c1cc2cc3CC(Oc3cc2oc1=O)C(OC(=O)C)(C)C)(C)C,non-mutagenic
+Clc1ccc(cc1)S(=O)O,non-mutagenic
+O=C1NC(=O)NC1(c1ccccc1)c1ccccc1,non-mutagenic
+Oc1ccccc1c1nc2c(o1)cccc2,non-mutagenic
+ClCCC(=O)N(c1snc2c1cccc2)CC(C)C,non-mutagenic
+O=C=Nc1ccc(cc1OC)c1ccc(c(c1)OC)N=C=O,mutagenic
+ClCC(=O)OC(P(=O)(OC)OC)C(Cl)(Cl)Cl,non-mutagenic
+[O-][N+](=O)c1cc(cc(c1O)[N+](=O)[O-])C(F)(F)F,non-mutagenic
+CCCCN(CCC(=O)O)N=O,mutagenic
+Clc1ccc2c(c1)oc1c2cccc1,mutagenic
+COc1cc(OC)c(cc1C1OC1C)OC,mutagenic
+NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+COc1c2OCOc2cc2c1nc1occc1c2OC,mutagenic
+Oc1ccc(cc1)Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+CCC(=O)C1c2cccc(c2C(=O)c2c1cccc2O)O,mutagenic
+OS(=O)(=O)c1ccc2c(c1)c(N=Nc1ccc(c(c1)C(=O)O)O)ccc2N=Nc1ccc(cc1)c1ccc(cc1)N=Nc1ccc(c(c1)C(=O)O)O,mutagenic
+[O-][N+](=O)c1cc(ccc1Cl)NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+CC(=O)N(c1ccc(cc1)[N+](=O)[O-])O,mutagenic
+CCCCCCCCCC(=O)O,non-mutagenic
+NC(C(=O)O)CSC(C(Cl)F)(F)F,non-mutagenic
+COc1c2ccc(=O)oc2c(c2c1cco2)OC,non-mutagenic
+CNC(=O)Oc1cccc2c1OC(C2)(C)C,non-mutagenic
+NC(C(=O)OC(C)(C)C)CN=N#N,mutagenic
+CCCCOC(=O)COc1ccc(cc1Cl)Cl,non-mutagenic
+Nc1ccc(c(c1Cl)Cl)Cl,non-mutagenic
+Cc1cc2cccc3c2c2c1cc1ccccc1c2cc3,mutagenic
+C/C=C\C=C,non-mutagenic
+Clc1cccc2c1nccc2,mutagenic
+OCCNCCNc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)NCCNCCO,mutagenic
+CN(CCO[C@@H](c1ccccc1C)c1ccccc1)C,non-mutagenic
+CC[C@]1(OCCc2c1[nH]c1c2ccc(c1CC)O)CC(=O)O,mutagenic
+O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@@H]1CC[C@@H]2C(=O)C)C)C,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1C)[N+](=O)[O-])C,mutagenic
+Nc1cc(N)c(cc1N=Nc1ccc(cc1)S(=O)(=O)O)C,mutagenic
+CC[N+](=C1C=CC(=C(c2ccc(cc2)S(=O)(=O)O)c2ccc(cc2)N(Cc2cccc(c2)S(=O)(=O)O)CC)C=C1)Cc1cccc(c1)S(=O)(=O)O,mutagenic
+Nc1cc2cccc3-c4c(-c(c1)c23)cccc4,mutagenic
+Cc1c2cc(C)c3c(c2nc2c1cccc2)cccc3,mutagenic
+O=C/C(=C(/C(=O)O)\Br)/Br,mutagenic
+O=C1CSC(=S)N1,non-mutagenic
+N#C/C(=N\OC(=O)OC(C)(C)C)/c1ccccc1,non-mutagenic
+BrCC=C,mutagenic
+CCC(n1c(=O)[nH]c(c(c1=O)Br)C)C,non-mutagenic
+[O-][N+](=O)c1ccc(o1)c1cscn1,mutagenic
+NC(=N)NN=C(/C=C\c1ccc(o1)[N+](=O)[O-])/C=C\c1ccc(o1)[N+](=O)[O-],mutagenic
+O=S1OC[C@H]2[C@H](CO1)[C@@]1(C([C@@]2(Cl)C(=C1Cl)Cl)(Cl)Cl)Cl,non-mutagenic
+Clc1ccc(c(c1)Cl)Cl,non-mutagenic
+N#C[C@@H]1COCCN1[C@H]1C[C@@H](O[C@H]([C@H]1O)C)O[C@H]1C[C@@](O)(Cc2c1c(O)c1c(c2O)C(=O)c2c(C1=O)c(OC)ccc2)C(=O)CO,non-mutagenic
+O=NN(Cc1cccc(c1)OC)C,mutagenic
+[C-]#[O+],non-mutagenic
+CCCCOc1ccc2c(n1)c(NCCCNCCCl)c1c(n2)cc(cc1)Cl,mutagenic
+Cc1cc(C)cc(c1)N,mutagenic
+Oc1c(Cl)cc(c(c1Cl)Cl)Cl,non-mutagenic
+CC(=O)Oc1cccc2c1nccc2,non-mutagenic
+Fc1cc(F)c2c(c1)nccc2,mutagenic
+CCCCCCCCCCOC(=O)C(=C)C,non-mutagenic
+O=C(c1ccccc1)C(=O)C,non-mutagenic
+Cc1ccc2c(c1)c(C)c1c(c2)cccc1,mutagenic
+OCC1OC(CC1O)n1cnc2c1ncnc2N,non-mutagenic
+CC(S)C,non-mutagenic
+Clc1cccc2c1cc1ccccc1c2,non-mutagenic
+c1ccc2c(c1)c1ccc3c4c1c(c2)sc4ccc3,mutagenic
+CC(=O)Nc1ccc2c3c1ccc1c3c(cc2)c(cc1)O,mutagenic
+Cc1ccc(cc1)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)O,non-mutagenic
+CC(=O)N(c1ccc(c(c1)Cl)Cl)O,non-mutagenic
+OCc1ccc2c(c1)c(CO)c1c(n2)c2ccccc2cc1,mutagenic
+ClC(c1ccccc1)C(=O)NCc1ccccc1,mutagenic
+O=C[C@H]([C@H]([C@@H]([C@H](O)C)N)O)O,non-mutagenic
+Clc1c2Oc3c(Oc2c(c(c1Cl)Cl)Cl)c(Cl)c(c(c3Cl)Cl)Cl,non-mutagenic
+OCC1OC(CC1O)n1cc(C=O)c(=O)[nH]c1=O,non-mutagenic
+O1C(C1c1ccccc1)c1ccccc1,non-mutagenic
+OCc1cc2cccc3c2c2c1c1ccccc1cc2cc3,non-mutagenic
+OC1C2OC2c2c(C1O)ccc1c2ccc2c1CCC2,mutagenic
+Cc1nccc2c1[nH]c1c2cccc1,mutagenic
+O=NN1C(Cc2c(C1C)[nH]c1c2cc(cc1)[N+](=O)[O-])C(=O)OC,mutagenic
+CCN(c1ccc(cc1)N=Nc1ccc(cc1Cl)[N+](=O)[O-])CC[N+](C)(C)C,mutagenic
+COc1ccc2c(c1)oc(=O)cc2CBr,non-mutagenic
+Nc1ccc2c(c1)nc1c(n2)cc(cc1)N,mutagenic
+Nc1ccc2-c3c(Cc2c1C(C)(C)C)cccc3,non-mutagenic
+c1ccc2c(c1)cccc2,non-mutagenic
+COc1ccc(cc1)O,non-mutagenic
+Oc1ccc2c(c1)c1c(cc2)ccc2c1CCN2C,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)c2c(c1)CCC=C2,mutagenic
+C[C@H](CNC[C@H](O)C)O,non-mutagenic
+c1ccc2c(c1)[nH]cn2,non-mutagenic
+OC(=O)C(NC(=O)COc1cc(Cl)c(cc1Cl)Cl)CCC(=O)O,non-mutagenic
+COP(=O)(SC)OC,non-mutagenic
+CCc1ccnc2c1cccc2,non-mutagenic
+CCCOC(c1ccccc1)(c1ccccc1)C(=O)OC1CCN(CC1)C,non-mutagenic
+[O-][N+](=O)[CH-]CCC,non-mutagenic
+Oc1ccc(cc1)C1(CCCCC1)c1ccc(cc1)O,non-mutagenic
+CCOP(=S)(Oc1nn(c(n1)Cl)C(C)C)OCC,mutagenic
+OC(=O)/C=C/c1ccc(cc1)N,non-mutagenic
+ClCc1ccc(cc1)F,non-mutagenic
+Cc1ccc(c(c1)C)C,non-mutagenic
+CCOCC(=O)O,non-mutagenic
+ONc1ccc(cc1)Oc1ccccc1,mutagenic
+NC(C(=O)O)Cc1ccccc1,non-mutagenic
+Nc1ccc(cc1N)c1ccc(c(c1)N)N,mutagenic
+Cc1cc2c(O)cccc2c2c1cc1ccccc1c2,mutagenic
+COc1ccc(cc1OC)C(=O)N1CCN(CC1)c1ccc2c(c1)CCC(=O)N2,non-mutagenic
+CCCC(=O)OCC,non-mutagenic
+OC1CCC2(C(C1)CCC1C2CC(=O)C2(C1CCC2C(CCC(=O)O)C)C)C,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1C=Cc3ccc2,mutagenic
+C=CC(=O)OCC(COC(=O)C=C)(C)C,non-mutagenic
+O=C1C=Cc2c(C1=O)c1ccc3c(c1cc2)cccc3,mutagenic
+Oc1cccc(c1C)O,non-mutagenic
+Cc1cc(ccc1N=Nc1c(O)ccc2c1cccc2)N=Nc1ccccc1C,mutagenic
+N#N=Nc1ccc2c(c1)nc1c(c2Nc2ccc(cc2OC)NS(=O)(=O)C)cccc1,mutagenic
+C=C1C(=O)O[C@H]2[C@@H]1[C@H](O)[C@@]1(C)C(=O)C=C[C@H]1[C@@H](C2)C,non-mutagenic
+CC(OS(=O)(=O)c1ccc(cc1)C)C,mutagenic
+Nc1cccc2c1nc1c(N)cccc1n2,non-mutagenic
+CN(CC[C@H](c1ccccn1)c1ccccc1)C,non-mutagenic
+Clc1ccc(cc1)[N+](=O)[O-],mutagenic
+CCc1cnccn1,non-mutagenic
+Nc1scc(n1)c1scc(c1)[N+](=O)[O-],mutagenic
+ClC/C(=C(/C(=O)O)\Cl)/C(Cl)Cl,mutagenic
+O=Cc1ccc(cc1)N,non-mutagenic
+OS(=O)(=O)OCc1c2ccccc2cc2c1ccc1c2cccc1,mutagenic
+Oc1ccc(c2c1C(=O)c1c(Cl)ccc(c1C2=O)O)Cl,mutagenic
+OS(=O)(=O)ONNCCc1ccccc1,mutagenic
+OCc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+CNc1ccc2c(c1C)nc(cn2)C,mutagenic
+CC(=O)Nc1cccc2c1cccn2,non-mutagenic
+OC(=O)CC(C(=O)O)O,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2nc2ccc(cc2c1C)C,mutagenic
+C1CN=C(N1)N/N=C/c1c2ccccc2c(c2c1cccc2)/C=N/NC1=NCCN1,mutagenic
+COc1c(OC)cc2c3c1-c1ccccc1C(=O)c3ncc2,mutagenic
+CCOc1cccc2c1nccc2,non-mutagenic
+O=C(c1ccccc1)/C=C/c1ccccc1,non-mutagenic
+CCOC(=O)CCl,non-mutagenic
+C#CCOCC[n+]1ccccc1/C=N/O,non-mutagenic
+O=C1C=C(C)C(=O)C(=C1)C,non-mutagenic
+ClCCN(CCCl)CCCl,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1ccccc1[nH]2,mutagenic
+NC(C(=O)O)CN=N#N,mutagenic
+Oc1ccc2c(c1)nc(n2C)N,non-mutagenic
+CS(=O)(=O)N1C2C1c1ccccc1-c1c2cccc1,mutagenic
+OCCn1c(CO)ncc1[N+](=O)[O-],mutagenic
+OCC(=O)[C@@]1(O)CC[C@@H]2[C@]1(C)C[C@H](O)[C@H]1[C@H]2CCC2=CC(=O)C=C[C@]12C,non-mutagenic
+CCN=NC(OO)(C)C,non-mutagenic
+COC(=O)C,non-mutagenic
+ClCC(Cl)Cl,non-mutagenic
+O=CC1=CC(C)C2C(C(C1C=O)O)CC(C2)(C)C,non-mutagenic
+[O-][N+](=O)c1c(C)c(C(=O)C)c(c(c1C(C)(C)C)[N+](=O)[O-])C,non-mutagenic
+CC(=O)NN,mutagenic
+Nc1ccc(c(c1)O)C,mutagenic
+CCCCOC(=O)c1cccc2c1nccc2,non-mutagenic
+COc1ccc2c(c1)[nH]c1c2ccnc1C,mutagenic
+OCC1OC(OC23CC(C(=O)C3C(C3(C(=C2)C)CC3)(C)O)C)C(C(C1O)O)O,mutagenic
+[O-][N+](=O)c1c2CCCCc2c2c3c1ccc1c3c(cc2)ccc1,non-mutagenic
+[O-][N+](=O)c1cnc(n1C)C(c1cc(cc(c1O)C(C)(C)C)C(C)(C)C)O,non-mutagenic
+CC(=O)Nc1cc2Cc3c(-c2cc1O)cccc3,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)n[nH]c2,mutagenic
+O=C(C(=C)C)OCCCCCOC(=O)C(=C)C,non-mutagenic
+Cc1cc2ccccc2c(c1)C,non-mutagenic
+CCCCCCCCCCCC[C@H]1CO1,non-mutagenic
+Cc1ccc(cc1)C(=O)n1ncc(c(c1=O)Cl)Cl,non-mutagenic
+OC1C2OC2c2c(C1O)ccc1c2nc2ccc3c(c2c1)cccc3,mutagenic
+Cc1ccc(cc1N=Nc1cc(N)ccc1C)N,mutagenic
+OC(=O)c1ccc(c(c1)Cl)Cl,non-mutagenic
+Cc1ncc2c(n1)CCC2,non-mutagenic
+CCCCON(C(=O)c1ccc2c(c1)cccc2)OC(=O)C,mutagenic
+CN(C#N)N=O,mutagenic
+N#Cc1c(Cl)c(C#N)c(c(c1Cl)Cl)Cl,non-mutagenic
+c1ccc2c(c1)occ2,non-mutagenic
+CCN(c1ccc2c(c1)[o+]c1c(c2c2ccccc2C(=O)O)ccc(c1)N(CC)CC)CC,mutagenic
+C1N2CN3CN1CN(C2)C3,mutagenic
+[O-][N@@+]1(C)CCC[C@@H]1c1cccnc1,non-mutagenic
+Nc1ccc(cc1)C(=O)N,non-mutagenic
+Cc1cc(C)c(cc1N=Nc1cc(c2c(c1O)cccc2)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+COc1ccc(cc1)C1OC1C,mutagenic
+Nc1ccc(cc1)CCc1ccc(cc1)N,mutagenic
+c1ccc2c(c1)c1ccc3c(c1cc2)cccc3,mutagenic
+[O-][N+](=O)c1cccc2c1csn2,mutagenic
+C[N+](=C1C=CC(=C(c2ccc(cc2)N(C)C)c2ccccc2)C=C1)C,non-mutagenic
+Nc1ccc(c(c1)S(=O)(=O)O)c1ccc(cc1S(=O)(=O)O)N,non-mutagenic
+[O-][N+](=O)C1=Cc2c3c1cccc3ccc2,mutagenic
+CC(OC(=O)C)C,non-mutagenic
+O=CNc1scc(n1)/C=C\c1ccc(o1)[N+](=O)[O-],mutagenic
+COC(=O)c1ccc(c2c1nc1ccccc1c2NCCCN(C)C)[N+](=O)[O-],mutagenic
+OCc1ccc2c(c1)C(=O)c1c(C2=O)cccc1,non-mutagenic
+CCN(c1ccc(cc1)N=Nc1cccnc1)CC,non-mutagenic
+COCCOC(=O)C,mutagenic
+COCCOCO/N=C\1/C(C)CC(C)(O)C(OC2OC(C)CC(C2O)N(C)C)C(C)C(OC2OC(C)C(C(C2)(C)OC)O)C(C(=O)OC(C(C(C1C)O)(C)O)CC)C,non-mutagenic
+OC1C2C(=O)C3=C(O)c4c(C(=O)C53C1C1C32C(=C(O)c2c(C3=O)cc(cc2O)C)C(=O)C5C1O)cc(cc4O)C,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)cccn2,mutagenic
+Fc1cc2cccnc2c2c1nccc2,mutagenic
+CCCCCCCC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)CCCCCCC,mutagenic
+Nc1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-],mutagenic
+O=C(Nc1ccc(c(c1)Cl)Cl)CCC(=O)O,non-mutagenic
+CC(=C)C(=O)O,non-mutagenic
+CN(c1ccc(cc1)N=Nc1cccc2c1cccc2)C,mutagenic
+Cc1cc(ccc1N=Nc1ccccc1)N(C)C,mutagenic
+Clc1ccc2c(c1)c(N)c1c(n2)cccc1,mutagenic
+CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)O,mutagenic
+CCC(=O)N(c1ccc(cc1)/C=C/c1ccccc1)O,mutagenic
+BrC[C@H](COP(=O)(OC[C@@H](CBr)Br)OC[C@@H](CBr)Br)Br,mutagenic
+OC1C=Cc2c(C1O)cc1-c3ccccc3-c3c1c2cc1ccccc31,mutagenic
+CC(=O)N(c1ccc(cc1)c1ccccc1)O,mutagenic
+O=CC1=CC2CC(CC2C23C1(C2)C(O)OC3=O)(C)C,mutagenic
+[O-][N+](=O)c1ccc(cc1)[C@]1(C)OC1,mutagenic
+CN(c1ccc(cc1)N=Nc1ccccc1)CCC#N,mutagenic
+CCCCCCC(C(=O)OC[C@@H]1CO1)(C)C,mutagenic
+FC(=C(F)F)F,non-mutagenic
+[O-][N+](=O)[C@@H](CO)C,non-mutagenic
+CC[N+](=C1C=CC(=C(c2ccc(cc2)N(CC)CC)c2ccc(cc2)N(CC)CC)C=C1)CC,mutagenic
+C[C@H]1CC[C@@H]([C@H](C1)O)C(C)C,non-mutagenic
+OC1C(O)C=Cc2c1ccc1c2cc2c(n1)ccc1c2cccc1,mutagenic
+COC(=O)[C@@]12O[C@@]2(CC)[C@@H](OC1=O)C,mutagenic
+CCCCCCOC[C@H]1CO1,mutagenic
+ClCCN(C(=O)NCCS(=O)(=O)N(C)C)N=O,mutagenic
+OCC1OC(C(C1O)O)(CO)OC1OC(CO)C(C(C1O)O)O,non-mutagenic
+CCCCCCCCC/C=C/C[C@H]1CC(=O)OC1=O,non-mutagenic
+CC1C=Cc2c1c1c(cc2)ccc2c1cccc2,non-mutagenic
+OCC1OC(C(C1O)O)n1cnc2c1nc(nc2N)c1ccc(cc1)[N+](=O)[O-],mutagenic
+OC1C(O)C2OC32c2c1cccc2-c1c3cc2c(c1)cccc2,mutagenic
+COC(=O)c1cc2OCOc2c2c1c(cc1c2cccc1OC)[N+](=O)[O-],mutagenic
+C[C@@H]1C(C)(C)c2c(C1(C)C)cc(c(c2)C)C(=O)C,non-mutagenic
+OC1C(OCC(C1O)O)Nc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+O=C(c1ccccc1)OCc1ccccc1[N+](=O)[O-],non-mutagenic
+OC(=O)/C=C/Cl,mutagenic
+O=NN(c1ccccc1)COC(=O)C,mutagenic
+Cn1cccc1,non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2S,mutagenic
+[O-][N+](=O)c1ccc2-c3cc4CCCCc4cc3CCc2c1,mutagenic
+O=C(c1cccc(c1)[N+](=O)[O-])ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+Nc1ccccc1S,mutagenic
+Cc1ccc(c(c1)S(=O)(=O)O)N,non-mutagenic
+Oc1n(/N=C/c2ccccc2)nnc2-c1nc1c2cccc1,mutagenic
+Cc1cc(O)nc(n1)S,non-mutagenic
+ClC(SN1C(=O)[C@H]2[C@H](C1=O)CC=CC2)(Cl)Cl,mutagenic
+O=C/C=C/c1ccc(cc1)N(C)C,non-mutagenic
+C/C=N/N(C=O)C,non-mutagenic
+CCO[P@@](=O)(c1ccccc1)Oc1ccc(cc1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1cc2ccc3c4c2c(c1)ccc4ccc3,mutagenic
+COC(=O)C12OC2(C)C(OC1=O)C,mutagenic
+O=C1C=Cc2c(C1=O)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+OC(=O)C(C(C(C(C(Cl)(F)F)(Cl)F)(F)F)(Cl)F)(F)F,non-mutagenic
+Cc1ccc2c(c1)cc1c(c2)ccc2c1cccc2,mutagenic
+CC(S(=O)(=O)Cl)C,mutagenic
+OC(=O)/C=C/c1ccc(cc1)/C=C/C(=O)O,non-mutagenic
+O=C1CCc2c1c1ccc3c(c1c1c2CCC1)cccc3,non-mutagenic
+OC[C@H]1O[C@H](C[C@H]1O)n1cc(CO)c(=O)[nH]c1=O,mutagenic
+COc1cc(CC2NCCc3c2cc(O)c(c3)O)cc(c1OC)OC,non-mutagenic
+CC(CC(=O)OCC1=CO[C@H]([C@@H]2[C@@H]1C[C@@H]([C@@]12CO1)OC(=O)C)OC(=O)CC(C)C)C,mutagenic
+O=CC=CNCCCCC(C(=O)O)N,mutagenic
+CCCCCCCC1CCC(=O)O1,non-mutagenic
+N#CCc1ccccc1,non-mutagenic
+Nc1cnc2c(c1)nc1n2cccc1,mutagenic
+ClCN1C(=O)c2c(C1=O)cccc2,mutagenic
+CC(=O)N(c1ccc(cc1)/C=C/c1ccccc1)O,mutagenic
+ClCCN(CCCNc1c2ccccc2nc2c1cccc2)CC,mutagenic
+c1cc2CCc3c4c2c(c1)cc1c4c2c(c3)cccc2cc1,mutagenic
+CC(=O)Nc1cccc2c1nccc2,mutagenic
+[O-][N+](=O)c1ccc2c(c1)/c(=N/C(=O)c1ccccc1)/sn2C(=O)c1ccccc1,mutagenic
+OCc1ccccc1[N+](=O)[O-],non-mutagenic
+Cc1cccc2c1-c1cc3ccccc3cc1C1C2O1,mutagenic
+COC(=O)[C@@]12O[C@@]2(C)[C@@H](OC1=O)C(C)C,mutagenic
+O[C@@H]1C=Cc2c([C@@H]1O)c1cc3ccccc3c(c1cc2)C,mutagenic
+Cc1cccc(c1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+Cc1ccccc1OC[C@H]1CO1,mutagenic
+CNC(=O)Oc1ccccc1OC(C)C,mutagenic
+Nc1ccc(c(c1)C)c1ccc(cc1C)N,mutagenic
+CC1CCC(C(C1)OC(=O)c1ccccc1N)C(C)C,non-mutagenic
+COC(=O)C1c2cc3c(c(c2C(CC1(O)CC)OC1OC(C)C(C(C1)N(C)C)O)O)C(=O)c1c(C3=O)c(O)ccc1O,mutagenic
+C=CC(=C)C,non-mutagenic
+ON(c1ccc(cc1)Oc1ccc(cc1)Cl)C(=O)C,mutagenic
+OCC12C(C=C(C(=O)C1O)C)OC1C3(C2(C)CC1O)CO3,non-mutagenic
+OC(=O)O,non-mutagenic
+COP1(=S)OCc2c(O1)cccc2,mutagenic
+C=C[C@@H]1CC[C@@]2([C@H](C1)O2)C,non-mutagenic
+ClC[C@H](OP(=O)(O[C@@H](CCl)C)O[C@@H](CCl)C)C,non-mutagenic
+CCC(c1ccc(cc1)C[N+](C)(C)C)CC(c1cccc(c1)C(CC)C)C,non-mutagenic
+[O-][N+](=O)c1ccc(o1)C(=O)OC,mutagenic
+ClC(=C(SSc1ccccc1[N+](=O)[O-])F)Cl,mutagenic
+Nc1nccs1,mutagenic
+O=NN(Cc1ccc(cc1)F)C,mutagenic
+Clc1c(Cl)cccc1Cl,non-mutagenic
+N#Cc1cc(I)c(c(c1)[N+](=O)[O-])O,non-mutagenic
+OCCOc1ccccc1,non-mutagenic
+CC(OC(=O)COc1ccc(cc1Cl)Cl)C,non-mutagenic
+CCCCCCOC(=O)c1ccccc1,non-mutagenic
+COC(=O)c1cc(ccc1[N+](=O)[O-])Oc1ccc(cc1Cl)Cl,mutagenic non-mutagenic
+Nc1cc(Cl)c(c(c1)Cl)N,mutagenic
+CNC(=O)/C=C(/OP(=O)(OC)OC)\C,mutagenic
+COC(=C1C(=NC(=C([C@@H]1c1cccc(c1)[N+](=O)[O-])C(=O)OC/C=C/c1ccccc1)C)C)O,non-mutagenic
+Oc1ccc2-c3c4c(-c2c1)ccc1c4c2c(c3)cccc2cc1,mutagenic
+CC1=CC(=O)c2c(C1=O)cccc2O,mutagenic
+CCOC(=O)CC(=O)CCl,non-mutagenic
+ClC(C(Cl)(Cl)Cl)(Cl)Cl,non-mutagenic
+N#CCCN(c1ccc(cc1)N=Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-])CC,mutagenic
+C=CC1CC2CC1C=C2,non-mutagenic
+O=NN(c1ccccc1)O,mutagenic
+CNCCS(=O)(=O)O,non-mutagenic
+CCOc1ccc(cc1)N,mutagenic
+n1sc2c(c1)cc(cc2)OC[C@H]1CO1,mutagenic
+CCN(CCC[C@H](Nc1ccnc2c1ccc(c2)Cl)C)CC,mutagenic
+NC(=N)c1ccc2c(c1)[nH]c(c2)C(=N)N,non-mutagenic
+C[C@H](c1ccccc1)O,non-mutagenic
+CC[C@]1(OCCc2c1[nH]c1c2cc(cc1CC)O)CC(=O)O,mutagenic
+COC1C(COC2OC(CO)C(C(C2O)O)O)OC(C(C1O)O)COCC1C(CO)OC(C(C1O)O)CC,non-mutagenic
+O=C(n1cncc1)n1cncc1,non-mutagenic
+O/N=C/C=N/O,non-mutagenic
+Clc1ccc2c(c1)nc([nH]2)N,non-mutagenic
+O=C1N(C)CCCN1C,non-mutagenic
+BrCc1ccc2c3c1-c1ccccc1-c3ccc2,mutagenic
+Clc1ccc(cc1)C(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)c1ccc(cc1)Cl,mutagenic
+[O-][N+](=Nc1cc(cc(c1C)[N+](=O)[O-])[N+](=O)[O-])c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C,mutagenic
+O=NN(C(C(=O)O)C)CC1(O)CCC(C(C1O)O)O,non-mutagenic
+OCCOCCOCC,non-mutagenic
+O=Nc1ccc(cc1)Nc1ccccc1,mutagenic
+O=C/C=C/c1ccccc1[N+](=O)[O-],mutagenic
+COc1cc2OC3C(c2c2c1c1CCC(=O)c1c(=O)o2)C1C(O3)O1,mutagenic
+OOC12C=CC3C(C2(C)CCC(C1)O)CCC1(C3CCC1C(CCCC(C)C)C)C,mutagenic
+COc1cccc2c1nc(s2)N,mutagenic
+Clc1cccc(n1)Cl,non-mutagenic
+NCC(C)C,non-mutagenic
+Cc1cccc2c1cc1ccc3c4c1c2ccc4ccc3,mutagenic
+Cc1c(N)ccc(c1C)N,non-mutagenic
+O=C1c2c3ccccc3ccc2-c2c3c1cccc3ccc2,non-mutagenic
+COc1c(OC)ccc2c1c[n+]1CCc3c(-c1c2)cc1c(c3)OCO1,non-mutagenic
+CC(=O)Nc1ccc2-c3c(Cc2c1)cccc3O,mutagenic
+OC(=O)COc1ccc(cc1C)Cl,non-mutagenic
+[O-][N+](=O)c1cccc2c1ccc1c2cccc1,mutagenic
+ClCC(CCl)Cl,mutagenic
+OC1C=Cc2c(C1O)ccc1c2ccc2c1CCC2=O,mutagenic
+OC1CCC2(C(C1)CC(=O)C1C2CCC2(C1CCC2C(CCC(=O)O)C)C)C,non-mutagenic
+Nc1ccc(cc1)c1ccc(cc1[N+](=O)[O-])N,mutagenic
+COC(=O)C1CSC2N1C(=O)C(=C2Cl)Cl,mutagenic
+OC1C(N)CC(OC1C)OC1CC(O)(Cc2c1c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2)C(=O)C,mutagenic
+COc1cc(F)ccc1[N+](=O)[O-],mutagenic
+OCc1ccc(o1)c1[nH]ccc2-c1nc1c2cccc1,mutagenic
+ClCCOC(=O)c1[n+]([O-])nnc2c1n(C)c1c2cccc1,mutagenic
+Cc1ccc2c3c1CC(c3c1c(c2)c2ccccc2cc1)OS(=O)(=O)O,mutagenic
+CCC(=O)OCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+Nc1ccnc2c1cccc2,non-mutagenic
+Cc1cc(ccc1N)c1ccccc1C,mutagenic
+OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O,non-mutagenic
+N#N=Nc1ccc(cc1)Nc1c2ccccc2nc2c1cccc2,mutagenic
+Oc1cccc2c1cc1c(c2)c2ccccc2c2c1cccc2,mutagenic
+Oc1c(N=Nc2ccc(c3c2cccc3)S(=O)(=O)O)c2ccc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+COc1ccc(c(c1)O)C(=O)c1ccccc1O,mutagenic
+CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C,non-mutagenic
+Cn1c(N)nc2c1cc1ccncc1n2,mutagenic
+OC(=O)C1OC1C(=O)O,non-mutagenic
+S=C1NCCN1,mutagenic
+ONc1cccc(c1C)C,mutagenic
+Clc1cc(Cl)c(cc1O)Cl,non-mutagenic
+Oc1cc2cccc3c2c2c1=C(O)C14C(c2cc3)(O4)CCCC1,mutagenic
+O[C@H]1C=C2c3c([C@@H]1O)cccc3-c1c2cc2ccccc2c1,mutagenic
+COc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)C,mutagenic
+CC(=CCOc1c2occc2cc2c1oc(=O)cc2)C,mutagenic
+Nc1ccccc1C(F)(F)F,non-mutagenic
+Oc1ccc2-c3c4c(-c2c1)cccc4c(cc3)[N+](=O)[O-],mutagenic
+Oc1cc2ccc3-c4c(-c5c3c2c2c1cccc2c5)cccc4,non-mutagenic
+N#CC(=Cc1ccc(o1)[N+](=O)[O-])C#N,mutagenic
+COc1cccc2c1cc([N+](=O)[O-])c1c2c2OCOc2cc1C(=O)O,mutagenic
+ClCCC(=O)/N=c/1\sn(c2c1cccc2)C(=O)CCCl,non-mutagenic
+COc1cc(N)ccc1NC(=O)C,mutagenic
+OCc1ccc(cc1)OC(=O)C,non-mutagenic
+[N-]=[N+]=NC[C@@H](CO)O,mutagenic
+Nc1ccc(cc1Cl)Oc1ccc(c(c1)Cl)N,mutagenic
+O=C1N(SC2CCCCC2)C(=O)c2c1cccc2,non-mutagenic
+COc1ccccc1CC1CO1,mutagenic
+Cc1cc2c(c3c1ncc(n3)c1ccccc1)nc(n2C)N,mutagenic
+COc1ccc(cc1)Nc1ccc(cc1)OC,non-mutagenic
+CCCCN(C[C@@H](CC)O)N=O,mutagenic
+O=C/C=C/C=C/C=O,mutagenic
+OCc1c2ccc3c(c2nc2c1cc(C)cc2)C=CC(C3O)O,mutagenic
+Cc1cccnc1,non-mutagenic
+OCCN(CC)CC,non-mutagenic
+O=Nc1ccc2c3c1ccc1c3c(cc2)ccc1[N+](=O)[O-],mutagenic
+COc1c(N)cc(c(c1C)N)C,non-mutagenic
+OC[C@H]([C@H]([C@H]([C@H]([C@H]1SCCN1N=O)O)O)O)O,mutagenic
+CCOC(=O)c1[nH]c2c(c1/N=C/c1ccc(cc1)NC(=O)C)cccc2,mutagenic
+[O-][N+](=O)c1ccc2c(c1)/c(=N/C(=O)c1ccc(cc1)[N+](=O)[O-])/sn2C(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+CCCCCc1cc(O)cc(c1)O,non-mutagenic
+O=C1CCC2=C3C=CC4(C(C3CCC2=C1)CCC4O)C,non-mutagenic
+CC(=O)N(c1ccc2-c3c(Cc2c1)cccc3)Nc1ccc2-c3c(Cc2c1)cccc3,mutagenic
+Nc1ccc2c(c1C(C)(C)C)cccc2,non-mutagenic
+CNc1ccc(cc1)Nc1c2ccccc2nc2c1cccc2,mutagenic
+CCC(=O)C=C,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)cc1c(c2[N+](=O)[O-])cccc1,mutagenic
+Cc1ccc2c(c1)c1ccc3c(c1cc2)ccc1c3cccc1C,non-mutagenic
+Fc1cccnc1,non-mutagenic
+OC(=O)C1NC(Cc2ccccc2O)c2c(C1)c1ccccc1[nH]2,non-mutagenic
+CON,non-mutagenic
+O=Cc1ccc(cc1)C,non-mutagenic
+BrC(C1=C(Cl)C(=O)OC1O)Br,mutagenic
+N#[N+]c1ccc(cc1)[N+](=O)[O-],mutagenic
+C1Oc2c(O1)cc(cc2)C[C@@H]1CO1,mutagenic
+Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)cccc1,mutagenic
+CC(=O)c1ccncc1,non-mutagenic
+CCN(c1cc(NC(=O)C)c(cc1OC)N=Nc1ccc(cc1)[N+](=O)[O-])CC,mutagenic
+ClCc1cccc(c1)N=Nc1ccc(cc1)N(C)C,mutagenic
+N1C2C1c1cccc3c1-c1c2cccc1C1C3N1,mutagenic
+COc1cc(O)cc2c1cc([N+](=O)[O-])c1c2c2OCOc2cc1C(=O)O,non-mutagenic
+OC[C@H]1O[C@@H](Oc2ccc(c3c2C(=O)c2ccccc2C3=O)O)[C@@H]([C@H]([C@@H]1O)O)O,mutagenic
+FC(=C)F,mutagenic
+O=C1NC(=O)N(C1)/N=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+CC(=O)NNc1ccccc1,mutagenic
+Nc1cccc2c1nc1ccccc1n2,mutagenic
+C=CC1CN2CCC1CC2C(c1ccnc2c1cc(OC)cc2)OC(=O)C(O)C,non-mutagenic
+COC(=O)C1=C(CC)C(OC1=O)C,mutagenic
+Clc1cccc2c1cccn2,mutagenic
+O=NN(CC(=O)C)C[C@H](O)C,mutagenic
+CCCC(=O)OC1C2OP(=O)(O)OCC2OC1n1cnc2c1ncnc2NC(=O)CCC,non-mutagenic
+O=C1c2cccc3c2c2c4c1cccc4ccc2cc3,non-mutagenic
+Cc1cccc(c1)N,non-mutagenic
+OCCN(c1ccc(cc1)N=Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])CCO,mutagenic
+O=NN1CCC(=O)NC1=O,mutagenic
+O=C1c2ccccc2-c2c1ccc1c2c2ccccc2cc1,non-mutagenic
+FC(C(C(C(I)(F)F)(F)F)(F)F)(F)F,non-mutagenic
+CCCCN(CC[C@H](O)C)N=O,mutagenic
+Cc1ccc2c(c1)cc1c(c2)cccc1,mutagenic
+OC1CC(O)C(=C)/C(=C/C=C/2\CCCC3(C2CCC3C(/C=C/C(C2CC2)O)C)C)/C1,non-mutagenic
+CC(=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+C=C[Si](Cl)(Cl)C,mutagenic
+O=C1C[C@]2([C@@H]([C@@H]1C)C2)C(C)C,non-mutagenic
+OCc1c2ccccc2c(c2c1cccc2)C,mutagenic
+c1cc2ccc3c4c2c(c1)ccc4cc1c3[C@@H]2O[C@@H]2CC1,mutagenic
+Cc1cccc2c1cc1ccccc1c2,non-mutagenic
+BrCc1ccccc1[N+](=O)[O-],non-mutagenic
+OCC(C(c1ccccc1)N=N#N)O,mutagenic
+CCOCC,non-mutagenic
+O=C(c1ccccc1)/C=C/c1cccc(c1)[N+](=O)[O-],non-mutagenic
+[O-][n+]1cnc2c(c1N)ncn2Cc1ccccc1,mutagenic
+ClC(=O)c1ccccc1C,mutagenic
+OS(=O)(=O)Oc1c2ccccc2c2c3c1ccc1c3c(cc2)ccc1,non-mutagenic
+CCOc1ccc2c(c1)c(N)c1c(n2)cc(cc1)N,mutagenic
+CCCON(C(=O)c1ccccc1)OC(=O)C,mutagenic
+OC1C2(Cl)C3(C4(C1(Cl)C1(C2(C3(Cl)C(C41Cl)(Cl)Cl)Cl)Cl)Cl)Cl,non-mutagenic
+CC(=O)c1ccccc1,non-mutagenic
+CC1=CCCc2c1cc(C)c1c2ccc2c1cccc2,mutagenic
+CCCCC(C(C(OC(=O)CC(C(=O)O)CC(=O)O)CC(CC(CCCCC(CC(C(N)C)O)O)O)C)OC(=O)CC(C(=O)O)CC(=O)O)C,non-mutagenic
+CCCOc1cc(c(cc1N/N=C(/C(=O)Nc1ccc(cc1)[N+](=O)[O-])\C(=O)C)OC)c1cc(OCCC)c(cc1OC)N/N=C(/C(=O)Nc1ccc(cc1)[N+](=O)[O-])\C(=O)C,mutagenic
+COc1ccc(cc1)CCC1OC1,mutagenic
+[O-][N+](=O)c1ccc2c(c1)s[nH]c2=O,mutagenic
+OC(=O)[C@@H](Cc1ccc(c(c1)O)O)N,mutagenic
+Oc1nsc2c1cccc2,non-mutagenic
+O=c1ccc2c(o1)c1ccoc1cc2,non-mutagenic
+COc1ccc(cc1)c1coc2c(c1=O)c(O)cc(c2)O,non-mutagenic
+ON(c1ccc(cc1)Cl)C(=O)C,non-mutagenic
+OC(C1CO1)CO,mutagenic
+Oc1ccc(cc1)O,non-mutagenic
+CCN=NO,mutagenic
+CNC(=O)CC(C(=O)NC(c1ccc(cc1)O)C(=O)NC1C(=O)N2C1SC(C2C(=O)O)(C)C)N,non-mutagenic
+O1C2C1C1N=NC2C2C1O2,non-mutagenic
+CC(=O)ON(c1ccc(cc1)c1ccccc1)C(=O)C,mutagenic
+Fc1ccc(cc1)C1OC1C(=O)c1ccccc1,non-mutagenic
+CC(=O)Nc1ccccc1,non-mutagenic
+CCCCN(CCCC)CCO,non-mutagenic
+Cc1ccc2c(c1)c(N)sn2,mutagenic
+Cn1c(N)nc2c1c1cccnc1cc2,mutagenic
+Oc1ccc(cc1)c1oc2cc(O)cc(c2c(=O)c1O)O,mutagenic
+O=c1oc2cccc(c2cc1[C@@H]1CCc2c(C1)cccc2)O,non-mutagenic
+COc1c2ccc(=O)oc2cc2c1cco2,mutagenic
+Oc1ccc2c(c1)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+CC(Sc1cc(ccc1N)Cc1ccc(c(c1)SC(C)C)N)C,mutagenic
+BrC(Br)Br,mutagenic
+OC(=O)c1ccccc1O,non-mutagenic
+CN(C(=O)NC)N=O,mutagenic
+Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(O)nc2c1cccc2,non-mutagenic
+C#CCNC(=NCCSCc1nc[nH]c1C)NC#N,non-mutagenic
+CC(COC[C@@H]1OC1)(COC[C@@H]1OC1)C,mutagenic
+N=C(Nc1ccccc1)Nc1ccccc1,mutagenic
+CCOC(=O)CC(O)C,non-mutagenic
+CCCCOc1ccc2c(n1)c(NCCCN(CCCl)CC)c1c(n2)cc(cc1)Cl,mutagenic
+C=CC1(C)CC(O)C2(C(C1)CCC1C32CCCC1(C(=O)O3)C)C,non-mutagenic
+Cn1c2cc(cnc2nc1[N+](=O)[O-])c1ccccc1,mutagenic
+O=C1C=CC(=O)c2c1c(O)ccc2O,mutagenic
+CC(CC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)CC(C)C)C,mutagenic
+C[C@@H]1C[C@H]2OC(=O)[C@@]3([C@H]2[C@H]([C@@]2([C@H]1C=CC2=O)C)O[C@]3(C)O)C,non-mutagenic
+COc1cc(O)c2c(c1)oc1c(c2=O)cc(cc1)OC,mutagenic
+[O-][N+](=O)c1ccc2c(c1)sc1c2cccc1,mutagenic
+O1C[C@@H]1[C@@H]1OC1,mutagenic
+c1ccc2c(c1)cc(c1c2cccc1)[C@@H]1CO1,mutagenic
+CCC(=O)N(C1CCCC1N(C)C)c1ccc(c(c1)Cl)Cl,non-mutagenic
+Cc1cc(c(c(c1)C(C)(C)C)O)C(c1ncc(n1C)[N+](=O)[O-])O,non-mutagenic
+COc1cc(O)c2c(c1)oc1c(c2=O)cc(cc1)O,mutagenic
+CCCCCCCC/C=C/CCCCCCCC(=O)O,non-mutagenic
+CN(C(=S)SNCCNSC(=S)N(C)C)C,mutagenic
+CCOC(=O)C1C(C1(C)C)C=C(C)C,non-mutagenic
+Nc1ccc2c(c1)oc1-c(n2)c2ccccc2c(=N)c1,mutagenic
+O/N=C/C1N(CCC[n+]2ccc(cc2)C(=O)N)C=CN1C,non-mutagenic
+Nc1ccc2c(c1)s[nH]c2=O,non-mutagenic
+CNC(=O)c1cccc(c1)NCC(=O)NCCc1ccc(c(c1)OC)OC,non-mutagenic
+OCC#N,non-mutagenic
+Nc1ccc(cc1)Oc1ccc(c(c1)N)N,mutagenic
+OC(=O)[C@@H]1CSCN1,non-mutagenic
+Cc1cnc2c(n1)cccc2,non-mutagenic
+O=CN1c2cc(OC)c(cc2C23C1C(O)(C(=O)OC)C(OC(=O)C)C1(C3N(CC2)CC=C1)CC)C1(CC2CN(CCc3c1[nH]c1c3cccc1)CC(C2)(O)CC)C(=O)OC,non-mutagenic
+OCc1c2ccc(cc2nc2c1ccc1c2cccc1)C,non-mutagenic
+COc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)O,mutagenic
+Cc1cc2[nH]c3c(c2c2c1cccc2)c1ccccc1c(c3)C,mutagenic
+C=CCCC1CO1,mutagenic
+COc1cc2C(=O)CCc2c2c1c1ccccc1cc2,mutagenic
+OCC1CCCO1,non-mutagenic
+OCC1OC(Oc2ccc(cc2)N=Nc2ccc(cc2)N(C)C)C(C(C1O)O)O,non-mutagenic
+CCN([N+](=NO)[O-])CC,mutagenic
+Cc1ccc2c3c1ccc1c3c(c2=O)ccc1,mutagenic
+CCc1ccc(cc1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+CCOP(=O)(Oc1ccccc1C(=O)OC(C)C)NC(C)C,mutagenic
+CC(=O)OC1C(=O)OC2C1OC(=O)C2OC(=O)C,non-mutagenic
+OCC12OOC2(C)c2c(O1)cccc2,non-mutagenic
+O=C1NC(=O)C(=C1Cl)Cl,mutagenic
+C=CCc1ccc(cc1)O,non-mutagenic
+CCOC(=O)C=C,non-mutagenic
+ClC[C@@H](CBr)Br,mutagenic
+CCN(C(=O)Cc1ccccc1)CC,non-mutagenic
+NC(=O)c1ccccc1C(=O)N,non-mutagenic
+OCCO,non-mutagenic
+O=Nc1c(nc2n1cc(s2)C)c1ccc(cc1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1cc(n(c1C(=O)C)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Fc1ccc2c(c1F)nccc2,mutagenic
+Clc1ccc2c(c1)c(N)sn2,mutagenic
+Oc1cccc2c1c1ccccc1c1c2cc2ccccc2c1,mutagenic
+O=c1nc[nH]c(=O)[nH]1,non-mutagenic
+N#C/C(=C\C=C\c1ccccc1[N+](=O)[O-])/c1ccc(cc1)Br,mutagenic
+Cc1cccc(c1)C(=O)O,non-mutagenic
+C/C=C/c1cc(OC)c(cc1OC)OC,mutagenic
+NN1C(=O)c2c(C1=O)cccc2,non-mutagenic
+Nc1cc2nc3ccccc3nc2cc1N,mutagenic
+CC(CCNc1snc2c1cccc2)C,non-mutagenic
+Cc1ccc2c3c1CCc3c1c(-c3ccccc3C3C1O3)c2,mutagenic
+OC(=O)c1ccc(c(c1)N)C,mutagenic
+COc1ccc2c(-c3c(OC)c(OC)cc4c3c(C2=O)ncc4)c1,non-mutagenic
+CCCCN(C[C@@H](CCO)O)N=O,mutagenic
+Cc1c(N)cccc1N=[N+](c1cccc(c1C)N)[O-],mutagenic
+O=CC1=C2CC(C[C@]2(O)[C@@H]([C@]2([C@]1(C=O)C2)C)OC(=O)C)(C)C,mutagenic
+c1ccc2c(c1)c1cc3ccc4c(c3cc1cc2)cncc4,mutagenic
+COc1ccc(c(c1)C)N,mutagenic
+[O-][N+](=O)C1c2ccccc2C(=O)c2c1cccc2,non-mutagenic
+OC1C2OC2c2c(C1O)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+Cc1ncc[nH]1,non-mutagenic
+Clc1cnc(c(c1)Cl)Oc1ccc(cc1)Oc1ncc(cc1Cl)Cl,non-mutagenic
+CCCCCN(N=O)CCCCC,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)c(cc1)[N+](=O)[O-],mutagenic
+CC(CC(=O)OC1CC2(COC(=O)C)C(C=C1C)OC1C3(C2(C)C(OC(=O)C)C1O)CO3)C,mutagenic
+CCCCCCCCCCCCCl,non-mutagenic
+ClCCOC(=O)Cc1c(C(=O)O)c2c(n1C)cccc2,mutagenic
+[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Nc1ccccn1,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)CCN2,mutagenic
+O=C1c2c(ccc(c2C(=O)c2c1c(ccc2O)[N+](=O)[O-])O)[N+](=O)[O-],mutagenic
+O=C1c2ccccc2N=C1c1[nH]c2c(c1O)cccc2,mutagenic
+ONc1cc(cc(c1C)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+O=C1CCCC=C1,non-mutagenic
+Cc1cccc2c1nc1c(c2)ccc2c1cccc2,non-mutagenic
+O=C1NCCN1/N=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+ClCCN(C(=O)NC1CCC(CC1)C)N=O,mutagenic
+ClCCN(c1cccc(c1)/C=C/C(=O)OC1CCC2C1(C)CCC1C2CCC2=CC(=O)NCCC12C)CCCl,non-mutagenic
+COc1c(c(C)cc2c1c(O)ccc2O)c1cc(O)c2c(c1O)cc(cc2OC)C,non-mutagenic
+Nc1ccn(c(=O)n1)C1C=C(C(C1O)O)CO,non-mutagenic
+Nc1[nH]cnc2-c1nc(n2)c1ccc(cc1)[N+](=O)[O-],mutagenic
+O=NN(C(C(=O)O)Cc1ccccc1)CC1(O)CCC(C(C1O)O)O,non-mutagenic
+O=CNc1scc(n1)c1ccc(s1)[N+](=O)[O-],mutagenic
+Nc1cccc2-c3c(Cc12)cccc3,mutagenic
+O=Nc1[nH]cnc1c1ccccc1,mutagenic
+OCC1OC(O)C(C(C1O)O)NC(=O)N(N=O)C,mutagenic
+Cc1ccc2c(-c3ccccc3C2C)c1,mutagenic
+COP(=O)(N1CCOCC1)OC,non-mutagenic
+Cc1cc2cc3cccc(c3c(c2c(c1)O)O)O,mutagenic
+C/C(=C/COC(=O)C)/CCC=C(C)C,non-mutagenic
+[O-][N+](=O)c1cc(C)c2c(c1C)c1cc(ccc1[nH]2)C(=O)C,mutagenic
+Cl/C=C(\SCc1ccccc1)/Cl,mutagenic
+COC(=O)C(Cl)Cl,mutagenic
+COc1cc(N=Nc2ccccc2)ccc1[N+](=O)[O-],mutagenic
+CCCCNC(=O)n1c(NC(=O)OC)nc2c1cccc2,non-mutagenic
+COc1ccc2c(c1)sc(n2)N,mutagenic
+OCCN(C(=O)N)N=O,mutagenic
+O=c1cc(C)c2c(o1)cc1c(c2)C2(C(O1)(C)OO2)C,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1ccccc1cc2[N+](=O)[O-],mutagenic
+COc1cc2CCN(C3c2c(-c2cc4OCOc4cc2C3)c1O)C,non-mutagenic
+CCCCCCCC(=O)Nc1snc2c1cccc2,non-mutagenic
+COc1ccc(c2c1oc1c3c(OC4C3CCO4)cc(c1c2=O)OC)O,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)/c(=N/C(=O)c1ccccc1Cl)/sn2C(=O)c1ccccc1Cl,mutagenic
+OOC(C)(C)C,mutagenic
+ClC(=C1OC(=O)C(=C1)Cl)Cl,mutagenic
+O=C1CCCN1c1ncc(s1)[N+](=O)[O-],mutagenic
+ONc1nc2c(n1C)cc(cn2)c1ccccc1,mutagenic
+CCCCCCCCCCCCCC[N+](Cc1ccccc1)(C)C,non-mutagenic
+OC1C2C(=O)C3=C(O)c4c(C(=O)C53C1C1C32C(=C(O)c2c(C3=O)c(O)c(cc2O)C)C(=O)C5C1O)c(O)c(cc4O)C,non-mutagenic
+ClCCN(C(=O)NCC(=O)N)N=O,mutagenic
+[O-][N+](=O)c1ccc(cc1)c1ccc(cc1)C(C)(C)C,non-mutagenic
+CCCOP(=S)(OP(=S)(OCCC)OCCC)OCCC,non-mutagenic
+Nc1cc(C)c2c(c1C)c1ccccc1[nH]2,mutagenic
+O=C(c1ccccc1)OCC(COC(=O)c1ccccc1)(COC(=O)c1ccccc1)C,non-mutagenic
+CC12OOC2(C)Oc2c1ccc1c2nccc1,non-mutagenic
+CC(CCOC(=O)C)C,non-mutagenic
+CCCCCCCCCCCCCCCCCC(=O)OCC1=CC=C2C1=C[C@@H](CC=C2C)C(=C)C,mutagenic
+COc1c(OC)ccc2c1c(=O)n(C)c1c2ccc2c1cc1OCOc1c2,mutagenic
+Cc1ccc(cc1)C(=O)ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+N#N=Nc1nc2c([nH]1)cccc2,mutagenic
+Ic1ccc(cc1)[n+]1nc(nn1c1ccc(cc1)[N+](=O)[O-])c1ccccc1,non-mutagenic
+OCc1ccc(cc1)Cl,non-mutagenic
+CC(=O)OC/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C)\C,non-mutagenic
+OCC(=O)C1(O)CC(OC2OC(C)C(C(C2)N(C)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)c(OC)ccc2,mutagenic
+CN(CCCNc1c2ccccc2nc2c1c(ccc2N(CCOC(=O)C)CCOC(=O)C)[N+](=O)[O-])C,mutagenic
+ONc1ccc(cc1)c1ccccc1,mutagenic
+OS(=O)(=O)c1ccccc1,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c(cc1c2c(ccc1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+N#C/C(=C\C=C\c1ccccc1[N+](=O)[O-])/c1ccc(cc1)C,mutagenic
+O=C1c2cc(ccc2OC21CC2)C(=O)C,non-mutagenic
+CC(=O)O[C@H]1C[C@H](CC=C1C)C(=C)C,non-mutagenic
+ONc1ccc(c(c1)Cl)Cl,non-mutagenic
+NC(=O)NNC(=O)N,non-mutagenic
+OC1CCN(CC1)N=O,mutagenic
+COc1ccc2-c3nccc4c3c(C(=O)c2c1)c(OC)c(c4)OC,mutagenic
+[O-][N+](=O)c1cnc(n1C)c1nnc(s1)N,mutagenic
+CN[C@H]1C[C@H](O[C@H]([C@@H]1O)C)O[C@H]1C[C@](O)(Cc2c1c(O)c1c(c2O)C(=O)c2c(C1=O)c(OC)ccc2)C(=O)C,mutagenic
+CCCCN(CCCC)N,non-mutagenic
+Cc1c(C)c2ccccc2c2c1c(Cl)c1ccccc1n2,mutagenic
+Nc1ccc(c2c1C(=O)c1ccccc1C2=O)N,mutagenic
+Cn1sc(cc1=O)Cl,mutagenic
+Clc1cccc(c1)Br,non-mutagenic
+CC(c1ccccc1)C,non-mutagenic
+NC(=O)C=C,non-mutagenic
+[O-][N+](=O)c1cc(ccc1Cl)C(F)(F)F,non-mutagenic
+OC(=O)C1NC(C)c2c(C1)c1ccccc1[nH]2,non-mutagenic
+Cc1nc2c(s1)cccc2,non-mutagenic
+O=NN1CSCC1,mutagenic
+CC12OC1C1CCCCC1c1c2cccc1,non-mutagenic
+CCCCOc1cc2C(=O)CCc2c2c1c1ccccc1cc2,non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N(c1ccc(cc1)[N+](=O)[O-])N=O,mutagenic
+Cl[C@@H]1CO1,mutagenic
+Nc1ccc(cc1)/C=C/c1ccc(cc1)N,mutagenic
+CC(Nc1nc(N)nc(n1)Cl)C,non-mutagenic
+CC[C@H](COC(=O)/C=C/c1ccc(cc1)/N=C/c1ccc(cc1)OC)C,mutagenic
+[O-][N+](=O)c1cccc2c1nccc2,mutagenic
+OC1C(O)C=Cc2c1cccn2,non-mutagenic
+Cc1ccc2c(c1)cccn2,mutagenic
+C1CCC2(CC1)CO2,non-mutagenic
+C1CC[C@H]2[C@@H](C1)O2,mutagenic
+Cc1cc(C)cc(c1)C,non-mutagenic
+[O-][N+](=O)c1ccccc1Cl,mutagenic
+Cc1c2ccccc2c2c3c1ccc1c3c(cc2)ccc1,mutagenic
+COP(=S)(SCn1nnc2c(c1=O)cccc2)OC,mutagenic
+O=NN(CC(=O)O)CC(=O)O,mutagenic
+[O-][N+](=O)c1cc2ccc3c4c2c(c1)ccc4cc(c3)[N+](=O)[O-],mutagenic
+COC(=O)/C(=C/c1ccco1)/[N+](=O)[O-],non-mutagenic
+CC(=O)NNC(=O)c1ccccn1,non-mutagenic
+O=C1NC(=O)C(=C(Cl)Cl)C1Cl,mutagenic
+Cc1cnc2c(n1)c1nc(n(c1cc2)C)N,mutagenic
+Fc1cccc2c1c1cccnc1cc2,mutagenic
+OC1CC(O)(Cc2c1c(O)c1c(c2O)C(=O)c2c(C1=O)c(O)ccc2)C(=O)C,mutagenic
+CC(COC(=O)C(=C)C#N)C,non-mutagenic
+CC(=O)OCc1ccc(cc1)[N+](=O)[O-],mutagenic
+OC[C@]12[C@H](C=C(C(=O)[C@@H]1O)C)O[C@@H]1[C@]3([C@@]2(C)[C@@H](OC(=O)C)[C@@H]1O)OC3,non-mutagenic
+O=C(C1OC1)Nc1ccccc1,mutagenic
+CC1=CC[C@H]2[C@H](C1)[C@H](CC=C2C)C(C)(C)C,non-mutagenic
+COC(=O)[C@@]12O[C@@]2(C)[C@@](NC1=O)(C)O,mutagenic
+[O-][N+](=O)c1ccc2c3c1cccc3c1c3c2cccc3ccc1,mutagenic
+Cn1cnc(c1Sc1[nH]cnc2-c1ncn2)[N+](=O)[O-],mutagenic
+CCc1cccc(c1NC(=O)C)CC,non-mutagenic
+O[C@@H]1[C@@H](O)[C@@H](O[C@@H]1n1ccc(nc1=O)N)COP(=O)(O)O,non-mutagenic
+[O-][N+](=O)c1[nH]cnc1c1ccccc1,mutagenic
+CCCC(=O)OCCC(C)C,non-mutagenic
+CN(c1ccc(cc1)N=Nc1ccccc1C(=O)O)C,mutagenic
+[O-][N+](=O)c1cc(ccc1S(=O)(=O)O)[N+](=O)[O-],non-mutagenic
+CCOCn1cc(F)c(=O)n(c1=O)C(=O)c1cccc(c1)C(=O)Oc1nc(ccc1C#N)OC(=O)c1ccccc1,non-mutagenic
+O=CC(=C(Cl)Cl)Cl,mutagenic
+NC(=O)N/N=C/C(=O)O,non-mutagenic
+Fc1cnc2c(c1)c1ccccc1cc2,mutagenic
+Clc1ccc(c(c1)Cl)C(=O)O,non-mutagenic
+CC(=O)Nc1ccc2-c3c(Cc2c1)cc(cc3)NC(=O)C,mutagenic
+OC/C=C/C1(O)CCC2C1(C)CC(c1ccc(cc1)N(C)C)C1=C3CCC(=O)C=C3CCC21,non-mutagenic
+Cc1cnc2c(n1)c1nc(n(c1c(c2)C)C)N,mutagenic
+CC(CC(C(=O)O)NC(=O)COc1ccc(cc1Cl)Cl)C,non-mutagenic
+Cc1ccc(c(c1)N)O,mutagenic
+ClCC1=CC(=O)OC1,mutagenic
+Nc1ccc(cc1)c1cc(Cl)c(c(c1)Cl)N,mutagenic
+OCC1OC(OC2CCC3(C(=CCC4C3CCC3(C4CC4C3C(C)C(O4)(OC)CCC(COC3OC(CO)C(C(C3O)O)O)C)C)C2)C)C(C(C1O)OC1OC(CO)C(C(C1O)O)O)OC1OC(C)C(C(C1O)O)O,non-mutagenic
+COc1cc(N=Nc2ccc(cc2)N)c(cc1N=Nc1c(O)c2cc(N)ccc2cc1S(=O)(=O)O)C,mutagenic
+CCOC(=O)N(CCOC(=O)C)N=O,mutagenic
+[O-][N+](=O)c1cc(Cl)c(c(c1)[N+](=O)[O-])N,mutagenic
+Cc1cc2cc3ccccc3c3c2c2c1cccc2cc3,mutagenic
+CCOc1ccccc1N,non-mutagenic
+CCOP(=O)(O/C(=C\Br)/c1ccc(cc1Cl)Cl)OCC,non-mutagenic
+O=C1NCCN1c1nccs1,mutagenic
+OCC1OC(OC2CCC3(C(=CCC4C3CCC3(C4CC4C3C(C)C3(O4)CCC(CO3)C)C)C2)C)C(C(C1O)OC1OC(CO)C(C(C1O)O)O)OC1OC(C)C(C(C1O)O)O,non-mutagenic
+OC1c2ccccc2-c2c(C1O)c(Cl)c1c(c2)cccc1,non-mutagenic
+Oc1cc2cccc3c2c2c1c(ccc2cc3)[N+](=O)[O-],mutagenic
+Clc1cc(Cl)c2c(c1)c(/N=C/c1ccc(cc1)[N+](=O)[O-])sn2,mutagenic
+OCc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+N#CC(=C(C#N)C#N)C#N,non-mutagenic
+CCn1cc(C(=O)O)c(=O)c2c1c(F)c(N1CCNC(C1)C)c(c2)F,mutagenic
+C/C/1=C/CCC(=C)[C@H]2[C@@H](CC1)C(C2)(C)C,non-mutagenic
+OC1c2cccc3c2c2c(C1O)c1ccccc1cc2cc3,mutagenic
+CCSCCOP(=S)(OCC)OCC,mutagenic
+Nc1ccc(c(c1)N)N=Nc1cccc(c1)N=Nc1ccc(cc1N)N,mutagenic
+CC(=O)C(Cl)(Cl)Cl,mutagenic
+CC(c1cc(Sc2cc(c(cc2C)O)C(C)(C)C)c(cc1O)C)(C)C,non-mutagenic
+NC1c2ccccc2-c2c1cccc2,non-mutagenic
+Cc1c[nH]cn1,non-mutagenic
+CCCC[C@H](CN)CC,non-mutagenic
+c1ccc(cc1)Cc1ccc(cc1)C[C@H]1CO1,mutagenic
+Clc1cc2NC=NS(=O)(=O)c2cc1S(=O)(=O)N,non-mutagenic
+c1ccc2-c3c([C@@H]4[C@H](c2c1)O4)c1ccccc1c1c3cccc1,mutagenic
+C=C1[C@H]2CC[C@@H](C1(C)C)C2,non-mutagenic
+C[C@@H]1CC[C@H](C(=O)C1)C(C)C,mutagenic
+CC(=O)Nc1ccc2c(c1)nccc2,mutagenic
+O[C@@H]1Cc2c3c1ccc1c3c3c(c2)cccc3cc1,mutagenic
+C[C@@H](Nc1ccc(cc1)N[C@@H](CCC(C)C)C)CCC(C)C,non-mutagenic
+CC(=O)Nc1snc2c1cc(Cl)cc2,mutagenic
+OC(=O)c1cc(Cl)cc(c1)Cl,non-mutagenic
+C=CC(=C)Cl,non-mutagenic
+Cc1ccc(cc1)S(=O)(=O)OCC1OC1,mutagenic
+C/C(=C\C=C\C=C(\C=C\C=C(\C=C\C1=C(C)C(=O)CCC1(C)C)/C)/C)/C=C/C=C(/C=C/C1=C(C)C(=O)CCC1(C)C)\C,non-mutagenic
+[O-][N+](=Nc1ccc(c(c1)[N+](=O)[O-])C)c1ccc(c(c1)[N+](=O)[O-])C,non-mutagenic
+Nc1ccc(cc1)c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)N,non-mutagenic
+CS(=O)(=O)OCCCNCCCOS(=O)(=O)C,mutagenic
+COc1nsc2c1cc(cc2)[N+](=O)[O-],mutagenic
+C=CC=C,mutagenic
+Cc1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+C=CC(=O)NC(CC(=O)C)(C)C,non-mutagenic
+CCOP(=S)(SCn1c(=O)oc2c1ccc(c2)Cl)OCC,non-mutagenic
+CCOP(=O)(SCCN(C(C)C)C(C)C)C,non-mutagenic
+COc1cc(CNC(=O)C(Br)C)ccc1O,mutagenic
+CN1CN(C)CSC1=S,mutagenic non-mutagenic
+[O-][N+](=O)c1cccc(c1C)N=[N+](c1cccc(c1C)[N+](=O)[O-])[O-],non-mutagenic
+OC(C(Cl)(Cl)Cl)(c1ccc(cc1)Cl)c1ccc(cc1)Cl,non-mutagenic
+C=CCN(CC=C)N=O,mutagenic
+OCc1ccc(cc1)F,non-mutagenic
+COc1cc(Cl)c(cc1Cl)OC,mutagenic
+CN(CCN(C)C)C,non-mutagenic
+Oc1c(Br)cc(cc1Br)C1(OS(=O)(=O)c2c1c(Br)c(Br)c(c2Br)Br)c1cc(Br)c(c(c1)Br)O,non-mutagenic
+NCC(=O)Nc1ccccc1,mutagenic
+O[C@H]1C=Cc2c([C@@H]1O)ccc1c2cc2cccc3c2c1C=C3,mutagenic
+N#Cc1cccc(c1)C#N,non-mutagenic
+c1ccc(cc1)Oc1ccccc1,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)cc[nH]2,mutagenic
+CC(CC(C(=O)O)NC(=O)COc1cc(Cl)c(cc1Cl)Cl)C,non-mutagenic
+Nc1ccc(cc1)c1ccc(c(c1)[N+](=O)[O-])N,mutagenic
+O=C=Nc1cccc(c1C)N=C=O,mutagenic
+OCc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+ClCc1cccc2c1c1ccc3c4c1c(c2)ccc4ccc3,mutagenic
+c1ccc2c(c1)cc1c(c2)ccc2c1cccc2,mutagenic
+[O-][N+](=O)c1cc2ccccc2c2c1cccc2[N+](=O)[O-],mutagenic
+OCCNc1ccc(cc1)N=Nc1ccc(cc1)N(CCO)CCO,non-mutagenic
+Cc1ccc(cc1)C(O)(C)C,non-mutagenic
+OCC1OC(C(C1O)O)n1cnc2c1nc(N)nc2NO,mutagenic
+[O-][N+](=O)c1ccc(cc1)S(=O)(=O)O,non-mutagenic
+OC(=O)C(Cc1ccc(c(c1)O)O)(N)C,non-mutagenic
+ClCc1ccccn1,mutagenic
+c1cc2cc3ccc4c(c3c3c2c(c1)C1OC31)cccc4,mutagenic
+CC(=O)/C=C\c1ccccc1,mutagenic
+CCc1ccccc1NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+Clc1cccc(n1)C(Cl)(Cl)Cl,mutagenic
+NC(=N)NC#N,mutagenic
+OCCN(C)C,non-mutagenic
+CCCCCOc1ccc(cc1)N=O,mutagenic
+ClCCNc1ccc(cc1)C,mutagenic
+Cc1ccccc1O,non-mutagenic
+BrCC(CCOP(=O)(OCCC(CBr)Br)OCCC(CBr)Br)Br,non-mutagenic
+COc1ccc2c(c1)cc1-c3cccc4c3c(-c1n2)ccc4,mutagenic
+N#CC(Cl)(Cl)Cl,mutagenic
+O=C1C=CC(=O)c2c1c(O)ccc2,mutagenic
+O=c1oc2ccc(cc2c2c1cccc2)[N+](=O)[O-],mutagenic
+Clc1ccc(c(c1)Cl)Cn1c(/C=N/OCc2ccccc2[N+](=O)[O-])nc2c1ccc(c2)[N+](=O)[O-],mutagenic
+C[C@@H]1O[C@@H]1C,mutagenic
+ClCCN(c1ccc(cc1)C[C@H](C(=O)O)N)CCCl,mutagenic
+C[C@H](c1ccc2c3c1ccc1c3c(cc2)ccc1)O,mutagenic
+Oc1ncc(c(n1)O)F,non-mutagenic
+CCCCSCCC(C(=O)O)N,non-mutagenic
+O=C1c2ccccc2C(=O)c2c1ccc(c2N)C,mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c2c(c1O)cc(cc2)S(=O)(=O)O,mutagenic
+O=C(C1=C(O)c2sccc2S(=O)(=O)N1C)Nc1ccccn1,non-mutagenic
+CCN(c1ccc2c(c1)oc1-c(c2c2ccc(cc2S(=O)(=O)O)S(=O)(=O)O)ccc(=[N+](CC)CC)c1)CC,mutagenic
+COC(=O)C1(OC1(CC)C(O)C)C(=O)N,non-mutagenic
+Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)N,non-mutagenic
+Oc1ccc2-c3c(Cc2c1)cc(cc3)[N+](=O)[O-],mutagenic
+OS(=O)(=O)c1cc2cc(c(c(c2c(c1N=Nc1ccc(cc1)N=Nc1ccc(cc1N)N)O)N)N=Nc1ccc(cc1)N=Nc1ccc(cc1N)N)S(=O)(=O)O,mutagenic
+OC1C(O)c2cccc3c2c2c1ccc(c2cc3)[N+](=O)[O-],mutagenic
+Oc1ccc2c(c1)c1c(cc2)ccc2c1nc([nH]2)C,mutagenic
+c1ccc(cc1)c1nc2c(o1)cccc2,non-mutagenic
+CC(ON(C(=O)c1ccccc1)OC(=O)C)C,mutagenic
+CC(c1cc(ccc1N)c1ccccc1)C,mutagenic
+ClCc1cc2cccc3c2c2c1c1ccccc1cc2cc3,mutagenic
+COC1=CC(=O)c2c(C1=O)nc(c1c2[nH]c2c1cccc2)C,mutagenic
+[O-][N+](=O)c1cc2c(cc1N)[nH]c1c2cccc1,mutagenic
+CCS,non-mutagenic
+FC(Br)(Cl)F,non-mutagenic
+N#N=NCc1ccccc1,mutagenic
+Cn1c2ccccc2c2c1cccc2,mutagenic
+CC/C=C\C#N,non-mutagenic
+O=Nc1ccc2c3c1ccc1c3c(cc2)c2c(c1)CCCC2,mutagenic
+COc1cc2c(cc1OC)OC[C@H]1[C@H]2C(=O)c2c(O1)c1C[C@H](Oc1cc2)C(=C)C,non-mutagenic
+OCc1ccc2-c3c4c(-c2c1)cccc4ccc3,mutagenic
+COC(=O)CCCC(=O)OC,non-mutagenic
+NC(=N)c1ccccc1,non-mutagenic
+CN(c1ccc2c(c1)ccc([n+]2C)/C=C/c1cc(n(c1C)c1ccccc1)C)C,mutagenic
+BrN1C(=O)CCC1=O,mutagenic
+S=c1c2cc3OCCOCCOCCOCCOCCOCCOc4cc1c(n(c2cc3)C)cc4,non-mutagenic
+CNC(=O)NO,non-mutagenic
+Cc1ccc(c(c1)C(=O)O)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc(cc1)O[C@@H]1OC1,mutagenic
+NCCS(=O)(=O)O,non-mutagenic
+Nc1ccccc1S(=O)(=O)O,mutagenic
+[O-][n+]1ncc2c(c1)nccc2,non-mutagenic
+Cc1ccc2-c3c4c(-c2c1)cc1ccccc1c4cc1c3cccc1,mutagenic
+Cc1ccc2c(c1)ccc1c2cc2ccccc2c1,mutagenic
+CN(N)C,mutagenic
+c1ccc2-c3c(Cc2c1)ccc1c3c2ccccc2cc1,non-mutagenic
+c1ccc2c(c1)cncc2,non-mutagenic
+O=C(Cn1ccnc1[N+](=O)[O-])NCc1ccccc1,mutagenic
+CCCCCCCCC1OC1CCCCCCCC(=O)OCC(CCCC)CC,non-mutagenic
+Nc1cccc(c1)S(=O)(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)CC=C2,mutagenic
+OC(=O)CCN=N#N,mutagenic
+Oc1ccc2c(c1N=Nc1ccc(c(c1)S(=O)(=O)O)c1ccc(cc1S(=O)(=O)O)N=Nc1c(O)ccc3c1cccc3)cccc2,non-mutagenic
+OC1C2OC2c2c(C1O)c1ccc3c(c1cc2)cccc3,mutagenic
+OC(COc1ccc(cc1C1CCCC1)O)CNC(C)(C)C,non-mutagenic
+CCCCC(CCCC)(CCC)S,non-mutagenic
+FC(c1ccccc1)(F)F,non-mutagenic
+O=C(c1ccccc1N)OC1CCCCC1,non-mutagenic
+N#N=Nc1nc2c(n1C)c1ccccc1cc2,mutagenic
+NC1CC(C)(C)N(C(C1)(C)C)O,mutagenic
+ON1C(=O)CCC1=O,non-mutagenic
+CCOC(=O)CC(=O)C,non-mutagenic
+CC(=O)ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+C=C[C@H](c1ccc(c2c1cccc2)OC)OC(=O)C,mutagenic
+c1ccc2c(c1)ccc1c2c2C=CCc2cc1,mutagenic
+[O-][N+](=O)c1cc(ccc1O)c1cccc(c1O)[N+](=O)[O-],non-mutagenic
+Nc1ccc(cc1)c1ccccc1,mutagenic
+CCc1c2C3OC3c3c(-c2cc2c1cccc2)cccc3,mutagenic
+OC(c1ccccc1)CN=N#N,mutagenic
+CC(Br)C,mutagenic
+N#CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+OCCn1c(C)ncc1[N+](=O)[O-],mutagenic
+O=NSCC(C(=O)N(C(=O)CCC(C(=O)O)N)CC(=O)O)N,mutagenic
+NC(=O)N(c1ccccc1)c1ccccc1,non-mutagenic
+ONc1cccc2c1cccc2,mutagenic
+OC1C(O)C2OC2c2c1ccc1c2cc2c(n1)ccc1c2cccc1,mutagenic
+C=CC(=O)OC[C@H]1CO1,mutagenic
+O=Nc1ccc2c3c1ccc1c3c(cc2)cc2c1cccc2,mutagenic
+CCCCCCc1ccc(cc1)c1ccc(cc1)C#N,non-mutagenic
+SCCC(=O)N1C(CSC1c1ccccc1O)C(=O)O,non-mutagenic
+CC1=CC(C)(C)Nc2c1cccc2,non-mutagenic
+CCCCCCCCCCCCCC(=O)O,non-mutagenic
+C[C@@H]1OCCc2c1cc1c(c2)C([C@@H](C1(C)C)C)(C)C,non-mutagenic
+O=NN(C(=O)c1ccccc1)C,mutagenic
+COC(=O)[C@@H]1c2cc3c(c(c2[C@H](C[C@@]1(O)CC)O[C@@H]1C[C@H](N)[C@H]([C@@H](O1)C)O)O)C(=O)c1c(C3=O)c(O)ccc1O,mutagenic
+CCn1cc(C(=O)O)c(=O)c2c1c(F)c(c1ccc(cc1)O)c(c2)F,mutagenic
+NC(=O)N(c1ccccc1)c1ccc(cc1)C(=O)O,mutagenic
+OCCN(c1ccc(c(c1)Cl)N=Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-])CCO,mutagenic
+COc1ccc2c(-c3nccc4c3c(C2=O)c(OC)c(c4)OC)c1,mutagenic
+Cc1cccc2c1ccc1c2ccc2c1cccc2,mutagenic
+Cc1cnc2c(n1)c(C)cc1c2nc(n1C)N,mutagenic
+Oc1cccc2c1cccn2,mutagenic
+Oc1cc2cccc3c2c2c1cc1ccccc1c2cc3,mutagenic
+CN(CCNC(=O)c1cccc2c1oc(c2)c1ccccc1)C,mutagenic
+O=c1oc2ccc(c3c2c2c1cccc2cc3)[N+](=O)[O-],mutagenic
+OCc1ccc2-c1cc(ccc2C)C(=C)C,mutagenic
+C[C@@H]1CC[C@H](CC1)C(C)C,non-mutagenic
+O=C1C(=O)c2ccccc2-c2c1cccc2,non-mutagenic
+CC(=O)Nc1ccc2c3c1ccc1c3c(c(=O)c2=O)ccc1,mutagenic
+ONc1ccc(cc1C(C)(C)C)c1ccccc1,mutagenic
+O/N=C/c1ccccn1,non-mutagenic
+ClCCCCN(COC(=O)C)N=O,mutagenic
+COc1cc2O[C@@H]3[C@H](c2c2c1c1[C@@H](O)C[C@@H](c1c(=O)o2)O)C=CO3,mutagenic
+CNC(=O)Oc1cccc2c1cccc2,mutagenic non-mutagenic
+Nc1cc(C)c(c(c1)[N+](=O)[O-])N,mutagenic
+ClCc1ccc2c3c1ccc1c3c(cc2)cc2c1cccc2,non-mutagenic
+CC(=O)Nc1nc(NC(=O)C)nc(n1)c1ccc(o1)[N+](=O)[O-],mutagenic
+BrC(C(Br)Br)Br,non-mutagenic
+Nc1cccc2c1ccc1c2cccc1,mutagenic
+CN1CCN(CC1)c1cc2c(cc1F)n1c(n2C2CC2)cc(=O)[nH]c1=O,mutagenic
+Cc1ccccc1,non-mutagenic
+COc1nncc2c1cccn2,non-mutagenic
+OCc1ccc(cc1)NNC(=O)CC[C@@H](C(=O)O)N,mutagenic
+[O-][N+](=O)c1c2C=CCCc2c2c3c1ccc1c3c(cc2)ccc1,mutagenic
+COC(=O)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(\C=C\C(=O)OC)/C)\C)/C)/C,mutagenic
+O=Nc1n(C)cnc1c1ccccc1,mutagenic
+c1ccc2c(c1)c1ccc3c(c1cc2)cccn3,mutagenic
+C1C2SCC=CN2C1=O,non-mutagenic
+CSCCC=O,non-mutagenic
+OCC(CNC(=O)c1c(I)c(N(C(=O)C)CC(CN(c2c(I)c(C(=O)NCC(CO)O)c(c(c2I)C(=O)NCC(CO)O)I)C(=O)C)O)c(c(c1I)C(=O)NCC(CO)O)I)O,non-mutagenic
+[O-][N+](=O)c1cc2c(cc1O)[nH]c1c2cccc1,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C(/C(=O)OC)\C,mutagenic
+COc1cccc2c1C(=O)c1c(C2=O)cccc1,mutagenic
+CN(c1ccc(cc1)C(c1ccc(cc1)N(C)C)c1ccccc1)C,non-mutagenic
+CCCCCCNCCCCCC,non-mutagenic
+O=C1[C@@]2(C)CC[C@@H](C1(C)C)C2,non-mutagenic
+ClC(=C)C=O,mutagenic
+[O-][N+](=O)c1c2ccccc2cc2c1cccc2,mutagenic
+CC(CCCCCOC(=O)Cc1cc(Cl)c(cc1Cl)Cl)C,non-mutagenic
+N#CC1=C(SCCS1)C#N,non-mutagenic
+BrC(C=O)CBr,mutagenic
+[O-][N+](=O)c1ccc(c(c1)O)N,mutagenic
+Cc1ccc(o1)C=O,non-mutagenic
+O=CN(N=O)C,mutagenic
+OCC(C(CO)O)O,non-mutagenic
+c1ccc(cc1)NN=Nc1ccccc1,mutagenic
+Clc1ccc(cn1)Cl,non-mutagenic
+OC(=O)C1=CC(N(C1(C)C)O)(C)C,non-mutagenic
+CC(CN(CC(C)C)N)C,mutagenic
+Cc1cc(C)c2c(n1)cc(c(c2)C)N,mutagenic
+N#Cc1ccc(cc1)C[C@]12C[C@@H](CN2C(=O)N(C1=O)c1cc(Cl)cc(c1)Cl)N=[N+]=[N-],mutagenic
+Cc1ccc(c(c1)[N+](=O)[O-])C,mutagenic
+O=C1C=CC(=O)C=C1c1ccccc1,non-mutagenic
+O=C(c1ccccc1)N(OC(=O)C)OCc1ccc(cc1)C(C)(C)C,mutagenic
+CC(=O)Nc1scc(n1)c1scc(c1)[N+](=O)[O-],mutagenic
+CCCN(c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])CCC,mutagenic non-mutagenic
+OC(=O)c1ccco1,non-mutagenic
+[O-][N+](=O)OOC(=O)C,mutagenic
+Cc1ccccc1N=Nc1c(O)ccc2c1cccc2,mutagenic
+OC(=O)CCC(=O)OC[C@@H]([C@H](c1ccc(cc1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl,non-mutagenic
+CCOC(=O)CC(C)C,non-mutagenic
+COc1nsc2c1cc(N)cc2,mutagenic
+O=NN(C(=N)N[N+](=O)[O-])C,mutagenic
+O=C(c1ccccc1)[C@@H]1O[C@H]1c1ccc(cc1)[N+](=O)[O-],non-mutagenic
+O[C@@H]1[C@H]2O[C@H]2c2c([C@H]1O)cc1c(c2)c2ccccc2cc1,mutagenic
+OCc1ccc2c(c1)c(C)c1c(-c3ccccc3C3C1O3)n2,non-mutagenic
+Fc1cccc2c1cc1-c3cccc4c3c(-c1c2)ccc4,mutagenic
+Fc1ccc2-c3c(-c4c2c1ccc4)cc1c(c3)cccc1,mutagenic
+Br[C@H](CBr)COC(=O)C=C,mutagenic
+CC(=O)Nc1ccc(cc1)N=Nc1ccc(cc1)N(C)C,mutagenic
+Oc1ccccc1Cl,non-mutagenic
+Nc1cc2ccccc2c2c1cccc2,mutagenic
+[O-][N+](=O)c1cccc2c1c1cccc(c1c(c2)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+OCCN(N=O)CCO,mutagenic
+O=C(c1csc(c1)[N+](=O)[O-])Nc1ccc(cc1)[N+](=O)[O-],mutagenic
+C=CC(=O)OCCN(C)C,non-mutagenic
+ClCCNCCCl,mutagenic
+O=C(Nc1cc(Cl)c(c(c1)Cl)Cl)CCC(=O)O,non-mutagenic
+COc1ccc2c(c1)c1c(OC)c(OC)cc3c1c(c2)N(C)CC3,non-mutagenic
+Fc1ccc(c2c1ccc1c2cccn1)F,mutagenic
+COc1ccc(cc1)c1nc(c([nH]1)c1ccccc1)c1ccccc1,mutagenic
+Clc1ccc(cc1)NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+C1OCCO1,non-mutagenic
+CNc1ccc(cc1)C(=C1C=CC(=[N+](C)C)C=C1)c1ccc(cc1)N(C)C,mutagenic
+COC(=O)c1oc(c(c1c1ccccc1)c1ccccc1)N(C(=O)C)OC(=O)C,non-mutagenic
+BrCC(CBr)Br,mutagenic
+[O-][N+](=O)c1ccc2-c3c(C(=O)c2c1)cccc3,mutagenic
+CC/C=C/C/C=C/C/C=C/CCCCCCCC(=O)O,non-mutagenic
+CC(=O)Nc1scc(n1)c1ccc(o1)[N+](=O)[O-],mutagenic
+CC(=O)Nc1ccnc2c1cccc2,non-mutagenic
+CNP(=S)(N1CC1)N1CC1,mutagenic
+BrCc1c2ccc3c4c2c2c5c1cccc5ccc2cc4ccc3,mutagenic
+ClCCN(c1ccc(cc1)CCCC(=O)O)CCCl,mutagenic
+Nc1ccc2c(c1)nc1c(n2)c(N)ccc1,mutagenic
+CSCC(C(=O)NC(C(C(=O)N1CSCC1C(=O)NC(C)(C)C)O)Cc1ccccc1)NC(=O)COc1cccc2c1ccnc2,non-mutagenic
+CCCCN(CCCO)N=O,mutagenic
+[O-][N+](=O)c1cc(N)c(c(c1)[N+](=O)[O-])O,mutagenic
+CC(Br)Br,non-mutagenic
+BrCCOC(=O)C=C,mutagenic
+Cl/C(=C(\C(F)(F)F)/Cl)/SSc1ccccc1[N+](=O)[O-],mutagenic
+OCCCCO,non-mutagenic
+Cc1nc2c(nc1C)c(C)cc1c2nc(n1C)N,mutagenic
+COP(=S)(OC)Cl,non-mutagenic
+O=C(c1ccc(cc1)Cl)NCOC(=O)C,non-mutagenic
+[O-][N+](=O)c1c(nc2n1CCS2)c1ccc(cc1)[N+](=O)[O-],mutagenic
+COc1cccc(c1O)C=O,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1ccccc1s2,mutagenic
+OCCc1c[nH]c2c1cccc2CC,non-mutagenic
+CC12OOC2(C)c2c(O1)cccc2,mutagenic
+COC(=O)c1ccccc1N,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(c3c2cccc3)ccc1,mutagenic
+O=Cc1ccc(cc1)[N+](=O)[O-],mutagenic
+Cc1ccc(cc1)S(=O)(=O)NC1CCCCC1,non-mutagenic
+ICI,non-mutagenic
+CN1CCN(CC1)c1cc2c(cc1F)n1c(n2C2CC2)cc(=O)n(c1=O)O,mutagenic
+N#N=NCC(C(=O)O)NC(=O)OC(C)(C)C,mutagenic
+ClC([C@@H](c1ccccc1Cl)c1ccc(cc1)Cl)Cl,non-mutagenic
+BrC(C1=C(Br)C(=O)OC1O)Br,mutagenic
+CC(=O)Nc1cccc(c1C(=O)O)N,mutagenic
+OCCNC(=O)c1c(C)[n+]([O-])c2c([n+]1[O-])cccc2,mutagenic
+CCCCCC(=O)Cc1cc(O)cc2c1C(=O)Oc1c(O2)c(CCCCC)c(c(c1)O)C(=O)O,non-mutagenic
+C/C=C\C=O,mutagenic
+OC1C(O)c2ccc3c4c2c2=C1c1ccccc1-c2cc4ccc3,non-mutagenic
+OC(=O)/C=C/c1ccc(c(c1)O)O,non-mutagenic
+Fc1cnc2c(c1)c(F)ccc2,non-mutagenic
+N#CCCC(=O)CCc1ccc(cc1)C(=O)O,mutagenic
+CCCCCl,non-mutagenic
+NNCCO,mutagenic
+COc1cc(cc(c1O)OC)C(=O)C,non-mutagenic
+N#Cc1cccc(c1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+ClC(C[C@@H]1OC1)(Cl)Cl,mutagenic
+CC(=O)OC=C,non-mutagenic
+OC[C@H]([C@H]([C@@H]([C@H](CO)O)O)O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)O,non-mutagenic
+C1CCc2c(C1)ccc1c2cc2-c3ccccc3CCc2c1,mutagenic
+[O-][N+](=O)c1cccc(c1N)C,mutagenic
+ClCC12C(Cl)C(C(C2(CCl)CCl)CC1(Cl)Cl)Cl,non-mutagenic
+C[Si](O[Si](C)(C)C)(O[Si](C)(C)C)C,non-mutagenic
+CCCN(CCCC(=O)O)N=O,mutagenic
+OC1C=Cc2c(C1O)cc(c1c2cc2ccccc2c1)C,mutagenic
+CCCCO,non-mutagenic
+ICCc1ccccc1,non-mutagenic
+O=NN(C(=O)O/N=C(\SC)/C)C,mutagenic
+O=C(c1ccc(c(c1)Cl)Cl)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)c1ccc(c(c1)Cl)Cl,mutagenic
+ClC(=C(c1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl)Cl)Cl,non-mutagenic
+CCCCCCCCSCN1C=CN(C1)C,non-mutagenic
+O1C2C1c1cccc3c1-c1c2cccc1C1C3O1,mutagenic
+O=S1(=O)CC=CC1,non-mutagenic
+CCCCCCC=C,non-mutagenic
+CCCCC1CO1,non-mutagenic
+S=P(N1CC1)(N1CC1)N1CC1,mutagenic
+Fc1c(F)c(F)c(c(c1F)Cl)F,non-mutagenic
+CNP(=O)(N(C)C)N(C)C,mutagenic
+Brc1cc(Br)cc(c1c1c(Br)cc(cc1Br)Br)Br,non-mutagenic
+CC(=O)Nc1ccc2-c3c(Cc2c1OC(=O)C)cccc3,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1cc(ccc1o2)[N+](=O)[O-],mutagenic
+ClCC#N,non-mutagenic
+CN(CCN(c1ccccn1)Cc1cccs1)C,non-mutagenic
+O=C1C(=C(Cl)C(=O)c2c1cccc2)Cl,mutagenic
+[O-][N+](=O)c1cc2ccccc2c2c1cccc2,mutagenic
+Oc1ccc(c2c1c(O)c1ccccc1c2O)O,mutagenic
+C[C@H]1C[C@@H](C)C(=O)[C@H](C1)[C@H](CC1CC(=O)NC(=O)C1)O,non-mutagenic
+OC(=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+Clc1ccc(cc1N)C(F)(F)F,non-mutagenic
+c1cnc2c(c1)C1OC1CC2,non-mutagenic
+CCCCOC(=O)/C=C\C(=O)OCCCC,non-mutagenic
+CCCCN(CCCC(=O)O)N=O,mutagenic
+Nc1ccc(cc1Cl)Cc1cc(O)c(c(c1)Cl)N,non-mutagenic
+C1CCC2(CO1)CO2,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)ccc1c2cc2ccccc2c1C,mutagenic
+CCSc1cc(ccc1N)Cc1ccc(c(c1)SCC)N,mutagenic
+CC([N+](=O)[O-])(C)C,non-mutagenic
+CCCCCCCCCC=C,non-mutagenic
+CCC[C@H](C[C@@H]([C@@H](OC(=O)C[C@H](C(=O)O)CC(=O)O)C[C@@H](C[C@@H](CCCC[C@@H](C[C@@H]([C@@H](N)C)O)O)O)C)OC(=O)C[C@H](C(=O)O)CC(=O)O)C,non-mutagenic
+[O-][N+](=O)c1cc(cc2c1cccc2)[N+](=O)[O-],mutagenic
+CC(CCCCCCCOP(=O)(Oc1ccccc1)Oc1ccccc1)C,non-mutagenic
+OCC(CBr)(CBr)CBr,mutagenic
+Cc1c2cnccc2c(c2c1c1ccccc1[nH]2)C,mutagenic
+[O-][n+]1ncc2c(c1)ccnc2,non-mutagenic
+COc1ccc(cc1)N=O,mutagenic
+CCOP(=S)(Oc1cc(C)nc(n1)C(C)C)OCC,non-mutagenic
+N#CCCCCC#N,non-mutagenic
+COc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl,mutagenic
+ONc1ccc(cc1Cl)Cc1ccc(c(c1)Cl)N,mutagenic
+COc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+COc1ccc2c3c1cccc3OC(=C2)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1cc[n+](c2c1cccc2)[O-],mutagenic
+N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)C1C(C1(C)C)(C)C,non-mutagenic
+CC(OC[C@@H]1OC1)C,mutagenic
+Cc1ccccc1Cl,non-mutagenic
+O=C1OC2=CCO[C@H](C2=C1)O,non-mutagenic
+O=C=Nc1ccc(cc1)N=C=O,non-mutagenic
+COP(=S)(SCN1C(=O)c2c(C1=O)cccc2)OC,mutagenic
+CCCCOCCOCCOCCCC,non-mutagenic
+C=Cc1ccccn1,non-mutagenic
+CN(CCOC(=O)C(=C)C)C,mutagenic
+ClCCCC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)CCCCl,mutagenic
+COc1cccc2c1C1(C)OOC1(O2)C,mutagenic
+Cc1cnc2c(n1)c(C)c1c(c2)nc(n1C)N,mutagenic
+Cc1ccc2c3c1ccc1c3c(C2)ccc1,mutagenic
+Cc1cnc2c(n1)c1nc(n(c1c(c2C)C)C)N,mutagenic
+Cc1ccc2c(c1)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+CN(CCNC(=O)c1cccc2c1ncc1c2cccc1)C,mutagenic
+N#N=Nc1nc2c(n1C)cc(cn2)c1ccccc1,mutagenic
+Fc1cccc(c1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+Br/C(=C\c1ccccc1)/[N+](=O)[O-],mutagenic
+CC(Cl)C,mutagenic
+CCO,non-mutagenic
+O=C1C(=CC(=O)c2c1cccc2)Nc1ccccc1,mutagenic
+OC(=O)C[C@@H](C(=O)O)C,non-mutagenic
+OC[C@@H]1SCCN1N=O,mutagenic
+OCCNC(=O)C(O)C,mutagenic
+Cc1cc2c(c3c1cccc3)ccc1c2cccc1,mutagenic
+O=C(NC(C(=O)O)Cc1c[nH]c2c1cccc2)COc1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+OC1C(O)C=Cc2c1cc1ccc3c4c1c2ccc4ccc3O,mutagenic
+Cc1c(C)c2nccnc2c2c1n(C)c(n2)N,mutagenic
+CC(=O)OCCOCCOCCOC(=O)C,mutagenic
+CC(OOC(C)(C)C)(CCC(OOC(C)(C)C)(C)C)C,non-mutagenic
+Oc1ccc(cc1O)C(C)(C)C,non-mutagenic
+Clc1ccc2c(c1)cccc2,non-mutagenic
+CCCCCC(=O)OCC,non-mutagenic
+OCC(C)C,non-mutagenic
+OC(=O)C(CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])N,mutagenic
+CC(=O)N(c1ccc2-c3c(Cc2c1)cccc3)Cl,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C/C(=O)OCCCC,mutagenic
+O=Nc1ccc(cc1Cl)Cc1ccc(c(c1)Cl)N,non-mutagenic
+c1ccc2c(c1)c1ccc3c4c1c(c2)c1ccccc1c4ccc3,mutagenic
+COS(=O)(=O)C(F)(F)F,mutagenic
+NNC(=O)c1ccncc1,mutagenic
+CCOc1cc2C(=O)CCc2c2c1c1ccccc1cc2,non-mutagenic
+COc1c2c(OC3C2C=CO3)cc2c1c(=O)c1c(o2)ccc(c1OC)Cl,mutagenic
+c1ccc2c(n1)c1ccc3c(c1cc2)cccn3,mutagenic
+CC(=O)Nc1ccc(c2c1c(O)c(N=Nc1ccc(c3c1cc(cc3)S(=O)(=O)O)N=Nc1ccc(cc1)S(=O)(=O)O)c(c2)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+C[C@H](C(=O)NCC(=O)O)S,non-mutagenic
+COc1c2c(ccc(c2cc(c1c1cc(OC(=O)C)c2c(c1OC(=O)C)cc(cc2OC)C)C)OC(=O)C)OC(=O)C,non-mutagenic
+OC(=O)Cc1ccccc1[N+](=O)[O-],mutagenic
+OCCN(CC(=O)N(C(Cc1ccccc1)(C)C)C)CC(=O)N(C(Cc1ccccc1)(C)C)C,non-mutagenic
+CCN(CCC[C@H](Nc1c2cc(OC)ccc2nc2c1ccc(c2)Cl)C)CC,mutagenic
+COS(=O)(=O)C,mutagenic
+Nc1ccc2c(c1)c(O)c(c(c2)S(=O)(=O)O)N=Nc1ccc(cc1)c1ccc(cc1)N=Nc1ccc(c(c1)C(=O)O)O,mutagenic
+[O-][N+](=O)c1c2ccc3c(c2cc2c1cccc2)cccc3,non-mutagenic
+OS(=O)(=O)c1cc(ccc1/C=C/c1ccc(cc1S(=O)(=O)O)Nc1nc(Nc2ccccc2)nc(n1)N1CCOCC1)Nc1nc(Nc2ccccc2)nc(n1)N1CCOCC1,non-mutagenic
+FC(C(F)(F)F)Cl,non-mutagenic
+CCCCCCCCCCCCOS(=O)(=O)O,non-mutagenic
+C[C@@H]1CCC(=C(C)C)C(=O)C1,non-mutagenic
+CC(=O)c1cccc2c1OC1(C2(C)OO1)C,mutagenic
+BrCc1c2ccccc2cc2c1c1ccccc1cc2,mutagenic
+ClCC=O,mutagenic
+CCC(Nc1snc2c1cccc2)C,non-mutagenic
+OCc1cc2ncc(nc2c2c1n(C)c(n2)N)C,mutagenic
+NC(=O)Nc1ccc(cc1)C,non-mutagenic
+CC(=O)OC[C@H]1O[C@@H](Oc2cccc3c2C(=O)c2c(C3=O)cccc2O)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C,mutagenic
+ClCCC(=O)N(c1snc2c1cccc2)C,mutagenic
+CNC(=O)[C@H](SCCSP(=O)(OC)OC)C,mutagenic
+NC(=O)Nc1cccc2c1nccc2,non-mutagenic
+c1ccc2c(c1)c1ccc3c4c1c(c2)ccc4cc1c3cccc1,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2cc2cccc3c2c1C=C3,mutagenic
+CC1CCCO1,non-mutagenic
+O=C(C(Cl)(Cl)Cl)Nc1snc2c1cc(C)cc2,mutagenic
+NC(=O)N,non-mutagenic
+Oc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+C[C@H]1CC(=O)O1,mutagenic
+CSCCC(C(=O)O)N,non-mutagenic
+O=c1c2cccc3c2c2c(c1=O)c(ccc2cc3)[N+](=O)[O-],mutagenic
+ONc1nc2c(n1C)ccc1c2nc(C)cn1,mutagenic
+ClC(C(=CC(=O)O)C(Cl)Cl)Cl,mutagenic
+O=C1CCC(=O)N1c1cc(Cl)cc(c1)Cl,non-mutagenic
+CC1(C)C2CCC3(C1C2)CO3,non-mutagenic
+Clc1cc(ccc1N=Nc1c2ccc(cc2cc(c1N)S(=O)(=O)O)S(=O)(=O)O)c1ccc(c(c1)Cl)N=Nc1c2ccc(cc2cc(c1N)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+Ic1ccc2c(c1)c(N)c1c(n2)cccc1,mutagenic
+O=NN(C(=O)N)CC(=O)O,non-mutagenic
+O[C@H]1O[C@@H](O)[C@]2([C@H](C1)[C@@H](C)C[C@@H]1[C@H](C2)C(=C)C(=O)O1)C,mutagenic
+CCCCCC[N+](=O)[O-],non-mutagenic
+CN(C(=O)OCC)N=O,mutagenic
+O=C(N(OC(=O)c1ccccc1)OCc1ccccc1)c1ccccc1,mutagenic
+COC(=O)c1ccc(cc1)N=Nc1ccc(cc1)N(OC(=O)C)C,mutagenic
+CC(=O)OCC12OOC2(C)c2c(O1)cccc2,mutagenic
+CCOC(=O)C1OC1C(=O)NC(C(=O)NCCC(C)C)CC(C)C,non-mutagenic
+[O-][N+](=O)c1nccn1C,mutagenic
+Fc1ccc(c(c1)[N+](=O)[O-])F,mutagenic
+CCCN=NC(OO)(C)C,mutagenic
+Fc1ccc2c(c1)nccc2,mutagenic
+BrC=C,mutagenic
+O=NN([C@@H](c1ccccc1)OC(=O)C)C,mutagenic
+O=C/C=C\c1ccco1,non-mutagenic
+N[C@H](C(=O)O)CCC(=O)NNc1ccccc1,mutagenic
+Cc1cc(ccc1N)N=Nc1ccccc1C,mutagenic
+CCOC(=O)[C@@H](c1ccccc1)SP(=S)(OC)OC,non-mutagenic
+C[n+]1c2ccccc2cc2c1cccc2,mutagenic
+Cc1cc(N)cc(c1)N,non-mutagenic
+N#CC(C(C#N)(C)C)(C)C,non-mutagenic
+Cc1ccc(c(c1)C)[N+](=O)[O-],mutagenic
+CN(c1ccc(cc1)N=Nc1ccc(cc1)S(=O)(=O)O)C,non-mutagenic
+CC(c1ccc(c(c1)O)C)C,non-mutagenic
+Oc1cccc2c1C(=O)c1ccccc1C2=O,mutagenic
+NCCNc1cccc2c1cccc2,mutagenic
+SC[C@H]([C@@H]1CC[C@H]([C@@H](C1)S)C)C,non-mutagenic
+CN(C[C@@H](Cl)C)C,mutagenic
+COc1cccc(c1)[N+](=O)[O-],non-mutagenic
+OCc1c(OC2OC(COC3OCC(C(C3O)O)O)C(C(C2O)O)O)cc2c(c1O)C(=O)c1c(C2=O)cccc1,mutagenic
+OC(=O)C(c1cccc(c1)C(=O)c1ccccc1)C,non-mutagenic
+CCOC(=O)C[C@@H](C(=O)OCC)S[P@](=O)(SC)OC,non-mutagenic
+C#C[C@](c1ccc(c(c1)C)C)(c1ccccc1)OC(=O)NC1CCCCC1,mutagenic
+COCC(COC(=O)c1ccccc1)(COC(=O)c1ccccc1)COC(=O)c1ccccc1,non-mutagenic
+ClCC(=O)Nc1c(CC)cccc1CC,mutagenic
+NN(C(=O)C)C(=O)C,non-mutagenic
+Nc1ccc2c(n1)n1ccccc1n2,mutagenic
+OCCc1ccc(cc1)Nc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1[N+](=O)[O-])O,mutagenic
+OCCN(c1ccc2c(c1)cccc2)CCO,mutagenic
+O=C(c1ccccc1)c1ccccc1,non-mutagenic
+OCC(=O)C1(O)CCC2C1(C)CC(=O)C1C2CCC2=CC(=O)C=CC12C,mutagenic
+O=CN(c1ccc(cc1)Oc1ccc(cc1)Cl)O,mutagenic
+CC(=O)OO,non-mutagenic
+COCCOCCOC,non-mutagenic
+Nc1ccc2c(n1)[nH]c1c2cccc1,mutagenic
+OC(=O)CCCC[C@H]1SSCC1,non-mutagenic
+Cc1c(C)cccc1N=Nc1c(O)ccc2c1cccc2,non-mutagenic
+SCCc1cnccn1,non-mutagenic
+Nc1nc(nc(n1)N)c1ccc(o1)[N+](=O)[O-],mutagenic
+CNCC(=O)O,non-mutagenic
+N/N=c/1\sc2c(n1C)cccc2,mutagenic
+Oc1cccc2c1ccc1c2ccc2c1cccc2,mutagenic
+OC(=O)CCC(C1CCC2C1(C)CCC1C2C(=O)CC2C1(C)CCC(=O)C2)C,non-mutagenic
+OCC(COc1ccc(cc1)C(c1ccc(cc1)OCC(CO)O)(C)C)O,non-mutagenic
+O=C/C=C/c1ccccc1Cl,mutagenic
+CC(CCCC(C1CCC2C1(C)CCC1C2CC(C2(C1(C)CCC(C2)O)O)O)C)C,mutagenic
+NC1CCCC(C1)N,non-mutagenic
+c1ccc2c(c1)c1ccc3c4c1c1c2cccc1cc4C=C3,mutagenic
+CCCC(=O)C1c2cccc(c2C(=O)c2c1cccc2O)O,mutagenic
+CC(=C)[C@@H]1CC=C([C@H](C1)O)C,non-mutagenic
+C=CCOC(=O)CC(C)C,non-mutagenic
+COC(=O)Nc1[nH]c2c(n1)cc(cc2)Sc1ccccc1,non-mutagenic
+BrCc1ccc(cc1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1cc2c(C(C(=O)OCC)C#N)snc2cc1,mutagenic
+Fc1ccc(cc1)/C=C/C(=O)c1ccccc1,non-mutagenic
+OC(=O)CCc1c[nH]c2c1cccc2,non-mutagenic
+OCc1ccnc2c1cccc2,non-mutagenic
+O=CN(C(=O)N(C)C)C,mutagenic
+ONc1ncnc2c1ncn2C,mutagenic
+O=C1OC(=O)c2c1cccc2,non-mutagenic
+N#Cc1ccc(cc1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+OCc1ccc2c3c1-c1ccccc1-c3ccc2,non-mutagenic
+NC(=O)OCC1C(NC(=O)/C(=N\OCC(=O)O)/c2csc(n2)N)C(=O)N1S(=O)(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1c([nH]2)c(C)cc(c1C)[N+](=O)[O-],mutagenic
+NC(C(=O)O)CSC(=O)NCCCl,mutagenic
+[O-][N+](=O)c1ccc2c(c1)cc1c(c2)cccc1,mutagenic
+CCCCOCCOCCSC#N,non-mutagenic
+c1ccc2c(c1)ccc1c2c2c([nH]1)ccc1c2cccc1,mutagenic
+CCCCN,non-mutagenic
+[O-][N+](=O)c1c(cc2c3c1-c1ccccc1-c3ccc2)[N+](=O)[O-],mutagenic
+O(Cc1ccccc1)CC1OC1,mutagenic
+Nc1scc(n1)c1cccnc1,non-mutagenic
+O=C(Cc1ccccc1)OCc1ccccc1,non-mutagenic
+O=NN(C(=O)Oc1ccc(c(c1C)C)C)C,mutagenic
+O=C(COC(=O)C)NCCCOc1cccc(c1)CN1CCCCC1,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1cccc3C=C2,mutagenic
+ClCc1cccnc1,mutagenic
+N[C@@H]1C[C@H]1c1ccccc1,non-mutagenic
+Cc1cccc2c1ccc1c2cc2c(c1)cccc2,mutagenic
+ClCc1ccccc1,mutagenic
+FC(c1cccc(c1)CN1C2C1c1ccccc1-c1c2cccc1)(F)F,mutagenic
+O=CN(c1ccc(cc1)[N+](=O)[O-])O,mutagenic
+COC(=O)C(Cl)C,mutagenic
+CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C,non-mutagenic
+C[C@H](CCc1ccccc1)NC[C@H](c1ccc(c(c1)C(=O)N)O)O,non-mutagenic
+CCN(CCCC(=O)O)N=O,mutagenic
+CC(=O)OCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+OCCc1ccc(cc1)[N+](=O)[O-],mutagenic
+NCC=C,non-mutagenic
+CCc1cc2C(=O)CCc2c2c1c1ccccc1cc2,mutagenic
+COc1cc2-c3c4OCOc4cc4c3C(Cc2cc1OC)N(C)CC4,mutagenic
+C[N+]1=CC=C(CC1)c1ccccc1,mutagenic
+Oc1cccc2c1nccc2,mutagenic
+O=NN(C(=O)C)C,mutagenic
+c1cc2ccc3c4c2c(c1)ccc4c1c2c3cccc2C=C1,mutagenic
+Clc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+CCC(COC(=O)c1ccccc1C(=O)O)CCC(=O)C,non-mutagenic
+CCN(C(=O)c1cccc(c1)C)CC,non-mutagenic
+Clc1cc2S/C(=C/3\Sc4c(C3=O)c(C)cc(c4)Cl)/C(=O)c2c(c1)C,non-mutagenic
+OC1C2OC2c2c(C1O)ccc1c2c(C)ccc1C,mutagenic
+Cc1ccc2c(c1)cc1c(c2)c2ccccc2cc1,mutagenic
+[O-][N+](=O)c1ccc(c(c1)Cl)Cl,mutagenic
+Nc1ccc(cc1)N(c1ccc2c(c1)cccc2)c1ccc2c(c1)cccc2,non-mutagenic
+OC1c2cc3ccc4c5c3c(c2C(C(C1O)S(=O)(=O)O)O)ccc5ccc4,non-mutagenic
+ClCCN(c1ccc2c(c1)cc(o2)[N+](=O)[O-])CCCl,mutagenic
+CCCCON(C(=O)c1ccccc1)OC(=O)C,mutagenic
+c1ccc2c(c1)ccc1c2nc2c(c1)ccc1c2cccc1,mutagenic
+OC1C(O)C(OC1n1cnc2c1ncnc2O)COP(=O)(O)O,non-mutagenic
+CC(OP(=O)(F)C)C,non-mutagenic
+[O-][N+](=O)CCl,mutagenic
+Cn1c(N)nc2c1cc1ccccc1n2,mutagenic
+CCCCCCc1ccc(cc1O)O,non-mutagenic
+CC(C(=O)O)N,non-mutagenic
+Cc1c2ccc3c(c2cc2c1cccc2)cccc3,mutagenic
+ClCc1ccc(cc1)Br,non-mutagenic
+BrCCBr,mutagenic
+ClC(=O)c1ccccc1,mutagenic
+CCCCOC(=O)c1ccc(cc1)N,non-mutagenic
+OC1C=Cc2c(C1O)c([N+](=O)[O-])c1c(c2)c2ccccc2cc1,mutagenic
+Clc1cc([N+](=O)[O-])c(cc1Cl)Cl,mutagenic
+ClC(C#N)Cl,mutagenic
+CC(=O)OC(C(=O)c1ccccc1)c1ccccc1,non-mutagenic
+OCC(C(c1ccc(cc1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl,non-mutagenic
+Oc1cc(O)c2c(c1)[o+]c(c(c2)O)c1cc(O)c(c(c1)O)O,non-mutagenic
+ONc1nc2[nH]c3c(c2cc1C)cccc3,mutagenic
+O=C(c1cccc(c1)C(=O)OC[C@@H]1OC1)OC[C@@H]1OC1,mutagenic
+ClCCCC(=O)N(c1snc2c1cccc2)C,non-mutagenic
+OS(=O)(=O)Oc1cccc2c1cc1ccc3c4c1c2ccc4ccc3,non-mutagenic
+CC(OC(=O)C(Oc1ccc(cc1)C(=O)c1ccc(cc1)Cl)(C)C)C,non-mutagenic
+Clc1c(Cl)ccc(c1Cl)Cl,non-mutagenic
+Fc1ccc(cc1)n1cc(C(=O)O)c(=O)c2c1cc(N1CCNCC1)c(c2)F,non-mutagenic
+CCSCSP(=S)(OCC)OCC,non-mutagenic
+COC(CC(=O)C)(C)C,non-mutagenic
+N#C/C(=C\C(C(C(c1ccc(c(c1)Cl)Cl)C#N)c1ccccc1)C)/c1ccc(c(c1)Cl)Cl,mutagenic
+c1ccc(cc1)c1ccccc1c1ccccc1,non-mutagenic
+OC(=O)c1cccc(c1Cl)Cl,non-mutagenic
+N#CCc1ccc(cc1)Cl,non-mutagenic
+C[N+](=C1C=CC(=C(c2ccc(cc2)N(C)C)c2ccc(cc2)N(C)C)C=C1)C,non-mutagenic
+NN(Cc1ccccc1)Cc1ccccc1,non-mutagenic
+O=C(C(C)C)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)C(C)C,mutagenic
+O=C1Nc2c(C1=O)cc(cc2)[N+](=O)[O-],mutagenic
+Oc1nc2c(o1)cccc2,non-mutagenic
+O=C(C(=C)C)OCCOCCOC(=O)C(=C)C,non-mutagenic
+OC(=O)C(CSC(=C(Cl)Cl)Cl)N,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(c3c2CCCC3)c(cc1)[N+](=O)[O-],mutagenic
+NC(=S)Nc1cccc2c1cccc2,mutagenic
+OC[C@H]1O[C@@H](O[C@H]2CC[C@]3(C(=CC[C@@H]4[C@@H]3CC[C@]3([C@H]4C[C@@H]4[C@@H]3[C@H](C)[C@@H]3N4C[C@H](CC3)C)C)C2)C)[C@H]([C@H]([C@H]1O)O[C@@H]1O[C@@H](CO)[C@H]([C@H]([C@H]1O)O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O,non-mutagenic
+CN(Nc1scc(n1)c1ccc(o1)[N+](=O)[O-])C,mutagenic
+CCCCCCCCC=C,non-mutagenic
+Nc1ccc(cc1)Nc1c2ccccc2nc2c1cccc2,mutagenic
+OC(=O)c1ccc(cc1)Cl,non-mutagenic
+COc1ccc(cc1)CN(N=O)C,non-mutagenic
+CCc1nccc(c1)C(=S)N,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)c1ccc(cc1)[N+](=O)[O-],mutagenic
+C=CC1(C)CCC2(C(C1)C(=O)CC1C32CCCC1(C(=O)O3)C)C,non-mutagenic
+Cl[C@H](C#N)Br,mutagenic
+ClC(C(=C(C(=O)O)Cl)C(Cl)Cl)Cl,mutagenic
+COc1ccc(cc1)c1c(onc1c1ccc(cc1)OC)CC(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c([C@H]3[C@@H]2O3)ccc1,mutagenic
+OC[C@@H]1O[C@@H](O[C@H]([C@@H](C(=O)N[C@@H]([C@H]([C@@H](C(=O)N[C@H](C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCCNCCCNC(=N)CC2CCC(CC2)Cl)[C@@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)c2nc[nH]c2)[C@@H]([C@@H]([C@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)OC(=O)N)O,mutagenic
+Cc1c2[C@H]3N[C@H]3c3c(-c2cc2c1cccc2)cccc3,mutagenic
+OCCN1CC1,mutagenic
+Nc1ccc(c(c1)[N+](=O)[O-])N,mutagenic
+FC(Cl)(Cl)Cl,non-mutagenic
+Cc1cccc2c1cccn2,mutagenic
+OC/C=C(\C(=O)OC)/C=C(/C=C(/C=C/C=C(/C(=O)C12OC2C(NC1=O)(O)CCO)\C)\C)\C,mutagenic
+O1C[C@@H]1COc1ccccc1,mutagenic
+Oc1ccc2c(c1)c1c([nH]2)c(C)cc(c1C)[N+](=O)[O-],mutagenic
+CCN1CCOCC1,mutagenic
+COC1=CC(=O)c2c(C1=O)nc(c1c2nc2-c1c[nH]cc2)C,mutagenic
+O=C1NC(=O)c2c1cccc2,non-mutagenic
+OCNC(=O)c1ccc(cc1)Cl,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2c(C)cc2c1CCC2,mutagenic
+ClCCN([C@@H](COc1ccccc1)C)Cc1ccccc1,mutagenic
+COC(=O)C1=C(C(OC1=O)C)c1ccccc1,non-mutagenic
+ClCC(F)(F)F,non-mutagenic
+Nc1ccc(cc1)c1ccc(cc1)Cl,mutagenic
+CC(=O)OCc1c2ccccc2c2c3c1ccc1c3c(cc2)ccc1,mutagenic
+CN(C(=N)N(C)C)C,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c(=O)[nH][nH]c2=O,mutagenic
+O=C1c2ccc3c(c2C(=O)c2c1c1sc(nc1cc2)c1ccccc1)sc(n3)c1ccccc1,non-mutagenic
+O=CC1=CC2CC(CC2C2(C1(C=O)C2)C)(C)C,mutagenic
+Oc1ccc2c(c1N=Nc1ccc(cc1)N=Nc1ccccc1)cccc2,mutagenic
+OCC1OC(CC1O)n1ccc(=O)[nH]c1=O,non-mutagenic
+OCCc1cc(N)cc(c1N)[N+](=O)[O-],mutagenic
+NC(=O)c1ccccc1C,non-mutagenic
+OC(=O)c1c[n+]([O-])c2c([n+]1[O-])cccc2,mutagenic
+COC(=O)C1=C(C)C(OC1=O)C(C)C,mutagenic
+CC(=O)CC(O)(C)C,non-mutagenic
+OC(=O)c1cc(ccc1N)S(=O)(=O)O,non-mutagenic
+Cc1c2ccccc2c(c2-c3c4c(-c12)cccc4ccc3)C,mutagenic
+O[C@@H]1CC[C@@H](O)[C@H](O)C[C@H](O)C[C@]2(O)C[C@H](O)[C@@H]([C@H](O2)C[C@H](/C=C/C=C/C=C/C=C/C=C/C=C/C=C/[C@@H]([C@H]([C@H]([C@@H](OC(=O)C[C@@H](C1)O)C)C)O)C)O[C@H]1O[C@H](C)[C@@H]([C@@H]([C@@H]1O)N)O)C(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)Sc1ccccc1,mutagenic
+[O-][N+](=O)c1cc(N)c(c(c1)[N+](=O)[O-])C,mutagenic
+ClCC(C(=C)Cl)Cl,mutagenic
+CCOC(=O)N(N=O)CC,mutagenic
+Cc1cc2cccnc2c(c1)C(=O)O,non-mutagenic
+CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC,non-mutagenic
+OCCN(CCO)CCO,non-mutagenic
+Oc1ccc(c(c1)C)O[P@](=O)(Oc1c(C)cccc1O)Oc1cc(O)ccc1C,non-mutagenic
+NC(=O)CBr,non-mutagenic
+CC(=O)N(c1ccc(cc1)Sc1ccccc1)O,mutagenic
+ClN1C(=O)N(C(C1=O)(C)C)Cl,non-mutagenic
+OC[C@H]1CC[C@H](O1)n1cnc2c1ncnc2O,mutagenic
+N#CCCC(=O)/C=C/c1ccc(cc1)C(=O)O,non-mutagenic
+O=C1CCc2c1ccc1c2c(C)cc2c1cccc2,mutagenic
+Clc1cccc(c1)C(=O)Cl,mutagenic
+OC(=O)c1cn2C(C)COc3c2c(c1=O)cc(c3C1(N)CC1)F,non-mutagenic
+CC(OC(=O)C(=C)C)C,non-mutagenic
+Oc1ccc(c(c1)O)C(=O)O,non-mutagenic
+Nc1ccc(cc1)F,mutagenic
+CCOCCOC(=O)C,mutagenic
+O=C(C(Br)(C)C)Nc1ccccc1,non-mutagenic
+Nn1c2ccncc2c2c1cccc2,mutagenic
+O1CCC2(CC1)CO2,mutagenic
+Nc1scc(n1)c1ccccc1,mutagenic
+CC(C(CCl)Br)Br,mutagenic
+C=CCOc1ccccc1OCC(CNC(C)C)O,non-mutagenic
+Oc1ccc(cc1)c1coc2c(c1=O)ccc(c2)O,non-mutagenic
+ClC(C(Cl)Cl)Cl,non-mutagenic
+CCCOc1ccc(cc1N)N,mutagenic
+[O-][N+](=O)c1ccccc1C,non-mutagenic
+Nc1ccc(cc1)Cl,mutagenic
+COc1ccc(cc1)CN(c1ccccn1)CCN(C)C,non-mutagenic
+OC1C=Cc2c(C1O)cc1c(c2)c(C)cc2c1cccc2,mutagenic
+CC(=O)NO,mutagenic
+CSCCC(C(=O)O)NC(=O)COc1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+c1cc2ccc3c4c2c(c1)cc1c4c(C=C1)cc3,mutagenic
+COc1c2ccc(cc2nc2c1cco2)O,non-mutagenic
+Clc1cccc(c1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+CSCCl,mutagenic
+O=C(c1cccc2c1oc(c1ccccc1)c(c2=O)C)OCCN1CCCCC1,non-mutagenic
+Nc1ccc(cc1Cl)NOS(=O)(=O)O,mutagenic
+ONc1ccc(c(c1)C)C,mutagenic
+Cc1cc(C)c2c(c1)c1ccccc1cc2,mutagenic
+ONC(=O)Cc1cn(cn1)N=O,mutagenic
+N#C/C(=C(/C#N)\N)/N,non-mutagenic
+O[C@@H]([C@@H](COS(=O)(=O)C)O)COS(=O)(=O)C,mutagenic
+OC(=O)/C=C/c1c[nH]cn1,non-mutagenic
+OCC1OC(CC1O)n1cc(Br)c(=O)[nH]c1=O,non-mutagenic
+Nc1cc([N+](=O)[O-])c(cc1F)N,mutagenic
+CC(=O)Nc1ccc(cc1)C(=O)[C@@H]1O[C@H]1c1ccccc1,mutagenic
+C1CC[C@@H]2[C@@H](C1)CCCC2,non-mutagenic
+Cc1ccc2c(c1)ccc1c2ccc2c1cccc2,mutagenic
+Clc1ccc(cc1)Cn1c2ccc(cc2c(c1C)/C=N/OCc1ccc(cc1Cl)Cl)[N+](=O)[O-],non-mutagenic
+N#CCCN(c1cc(NC(=O)C)c(cc1OC)n1nc2c(n1)c(Br)cc(c2Cl)N)CC,mutagenic
+COP(=O)(Oc1c(Cl)cc(cc1Cl)C)OC,non-mutagenic
+Clc1cc(N)c(c(c1)Cl)O,non-mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)ccc1c2ccc2c1cc(cc2)O,mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1C)[N+](=O)[O-])N,mutagenic
+O=NN(CC1(O)CCC(C(C1O)O)O)CC(=O)O,non-mutagenic
+Clc1nncc2c1ccnc2,non-mutagenic
+COC(=O)c1oc(c(c1c1ccccc1)c1ccccc1)[N+](=O)[O-],mutagenic
+Nc1cccc2c1cc1ccccc1c2,mutagenic
+CSCC(C(=O)O)N,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+CC(=O)[C@H](O)C,non-mutagenic
+CC1CCC2(OC1)OC1C(C2C)C2(C(C1)C1CC=C3C(C1CC2)(C)CCC(C3)O)C,non-mutagenic
+OC(=O)c1cccc(c1)C(=O)O,non-mutagenic
+CC(C1c2cc(C(=O)C)c(cc2C(C1C)(C)C)C)C,non-mutagenic
+c1ccc(cc1)Nc1ccc(cc1)Nc1ccccc1,mutagenic
+COc1c2cc3OCOc3cc2nc2c1cco2,mutagenic
+c1ccc2c(c1)cc1c3c2C=Cc3ccc1,mutagenic
+CCCCC(=O)n1ncc(c(c1=O)Cl)Cl,non-mutagenic
+[O-][N+](=O)/C=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+CCCCC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)CCCC,mutagenic
+COc1cc(N)c(cc1N)C,non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc(n1)C(=O)N,non-mutagenic
+CC(=O)Nc1cccc(c1)C,non-mutagenic
+COc1nncc2c1ccnc2,non-mutagenic
+Nc1ncnc2c1ncn2C,mutagenic
+CN(c1ccc2c(c1C)nc(c(n2)C)C)C,mutagenic
+[O-][N+](=O)c1cc2c3ccccc3sc2c2c1cccc2,mutagenic
+CCCc1cc2ccccc2c2c1c1C3OC3C(C(c1cc2)O)O,non-mutagenic
+OCCc1ccccc1[N+](=O)[O-],mutagenic
+Cc1ccc(cc1)/C(=C\CN1CCCC1)/c1ccccn1,non-mutagenic
+O=C(C(C)C)Nc1snc2c1ccc(c2)Cl,non-mutagenic
+C[C@H]1CN1,mutagenic
+Oc1ccnc2c1cccc2,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1cccc3c1c3c2c(ccc3ccc1)[N+](=O)[O-],mutagenic
+O=C(N[C@H](C(=O)NCC(=O)O)CS/C(=C(\C(=C(Cl)Cl)Cl)/Cl)/Cl)CC[C@@H](C(=O)O)N,mutagenic
+CC(=O)Nc1ccc(cc1)S(=O)(=O)N,non-mutagenic
+CC(=O)Nc1snc2c1cc(Cl)cc2Cl,non-mutagenic
+Oc1cccc2c1c1c(cc2)[nH]c2c1c1ccccc1cc2,non-mutagenic
+CC(CCC[C@H]([C@@H]1CC[C@H]2[C@@]1(C)CCC/C/2=C/C=C\1/C[C@@H](O)CCC1=C)C)C,non-mutagenic
+CCOCCOCC,mutagenic
+O=C(/C=C/c1ccc(o1)[N+](=O)[O-])N/N=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+CCCCCC(/C=C/C=O)O,non-mutagenic
+OCCN(c1ccc(c(c1)[N+](=O)[O-])NC)CCO,mutagenic
+CCOc1ccc(cc1)NO,mutagenic
+CCN(CC#CC(OC(=O)C(c1ccccc1)(C1CCCCC1)O)(C)C)CC,non-mutagenic
+O=C1C[C@H]2C([C@]1(C)CC2)(C)C,non-mutagenic
+O=C([C@H]1CCCC[C@@H]1C(=O)OC[C@@H]1OC1)OC[C@@H]1OC1,mutagenic
+O=C1C(=O)c2c3c1cccc3ccc2,mutagenic
+CC(C(C(=O)OCC1CCN2C1CCC2)(C(O)C)O)C,non-mutagenic
+c1ccc2c(c1)nc1c(c2)cccc1,mutagenic
+OC1c2ccccc2-c2c(C1O)c1ccccc1cc2,non-mutagenic
+ClCCC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)CCCl,mutagenic
+Nc1ncnc2c1ncn2C(c1ccccc1)(c1ccccc1)c1ccccc1,mutagenic
+Nc1ccc2-c3c(Cc2c1)cc(cc3)[N+](=O)[O-],mutagenic
+OCNc1ncnc2c1ncn2C1OC(C(C1O)O)CO,mutagenic
+CNC[C@H](c1cccc(c1)O)O,non-mutagenic
+NC(C(=O)O)CSC(C(Cl)Cl)(F)F,non-mutagenic
+Clc1c(Cl)c([N+](=O)[O-])c(c(c1Cl)Cl)Cl,non-mutagenic
+COc1ccc2c(c1)nc([nH]2)N,non-mutagenic
+CCC1c2ccc(cc2C(=C1c1ccc(cc1)O)C)O,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)c1ccccc1,mutagenic
+OC[C@H]1O[C@@H](Oc2cc(OC)cc3c2c(=O)c2c(o3)c(O)ccc2O)[C@@H]([C@H]([C@@H]1O)O)O,mutagenic
+OC1C2=C(C)C3(C(C(=O)C2=CC1(C)C)(C)O)CC3,mutagenic
+NC(C(=O)O)CCS/C(=C/Cl)/Cl,mutagenic
+CCOC(=O)C[n+]1csc2c1cccc2,non-mutagenic
+[O-][n+]1c2ccc3c(c2cc2c1ccc1c2cccc1)cccc3,non-mutagenic
+CCOC(=O)OCC,non-mutagenic
+NCCc1c[nH]c2c1cc(O)cc2,non-mutagenic
+OC[C@@H](c1ccccc1)C(=O)O[C@@H]1C[C@@H]2N([C@H](C1)[C@H]1[C@@H]2O1)C,non-mutagenic
+O=C(C(Cc1c[nH]cn1)NC(=O)C(CS(=O)(=O)C(C)(C)C)Cc1ccccc1)NC(C(C(C1CC1)O)O)CC1CCCCC1,non-mutagenic
+O=NN1CCCN(CC1)N=O,mutagenic
+[O-][N+](=O)c1cccc2-c3c4c(-c12)ccc1c4c2c(c3)cccc2cc1,mutagenic
+CN(c1ccc(cc1)/C=C/c1ccc(cc1)[N+](=O)[O-])C,mutagenic
+OC(=O)C(=O)Nc1cccc(c1)c1n[nH]nn1,non-mutagenic
+Oc1cc2OC3C(c2c2c1c(=O)c1c(o2)cccc1O)CCO3,non-mutagenic
+COc1ccccc1NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+c1ccc2c(c1)ccc1c2cc2cccc3c2c1C=C3,mutagenic
+OC(=O)c1ccc(o1)[N+](=O)[O-],mutagenic
+O1C[C@@H]1c1ccccc1,mutagenic
+CN(CCCNc1c2ccccc2nc2c1cccc2)C,mutagenic
+CC1OC(C)CN(C1)N=O,mutagenic
+[O-][N+](=O)c1cc(cc(c1c1ccccc1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+[O-][n+]1cccc2c1cccc2,non-mutagenic
+c1ccc2c(c1)cc1c3c2C=Cc3c2c(c1)cccc2,mutagenic
+FC(C(Cl)(F)F)(Cl)F,non-mutagenic
+O=c1ccc2c(o1)cc1c(c2)CC(O1)C(O)(C)C,mutagenic
+[O-][N+](=O)c1ccc2c(c1)csn2,mutagenic
+CCCCCCCCCCCC(=O)N(CCO)CCO,non-mutagenic
+Fc1cc2cccnc2c(c1)F,mutagenic
+Brc1ccc2c(c1)[nH]c(c2)C(=N)N,non-mutagenic
+CCNc1cccc(c1)O,mutagenic
+C[C@@H]1CCc2c1cc(C)c1c2ccc2c1cccc2,mutagenic
+COc1cccc2c1OC1(C2(C)OO1)C,mutagenic
+CN(CCCNc1c2ccccc2nc2c1cccc2[N+](=O)[O-])C,mutagenic
+COC(=O)[C@@]12O[C@@]2(CC)[C@@](NC1=O)(C)O,mutagenic
+ONc1nc2c(n1C)ccc1c2cccn1,mutagenic
+Oc1ccc2c(n1)cccc2,non-mutagenic
+Nc1ccc2c(c1)CN1C(=N2)c2c(C1=O)cccc2,mutagenic
+Cc1ccc(c(c1)O)N,mutagenic
+Nc1[nH]cnc2-c1ncn2,mutagenic
+Cc1ccc(c(c1)N)N,mutagenic
+c1ccc2-c3cc4ccc5c(c4cc3[C@@H]3[C@H](c2c1)O3)cccc5,mutagenic
+C=CC(=O)OCCCCOC(=O)C=C,non-mutagenic
+O=C1C(=CC(C=C1C(C)(C)C)(C)OOC(C)(C)C)C(C)(C)C,non-mutagenic
+C=C[C@H](c1ccc2c(c1)OCO2)O,non-mutagenic
+ClCCN(CCCNc1c2ccccc2nc2c1ccc1c2nccc1)CC,mutagenic
+CC(=O)ON(c1ccccc1C)C(=O)C,non-mutagenic
+OCP(CO)(CO)CO,non-mutagenic
+OCC1OC(OC2CCC3(C(=CCC4C3CCC3(C4CC4C3C(C)C3N4CC(CC3)C)C)C2)C)C(C(C1OC1OC(C)C(C(C1O)O)O)O)OC1OC(C)C(C(C1O)O)O,non-mutagenic
+COc1cc2CCN([C@H]3c2cc1Oc1c2c(CCN([C@H]2Cc2ccc(Oc4cc(C3)ccc4OC)cc2)C)cc2c1OCO2)C,mutagenic
+NC(=O)NCC(=O)O,non-mutagenic
+CNCCO,non-mutagenic
+CCN(S(=O)(=O)c1ccc(cc1)N)CC,non-mutagenic
+OCc1ccc2c3c1Sc1cc(Cl)ccc1-c3nn2CC[N+](CC)(CC)[O-],mutagenic
+C/C=C\c1ccc(c(c1)OC)O,non-mutagenic
+CCN(CC)N,non-mutagenic
+OC1C(O)C(Oc2ccc3c(c2)c2ccc4c5c2c(c3)ccc5ccc4)OC(C1O)C(=O)O,non-mutagenic
+O=S1(=O)CCCCO1,mutagenic
+ON1c2ccccc2/C(=N\c2ccccc2)/C1(C)c1ccccc1,non-mutagenic
+OCC(N[C@@H]1C[C@](O)(CO)[C@@H]([C@H]([C@@H]1O)O)O)CO,non-mutagenic
+c1ccc2c(c1)sc(n2)SSc1nc2c(s1)cccc2,mutagenic
+C[C@@H]1O[C@@H](C)O[C@H](C1)OC(=O)C,mutagenic
+ClC(=C1C=CC(=O)O1)Cl,mutagenic
+CC(NCC(c1ccc(c(c1)O)O)O)C,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1Cl)Cl)Cl,mutagenic
+ClC(=Cc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl)Cl,non-mutagenic
+CCSCC[C@@H](C(=O)O)N,non-mutagenic
+c1cc2ccc3c4c2c(c1)ccc4cc1c3CC[C@@H]2[C@H]1O2,mutagenic
+COC1OC(=O)C(=C1C(Cl)Cl)Cl,mutagenic
+ClC1CCN(CC1)N=O,mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C,mutagenic
+ONc1[nH]cnc2-c1ncn2,mutagenic
+CCOC(=O)c1ccccc1C(=O)OCC,non-mutagenic
+CN(CCCNc1c2ccccc2nc2c1c(ccc2Cl)[N+](=O)[O-])C,mutagenic
+c1ccc2c(c1)cc1c3c2cnc2c3c(cc1)ccc2,mutagenic
+Nc1nc(N)nc(n1)Cl,non-mutagenic
+Nc1cccc2c1cccc2,mutagenic
+[O-][N+](=O)c1ccc2-c3c(Cc2c1)cccc3[N+](=O)[O-],mutagenic
+ClC(=O)OCc1ccccc1,non-mutagenic
+COC1=C(OC)C(=O)C(=CC1=O)C,non-mutagenic
+Brc1ccc2c(c1)c(N)c1c(n2)cccc1,mutagenic
+C#CC1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)OC,non-mutagenic
+[O-][N+](=O)c1cc2cccc3-c4c(-c(c1)c23)cccc4,mutagenic
+[O-][N+](=O)C1CCCC1,mutagenic
+CC(c1ccc2c(c1)ccc1c2cccc1C)C,non-mutagenic
+CNC(=O)ON(C(=O)NC)C(=O)C,mutagenic
+O[C@H]1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2[C@H](CCC(=O)O)C)C)C,non-mutagenic
+ClCCN(c1cnc(nc1O)O)CCCl,mutagenic
+CCCCCCCCCCCCCO,non-mutagenic
+NNc1nncc2c1cncc2,mutagenic
+CC(COC(=O)Cc1ccccc1)C,non-mutagenic
+CCCCCCCCCCCl,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)[nH]c1c2cccc1,mutagenic
+CC(c1cc(ccc1OP1OCC2(CO1)COP(OC2)Oc1ccc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)(C)C,non-mutagenic
+O=C1CCC(=O)N1c1ccc(c(c1)Cl)Cl,non-mutagenic
+CC(=O)Cl,non-mutagenic
+Clc1ncccc1Cl,mutagenic
+OCCNc1ccc(cc1[N+](=O)[O-])N(CCO)CCO,mutagenic
+Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)O,mutagenic
+COc1ccc2c(c1)nc1c(c2OC)cco1,mutagenic
+COP(=O)(SC)SC,non-mutagenic
+COCCOCCO,non-mutagenic
+Nc1cc2ccccc2cc1N,mutagenic
+Oc1ccc2-c3ccc(c4c3C(C3c2c1C(=O)C1OC31)(O)CCC4=O)O,mutagenic
+CCOP(=O)(N(C)C)C#N,non-mutagenic
+ONc1ccc(cc1)c1ccc(cc1)C(C)(C)C,mutagenic
+O=P(Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1,non-mutagenic
+OC[C@H]1CO1,mutagenic
+[O-][N+](=O)c1ccccc1C(=O)N,mutagenic
+OC(CN=N#N)CN=N#N,mutagenic
+COCCN(c1cc(NC(=O)C)c(cc1OC)n1nc2c(n1)c(Br)cc(c2Cl)N)CCOC,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1cc(ccc1c(c2)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+ClCc1ccc(cc1)C(F)(F)F,non-mutagenic
+Clc1cc(Cl)c(c(c1O)Cc1c(O)c(Cl)cc(c1Cl)Cl)Cl,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2cccc1,mutagenic
+Clc1c2ccc3c(c2cc2c1cccc2)cccc3,mutagenic
+COc1cccc(c1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+N#C/C(=C/C(C(C(c1ccc(cc1)Br)C#N)c1ccccc1)C)/c1ccc(cc1)Br,non-mutagenic
+[O-][N+](=O)c1nc2c(n1C)cccc2,mutagenic
+BrC[C@H]1CO1,mutagenic
+ClCCCC(=O)N(c1snc2c1cccc2)CC,non-mutagenic
+CSCNc1ccccc1,mutagenic
+[O-][N+](=O)c1cc2cccc3c2c2c1cccc2c1c3cccc1,mutagenic
+ClCCOC(=O)Cl,non-mutagenic
+O=C(C(C)C)Nc1snc2c1cccc2,non-mutagenic
+CC(=O)OCc1ccccc1[N+](=O)[O-],non-mutagenic
+CN(N=Nc1ccccc1)C,mutagenic
+CC(=O)Nc1nnc(s1)c1ccc(o1)[N+](=O)[O-],mutagenic
+O=C(C1OC1c1ccc(cc1)c1ccccc1)c1ccccc1,non-mutagenic
+Oc1ccc(c(c1)O)N=Nc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+CCCCCCCCCCCCCC(=O)[N-][N+](CC(O)C)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1c1ccccc1c1c3c(cc2)ccc1O,mutagenic
+OC(=O)C(Cc1ccc(cc1)O)N,non-mutagenic
+BrCCSCC(C(=O)OC)NC(=O)C,mutagenic
+BrCC(=O)c1ccc(cc1)c1ccccc1,mutagenic
+O=C(Nc1ccc(cc1)O)CC(=O)C,non-mutagenic
+O=C1c2ccccc2-c2c1c1c(cc2)ccc2c1cccc2,non-mutagenic
+OCC[C@]1(O)NC(=O)[C@]2([C@@H]1O2)C(=O)/C(=C/C=C/C(=C/C(=C/C(=C\C)/C(=O)OC)/C)/C)/C,mutagenic
+CC(=O)N1CNC(=O)N(C1=O)C(=O)C,non-mutagenic
+CC1CCCC(N1CCCC(c1ccccn1)(c1ccccc1)O)C,non-mutagenic
+OCCN(c1ccc(cc1)N=Nc1ccc(cc1C#N)[N+](=O)[O-])CCO,mutagenic
+O=C1CN=C(c2c(N1)ccc(c2)Cl)c1ccccc1,non-mutagenic
+CCCCCCCCCCCCCC=C,non-mutagenic
+[O-][N+](=O)c1cccc2c1c(C)ccc2,mutagenic
+NC(=S)NNC(=S)N,non-mutagenic
+ONc1ccc(cc1)N=Nc1ccccc1,mutagenic
+O=C(OC[C@H]1CO1)CCCCCC(C)(C)C,mutagenic
+Nc1nc(O)c2c(n1)nn[nH]2,non-mutagenic
+CCCCOc1ccc(cn1)N=Nc1ccc(cc1)N(CC)CC,mutagenic
+CCCC(=O)Nc1snc2c1ccc(c2)Cl,non-mutagenic
+[O-][N+](=O)c1cccc(c1)S(=O)(=O)OC[C@H]1CO1,mutagenic
+O=C(Nc1ccc(cc1)[N+](=O)[O-])CCC(C(=O)O)N,non-mutagenic
+Oc1cc(cc2c1C(=O)c1c(C2=O)cccc1O)C(=O)O,mutagenic
+CCCCCC,non-mutagenic
+[O-][N+](=O)c1cccc2c1nc1c(n2)cccc1[N+](=O)[O-],mutagenic
+ClCc1ccc2-c3c4c(-c2c1)cccc4ccc3,mutagenic
+OCC(Cl)Cl,mutagenic
+CCc1c2C3NC3c3c(-c2cc2c1cccc2)cccc3,mutagenic
+CN(c1ccc2c(c1)[s+]c1c(n2)cc(c(c1)N)C)C,mutagenic
+CC(=O)Nc1nc2c(n1C)ccc1c2cccn1,mutagenic
+CC1=CC(=O)CC(C1)(C)C,non-mutagenic
+OC(=O)CC[C@@H](C(=O)O)N,non-mutagenic
+ClCCN(P1(=O)OCCCN1CCCl)CCCl,mutagenic
+O=Cc1ccc2-c1cocc2COC(=O)C,mutagenic
+ClCC(C(Br)(C)C)Br,non-mutagenic
+Cc1ccccc1c1nc2c(o1)cccc2,non-mutagenic
+COc1ccc2c3c1O[C@H]1[C@@]43CCN([C@H](C2)[C@@H]4C=C[C@@H]1O)C,non-mutagenic
+O=NN(Cc1ccccc1)C,mutagenic
+[O-][N+](=O)c1ccc2c3c1[C@@H]1O[C@@H]1c1c3c(cc2)ccc1,mutagenic
+Fc1cc(cc(c1N)F)c1cc(F)c(c(c1)F)N,mutagenic
+Cc1cc(C)cc(c1)N=Nc1c(O)ccc2c1cccc2,non-mutagenic
+O=C(Nc1c(C)cccc1C)CN1CCCC1=O,non-mutagenic
+C=C[C@@](CCC=C(C)C)(O)C,non-mutagenic
+CC(=O)Nc1ccc(cc1Cl)Cc1ccc(c(c1)Cl)N,mutagenic
+COc1c2cc(OC)ccc2nc2c1cco2,mutagenic
+CSCCC(C(=O)NC(C(=O)O)Cc1ccccc1)NC=O,non-mutagenic
+c1ccc2c(c1)c1cc3ccc4c(c3cc1cc2)cccc4,mutagenic
+CC(=O)OCc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+c1ccc2c(n1)c1CCC3C(c1cc2)O3,non-mutagenic
+[C-]#N,non-mutagenic
+COc1c([N+](=O)[O-])c(C)c(cc1C(C)(C)C)[N+](=O)[O-],non-mutagenic
+Nc1ccc(c(c1)N)N=Nc1ccc2c(c1)c(O)c(c(c2)S(=O)(=O)O)N=Nc1ccc(cc1)Nc1ccc(cc1S(=O)(=O)O)N=Nc1c(O)c2cc(N=Nc3ccc(cc3N)N)ccc2cc1S(=O)(=O)O,mutagenic
+[O-][N+](=O)c1c(Cl)c(Cl)c2c(c1Cl)Oc1c(O2)c(Cl)c(cc1)Cl,mutagenic
+Brc1ccc(c(c1)Br)Oc1cc(Br)c(cc1Br)Br,non-mutagenic
+CCc1ccccc1[N+](=O)[O-],non-mutagenic
+ClC(c1ccccc1)C(=O)Cl,mutagenic
+OC(=O)Cc1ccc(cc1)N,mutagenic
+CCCSC(=O)Cl,mutagenic
+[O-][N+](=O)NC(=N)NC,mutagenic non-mutagenic
+Oc1ccc2c(c1N=Nc1ccccc1)ccc(c2)S(=O)(=O)O,non-mutagenic
+COC(C1=C(N2CC2)C(=O)C(=C(C1=O)N1CC1)C)COC(=O)N,mutagenic
+COCC12OOC2(C)c2c(O1)cccc2,mutagenic
+Brc1ccc(cc1)CN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+O1COCOC1,non-mutagenic
+OCCOc1cc(O)c2c(c1)oc(c(c2=O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O)c1ccc(c(c1)OCCO)OCCO,non-mutagenic
+Cc1ccc2c(c1)c(C)c1c(c2C)cccc1,mutagenic
+[O-][N+](=O)c1cc2c(N)snc2cc1,mutagenic
+C/C=C/C1=CC(=O)C23C(C1=O)(O)OC(C3C2)(C)C,mutagenic
+Cl[C@@H](C(F)(F)F)Br,non-mutagenic
+NCCNCCNCCN,mutagenic
+CN(c1ccc(cc1)N=Nc1ccccc1)C,mutagenic
+CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2c1cccc2,non-mutagenic
+C=CCCCC[C@@H]1OC1,mutagenic
+NCCCN,non-mutagenic
+C1CC=C2C(C1)CCc1c2cccc1,mutagenic
+Cc1cc(C)c(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+ClCc1ccccc1CCl,non-mutagenic
+Cn1cnc(c1c1ccccc1)[N+](=O)[O-],non-mutagenic
+Cc1cc2-c3ccccc3Cc2cc1C,non-mutagenic
+O=Nc1ccc2-c3c(Cc2c1)cccc3,mutagenic
+Cc1ccc2c(c1Nc1ccccc1)C(=O)c1c(C2=O)cccc1,mutagenic
+Nc1ccc(cc1)Oc1ccc(cc1)N,mutagenic
+OC1CCC2(C(C1)CC(C1C2CC(O)C2(C1CCC2C(CCC(=O)O)C)C)O)C,mutagenic
+Cc1ccc(cc1)[C@H]1OC1,mutagenic
+N=C1CCC(=N)c2c1c(O)c1c(c2O)cccc1,mutagenic
+c1cc[n+]2c(-c3cccc[n+]3CC2)c1,non-mutagenic
+OC(=O)c1cccnc1,non-mutagenic
+Cl/C=C(/CSC(=O)N(C(C)C)C(C)C)\Cl,mutagenic
+OC1C(O)c2cccc3c2c2c1cc1ccccc1c2cc3,mutagenic
+NC(C(=O)O)CS/C=C/Cl,mutagenic
+Oc1cc2cc3ccccc3c3c2c2c1cccc2cc3,mutagenic
+O=c1[nH][nH]c(=O)c2c1cccc2,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)ccc1c2cccc1,mutagenic
+CC1=C[C@@H]2[C@H](N(C1)C)Cc1c3c2cccc3[nH]c1,mutagenic
+Oc1ccc2-c3c4c(-c2c1)cc1cccc2c1c4c(cc3)cc2,mutagenic
+C=CCN(c1cc(NC(=O)C)c(cc1OC)N=Nc1c(Br)cc(cc1[N+](=O)[O-])[N+](=O)[O-])CC=C,mutagenic
+c1ccc2c(c1)Sc1c(N2)cccc1,non-mutagenic
+c1ccc2-c3c4c(-c2c1)ccc1c4c(cc3)C=C1,mutagenic
+CCN(c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)N(CC)CC)CC,mutagenic
+c1ccc2c(c1)ccc1c2cc2c(n1)ccc1c2cccc1,mutagenic
+Brc1ccc(cc1)[N+](=O)[O-],mutagenic
+ClCCCl,mutagenic
+ClCCNCCCNc1c2cc(OC)ccc2nc2c1ccc(c2)Cl,mutagenic
+CCN(CCn1nc2c3c1Sc1cc(Cl)ccc1-c3c(cc2)C)CC,mutagenic
+COc1cc2c(cc1OC)nc1c(c2O)cccc1,mutagenic
+O=C/C(=C(/C(=O)O)\Cl)/C,mutagenic
+OCCN1CCNCC1,non-mutagenic
+Cc1cc2ccccc2c2c1cc1ccccc1c2,mutagenic
+O=CC1C=COC=C1,non-mutagenic
+CN(C=O)N,non-mutagenic
+NC(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+CCCC(=O)O,non-mutagenic
+OC/C=C(\C=C/C=C(\C=C/C1=C(C)CCCC1(C)C)/C)/C,mutagenic
+Oc1ccc2c(c1N=Nc1ccc(c3c1cccc3)S(=O)(=O)O)c(cc(c2)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+Nc1ccc2c(c1)c1ccccc1n2C,mutagenic
+NC(=O)N=NC(=O)N,mutagenic
+CC([N+](=O)[O-])(Cl)Cl,mutagenic
+O=C1OCC1(C)C,mutagenic
+OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)NCc1cnc2c(n1)c(O)nc(n2)N,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])N,mutagenic
+NCCNCCNCCNCCN,mutagenic
+Oc1ncc2c3c1ccc1c3c(cc2)ccc1,non-mutagenic
+COc1ccc(cc1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+CN(CCNC(=O)c1cccn2c1nc(c2)c1ccccc1)C,mutagenic
+ClCCN(c1ccc(cc1)OCC(=O)O[C@H]1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC(=O)N2)C)C)CCCl,mutagenic
+O=C1NS(=O)(=O)c2c1cccc2,non-mutagenic
+C[C@H]1CCOS(=O)(=O)O1,mutagenic
+Clc1ccc(cc1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+CCCC[C@H](COC(=O)CCCCC(=O)OC[C@@H](CCCC)CC)CC,non-mutagenic
+CC(=O)OC12CCC3[C@@](C1)(CC2=C)CCC1[C@@]3(C)CCC[C@@]1(C)C(=O)O,non-mutagenic
+CN(c1ccc(cc1)N=Nc1ccc2c(c1)cccc2)C,mutagenic
+COO,mutagenic
+N[C@H](C(=O)O)CSCc1ccccc1,non-mutagenic
+SC(=N/C=C/N=C(S)S)S,non-mutagenic
+OC[C@@H]1O[C@@H](O[C@H]([C@@H](C(=O)N[C@H]([C@H]([C@@H](C(=O)N[C@H](C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCCN(CCC(N(c2ccc(c(c2)OCc2ccccc2)OCc2ccccc2)C)N(c2ccc(c(c2)OCc2ccccc2)OCc2ccccc2)C)C)[C@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)c2nc[nH]c2)[C@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)OC(=O)N)O,mutagenic
+Cc1ccc(cc1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+OCCN(c1ccc(cc1O)[N+](=O)[O-])CCO,mutagenic
+CN(c1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)N(C)C)C,mutagenic
+CC(=O)Nc1cc(N=Nc2ccc(c(c2)NC(=O)C)C)ccc1C,non-mutagenic
+OCc1cnc2c(n1)c1nc(n(c1cc2)C)NS(=O)(=O)O,non-mutagenic
+CC1CCCC2(C1(O)CCCC2)C,non-mutagenic
+Clc1ccc(c(c1)N=Nc1c(O)c(cc2c1cccc2)C(=O)Nc1ccccc1)Cl,mutagenic
+Cc1ccc2c(c1)c(N)c1c(n2)cccc1,mutagenic
+Cn1c(N)nc2c1ccc1c2nc(c(n1)c1ccccc1)c1ccccc1,non-mutagenic
+COC(C(Cl)Cl)(F)F,non-mutagenic
+[O-][N+](=O)c1c2ccccc2c2c3c1CCc1c3c(cc2)ccc1,mutagenic
+O=CC(=O)O,mutagenic
+Nc1ccc(cc1)Oc1ccc(cc1Cl)Cl,mutagenic
+CC(=O)CCOOCCC(=O)C,non-mutagenic
+c1ccc(cc1)C(c1ccccc1)c1ccccc1,non-mutagenic
+OC[C@H]1CC[C@H](O1)n1cnc2c1ncnc2N,mutagenic
+O=NN(Cc1ccc(cc1)C(=O)O)C,non-mutagenic
+NC(C(=O)O)CCCCNCC(C(=O)O)N,non-mutagenic
+O=CC1=CC2(O)CC(CC2C2(C1(C=O)C2)C)(C)C,mutagenic
+Clc1cccc2c1cccc2,mutagenic
+CNNCc1ccc(cc1)C(=O)NC(C)C,non-mutagenic
+CCN1CCNC(=O)C1=O,non-mutagenic
+[O-][N+](=O)c1cccc2c1cccc2,mutagenic
+OC(=O)/C=C/c1cccc(c1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1cccc2c1c1ccccc1o2,mutagenic
+Cn1c(=O)n(C)c2c(c1=O)nc[nH]2,non-mutagenic
+[O-][N+](=O)c1c2ccccc2c(c2c1cccc2)[N+](=O)[O-],non-mutagenic
+Oc1ccc(c2c1cccc2)O,mutagenic
+COP(=O)(OC=C(Cl)Cl)OC,mutagenic
+CC(CC(c1ccc(cc1)OCCOCC[N+](Cc1ccccc1)(C)C)(C)C)(C)C,non-mutagenic
+c1cc2ccc3c4c2c(c1)cc1c4c2c(c3)cccc2cc1,mutagenic
+c1ccc2c(n1)C1OC1C1C2O1,non-mutagenic
+CCCOC(=O)c1ccc(cc1)O,non-mutagenic
+O=C1C=CC(=NC(=O)C)C=C1,non-mutagenic
+FCC(F)(F)F,non-mutagenic
+O=C1c2ccccc2-c2c3c1ccc1c3c(cc2)c2c3c1ccc1c3c(-c3c(C1=O)cccc3)cc2,mutagenic
+Nc1cc(Cl)cc(c1)Cl,non-mutagenic
+O1CCOCCOc2c(OCCOCC1)cccc2,non-mutagenic
+COc1cc([N+](=O)[O-])c(c(c1)C(C)(C)C)O,non-mutagenic
+COC(=O)Nc1[nH]c2c(n1)cc(cc2)C(=O)c1ccc(cc1)F,non-mutagenic
+COc1cc(O)c2c(c1)C1=CC(O)C(CC1(OC2=O)C)O,non-mutagenic
+O=C1C=CC2=[N+](C(/C(=N/c3ccccc3)/C2=C1)(c1ccccc1)c1ccccc1)[O-],non-mutagenic
+OC1OC(=O)C=C1CCl,mutagenic
+CC(c1ccccc1)CCN=N#N,mutagenic
+CCOc1ccc(cc1)N(C(=O)C)O,mutagenic
+OC(=O)C(c1ccc(cc1)Oc1nccs1)C,non-mutagenic
+CCC(=O)O,non-mutagenic
+CCOC(=O)c1ccc(cc1)N(C=O)O,non-mutagenic
+CCN=C=S,non-mutagenic
+c1ccc2c(n1)c1[nH]ccc1cc2,non-mutagenic
+OO[C@@H]1CCCc2c1cccc2,mutagenic
+BrCC(=C)Br,mutagenic
+O=C1CCC(C(=O)N1)N1C(=O)c2c(C1=O)cccc2,non-mutagenic
+[O-][N+](=O)c1ccccc1C(=O)O,mutagenic
+Cc1ccc(c(c1)O)O,non-mutagenic
+CC(CCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC(C)C)C,non-mutagenic
+Cc1c(C)c([N+](=O)[O-])c(c(c1C)[N+](=O)[O-])C(C)(C)C,non-mutagenic
+Nc1cccc(c1)Cl,non-mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/OCC(O)C,mutagenic
+C/C=C\1/CC(=C)[C@](O)(CO)C(=O)OCC2=CCN3[C@H]2[C@@H](OC1=O)CC3,mutagenic
+COc1ccc(c2c1C(=O)c1ccccc1C2=O)N,mutagenic
+Nc1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-],mutagenic
+COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)[C@@H](O)C[C@](C2)(O)C(=O)C,mutagenic
+C[Si](N=N#N)(C)C,mutagenic
+CC#CC(c1ccccc1)(c1ccccc1)OC(=O)NC1CCCCC1,mutagenic
+c1ccc(cc1)P(c1ccccc1)c1ccccc1,non-mutagenic
+ONC(=O)c1ccc2c(c1)cccc2,mutagenic
+N#Cc1ccc2c(c1)nc([nH]2)N,mutagenic
+CC12OOC1Oc1c2cccc1,mutagenic
+Oc1ccc(c(c1Cl)Cl)Cl,non-mutagenic
+Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)ccc1,mutagenic
+Clc1ccc(cc1)Cn1c(/C=N/OCc2cccc(c2)[N+](=O)[O-])nc2c1ccc(c2)[N+](=O)[O-],non-mutagenic
+CCCCN(/C(=N/O)/C=O)N=O,mutagenic
+CNc1ccc(cc1)[N+](=O)[O-],mutagenic
+C(C[C@@H]1OC1)CC[C@@H]1OC1,mutagenic
+O=CCC(C)C,non-mutagenic
+OC1C(O)C2OC2c2c1ccc1c2c2ccccc2c2c1cccc2,mutagenic
+CC(=O)Nc1ccc(cc1)Nc1ccc(cc1)[N+](=O)[O-],mutagenic
+CC(O)C,non-mutagenic
+CCl,mutagenic
+O=C1NCC(=O)N1,non-mutagenic
+Oc1c(O)ccc2c1C(=O)c1c(C2=O)c(O)ccc1O,mutagenic
+COC[C@H]1CO1,mutagenic
+COc1ccc(cc1)CN(c1ccccn1)CC[N+](C)(C)[O-],non-mutagenic
+NN(c1ccc(cc1)C)c1ccc(cc1)C,mutagenic
+Cc1nc(C)cc(c1)c1cc2c(cc1F)n1c(n2C2CC2)cc(=O)[nH]c1=O,mutagenic
+OC(=O)CCl,non-mutagenic
+ClCC(CCl)Br,mutagenic
+CO/N=C(/c1csc(n1)N)\C(=O)NC1C(=O)N2C1SCC(=C2C(=O)OCOC(=O)C(C)(C)C)/C=C/c1scnc1C,non-mutagenic
+O=NN(C(=O)c1n(C)cnc1N(N=O)C)C,mutagenic
+c1ccc2-c3c4c(-c2c1)c1ccccc1cc4ccc3,mutagenic
+O=C(c1csc(c1)[N+](=O)[O-])Nc1ccccc1C,mutagenic
+CC(=N)S,non-mutagenic
+COc1nsc2c1ccc(c2)N,mutagenic
+[O-][N+](=O)c1ccccc1O,non-mutagenic
+Cc1cnc2c(n1)c1nc(n(c1cc2C)C)N,mutagenic
+Nc1ccc(cc1)/C=C/c1ccccc1,mutagenic
+O=C1CCc2c1c1ccc3c(c1c(c2)C)cccc3,mutagenic
+OC1CCCc2c1cc1ccc3c4c1c2ccc4c(cc3)[N+](=O)[O-],mutagenic
+CCCCCCC1OC1,non-mutagenic
+c1ccc2c(c1)c1cc3ccc4c(c3nc1cc2)cccc4,mutagenic
+NNC(=O)N,non-mutagenic
+CC1CN(C)C2C(C1)c1cccc3c1c(C2)cn3C1CCCC1,mutagenic
+Nn1nnc2-c(c1O)nc1c2cccc1,mutagenic
+N#N=NCC(C(C(C(CO)O)O)O)O,mutagenic
+NC(=O)N/N=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+c1ccc(cc1)Oc1ccc(cc1)/C=N/N1N=Nc2c(C1)[nH]c1c2cccc1,non-mutagenic
+N#Cc1cccc(c1)/C=C/c1ccc(cc1)N,mutagenic
+COc1cc(O)ccc1Nc1c2ccccc2nc2c1cccc2,mutagenic
+Cc1c2C3NC3c3c(-c2c(c2c1cccc2)C)cccc3,mutagenic
+O=c1ccc2c(o1)cccc2,mutagenic
+Clc1nncc2c1cccn2,non-mutagenic
+CCN(C(=O)N(C)C)N=O,mutagenic
+O=NN1CCCCCCCCCCCC1,mutagenic
+Nc1cc([N+](=O)[O-])c(c(c1C)C)N,mutagenic
+O=NN(Cc1ccc(cc1)C)C,non-mutagenic
+O=Nc1cc(ccc1C)[N+](=O)[O-],mutagenic
+Cc1cccc(c1N)C,mutagenic non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)C)N,mutagenic
+Clc1ccc(cc1)C(=O)c1ccc(cc1)OC(C(=O)O)(C)C,non-mutagenic
+CC(=O)Nc1ccc(cc1)Oc1ccc(cc1)N,mutagenic
+NNc1ccccc1,mutagenic
+O=C1c2ccccc2CCc2c1cccc2,non-mutagenic
+CC(N)(C)C,non-mutagenic
+O=C1C=CC(=O)O1,non-mutagenic
+c1cc2ccc3c4c2c(c1)ccc4cc1c3cco1,mutagenic
+Cc1cccc2c1nccc2,mutagenic
+CCCC[C@@H](COC(=O)c1cccc(c1)C(=O)OC[C@H](CCCC)CC)CC,non-mutagenic
+O1CC1Oc1ccccc1,mutagenic
+Oc1ccc(c(c1)C(C)(C)C)O,non-mutagenic
+COc1cc2-c3c(O)c(OC)cc4c3C(Cc2cc1O)[N+](C)(C)CC4,non-mutagenic
+CC/C=C/C=C/C=C/C=C/OCC(CO)O,mutagenic
+O=Nc1cccc(c1)c1ccccc1,mutagenic
+ClCCC(=O)N(c1snc2c1cccc2)CC,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2c(C)cc2c1CCC2,mutagenic
+CC(c1c(C)n(n(c1=O)c1ccccc1)C)C,non-mutagenic
+S(Cc1ccccc1)SCc1ccccc1,mutagenic
+Nc1cc2nc3cc(N)c(cc3cc2cc1C)C,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)cc2c1CCCC2,mutagenic
+OCCNC(=O)N(CCCl)N=O,mutagenic
+[CH2-][N+](=O)[O-],non-mutagenic
+Nc1cc(N)c(cc1N=Nc1ccccc1)C,mutagenic
+Cc1cc(O)c(cc1C1(OS(=O)(=O)c2c1cccc2)c1cc(C)c(cc1C)O)C,non-mutagenic
+CCN(S(=O)(=O)c1ccc(cc1)NC(=O)C)CC,non-mutagenic
+CN(c1ccc2c(c1)nc1c(c2)ccc(c1)N(C)C)C,mutagenic
+O=C(c1ccccc1)Nc1cccc2c1C(=O)c1c(C2=O)c(Cl)ccc1,mutagenic
+OC(=O)C1CC=C(C=C1)OP1(Oc2ccc(cc2)C(=O)O)NP(Oc2ccc(cc2)C(=O)O)(Oc2ccc(cc2)C(=O)O)NP(N1)(Oc1ccc(cc1)C(=O)O)Oc1ccc(cc1)C(=O)O,non-mutagenic
+CCCCCCCCCc1ccccc1C(OS(=O)(=O)O)CO,non-mutagenic
+Oc1ccc2c(c1)c(cc(c2)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+IC(I)I,mutagenic
+ClCBr,mutagenic
+O=C1NC(=O)C(N1)(c1ccc(cc1)O)c1ccccc1,non-mutagenic
+CCCCC(=O)Nc1snc2c1cc(Cl)cc2,non-mutagenic
+C=CC(=O)OCCCCCOC(=O)C=C,non-mutagenic
+CC[C@H]1CN2CCc3c([C@H]2C[C@H]1C[C@H]1NCCc2c1cc(OC)c(c2)OC)cc(c(c3)OC)OC,non-mutagenic
+Cc1ccc(cc1NCC)O,mutagenic
+Cc1ccc2c(c1)c1ccc3c4c1c(c2)ccc4ccc3,mutagenic
+c1ccc2c(c1)[nH]cc2,non-mutagenic
+COc1ccc(cc1)OC,non-mutagenic
+O=NN1CCC[C@@H]1c1cccnc1,mutagenic
+CCCCCCCCO,non-mutagenic
+[O-][N+](=O)c1cccc(c1Cl)Cl,non-mutagenic
+O=C/C=C/C=O,mutagenic
+Nc1ccccc1N,mutagenic
+Cc1cc2c(C)cccc2c2c1c1ccccc1cc2,mutagenic
+[O-][N+](=O)c1c2CCC=Cc2c2c3c1ccc1c3c(cc2)ccc1,non-mutagenic
+O=C1c2ccccc2CN2N1Cc1ccccc1C2=O,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)Oc1c(O2)cccc1,mutagenic
+CC1CS1,non-mutagenic
+[O-][N+](=O)c1scc(c1)C(=O)N,mutagenic
+c1ccc2c(n1)c1ncccc1cc2,non-mutagenic
+c1ccc2c(c1)cc1c(c2)cc2c3c1C=Cc3ccc2,mutagenic
+C/C=C/C,non-mutagenic
+O[C@@H](c1ccc2c(c1)OCO2)[C@@H]1CO1,mutagenic
+c1ccc2c(c1)ccc1c2cc2cccc3c2c1C1OC31,mutagenic
+CC(=O)Nc1ccc(cc1)Cc1ccc(cc1)N,non-mutagenic
+OC(c1ccc(cc1)Cl)(c1ccc(cc1)Cl)C1CC1,non-mutagenic
+[O-][N+](=O)c1cc2c(Cl)nsc2cc1,mutagenic
+[O-][N+](=O)c1ccc2c(c1)cc1-c3cccc4c3c(-c1n2)ccc4,mutagenic
+O=C1c2ccccc2Cc2c1cccc2,mutagenic
+Nc1ccc(c(c1)N)Cl,mutagenic
+Fc1ccccn1,mutagenic
+Oc1c2ccccc2cc2c1ccc(c2O)O,mutagenic
+CC(=O)Nc1ccc(cc1)Oc1ccc(cc1)NC(=O)C,non-mutagenic
+COC(=O)C(=C)C#N,mutagenic
+O=Nc1ccc(cc1)Oc1ccccc1,mutagenic
+[O-][N+](=O)c1ccccc1,non-mutagenic
+O=C=S,mutagenic
+NC(C(=O)O)CSC(C(Br)Cl)(F)F,mutagenic
+C[C@H](CN(C[C@H](O)C)C[C@H](O)C)O,non-mutagenic
+CC(c1ccccc1)N(C)C,non-mutagenic
+[O-][N+](=O)c1cn(c(n1)Cl)C[C@@H](COC)O,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1c(cc2[N+](=O)[O-])cccc1[N+](=O)[O-],mutagenic
+CC(=O)N(c1ccc(cc1)N=Nc1ccc(cc1)N(C)C)C,mutagenic
+[O-][N+](=O)C1=Cc2c3c1cc1cc4ccccc4cc1c3ccc2,mutagenic
+CCCC[C@H](COC(=O)c1ccccc1C(=O)O)CC,non-mutagenic
+NNc1scc(n1)c1ccc(cc1)N,mutagenic
+Cc1ccc(cc1)NN=NCc1ccccc1,mutagenic
+CCCCCCCCCCCCCCCCCC(=O)NCCCCC(C(=O)O)NC(=O)CCC(C(=O)N)NC(=O)C(NC(=O)C(OC(C(C(CO)O)O)C(NC(=O)C)C=O)C)C,non-mutagenic
+C[C@H]1CO1,mutagenic
+OC1=C/C(=N\c2ccc(cc2)[N+](=O)[O-])/C(=O)C=C1c1nnc(s1)NC(=O)c1ccccc1,mutagenic
+Cc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+O=C(C(F)(F)F)C(F)(F)F,non-mutagenic
+O=C(N(C)C)Nc1cccc(c1)C(F)(F)F,non-mutagenic
+COCCc1ccc(cc1)OCC(CNC(C)C)O,non-mutagenic
+OS(=O)(=O)c1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+CC1(OC1)c1ccc(cc1)c1ccccc1,mutagenic
+O=C/C(=C(/C(=O)O)\Cl)/Cl,mutagenic
+CCCCCC(=O)O,non-mutagenic
+Clc1ccc2c(c1)Oc1c(O2)cc(cc1)Cl,non-mutagenic
+[O-][N+](=O)c1cc(Cl)c(c(c1)Cl)N,mutagenic
+O=C(C1c2ccccc2Oc2c1cccc2)OCC[N+](C(C)C)(C(C)C)C,non-mutagenic
+Cc1ccc2c(c1)C(=O)c1c(C2=O)cccc1,non-mutagenic
+CC(=O)Nc1ccc(cc1)Sc1ccccc1,mutagenic
+N#CCCN(c1ccc(cc1)N=Nc1ccc2c(c1)scn2)C,mutagenic
+ClC(=C(c1ccc(cc1)Cl)c1ccc(cc1)Cl)Cl,non-mutagenic
+CCCCCCCOc1ccccc1NC(=O)OCCN1CCCCC1,non-mutagenic
+OC(=O)C(C(C(C(C(C(C(Cl)(F)F)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F,non-mutagenic
+COc1ccccc1N=Nc1c(O)ccc2c1cccc2,mutagenic
+O=CN(c1ccc2c(c1)cccc2)O,mutagenic
+CC(=O)c1ccco1,mutagenic
+CCCCNCC,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1-c1ccccc1-c3ccc2,mutagenic
+[O-][N+](=O)c1ccc2c(c1)ncn2C,non-mutagenic
+COc1ccccc1c1ccccc1,non-mutagenic
+CC(CC(=O)CC(C)C)C,non-mutagenic
+Brc1ccc(cc1)/C=C/C(=O)c1ccccc1,non-mutagenic
+CNP1(NC)NP(NC)(NC)NP(N1)(NC)NC,non-mutagenic
+Nc1ccc(cc1)CCc1ccccc1,mutagenic
+CCOC(=O)Nc1cccc2c1nc1-c2c[nH]cc1,non-mutagenic
+Fc1ccc2-c3c(C(c2c1)C)cccc3,mutagenic
+Nc1cccc2c1C(=O)c1cccc(c1C2=O)N,mutagenic
+CCn1c2ccc(cc2c2c1cccc2)N,mutagenic
+Cc1cccc2c1N(C)C1=Nc3c(C1C2C)cccc3,mutagenic
+OCCNc1ccc(c2c1C(=O)c1ccccc1C2=O)NC,mutagenic
+CCCCN(CCC(=O)OC)N=O,mutagenic
+Clc1ccc(c(c1)N)[N+](=O)[O-],mutagenic
+COCC=O,mutagenic
+Cc1scc(n1)c1ccc(o1)[N+](=O)[O-],mutagenic
+CN(N=Nc1ccc(cc1)[N+](=O)[O-])C,mutagenic
+ONc1cc(C)ccc1C,mutagenic
+c1ccc2-c3ccc4c(c3[C@@H]3[C@H](c2c1)N3)cccc4,mutagenic
+O=NN1CN2CN(C1)CN(C2)N=O,mutagenic
+NNc1nc2c(s1)c1c(cc2)nc2c(c1O)cccc2,mutagenic
+OC(=O)[C@H](Br)Cl,mutagenic
+NC(=O)C1CO1,mutagenic
+COC(=O)C(Oc1ccc(cc1)c1ccc(cc1)Cl)(C)C,non-mutagenic
+Nc1ccc2c(c1)[s+]c1c(n2)ccc(c1)N,mutagenic
+O=C1c2cc(ccc2-c2c1cc(cc2)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)N1C(=O)c2c3c1cc1c(OC)cccc1c3c1c(c2)OCO1,non-mutagenic
+SC[C@@H](C(=O)O)NC(=O)C,mutagenic
+CC1=Cc2nc3c(c(c2C(C1O)O)C)ccc1c3cccc1,mutagenic
+CCCCON=O,mutagenic
+ClC[C@@H]1O[C@H](CCl)O[C@@H](O1)CCl,mutagenic
+Fc1ccc2c(n1)cccc2,non-mutagenic
+N1CCN(CC1)c1ccccc1,non-mutagenic
+COC(C)(C)C,non-mutagenic
+CN(CCNS(=O)(=O)c1cccc2c1nccc2)C,non-mutagenic
+Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccccc1,non-mutagenic
+Oc1ccccc1c1ccccc1O,non-mutagenic
+COc1cc(C=O)ccc1OC,non-mutagenic
+ClCc1ccc(cc1)CCl,non-mutagenic
+Oc1ccc2c(c1)c1c(C)c(N)cc(c1[nH]2)C,mutagenic
+Cc1ccc(cc1)S(=O)(=O)n1ncc(c(c1=O)Cl)Cl,non-mutagenic
+CC(=O)OCN([N+](=O)[O-])C,mutagenic
+CC(c1c(N)ccc2-c3c(Cc12)cccc3)C,mutagenic
+Cc1cccc2-c3c(C(c12)C)cccc3,mutagenic
+[O-][N+](=O)OC(CO[N+](=O)[O-])CO[N+](=O)[O-],mutagenic
+CCOP(=S)(Oc1ccc(cc1)S(=O)C)OCC,non-mutagenic
+CCCCON(C(=O)c1ccc(cc1)OC)OC(=O)C,mutagenic
+Br[C@@H]1CC[C@H](Br)[C@H](Br)CC[C@H]([C@H](CC[C@H]1Br)Br)Br,non-mutagenic
+CN(C(=O)/C=C/c1ccc(o1)[N+](=O)[O-])C,mutagenic
+CN(CCCNc1c2ccccc2nc2c1c(ccc2)[N+](=O)[O-])C,mutagenic
+c1ccc2-c3ccc4c(c3C3C(c2c1)O3)cccc4,mutagenic
+CCN(C(=O)/C(=C(\OP(=O)(OC)OC)/C)/Cl)CC,mutagenic
+OC(=O)C(CS/C(=C(/C(=C(Cl)Cl)Cl)\Cl)/Cl)N,mutagenic
+COc1cc(OC)c(c(c1)n1c(cc(=O)c(c1c1ccc(cc1)F)C)c1ccccc1)Cl,non-mutagenic
+Nc1c2cc(C)ccc2nc2c1cc(C)cc2,mutagenic
+FC(C(C(F)(F)F)F)F,non-mutagenic
+Cc1ccc(c(c1C(c1ncc(n1C)[N+](=O)[O-])O)O)C(C)(C)C,non-mutagenic
+CN(c1ccc2c(c1)[s+]c1c(n2)ccc(c1)N(C)C)C,mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/C=C/OCC(CO)O,mutagenic
+CC(=O)Nc1cccc(c1C)N=Nc1cccc(c1C)NC(=O)C,non-mutagenic
+CNC(=O)NC,non-mutagenic
+CCCC[C@H](COCCC#N)CC,non-mutagenic
+OC(=O)CCCCCCCCCCCNC(=O)C1CC(N(C1(C)C)O)(C)C,non-mutagenic
+O=C1CCCc2c1cc(C)c1c2ccc2c1cccc2,mutagenic
+COc1cc(C=O)ccc1O,non-mutagenic
+CCNS(=O)(=O)c1ccc(cc1)C,non-mutagenic
+N#CCC[C@H](C#N)C,mutagenic
+Cc1c2ccc3c(c2nc2c1cccc2)cccc3,mutagenic
+O=C(C(c1ccccc1)N)NC1C(=O)N2C1SC(C2C(=O)OCc1oc(=O)oc1C)(C)C,non-mutagenic
+O=c1ccc2c(o1)cc1c(c2OCC2OC2(C)C)cco1,non-mutagenic
+CNCCCN1c2ccccc2CCc2c1cccc2,non-mutagenic
+Clc1ccc(cc1)Nc1ccc(cc1)[N+](=O)[O-],mutagenic
+CCOC(=O)C(=NNc1ccc(cc1)c1ccc(cc1)NN=C(C(=O)OCC)C(=O)OCC)C(=O)OCC,non-mutagenic
+Cc1c(C)ccc(c1C)C,non-mutagenic
+O=NN(C(C(=O)C)OC(=O)C)C,mutagenic
+[O-][N+](=O)C1=Cc2c3c1cccc3c1c(c2)cc2c(c1)cccc2,mutagenic
+O=c1cc(C)c2c(o1)c1CCCN3c1c(c2)CCC3,mutagenic
+O=Cc1c(O)cc2c(c1O)C(=O)c1c(C2=O)cccc1,non-mutagenic
+CCCCCC(/C=C/C1C(O)CC(=O)C1C/C=C/CCCC(=O)O)(O)C,non-mutagenic
+CC(=O)Nc1ccc(cc1)O,non-mutagenic
+[O-][N+](=O)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-],mutagenic
+N#N=NCC(C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C,mutagenic
+O=c1oc(c(o1)CN1CCN(CC1)c1cc2c(cc1F)c(=O)c(c1n2C(C)S1)C(=O)O)C,non-mutagenic
+OC(=O)Cc1cccc(c1)[N+](=O)[O-],non-mutagenic
+Cc1cc(C)c(c(c1)C)C,non-mutagenic
+CC(=O)N,non-mutagenic
+ClC/C(=C(\C(=O)O)/Cl)/C=O,mutagenic
+CC(=O)n1ncc(c(c1=O)Cl)Cl,non-mutagenic
+ClCC(=O)Nc1snc2c1ccc(c2)Cl,mutagenic
+Clc1cc(Cl)c(c(c1Cl)[N+](=O)[O-])Cl,non-mutagenic
+CC(c1ccc(cc1)OC[C@@H]1OC1)(C)C,mutagenic
+ONc1cc2c([nH]1)cccc2,mutagenic
+Cc1cnc2c(n1)c(C)c(c1c2nc(n1C)N)C,mutagenic
+CC1CN(N=O)CC(N1C(=O)c1ccccc1)C,non-mutagenic
+Nc1ccc(cc1C)S(=O)(=O)O,non-mutagenic
+O=C1c2ccccc2C(=O)c2c1c(O)c(c(c2)O)C(=O)O,non-mutagenic
+Nc1c(C)cc(c(c1C)[N+](=O)[O-])N,non-mutagenic
+CC(O)(C)C,non-mutagenic
+CC(CC(=O)Nc1snc2c1cc(Cl)cc2)C,non-mutagenic
+O=C([C@H]1[C@@H](C1(C)C)C=C(C)C)OCN1C(=O)C2=C(C1=O)CCCC2,mutagenic
+NCN,mutagenic
+ClCC1C(CCl)C2(C(C1(Cl)C(=C2Cl)Cl)(Cl)Cl)Cl,non-mutagenic
+CC[C@@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O,non-mutagenic
+CCCCOCCOCCO,non-mutagenic
+CCCCCCCCCCCCCC(=O)N(c1ccc2-c3c(Cc2c1)cccc3)O,mutagenic
+BrCC(COP(=O)(OCC(CBr)Br)O)Br,mutagenic
+OCc1ccc(o1)C=O,mutagenic
+Oc1ccc2c(c1)c1c(cc2)ccc2c1n(C)cc2,mutagenic
+CCCCC(COC(=O)c1ccc(cc1)C(=O)OCC(CCCC)CC)CC,non-mutagenic
+C[C@H](CN)O,mutagenic
+ClN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+ClCCN(CCCNc1c2cc(OC)ccc2nc2c1ccc(c2)Cl)CC,mutagenic
+ClCc1ccc2-c3c(-c4c2c1ccc4)cccc3,mutagenic
+OC(=O)C1CSSC(C(=O)N1)(C)C,non-mutagenic
+[O-][N+](=O)c1cccc2c1oc1c2cccc1,mutagenic
+COc1cc2OC3C(c2c2c1c1CCC(=O)c1c(=O)o2)CCO3,mutagenic
+ClC(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+OC(COc1cccc2c1c1ccccc1[nH]2)CNC(C)C,non-mutagenic
+O=C1C2(Cl)C3(C4(C1(Cl)C1(C2(C3(Cl)C(C41Cl)(Cl)Cl)Cl)Cl)Cl)Cl,non-mutagenic
+O=Cc1ccccc1O,non-mutagenic
+OC[C@H]1O[C@@H](Oc2cccc3c2C(=O)c2c(C3=O)cccc2O)[C@@H]([C@H]([C@@H]1O)O)O,mutagenic
+CCOc1cccc(c1)N,mutagenic
+CCOC[C@H](COc1ccc(cc1)NC(=O)CC[S+](C)C)O,non-mutagenic
+Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)O,mutagenic
+C=CC(=O)OCC(C)(C)C,non-mutagenic
+[O-][N+](=O)c1cc2[nH]c3c(c2cc1N)cccc3,mutagenic
+O=C1c2ccccc2C(=O)c2c1ccc(c2[N+](=O)[O-])C,mutagenic
+Oc1ccc(c(c1)Cl)Cl,non-mutagenic
+O(Cc1ccccc1)Cc1ccccc1,non-mutagenic
+Cc1ccc(cc1)CC[C@@H]1OC1,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2c2ccc3c(c2cc1)cccc3,mutagenic
+O=C1OC(=O)c2c1cc(cc2)C(=O)O,non-mutagenic
+C[n+]1c2ccccc2c(c2c1cccc2)N,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)c1ccc3c(c1cc2[N+](=O)[O-])cccc3,mutagenic
+Cc1ccc(cc1)S(=O)(=O)OCc1ccc(cc1)[N+](=O)[O-],mutagenic
+O=C(c1ccccc1)/C=C/c1ccc(cc1)Oc1ccccc1,non-mutagenic
+COc1ccc(cc1N)C,mutagenic
+CCCCC=C,non-mutagenic
+CC(=O)Nc1ccc(cc1)/C=C\c1ccccc1,mutagenic
+FC(C(Cl)(Cl)F)(Cl)Cl,mutagenic
+CC/C=C/CC/C=C/C=O,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2cccn1,non-mutagenic
+CCCC[C@H](COC[C@H]1CO1)CC,mutagenic
+Oc1ccc2c(c1)oc(=O)c1c2oc2c1ccc(c2)O,non-mutagenic
+CCN(c1ccccc1)Cc1ccccc1,non-mutagenic
+COc1ccc(cc1)C(C(Cl)(Cl)Cl)c1ccc(cc1)OC,non-mutagenic
+CCCCN(C[C@H](C1=CC(=[N+]=[N-])C(=O)C=C1)O)N=O,mutagenic
+Oc1c(O)cccc1O,mutagenic
+COS(=O)(=O)OC,mutagenic
+CN(c1ccc(cc1)N=Nc1ccc2c(c1)scn2)C,mutagenic
+NN(c1ccccc1)c1ccccc1,non-mutagenic
+CCN=[N+](C)[O-],non-mutagenic
+[O-][N+](=O)c1ccc2-c3cc4CCc5c(-c4cc3CCc2c1)cccc5,mutagenic
+OOC([C@@H]1CC[C@H](CC1)C)(C)C,mutagenic
+OC(=O)/C=C/C=C/C(=O)O,non-mutagenic
+O=C1Cc2cc3ccc(cc3cc2C(C1O)O)[N+](=O)[O-],non-mutagenic
+CC(CCON=O)C,mutagenic
+CCNC(=O)CCC(C(=O)O)N,non-mutagenic
+CCCCC/C=C\C=C/C=O,non-mutagenic
+CCCN(C(=O)N)N=O,mutagenic
+CCCCCCCC/C=C\CCCCCCCC(=O)OC,non-mutagenic
+Fc1ccc(c(c1)F)N,mutagenic
+[O-][N+](=O)c1cc(cc(c1Cl)[N+](=O)[O-])C(F)(F)F,non-mutagenic
+OC(COc1cccc2c1C=CC2)CNC(C)C,non-mutagenic
+c1ccc2c(c1)c1ccc3c(c1cc2)nccc3,mutagenic
+ClCC(=O)N(c1snc2c1cccc2)C,non-mutagenic
+CCCCCCCCS(=O)[C@@H](Cc1ccc2c(c1)OCO2)C,non-mutagenic
+CCCCC(=C)C=O,mutagenic
+Nc1ccc(cc1)Sc1ccc(cc1)N,mutagenic
+COc1ccc(c(c1)OC)N,mutagenic
+CC(=O)N(C)C,non-mutagenic
+COc1cc2O[C@@H]3[C@H](c2c2c1c1[C@@H](Cl)[C@H](C(=O)c1c(=O)o2)Cl)C=CO3,mutagenic
+OC1C(O)c2ccc(c3c2c2c1cccc2c1c3cccc1)[N+](=O)[O-],mutagenic
+OC(=O)C1OC(Oc2cccc3c2cc2ccc4c5c2c3ccc5ccc4)C(C(C1O)O)O,non-mutagenic
+CCN(CCOc1ccc2-c3c(C(=O)c2c1)cc(cc3)OCCN(CC)CC)CC,mutagenic
+O1CCOCCOCCOCCOCCOCC1,non-mutagenic
+CCOC(=O)C[C@H](C(=O)OCC)SP(=O)(OC)OC,non-mutagenic
+O=C1C(c2ccc3c(n2)cccc3)C(=O)c2c1cccc2,mutagenic
+CC(=O)O,non-mutagenic
+Cc1ccc(cc1N)N=Nc1ccc(c(c1)N)C,mutagenic
+ClC1=C(Cl)C(C(=C1Cl)Cl)(Cl)Cl,non-mutagenic
+CCN(CC)CC,non-mutagenic
+BrCc1cccc2-c3c4c(-c12)cccc4ccc3,mutagenic
+N#N=NCC(Cn1cnc2c1nc(N)nc2N)O,mutagenic
+O=C=NC1CCCCC1,non-mutagenic
+C=CC(=O)OCCCCCCOC(=O)C=C,non-mutagenic
+O=c1n(CC2CO2)sc2c1ccc(c2)OCC1CO1,mutagenic
+CCCNC(=O)NS(=O)(=O)c1ccc(cc1)Cl,non-mutagenic
+O=Cc1ccc(cc1)O,non-mutagenic
+CCCSSCC=C,non-mutagenic
+OC(C(Cl)(Cl)Cl)Nc1snc2c1cccc2,non-mutagenic
+NNC(C(=O)O)(Cc1ccc(c(c1)O)O)C,mutagenic
+Brc1c(Oc2c(Br)c(Br)c(c(c2Br)Br)Br)c(Br)c(c(c1Br)Br)Br,non-mutagenic
+Clc1cc(N)c(c(c1)S(=O)(=O)O)O,non-mutagenic
+c1ccc2-c3c4c(-c2c1)nc1ccccc1c4c1c(n3)cccc1,non-mutagenic
+C1CCCC1,non-mutagenic
+ClC(C(Cl)(Cl)Cl)Cl,non-mutagenic
+ONc1ccc(cc1C)C,mutagenic
+CSSC,non-mutagenic
+COc1cccc2c1nc1occc1c2OC,mutagenic
+Cc1c(C)cccc1C,mutagenic
+Oc1c2c(OC3C2C=CO3)cc2c1c(=O)c1c(o2)cccc1O,non-mutagenic
+N[C@@H](C(=O)O)Cc1ccc(cc1)F,non-mutagenic
+NC(C(=O)O)CSC(C(Br)Br)(F)F,mutagenic
+Oc1cc2c(=O)oc3c4c2c(c1O)oc(=O)c4cc(c3O)O,non-mutagenic
+OC[C@@]1(O)C[C@H](O[C@@H]2O[C@@H](C)[C@H]([C@H]([C@H]2I)O)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2,mutagenic
+COc1nncc2c1nccc2,non-mutagenic
+Nc1ccc2c(c1)c1c(C)c3cnccc3c(c1[nH]2)C,mutagenic
+COc1cc(ccc1N=Nc1c(O)c2ccc(cc2cc1S(=O)(=O)O)N)c1ccc(c(c1)OC)N=Nc1cc(c2c(c1O)cccc2)S(=O)(=O)O,mutagenic
+N#N=NCC(Cn1cnc2c1ncnc2SC)O,mutagenic
+COc1ccc(cc1OC)Cc1nccc2c1cc(OC)c(c2)OC,non-mutagenic
+BrCCC(=O)N1CCN(CC1)C(=O)CCBr,mutagenic
+Clc1ccc(cc1)c1nc2c(o1)cccc2,non-mutagenic
+OC1CCCCC1,non-mutagenic
+N#N=Nc1ccc(c(c1)[N+](=O)[O-])F,mutagenic
+[O-][N+](=O)c1cc2ccccc2c2c1c(cc1c2OCO1)C(=O)O,mutagenic
+CCCCN(CC)CC,non-mutagenic
+CC(COC(=O)C(=C)C)C,non-mutagenic
+Clc1ccc(c(c1)Cl)C(Cl)(Cl)Cl,mutagenic
+Oc1cc2c3c4c1cccc4ccc3cc1c2cccc1,mutagenic
+O[C@H]1C=Cc2c([C@@H]1O)c1cc3c(nc1cc2)ccc1c3cccc1,mutagenic
+O=NN(C(=O)C(C(C)C)NC(=O)C)CC(=O)O,mutagenic
+[O-][N+](=O)c1ccccc1Nc1ccccc1,non-mutagenic
+Clc1ccc(c(c1)Cl)O,non-mutagenic
+C[C@@H]1CN(N=O)[C@H](CN1N=O)C,mutagenic
+Clc1ccc(cc1)C(=O)Cl,non-mutagenic
+O=C(c1ccccc1O)OCc1ccccc1,non-mutagenic
+OS(=O)(=O)c1ccc(cc1)NN=Nc1ccc(cc1)S(=O)(=O)O,non-mutagenic
+ClC(=O)CCc1ccccc1,mutagenic
+Nc1ccc2c(c1)nc1c(c2N)cccc1,mutagenic
+NCC(=O)NCC(=O)NCC(=O)NCC(=O)O,non-mutagenic
+CCc1ccc2c(c1[N+](=O)[O-])C(=O)c1c(C2=O)cccc1,mutagenic
+FC(C(F)(F)F)C(F)(F)F,non-mutagenic
+ClCC(CBr)(Br)C,non-mutagenic
+Nc1ccc(cc1)N=Nc1ccc(cc1)N,mutagenic
+O=C(Nc1ccccc1)CC(=O)C,non-mutagenic
+c1ccc2-c3c4c(-c2c1)cc1cccc2c1c4c(cc3)cc2,mutagenic
+O=C(c1csc(c1)[N+](=O)[O-])Nc1ccccc1F,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)[n+](c2c1cccc2)[O-],mutagenic
+Brc1ccc(cc1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+ClC/C=C/CCl,mutagenic
+ONc1ccc2-c3c(Cc2c1)cccc3,mutagenic
+Cc1ccccc1Br,non-mutagenic
+OCCN=N#N,mutagenic
+Nc1ccc(cc1)N,mutagenic
+Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1C(=O)C)O,non-mutagenic
+[O-][N+](=O)c1cc(ccc1O)c1ccccc1,non-mutagenic
+O=NN(Cc1ccc(cc1)[N+](=O)[O-])C,mutagenic
+O=C1c2c(N)ccc(c2C(=O)c2c1c(N)ccc2N)N,mutagenic
+Clc1c(O)cccc1Cl,non-mutagenic
+[O-][N+](=O)c1ccccc1C(=O)Cl,mutagenic
+CCNC(=O)Nc1ccc(c(c1)C(=O)C)OCC(CNC(C)(C)C)O,non-mutagenic
+Nc1sc2c(n1)c(Cl)ccc2,non-mutagenic
+CC(c1cc(N)c(cc1N)[N+](=O)[O-])C,mutagenic
+O=C(c1csc(c1)[N+](=O)[O-])Nc1ccccc1Cl,mutagenic
+CCn1c(N)nc2c1ccc1c2ncc(n1)C,mutagenic
+[O-][N+](=O)NC(=N)N(N=O)CCCCCC,mutagenic
+Nc1ccc(cc1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+CC(C(C)(C)C)OP(=O)(Cl)C,non-mutagenic
+O=C1C=CC(=O)C(=C1)C(C)(C)C,mutagenic
+CCCCON(C(=O)c1ccc(cc1)Br)OC(=O)C,mutagenic
+Cc1cccc2c1-c1ccccc1C2C,mutagenic
+O=C1C=Cc2c(C1=O)ccc1c2c(C)cc2c1cccc2,mutagenic
+OCCN(CCO)C,non-mutagenic
+C/C=C\C=C/C(=O)O,non-mutagenic
+C[C@@H]1CCc2c1ccc1c2ccc2c1cccc2,mutagenic
+Sc1nc2c([nH]1)cccc2,non-mutagenic
+Ic1ccc(cc1)N=N/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/c1ccccc1,non-mutagenic
+[O-][n+]1cccc2c1C1OC1C=C2,non-mutagenic
+ON1c2ccccc2/C(=N\c2ccccc2)/C1(c1ccccc1)c1ccccc1,non-mutagenic
+OC1C2OC2c2c(C1O)ccc1c2c(C)cc2c1cc(cc2)C,mutagenic
+OC(=O)CCN[N+](C)(C)C,non-mutagenic
+[O-][N+](=O)C1=Cc2c3c(O1)cccc3ccc2,mutagenic
+BrCCC(Br)Br,mutagenic
+CC1=CC(=O)C(=CC1=O)C,non-mutagenic
+O[C@H]1C(OC[C@H]([C@@H]1O)O)Nc1ccc(cc1)C,mutagenic
+BrCCOC(=O)CC(C(=O)OCCBr)O,mutagenic
+CC(=O)OCc1c2ccccc2c(c2c1c1ccccc1cc2)C,mutagenic
+CCSC(=O)Cl,non-mutagenic
+CCN(c1ccccc1)CC,non-mutagenic
+O=C1c2ccccc2C(=O)C1(O)O,non-mutagenic
+CCCCN(C(=O)N)N=O,mutagenic
+CN1CCC(=CC1)c1ccccc1,non-mutagenic
+ClCCN(c1ccc2c(c1)oc(c2)[N+](=O)[O-])CCCl,mutagenic
+Cc1ccc(c(c1)C)/N=C/N=C/N(c1ccc(cc1C)C)C,non-mutagenic
+COC(=O)C1c2cc3c(c(c2C(CC1(O)CC)OC1OC(C)C(C(C1)N(C)C)O)O)C(=O)c1c(C3=O)cccc1O,mutagenic
+COc1cc(ccc1N=N[C@@H](C(=O)Nc1ccccc1OC)C(=O)C)[N+](=O)[O-],non-mutagenic
+OC1C=Cc2c(C1O)cc1c(c2)ccc(c1)[N+](=O)[O-],mutagenic
+O=NN(CC(=O)C)COC(=O)C,mutagenic
+COc1ccc(cc1)/C(=C\C(=O)O)/Br,mutagenic
+ClC[C@H](O[C@@H](CCl)C)C,mutagenic
+Cc1ccc(cc1)NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+COC(=O)c1ccc(cc1)C,non-mutagenic
+CC(=O)OCc1ccco1,mutagenic
+CC(c1cccc(c1)C(OOC(C)(C)C)(C)C)(OOC(C)(C)C)C,non-mutagenic
+CNS(=O)(=O)c1ccc(cc1)N,non-mutagenic
+Cc1c2cccc(c2nc2c1ccc1c2cccc1)C,mutagenic
+CCc1ccccc1N,non-mutagenic
+C1=COc2c(C=C1)c1cc3ccccc3cc1c1c2cccc1,mutagenic
+C1C=Cc2c(C1)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+[O-][N+](=O)c1ccc(cc1)N=Nc1ccccc1,mutagenic
+C=CC(=C)CCC=C(C)C,non-mutagenic
+Cc1cc(cc(c1)C)[N+](=O)[O-],mutagenic
+Oc1c(O)cc(c2c1C(=O)c1ccccc1C2=O)O,mutagenic
+CCCOC(=O)c1cc(O)c(c(c1)O)O,non-mutagenic
+ClCCN(c1ccc2c(c1)cccc2)CCCl,mutagenic
+OC1C(O)C(O)COC1(O)CN(c1ccc(cc1)C)N=O,mutagenic
+O=C=Nc1ccc(c(c1)N=C=O)C,mutagenic
+ClC(=C)C#N,non-mutagenic
+COc1ccc2c(c1)[nH]c1c2CCN=C1C,non-mutagenic
+COc1cccc(c1)/C=C/c1ccc(cc1)N,mutagenic
+OCCN(N=O)CC,mutagenic
+Clc1ccc2c(c1)nc(n2C)N,mutagenic
+OC(=O)c1cccc(c1C)[N+](=O)[O-],mutagenic
+ClCCCNC(=O)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N,mutagenic
+OCC1OC(CC1O)n1cnc2c1nc(O)nc2N,non-mutagenic
+Oc1ncnc2c1cccc2,non-mutagenic
+O=CC(=C(Cl)Cl)C(Cl)Cl,mutagenic
+CC(=O)OCc1ccc2c(c1)OCO2,non-mutagenic
+ClC(/C(=C(/C(=O)O)\Cl)/C(=O)O)Cl,mutagenic
+OCc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)ccc1,mutagenic
+Nc1ccc2c(c1)cns2,mutagenic
+[O-][N+](=O)c1ccc(cc1)c1nc2-c(c([nH]1)N)ncn2,mutagenic
+Sc1nc2c(s1)cccc2,non-mutagenic
+N#CCC[C@](C#N)(CBr)Br,non-mutagenic
+COc1ccc(cc1)N=[N+](c1ccc(cc1)OC)[O-],mutagenic
+COP(=S)(Oc1ccc(c(c1)C)[N+](=O)[O-])OC,mutagenic non-mutagenic
+CCOc1ccc(cc1)[N+](=O)[O-],mutagenic
+NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)O)N[C@H](C(=O)O)CCc1ccccc1,non-mutagenic
+Clc1cc(N)c(cc1c1cc(Cl)c(cc1Cl)N)Cl,mutagenic
+ClCCN(C(=O)NC1CCCCC1)N=O,mutagenic
+Cc1ccccc1N=Nc1ccc(cc1)N(C)C,non-mutagenic
+[O-][N+](=O)c1c2ccccc2c2c3c1ccc1c3c(cc2)c(cc1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc2c(c1)Oc1c(O2)ccc(c1)[N+](=O)[O-],mutagenic
+O[C@@H]1[C@@H]2O[C@@H]2c2c([C@H]1O)ccc1-c3c4c(-c21)cccc4ccc3,mutagenic
+Nc1ccc(c(c1)Cl)c1ccc(cc1Cl)N,mutagenic
+OC(=O)C1(C)CCCC2(C1CCC13C2CCC(C3)(C(=C)C1)O)C,mutagenic
+O=C1C=CC(=O)N1c1ccc(cc1)Cc1ccc(cc1)N1C(=O)C=CC1=O,non-mutagenic
+CCCC[C@@H](C(=O)O)CC,non-mutagenic
+Cc1ccc(c(c1)C)OP(=O)(Oc1ccc(cc1C)C)Oc1ccc(cc1C)C,non-mutagenic
+CCCCCCCCCCCCCOC(=O)C[N+](CC)(CC)CC,non-mutagenic
+COC(=O)c1ccc(cc1)C=O,non-mutagenic
+CC(C1C(=O)N2C1SC(=C2C(=O)O)C1CCCO1)O,non-mutagenic
+ClC1=CC(=O)C(C1=O)(Cl)Cl,mutagenic
+O=CC1C(=CCC2C1(C)CCC1C2(C)CCCC1(C)C)C=O,non-mutagenic
+N#N=Nc1nc2c(n1C)cccc2,mutagenic
+CN(CCN(c1ccccn1)Cc1ccc(cc1)O)C,non-mutagenic
+CC1OC(=O)c2c(C1)ccc(c2O)C(=O)NC(C(=O)O)Cc1ccccc1,non-mutagenic
+OC(=O)C(CC(=O)O)(CC(=O)O)O,non-mutagenic
+O=CNc1scc(n1)c1scc(c1)[N+](=O)[O-],mutagenic
+CCC(=O)/C=C/C1C(=CCCC1(C)C)C,non-mutagenic
+c1ccc(cc1)NNc1ccccc1,mutagenic
+CCCCCOc1cccc(c1)NC(=O)OC1CCCCC1N1CCCC1,non-mutagenic
+CCCN(CCC)CCC,non-mutagenic
+O=C1NC(=O)C(=C(Cl)Cl)C1,mutagenic
+NC(C(=O)O)C(C)C,non-mutagenic
+CCCCCC(=O)OCC=C,non-mutagenic
+Nc1cccc(c1)C(F)(F)F,non-mutagenic
+COc1cc(ccc1NC(=O)C)[N+](=O)[O-],mutagenic
+CC(CCC[C@H]([C@@H]1CC[C@H]2[C@]1(C)CC[C@@H]1[C@H]2CC2([C@H]3[C@]1(C)CC[C@@H](C3)Br)S(=O)(=O)CCS2(=O)=O)C)C,mutagenic
+CNS(=O)(=O)c1ccc(cc1)NC(=O)C,non-mutagenic
+OC[C@H]1O[C@@H](C[C@@H]1N=[N+]=[N-])n1cc(C)c(=O)[nH]c1=O,mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c2c3c1c1CCCCc1c1c3c(cc2)ccc1,mutagenic
+O=NN(c1ccncc1)C,non-mutagenic
+COC1=C[C@@H]2[C@@H]3Cc4c([C@@]2(CC1=O)CCN3C)c(O)c(cc4)OC,non-mutagenic
+CNC(=O)O/N=C\C(SC)(C)C,non-mutagenic
+CC(=O)Nc1snc2c1cccc2,mutagenic
+C=CCN(C1c2ccccc2-c2c(C1N1C3C1c1ccccc1-c1c3cccc1)cccc2)CC=C,non-mutagenic
+[O-][N+](=O)c1oc(c(c1Cl)Cl)C(=O)C,mutagenic
+OCC1OC(OC(C(C(=O)NC(C(C(C(=O)NC(C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCc2nc[nH]c2)C(O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)C(CC(=O)N)NCC(C(=O)N)N)c2nc[nH]c2)C(C(C1O)O)OC1OC(CO)C(C(C1O)OC(=O)N)O,mutagenic
+Fc1ccc(cc1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+ClC/C(=C(\C(=O)O)/Cl)/C(=O)O,non-mutagenic
+CCCNc1snc2c1cccc2,non-mutagenic
+N#Cc1ccc2c(c1)nc(n2C)N,mutagenic
+O=C(C1OC1)NCc1ccccc1,mutagenic
+[O-][N+](=O)c1cncn1C,mutagenic
+O=S1(=O)OCCCO1,mutagenic
+OC(=O)Cc1ccc(cc1)Cl,non-mutagenic
+Oc1cccc(c1)N(C)C,mutagenic
+Nc1c2ccccc2cc2c1cccc2,mutagenic
+[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Cl,mutagenic
+CCc1cccc(c1N)CC,mutagenic
+[O-][N+](=O)c1cc2ccccc2cc1C,non-mutagenic
+CC(=O)OC1C(OCC(C1OC(=O)C)OC(=O)C)Nc1ccc(cc1)[N+](=O)[O-],mutagenic
+OCC1(O)CCC23CC1CC2CCC1C3(C)CCC(C1(C)CO)O,non-mutagenic
+CCC(=O)NCc1ccccc1,non-mutagenic
+ClC[C@H](Cl)C,mutagenic
+OC(=O)[C@@H]1[C@H](C(=O)O)[C@]2(C([C@]1(Cl)C(=C2Cl)Cl)(Cl)Cl)Cl,non-mutagenic
+O=C1C=CC(=O)C1(Cl)Cl,mutagenic
+CNC(=O)N(C(=O)NC)O,non-mutagenic
+BrCC#N,non-mutagenic
+[O-][N+](=O)c1ccc(s1)c1nc(N2CCOCC2)c2c(n1)cccc2,mutagenic
+C/C=N\O,mutagenic
+Fc1ccc(cc1)CN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+O(CC1OC1)CCOCC1OC1,mutagenic
+Nc1cc(cc2c1c(O)c(c(c2)S(=O)(=O)O)N=Nc1ccccc1)S(=O)(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)Nc1ccccc1,non-mutagenic
+O=C1C=Cc2c(C1=O)ccc1c2ccc2c1cccc2,non-mutagenic
+CC(=O)N(c1ccc2-c3c(Cc2c1)cccc3)OC(=O)c1ccccc1,mutagenic
+NC[C@@H]1CC[C@H](CC1)C(=O)c1ccc(cc1)CCC(=O)O,non-mutagenic
+OC1COC2(C1CC(=O)C2(O)Cc1cn(c2c1cccc2)C)O,mutagenic
+CCC(=O)C(=O)CC,mutagenic
+ClCCSCCCl,mutagenic
+N#N=Nc1ccc2c(c1)c(Nc1ccc(cc1)NS(=O)(=O)C)c1c(n2)cccc1,mutagenic
+CCOP(=S)(Oc1cnc2c(n1)cccc2)OCC,non-mutagenic
+CCCCOC(=O)COc1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+CCCC(=O)Nc1ccc(c(c1)C(=O)C)OC[C@@H](CNC(C)C)O,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)/C=C/c1cccc(c1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C/c1ccc(cc1)C(=O)O,mutagenic
+Oc1cc2ccccc2c(c1)O,mutagenic
+O=C/C(=C\c1ccccc1)/C,non-mutagenic
+Oc1ccc2c(c1)c1c(cc2)c(C)cc2c1nc([nH]2)C,mutagenic
+Cc1cc(O)c2c(c1O)C(=O)c1c(C2=O)c(O)ccc1O,mutagenic
+COc1ccc2c(c1)ccc(c2)C(C(=O)O)C,non-mutagenic
+COc1c(OC)ccc2c1C(=O)O[C@@H]2[C@@H]1N(C)CCc2c1cc1OCOc1c2,non-mutagenic
+OC(=O)/C(=C(/C(=O)O)\C)/Cl,non-mutagenic
+Clc1ccc(c(c1)C)O,non-mutagenic
+CC(CCCC(C1CCC2C1(C)CCC1C2CC=C2C1(C)CCCC2)C)C,non-mutagenic
+Fc1ccccc1C(=O)c1c(C)nn(c1N)C,mutagenic
+C1C/C=C/CCC2C(CC/C=C\1)O2,non-mutagenic
+[O-][n+]1cnc2c(c1N)[nH]cn2,mutagenic
+CC(=O)Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)N,non-mutagenic
+COc1ccc2c(c1)c1cc(OC)ccc1c1c2c2ccc(cc2c2c1ccc(c2)OC)OC,mutagenic
+Clc1ccc(c(c1)Cl)N,mutagenic
+CCCCCCCCCCCCCCCCCCCCCCCCCCCCO,non-mutagenic
+CC(=C)C#N,non-mutagenic
+CN,non-mutagenic
+NCCc1c[nH]c2c1cccc2,non-mutagenic
+CC1=Nc2c(C1(C)C)cccc2,non-mutagenic
+N#N=Nc1ccc2c(c1)nc1c(c2Nc2ccc(cc2)NS(=O)(=O)C)cccc1,mutagenic
+BrC/C=C\CBr,mutagenic
+CCCCN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+Clc1ccc2c(c1)nsc2N,mutagenic
+CO/N=C(/c1nsc(n1)N)\C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)C[n+]1ccn2c1cccn2,non-mutagenic
+C[C@@H](ON=O)CC,mutagenic
+CC(C(=O)Nc1ccccc1)C,non-mutagenic
+[O-][N+](=O)c1c(C)cc(c2c1nsn2)C,mutagenic
+Clc1ccc(c(c1)N)Cl,non-mutagenic
+[O-][N+](=O)c1ccccc1/C=C/c1ccccn1,mutagenic
+Oc1ccc2c(c1)c1c(cc2)ccc2c1nc(n2C)C,mutagenic
+CCOc1ccccc1OCC1CNCCO1,non-mutagenic
+CCC/C=C/C(=O)OC1C(C)(C)CC2C1(O)C=C(C=O)C13C2(C1)C(=O)OC3O,mutagenic
+COc1cc2O[C@@H]3[C@H](c2c2c1c1CC[C@@H](c1c(=O)o2)O)C=CO3,mutagenic
+c1ccc2c(c1)Cc1c(C2)c2ccccc2c2c1cccc2,mutagenic
+OCC12COC(N2C(OC1)c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-],mutagenic
+CCN([N+](=O)[O-])CCO[N+](=O)[O-],mutagenic
+OC(=O)CC[C@@H](C(=O)O)NC(=O)c1cc(Cl)c(c(c1)Cl)N(Cc1cnc2c(n1)c(N)nc(n2)N)C,non-mutagenic
+Nc1cc(cc(c1O)Cl)[N+](=O)[O-],mutagenic
+Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)c(c(c1)C)O,mutagenic
+Cc1cccc2c1cc1ccc3c(c1c2)cccc3,mutagenic
+Cc1cc2CCCc2c2c1c1ccccc1cc2,non-mutagenic
+CON(C(=O)Nc1ccc(cc1)Br)C,non-mutagenic
+OC(COc1ccc(cc1C(=O)C)NC(=O)Nc1ccc(c(c1)C(=O)C)OCC(CNC(C)(C)C)O)CNC(C)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)Cl)N,mutagenic
+Cn1c2ccc3c(c2c2c1ccc1c2cccc1)cccc3,mutagenic
+Clc1cnc2c(c1)cccc2,non-mutagenic
+COP(=S)(Oc1ccc(cc1)[N+](=O)[O-])OC,mutagenic
+C1CCC2C(C1)CC1(CC2)CO1,non-mutagenic
+Oc1ccc(cc1)C1Oc2c3C1C(=O)N1CCCCNCCCNC(c(c3)cc2)CC(=O)NCCC1,mutagenic
+Oc1nnc(c(n1)O)C,non-mutagenic
+Clc1ccc(c(c1)Cl)COC(=O)c1cccc2c1nccc2,non-mutagenic
+OCC(C(C(C(C=O)O)O)O)O,non-mutagenic
+Oc1cc2ccccc2c2c1cccc2,mutagenic
+NCC1(C)CC(N)CC(C1)(C)C,non-mutagenic
+OC(=O)CCCCCCCCC(=O)O,non-mutagenic
+Nc1ccc(c(c1)N)O,mutagenic
+O=NN(C(C(=O)O)C(=O)O)CC1(O)CCC(C(C1O)O)O,non-mutagenic
+OC1c2ccccc2-c2c(C1O)c(Br)c1c(c2)cccc1,non-mutagenic
+CN(CCNC(=O)c1ccc2c(c1)c(N)c1c(n2)cccc1)C,non-mutagenic
+Cc1ccc2c(c1)nc([nH]2)N,mutagenic
+Oc1ncc(cc1N)c1ccncc1,non-mutagenic
+ClC1=C(Cl)[C@@]2(C([C@@]1(Cl)[C@@H]1[C@H]2[C@H]2C[C@@H]1C=C2)(Cl)Cl)Cl,non-mutagenic
+[O-][N+](=O)OCCN([N+](=O)[O-])C,mutagenic
+BrCc1c2ccccc2c(c2c1c1ccccc1cc2)C,mutagenic
+Cc1ccc(c2c1ccc1c2cccc1)C,mutagenic
+C1CCc2c(C1)ccc1c2cc2c(n1)ccc1c2cccc1,mutagenic
+CC(=O)[C@H](C(=O)Nc1ccccc1)N=Nc1ccc(cc1Cl)c1ccc(c(c1)Cl)N=N[C@@H](C(=O)Nc1ccccc1)C(=O)C,non-mutagenic
+CNC(=O)N(c1nc2c(s1)cccc2)C,non-mutagenic
+COC1=CC=CC=CC1,mutagenic
+CC(N1C(=O)c2ccccc2NS1(=O)=O)C,non-mutagenic
+CC(c1ccccc1)CN=N#N,mutagenic
+ClCCN(P(=O)(O)N)CCCl,mutagenic
+O=C1Nc2c3c1cc1OCOc1c3c1c(c2)cccc1,mutagenic
+CN(CCCNc1c2ccccc2nc2c1ccc(c2)[N+](=O)[O-])C,mutagenic
+CCc1cccc2c1[nH]c1c2CCOC1(C)CC,non-mutagenic
+O=Cc1ccccc1C,non-mutagenic
+Oc1ccc2c(c1)oc(=O)cc2C,non-mutagenic
+CS(=O)(=O)C,non-mutagenic
+O=NN(C(=O)Oc1cccc2c1cccc2)C,mutagenic
+O=C1c2c(ccc(c2[N+](=O)[O-])C)C(=O)c2c1cccc2[N+](=O)[O-],mutagenic
+CCn1nc(C(=O)O)c(=O)c2c1cc1OCOc1c2,mutagenic
+Oc1ccc(cc1)c1ccc(cc1C)N,mutagenic
+Clc1ccc(cc1)COC(=O)c1cccc2c1nccc2,non-mutagenic
+ClCc1c2ccccc2c(c2c1cccc2)C,mutagenic
+OC(=O)[C@]1(C)CCC[C@@]2(C1CC[C@]13C2CC[C@@](C3)(C(=O)C1)C)C,non-mutagenic
+c1ccc2-c3c4c(-c2c1)c1ccccc1cc4c1c(c3)cccc1,mutagenic
+CC(=O)Nc1cccc(c1C)N=[N+](c1cccc(c1C)NC(=O)C)[O-],non-mutagenic
+Cc1ccc(cc1)/C=C/c1ccc(cc1)N,mutagenic
+[O-][N+](=O)c1ccc(c(c1)C)[N+](=O)[O-],mutagenic
+Clc1ccc(cc1)S(=O)(=O)c1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)nc1c(n2)ccc(c1)[N+](=O)[O-],mutagenic
+ClC#N,non-mutagenic
+c1ccc2c(c1)cc1c(c2)c2ccc3c(c2cc1)cccc3,non-mutagenic
+ClCSP(=S)(OCC(C)C)OCC(C)C,non-mutagenic
+[O-][N+](=O)c1oc2c(c1)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+CN(P(=O)(N(C)C)N(C)C)C,non-mutagenic
+OC1C=Cc2c(C1O)c1ccc3c4c1c(c2)ccc4ccc3[N+](=O)[O-],mutagenic
+Oc1ccc2c(c1)c1ccc3c4c1c(c2)ccc4ccc3,mutagenic
+CC(=O)/C=C/c1ccco1,non-mutagenic
+CNC(=S)N(C)C,non-mutagenic
+Clc1ccc(cc1)OCCO/C(=C(\n1cncc1)/C)/c1ccc(cc1Cl)Cl,non-mutagenic
+OC1C=Cc2c(C1O)ccc1c2nc2cc(C)ccc2c1C,mutagenic
+O=C(c1ccccc1C(=O)OC1CCCCC1)OC1CCCCC1,non-mutagenic
+O=C(C1OC1c1ccccc1)c1ccc(cc1)c1ccccc1,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1ccccc1n2C,mutagenic
+OCC1OC(C(C1O)O)n1cnc2c1nc(O)nc2N,non-mutagenic
+Cc1ccc2c(c1)nccc2,mutagenic
+OC(=O)Cc1ccc(cc1)[N+](=O)[O-],mutagenic
+OC(CC(CC(=O)O)O)CCn1c(C(C)C)c(c(c1c1ccc(cc1)F)c1ccccc1)C(=O)Nc1ccccc1,non-mutagenic
+CC(=O)Nc1ccc(cc1)/C=N/n1nnc2-c(c1O)ncc2,mutagenic
+O[C@@H](COc1ccc(cc1C(=O)C)NC(=O)N)CNC(C)(C)C,mutagenic
+O=NN(C1OCC(C(C1O)O)O)c1ccc(cc1)C(=O)O,mutagenic
+CCOP(=O)(Oc1cc(C)ccc1[N+](=O)[O-])NC(CC)C,non-mutagenic
+NCCc1cc(O)c(cc1O)O,mutagenic
+OC(=O)COc1ccccc1,non-mutagenic
+CC(=O)OCC=C,mutagenic
+[O-][N+](=O)c1ccccc1Br,mutagenic
+CCSC(=O)N1CCCCCC1,non-mutagenic
+COC(=C1C(=NC(=C(C1c1ccccc1[N+](=O)[O-])C(=O)OC)C)C)O,non-mutagenic
+OCC1OC(CC1O)n1cnc2c1nc(nc2N)c1ccc(cc1)[N+](=O)[O-],mutagenic
+ClCc1ccc(cc1)C#N,non-mutagenic
+ClCCOP(OCCCl)OCCCl,mutagenic
+CN(c1ccc(cc1)C(=O)c1ccc(cc1)N(C)C)C,mutagenic
+Oc1ccc(cc1)/C=N/n1nnc2-c(c1O)nc1c2cccc1,mutagenic
+Oc1c2cc(N)c(cc2cc(c1N=Nc1ccc(c2c1cc(cc2)S(=O)(=O)O)N=Nc1ccc(cc1)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+CCS(=O)CCSP(=O)(OC)OC,mutagenic
+COP(=S)(SCC(=O)N(C=O)C)OC,non-mutagenic
+Oc1ccc(cc1)c1cc(=O)c2c(o1)cc(cc2O)O,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)C(=O)O)C,mutagenic
+OC1C=Cc2c(C1O)cc1c(c2)cc(cc1)[N+](=O)[O-],mutagenic
+COP(=S)(Oc1ccc(c(c1)C)N)OC,mutagenic
+[O-][N+](=O)[CH-]C,non-mutagenic
+O=C(OC(C)(C)C)/C=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+COc1ccc(cc1)C=O,non-mutagenic
+c1cc2ccc3c4c2c(n1)ccc4ccc3,mutagenic
+Cl/C=C(/c1cc(Cl)c(cc1Cl)Cl)\OP(=O)(OC)OC,non-mutagenic
+Cc1cnc2c(c1)cccc2,mutagenic
+COc1cc(N=Nc2ccccc2)ccc1N,mutagenic
+[O-][N+](=O)c1c(C)ccc2c1cccc2,mutagenic
+OCC([N+](=O)[O-])(CO)Br,non-mutagenic
+OC(=O)/C=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+CCc1ccccc1O,non-mutagenic
+OCC(=O)Nc1c(CC)cccc1CC,mutagenic
+c1ccc2c(c1)c(OCC1CO1)ns2,mutagenic
+CSCC[C@H]1NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)CC(=O)O)CCCN=C(N)N)[C@H](CC)C)C)CCC(=O)N)CO)CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCCN=C(N)N)Cc1ccccc1)CO)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)N)CC(C)C)CCCN=C(N)N)CCCN=C(N)N)CO)CO,non-mutagenic
+C1CCO1,mutagenic
+CCN(CCNc1ccc(c2c1c(=O)c1c(s2)cccc1)COC(=O)c1ccco1)CC,mutagenic
+ClCC(=C)Cl,mutagenic
+COCC1CN(C)C2C(=C1)c1cccc3c1c(C2)cn3C,mutagenic
+CN(CC[C@@H](N(C)C)C)C,non-mutagenic
+O=C(Nc1cc(Cl)cc(c1)Cl)CCC(=O)O,non-mutagenic
+CN(/C=N/c1ccc(cc1C)Cl)C,non-mutagenic
+O=Nc1cccc(c1C)[N+](=O)[O-],non-mutagenic
+[O-][N+](=O)c1cc(ccc1N)c1ccc(c(c1)[N+](=O)[O-])N,mutagenic
+COC(=O)C1c2cc3c(c(c2C(CC1(O)CC)OC1OC(C)C(C(C1)N(C)C)OC1CC(O)C(C(O1)C)OC1CCC(=O)C(O1)C)O)C(=O)c1c(C3=O)cccc1O,mutagenic
+Nc1[nH]nc(n1)N,non-mutagenic
+Nc1ccc2c(c1)nc1c(c2)cccc1,mutagenic
+CCn1cc(C(=O)O)c(=O)c2c1cc1OCOc1c2,mutagenic
+Oc1n(/N=C/c2ccc(cc2)c2ccccc2)nnc2-c1nc1c2cccc1,non-mutagenic
+CCCCCCCCCC,non-mutagenic
+CN(CCCNc1c2ccccc2nc2c1cc(cc2)[N+](=O)[O-])C,mutagenic
+NCCC[C@H](Nc1cc(OC)cc2c1nccc2)C,mutagenic
+O=C1CN(CCN2CC(=O)N(C(=O)C2)CN2CCOCC2)CC(=O)N1CN1CCOCC1,mutagenic
+BrC1C(Cl)C(Br)C(C(C1Br)Br)Br,non-mutagenic
+NCCNCCNCCNCCNCCN,mutagenic
+O=C1CCCCCO1,non-mutagenic
+Oc1cccc(c1)Cl,non-mutagenic
+Cc1c2C3OC3c3c(-c2c(c2c1cccc2)C)cccc3,mutagenic
+O=Nc1cc2OCOc2cc1O,mutagenic
+NC(=S)Nc1ccccc1,non-mutagenic
+NCc1cccc(c1)CN,non-mutagenic
+NCc1ccc(cc1)CN,non-mutagenic
+CCCCC/C(=C/c1ccccc1)/C=O,non-mutagenic
+OCCN(CC(=O)O)N=O,mutagenic
+Fc1cccc2c1ccc1-c3c4c(-c21)cccc4ccc3,mutagenic
+CN(CCC(c1ccccn1)c1ccc(cc1)Cl)C,non-mutagenic
+OCCNC(=O)CSc1nc(Cl)cc(n1)Nc1c(C)cccc1C,non-mutagenic
+C=CCc1ccc(c(c1)O)O,mutagenic
+ClCC(=O)OC(C)C,non-mutagenic
+Clc1ccc2c(c1)nc([nH]2)C,mutagenic
+Oc1ccccc1,non-mutagenic
+CC[C@H]([N+](=O)[O-])[C@H](O)C,non-mutagenic
+OCC(CBr)(CBr)CO,mutagenic
+Nc1nc2c(s1)cc(cc2)[N+](=O)[O-],mutagenic
+CCS(=O)(=O)CCn1c(C)ncc1[N+](=O)[O-],mutagenic
+NCC(C(=O)NC1CC(N)C(C(C1OC1CCC(C(C1O)NC)(C)O)O)OC1CC(CN)C(C(C1O)O)O)O,non-mutagenic
+[O-][N+](=O)c1cc(ccc1c1ccc(cc1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+[O-][N+](=Nc1ccc(c(c1)N)C)c1ccc(c(c1)N)C,mutagenic
+OCc1ccc(cc1)C#N,non-mutagenic
+CCc1ccc(nc1)C,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)/C=N/c1snc2c1cccc2,mutagenic
+[O-][N+](=O)c1cc2cc(ccc2c2c1cccc2)[N+](=O)[O-],mutagenic
+COc1c2C(=O)c3ccccc3C(=O)c2cc(c1C=O)O,non-mutagenic
+[O-][N+](=O)/C=C/c1ccccc1,mutagenic
+CC(=C)[C@@H]1CC=C(C(=O)C1)C,non-mutagenic
+CC/C(=C(\c1ccc(cc1)OP(=O)(O)O)/CC)/c1ccc(cc1)OP(=O)(O)O,non-mutagenic
+OCc1c2ccc3c(c2c(c2c1cccc2)C)cccc3,mutagenic
+Fc1cnc2c(c1)ccc1c2cccc1,non-mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C/C(=O)OCC,mutagenic
+CC(=O)Nc1nc2c(n1C)c(C)cc1c2cccn1,mutagenic
+ClCC(CCl)O,mutagenic
+NC1CCN(C1)c1nc2n(cc(c(=O)c2cc1F)C(=O)O)c1ccc(cc1F)F,mutagenic
+CCCCCCCCCC(=O)OCCN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F,non-mutagenic
+CCCC(=O)Cl,mutagenic
+COc1c2N(C)C3C(c2cc(c1OC)Cl)(O)C(C12N3C(=O)C(C)(SS1)N(C2=O)C)O,non-mutagenic
+CCCCC(COC(=O)COc1ccc(cc1Cl)Cl)CC,non-mutagenic
+Nc1nnc(s1)S,non-mutagenic
+[O-][N+](=O)c1ccc(cc1C(C)(C)C)c1ccccc1,non-mutagenic
+Nc1c(C)n(n(c1=O)c1ccccc1)C,non-mutagenic
+OC(C(Cl)(Cl)Cl)O,mutagenic
+COc1ccc2c(c1)c(CCNC(=O)C)c[nH]2,non-mutagenic
+O=NN(CC(=O)C)CC(=O)C,mutagenic
+[O-][N+](=O)c1ccc(cc1)CN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+ClCC(=O)Nc1snc2c1cc(Cl)cc2,mutagenic
+Cn1ccnc1S,non-mutagenic
+OCCc1c[nH]c2c1ccc(c2)[N+](=O)[O-],mutagenic
+OCC#CCO,non-mutagenic
+OC(=O)CCc1ccccc1,non-mutagenic
+O=Nc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+OC1C(O)C(O)COC1(O)CNc1ccc(cc1)C,non-mutagenic
+CN(N=O)CC,mutagenic
+CC(COC(=O)CCCCC(=O)OCC(C)C)C,non-mutagenic
+Oc1nc(O)nc(c1)C(=O)O,non-mutagenic
+C(COC[C@@H]1OC1)CCOC[C@@H]1OC1,mutagenic
+COc1nsc2c1cc(OCC1CO1)cc2,mutagenic
+CCN=[N+](CC)[O-],non-mutagenic
+CCCC(=O)Nc1snc2c1cc(Cl)cc2,non-mutagenic
+Clc1cccc(c1)C(F)(F)F,non-mutagenic
+Nc1cc(C(C)C)c(c(c1)[N+](=O)[O-])N,non-mutagenic
+ClC(=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+C=CCc1cc(OC)c2c(c1)OCO2,non-mutagenic
+Nc1ccccc1SCSc1ccccc1N,mutagenic
+O=NN(c1ccccn1)C,mutagenic
+Nc1ccc2c(-c3ccccc3C2)c1,mutagenic
+NCCCNCCCCN(N(N=O)O)CCCN,mutagenic
+[O-][N+](=O)c1ccc(cc1)/C=C/c1ccccc1,mutagenic
+ClC=C(C)C,mutagenic
+CC(=O)OCc1ccccc1N=Nc1ccc(cc1)N(C)C,mutagenic
+CCOCOCC,non-mutagenic
+OC[C@H]1O[C@@H](O[C@H]2CC[C@]3(C(=CC[C@H]4[C@H]3CC[C@]3([C@H]4C[C@@H]4[C@@H]3[C@H](C)[C@H]3N4C[C@@H](CC3)C)C)C2)C)[C@@H]([C@H]([C@@H]1O[C@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O[C@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)O)O)O)O,non-mutagenic
+C/C=C/C[C@H]([C@H]([C@H]1C(=O)N[C@@H](CC)C(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)O)C,non-mutagenic
+c1ccc(cc1)OP(Oc1ccccc1)Oc1ccccc1,non-mutagenic
+CCCCCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCC,non-mutagenic
+CC(=O)OC(c1ccc(o1)[N+](=O)[O-])OC(=O)C,mutagenic
+OCCN(C(C)(C)C)CCO,non-mutagenic
+BrCC1=C(Br)C(=O)OC1O,mutagenic
+COc1ccc(cc1)C(=O)ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+CCCC(c1cc(c(cc1C)O)C(C)(C)C)c1cc(c(cc1C)O)C(C)(C)C,non-mutagenic
+CCc1c2ccc3c(c2cc2c1cccc2)C1OC1C(C3O)O,mutagenic
+CCC1(C(=O)NCNC1=O)c1ccccc1,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)c2c([n+]1[O-])cccc2,mutagenic
+OC(=O)C1N2C(=O)CC2S(=O)(=O)C1(C)Cn1ccnn1,non-mutagenic
+O=NN1CCC[C@@H](C1)C,mutagenic
+CSCCC(C(=O)NC(C(=O)NC(C(=O)N)Cc1ccccc1)CC(=O)O)NC(=O)C(Cc1c[nH]c2c1cccc2)N,non-mutagenic
+CCOC(C)(C)C,non-mutagenic
+OCCN(c1nc(nc2c1cccc2)c1ccc(s1)[N+](=O)[O-])CCO,mutagenic
+ClC(=O)Cc1ccccc1,mutagenic
+CCC1(OCCc2c1[nH]c1c2cccc1C(O)C)CC(=O)O,non-mutagenic
+BrCC(=O)c1ccccc1,non-mutagenic
+Cc1ccc2c(c1)c(ccc2)[N+](=O)[O-],mutagenic
+ONc1ccccc1C,mutagenic
+COc1cc(/C=C/C(=O)O)ccc1O,non-mutagenic
+O=C1NC(=O)CN(C1)CC(N1CC(=O)NC(=O)C1)C,non-mutagenic
+Oc1cc2OC(Cc2c2c1c(=O)c1c(n2C)cccc1)C1(C)CO1,mutagenic
+O=C1C=C2c3c(C1=O)cccc3-c1c2cc2ccccc2c1,mutagenic
+C#CC1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O,non-mutagenic
+CCC(C)(C)C,non-mutagenic
+c1ccc2c(c1)c1ccc3c(c1cc2)ccc1c3cccc1,mutagenic
+[O-][N+](=O)c1cc2c(cccc2c2c1cccc2[N+](=O)[O-])[N+](=O)[O-],mutagenic
+OC[C@H](CN(C[C@H](O)C)N=O)O,mutagenic
+CC(COC(=O)c1ccccc1N)C,non-mutagenic
+COc1cccc(c1)C(=O)ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+CC1CCC2C(C3(C1C=CC3=O)C)OC(=O)C2=C,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)c2c(c1)cccc2,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2c(C)c(C)c2c1cccc2,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(c3c2cccc3)c(cc1)[N+](=O)[O-],mutagenic
+COC(=O)C(Cc1ccc(cc1)Cl)N,non-mutagenic
+c1ccc2-c3c([C@@H]4[C@H](c2c1)N4)c1ccccc1c1c3cccc1,mutagenic
+OCc1c(OC)cc2c(c1OC)C(=O)c1c(C2=O)cccc1,non-mutagenic
+Oc1ccc2c(c1)c1c(cc2)ccc2c1n(C)c(n2)C,mutagenic
+COc1ccc2c(c1)ccc(c2)CCC(=O)C,non-mutagenic
+CC(COS(=O)(=O)C)C,mutagenic
+[O-][N+](=O)c1cc(ccc1[N+](=O)[O-])C(=O)O,mutagenic
+CC(=O)N[C@H](C(=O)O)CS/C(=C(/C(=C(Cl)Cl)Cl)\Cl)/Cl,mutagenic
+Cc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+CN([N+](=O)[O-])C,mutagenic
+Nc1ccc(cc1Cl)Cc1ccc(c(c1)Cl)N,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2ccc2c1cc(cc2)O,mutagenic
+CCCCN(CC(OCc1ccccc1)CO)N=O,mutagenic
+Cc1ccc(cc1)NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)ccc1c2ccc2c1cccc2,mutagenic
+OC1=C(O)C(=O)C1=O,non-mutagenic
+ClCCN(c1ccc(cc1)CCCC(=O)O[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CCC(=O)N2)CCCl,mutagenic
+CC(=[N+]([O-])[O-])C,mutagenic
+Cc1ccc(cc1)S(=O)(=O)N1C2C1c1ccccc1-c1c2cccc1,mutagenic
+ONc1cc[n+](c2c1cccc2)[O-],mutagenic
+CC1=CC(=O)c2c(C1=O)c1-c(c([nH]2)C)c2c(n1)cccc2,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1c(cc2)cccc1[N+](=O)[O-],mutagenic
+CCOC(=O)C(c1ccc(cc1)Cl)(c1ccc(cc1)Cl)O,non-mutagenic
+[O-][N+](=O)c1cccc2c1nsc2C(C(=O)OCC)C#N,mutagenic
+OC(=O)C(NC(=O)COc1cc(Cl)c(cc1Cl)Cl)CC(=O)O,non-mutagenic
+ClCCN(CCCNc1c2ccccc2nc2c1ccc1c2cccc1)CC,mutagenic
+N#Cc1c(Cl)cccc1Cl,non-mutagenic
+[O-][N+](=O)c1cc2cccc3c2c2c1cccc2cc3,mutagenic
+O=NN1CCC[C@@H](C1)Cl,mutagenic
+Cn1c(N)nc2c1cc1ccccc1c2,mutagenic
+CC(=O)Nc1ccc2-c3c(-c4c2c1ccc4)ccc(c3)O,mutagenic
+CC(OC(=O)CC(=O)OC(C)C)C,non-mutagenic
+Oc1ncnc(c1)O,non-mutagenic
+Cc1ccccc1N=Nc1ccc(c(c1N)C)N,mutagenic
+NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+OCc1ccc(cc1)C(F)(F)F,non-mutagenic
+Clc1cc(Cl)c(c(c1)Cl)Cl,non-mutagenic
+Sc1[nH]cnc2-c1ncn2,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2c(C)cc2c1cccc2C,mutagenic
+Ic1cccc(c1)[N+](=O)[O-],non-mutagenic
+COC(=O)c1ccc(cc1)C(=O)OC,non-mutagenic
+NNc1nncc2c1cccn2,mutagenic
+O=C1c2cc(ccc2N=C1c1[nH]c2c(c1O)cc(cc2)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+NNc1ccccc1[N+](=O)[O-],mutagenic
+Cc1c(N)cccc1Cl,non-mutagenic
+CCCC(=O)C,non-mutagenic
+OCc1ccc2c(c1)c(C)c1c(n2)c2ccccc2cc1,mutagenic
+CC(=C)C1CCC2(C(C1)O2)C,non-mutagenic
+O=C(NCc1ccccc1)CCNNC(=O)c1ccncc1,mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c2c3c1c1ccccc1c1c3c(cc2)ccc1,mutagenic
+C/C=C/c1ccc2c(c1)OCO2,non-mutagenic
+c1ccc2c(-c3cc4C5NC5c5c(-c4cc3C3C2N3)cccc5)c1,mutagenic
+CC1=CC[C@H]2C[C@@H]1C2(C)C,non-mutagenic
+OC1C=Cc2c(C1O)c1cccnc1cc2,non-mutagenic
+Clc1cc(Cl)cc(c1[N+](=O)[O-])Cl,non-mutagenic
+O1CCOC2CCCCC2OCCOCCOC2C(OCC1)CCCC2,non-mutagenic
+CN1CCN=N1,mutagenic
+COCCCN,non-mutagenic
+Clc1ccc2c(n1)cccc2,non-mutagenic
+OC1C=CC2=C(C1O)c1cccc3c1c2ccc3,mutagenic
+CCCC(=O)Nc1snc2c1cccc2,non-mutagenic
+CC1=CC[C@H](CC1)C(=C)C,non-mutagenic
+O=C(C(=O)c1ccccc1)c1ccccc1,non-mutagenic
+Nc1cccc2-c3c4c(-c12)cccc4ccc3,mutagenic
+CC(=O)ON(C(=O)c1ccccc1)OCc1ccc(cc1)Cl,mutagenic
+OC(=O)COc1ccc2c(c1)cccc2,non-mutagenic
+C=COC(=O)C=C,non-mutagenic
+C1CCc2c(C1)cccc2,non-mutagenic
+C/C(=C\C=C\C=C(\C=C\C=C(\C=C\C1=C(C)CCCC1(C)C)/C)/C)/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C,mutagenic
+CCCCCCCCCCCCCN1CC(C)OC(C1)C,non-mutagenic
+Nc1ccc2c(c1)nccc2,mutagenic
+[O-][N+](=O)c1ccc(o1)/C(=N/O)/N,mutagenic
+c1cc2ccc3c4c2c(c1)c1cccc2c1c4c(cc3)cc2,mutagenic
+BrCc1ccc2-c3c4c(-c2c1)cccc4ccc3,mutagenic
+CCCBr,non-mutagenic
+O=C1NCCN1c1ncc(s1)[N+](=O)[O-],mutagenic
+Oc1ccc2c(c1N=Nc1ccc(cc1)S(=O)(=O)O)cccc2,non-mutagenic
+CCCC[C@H](COC(=O)c1ccccc1C(=O)OC[C@@H](CCCC)CC)CC,non-mutagenic
+NCCO,non-mutagenic
+CCCCCCCCCCCCCCCCN,non-mutagenic
+ONc1ccccc1c1ccccc1,mutagenic
+COc1cc2nc3cc(N)ccc3nc2cc1N,mutagenic
+Cc1cc2ccc3c4c2c(c1)ccc4cc1c3cccc1,mutagenic
+ONc1ncnc2c1ncn2Cc1ccccc1,mutagenic
+Nc1nc2c(s1)ccc1c2cccn1,mutagenic
+O=C(c1ccc(cc1)C(C)(C)C)ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2cc2ccc3c(c2n1)cccc3,non-mutagenic
+COc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1O)C,mutagenic
+CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCC,non-mutagenic
+Cc1ccc2c(c1)c1ccc3c(c1cc2)cccc3,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2nccc1,mutagenic
+OC/C(=C(\C(=O)O)/Cl)/C(Cl)Cl,mutagenic
+C1CN1c1nc(nc(n1)N1CC1)N1CC1,mutagenic
+O=C(N(c1ccccc1)C)c1csc(c1)[N+](=O)[O-],mutagenic
+CCCCCCC(=O)O,non-mutagenic
+[O-][N+](=O)c1cc(ccc1N=Nc1c(O)ccc2c1cccc2)[N+](=O)[O-],mutagenic
+OC1=C(O)c2nc3c(cc2C24C1(CCCC4)O2)ccc1c3cccc1,non-mutagenic
+OC1c2ccccc2Oc2c1cccc2,mutagenic
+CCN(c1ccc(c(c1)O)N=O)CC,non-mutagenic
+COc1nsc2c1cccc2[N+](=O)[O-],mutagenic
+CN1CCC=C2C1CCc1c2nc(s1)N,mutagenic
+C[C@]1(N)CC[C@H](CC1)C(N)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)cc2c1C=CCC2,mutagenic
+CC(CCCCCCCOC(=O)C(=C)C)C,non-mutagenic
+CN1CCC(=C2c3ccccc3C=Cc3c2cccc3)CC1,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)N)O,mutagenic
+CN(CCNC(=O)c1cccc2c1cc1ccccc1n2)C,mutagenic
+NC=O,non-mutagenic
+CCN(c1ccc(cc1)N=Nc1ccc(cc1Cl)[N+](=O)[O-])CC,mutagenic
+OC(=O)C1(N)CCCC1,non-mutagenic
+c1ccc2c(c1)cc1-c3cccc4c3c(-c1c2)ccc4,mutagenic
+O=c1c2cccc3c2c2c1cccc2cc3,mutagenic
+[O-][N+](=O)c1ccc2c(c1)NCC2,mutagenic
+COc1ccc(cc1)/C=N/n1nnc2-c(c1O)nc1c2cccc1,mutagenic
+C1CCCO1,non-mutagenic
+C=C1C(=O)OC2CCN3C2C(=CC3)COC(=O)C(C(C1C)C)(C)O,non-mutagenic
+OCCN(c1ccc(c(c1)C)N=Nc1ccc(cc1)N)CCO,non-mutagenic
+BrCC(=O)c1ccc(cc1)Br,non-mutagenic
+CCCC(=O)Nc1snc2c1cc(C)cc2,non-mutagenic
+OCCCCCCC/C=C/C=C/C,non-mutagenic
+BrC(C(Br)(C)C)COP(=O)(OCC(C(Br)(C)C)Br)OCC(C(Br)(C)C)Br,non-mutagenic
+OC(=O)/C=C/C(=O)CC(=O)C,non-mutagenic
+CCc1cc(Cc2cc(C)c(c(c2)CC)N)cc(c1N)C,non-mutagenic
+C=CCC1=C(C)[C@@H](CC1=O)OC(=O)[C@H]1[C@@H](C1(C)C)C=C(C)C,mutagenic
+Clc1ccccc1Cl,non-mutagenic
+O=C(N1CCCCC1)/C=C/C=C/c1ccc2c(c1)OCO2,non-mutagenic
+ClCC(=O)Nc1snc2c1cccc2,mutagenic
+ClCCN(C)C,mutagenic
+N#CCC#N,non-mutagenic
+[O-][N+](=O)c1ccc2-c3c(Cc2c1)cccc3O,mutagenic
+ON(C(=O)c1ccccc1)c1ccc2-c3c(Cc2c1)cccc3,mutagenic
+OCCOCCO,non-mutagenic
+CCCCNC(=O)NS(=O)(=O)c1ccc(cc1)C,non-mutagenic
+Fc1ccccc1,mutagenic
+CC12CCC(C2(C)C)CC1(C)O,non-mutagenic
+Cc1cnc2c(n1)c1nc(n(c1cc2)C)NS(=O)(=O)O,non-mutagenic
+C=CC(=O)OCCOCCOC(=O)C=C,non-mutagenic
+OCCCc1ccccc1,non-mutagenic
+OCc1ccc2-c3c(-c4c2c1ccc4)cccc3,non-mutagenic
+CCC(C1NC(=O)C(=C1O)C(=O)C)C,non-mutagenic
+Cc1cc2cccc3c2c2c1c1ccccc1cc2cc3,mutagenic
+CCCN(C(=O)SCC)CCC,non-mutagenic
+O=NN(C(=O)N)C,mutagenic
+C=CC(=O)N(C[C@@H]1OC1)C[C@@H]1OC1,mutagenic
+C[C@@H]1CNC[C@H](O1)C,mutagenic
+N#Cc1ccccc1,non-mutagenic
+Cc1ccc(cc1)c1nc2n(c1[N+](=O)[O-])CCS2,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1cccc(c1cc2[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Nc1ccc(cc1)O,non-mutagenic
+ClCc1ccc(cc1)Cl,non-mutagenic
+CC(NC(=O)c1cccnc1)CNC(=O)c1cccnc1,non-mutagenic
+CC[C@@H](NCCN[C@@H](CO)CC)CO,non-mutagenic
+Nc1cc(N)c(cc1N=Nc1ccccc1C)C,mutagenic
+CCCCCCCCCCCCCCCCCC[N+](Cc1ccccc1)(C)C,non-mutagenic
+[O-][n+]1cccc(c1)C1CCC(=O)N1C,non-mutagenic
+NC(=N)C(N=NC(C(=N)N)(C)C)(C)C,mutagenic
+Clc1cnn(c(=O)c1Cl)C(=O)c1ccccc1,non-mutagenic
+O=C/C=C/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc(c2c1cccc2)C,mutagenic
+C=CCc1ccc(c(c1)OC)OC,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c(N)c1c(n2)cccc1,mutagenic
+c1ccc2-c3c(Cc2c1)cccc3,non-mutagenic
+COc1cc(OC)c2c(c1)c1c3OCOc3cc(c1c(c2)[N+](=O)[O-])C(=O)O,non-mutagenic
+Oc1nc(Cl)nc(n1)Cl,non-mutagenic
+C=C1C2CCC3C(C1O)(C2)CCC1C3(C)CCCC1(C)C(=O)O,non-mutagenic
+OC1COC(=C(C1=O)O)C,mutagenic
+Cc1ccc(c(c1)N)C,mutagenic
+Nc1ccc2c(c1)[o+]c1c(c2c2ccccc2C(=O)O)ccc(c1)N,non-mutagenic
+ClCCNCCCNc1c2ccccc2nc2c1cccc2,mutagenic
+Clc1cnn(c(=O)c1Cl)S(=O)(=O)c1ccccc1,non-mutagenic
+CSCC(C(=O)O)NC(=O)C(SC)(C)C,non-mutagenic
+O[C@H]1[C@H](O)C=Cc2c1ccc1c2cc2c3c1CCc3c(cc2)C,mutagenic
+COC1C(N)CC(OC1C)OC1CC(O)(Cc2c1c(O)c1c(c2O)C(=O)c2c(C1=O)c(OC)ccc2)C(=O)CO,mutagenic
+CC(=O)O[C@@H]1C(=O)[C@]2(C)[C@@H](O)C[C@@H]3[C@]([C@H]2[C@@H]([C@@]2(C(C1=C(C)[C@@H](OC(=O)[C@@H]([C@H](c1ccccc1)NC(=O)c1ccccc1)O)C2)(C)C)O)OC(=O)c1ccccc1)(CO3)OC(=O)C,non-mutagenic
+CC(Oc1ccc2c(c1)occ(c2=O)c1ccccc1)C,non-mutagenic
+CCC(OS(=O)(=O)C)C,mutagenic
+ClSC(Cl)(Cl)Cl,mutagenic
+n1ccc(cc1)c1ccccn1,mutagenic
+O=C(c1ccccc1)OOC(=O)c1ccccc1,non-mutagenic
+O=Cc1cccc(c1)[N+](=O)[O-],mutagenic
+Cc1ccc(cc1)C(C)(C)C,non-mutagenic
+O=C(Nc1n(C)nc(c1C(=O)c1ccccc1F)C)CNCCCN1CCCC[C@H]1C,mutagenic
+COc1c(OC)cc2c(-c3ccc(c(=O)cc3[C@@H](CC2)NC(=O)C)OC)c1OC,non-mutagenic
+COc1ccc2-c3c(OC)c(OC)cc4c3c(C(=O)c2c1)ncc4,mutagenic
+BrCC1CN(C)C2C(C1)c1cccc3c1c(C2)c[nH]3,mutagenic
+[O-][N+](=O)c1ccc2-c3c(-c4c2c1ccc4)cc1c(c3)cccc1,mutagenic
+N#N=Nc1ccc2c(c1)c(Nc1ccc(cc1OC)NS(=O)(=O)C)c1c(n2)cccc1,mutagenic
+C[C@H](c1cc2ccc3c4c2c(c1)ccc4ccc3)O,mutagenic
+OCCn1c(=O)n(CCO)c(=O)n(c1=O)CCO,non-mutagenic
+CC(=O)CCl,non-mutagenic
+O=C(Nc1ccc(c(c1)Cl)Cl)Nc1ccc(cc1)Cl,non-mutagenic
+Cc1cccc(c1)[N+](=O)[O-],non-mutagenic
+CN(CCC=C1c2ccccc2CCc2c1cccc2)C,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)nc1c(n2)c(ccc1)[N+](=O)[O-],mutagenic
+BrCC1=C(Br)C(=O)OC1,mutagenic
+ONc1cnc2c(c1)nc1n2cccc1,mutagenic
+Nc1scc(n1)c1ccc(o1)[N+](=O)[O-],mutagenic
+CC(C#N)C=C,non-mutagenic
+O=C1c2ccccc2C(=O)c2c1ccc(c2O)O,mutagenic
+O=C(N[C@H](C(=O)NCC(=O)O)CSC(=C(Cl)Cl)Cl)CC[C@@H](C(=O)O)N,mutagenic
+Nc1cccc2c1c1ccccc1cc2,non-mutagenic
+Oc1ccc(c2c1cccc2)N=Nc1ccc(cc1)S(=O)(=O)O,non-mutagenic
+CO[C@H]([C@@](C(O)(C)C)(C(=O)OCC1=CCN2[C@H]1[C@H](CC2)OC(=O)/C(=C\C)/C)O)C,mutagenic
+[O-][N+](=O)c1ccc2c3c1cccc3c1c3c2cccc3ccc1[N+](=O)[O-],mutagenic
+O=C(OC(C)(C)C)N/N=C/C1=CN(O)c2c(N1O)cccc2,mutagenic
+Cc1cc(Cc2cc(C)cc(c2O)C(C)(C)C)c(c(c1)C(C)(C)C)O,non-mutagenic
+O/N=C(/c1ccc(c(c1)O)O)\N,mutagenic
+O=C1c2ccccc2C(=O)c2c1ccc1c2nc2c(n1)c1c(cc2)c(O)c2c(c1O)cccc2,non-mutagenic
+CC(=O)Nc1ccc(c(c1)N)C,mutagenic
+c1cnc2c(c1)CCC1C2O1,non-mutagenic
+CCOP(=S)(OCC(C)C)SCCl,non-mutagenic
+OC(=O)CNCP(=O)(O)O,non-mutagenic
+C(C1OC1)Cc1ccccc1,mutagenic
+OC(=O)c1ccc(cc1)C,non-mutagenic
+NC1CC(OC(C1O)C)OC1CC(O)(Cc2c1c(O)c1c(c2O)C(=O)c2c(C1=O)c(O)ccc2)C(=O)C,mutagenic
+ClCCC(CBr)Br,non-mutagenic
+OCC1OC(OC23CCC4C(C2)(CC3=C)CCC2C4(C)CCCC2(C)C(=O)OC2OC(CO)C(C(C2O)O)O)C(C(C1O)O)OC1OC(C)C(C(C1O)O)O,non-mutagenic
+COC(=O)/C(=C/c1ccc(o1)Br)/[N+](=O)[O-],non-mutagenic
+CCOc1ccc(cc1)N=O,mutagenic
+O/N=C/C1N(CCN(C)C)C=CN1C,non-mutagenic
+ClC[C@@H](CBr)Cl,mutagenic
+CC(c1ccccc1)Br,non-mutagenic
+O=Cc1ccccc1Cl,non-mutagenic
+CCCCCCCCCCCCN(N=O)C,mutagenic
+CCCCCCC(COc1ccc(cc1)c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)OCC(CCCCCC)CCCC)CCCC,non-mutagenic
+Nc1ccc(c(c1)[N+](=O)[O-])C,mutagenic
+ClC[C@H]1CO1,mutagenic
+CCN(c1ccc2c(c1)oc1-c(c2c2ccccc2C(=O)O)ccc(=[N+](CC)CC)c1)CC,non-mutagenic
+COCC1OC(=O)N(C1)c1ccc2c(c1)sc(n2)C(CCC#N)O,non-mutagenic
+COC(=O)C(=C)Cl,mutagenic
+CNC(=O)ON(C(=O)NC)C(=O)NC,non-mutagenic
+COc1c2cc(OC)cc(c2c(c2c1cc(C)oc2=O)O)O,mutagenic
+ON1C(C)(C)CCCC1(C)C,non-mutagenic
+c1cnc2c(c1)c1CCC3C(c1cc2)O3,non-mutagenic
+Nc1ccc2c(c1)ccc1c2ccc2c1cccc2,mutagenic
+CCCCOCCO,non-mutagenic
+CCOC(=O)C(=NNc1ccc(cc1OC)c1ccc(c(c1)OC)NN=C(C(=O)OCC)C(=O)OCC)C(=O)OCC,non-mutagenic
+Oc1ccc2c(c1N=Nc1ccc3c(c1S(=O)(=O)O)cccc3)cccc2,non-mutagenic
+OC(=O)c1cccc2c1nccc2,non-mutagenic
+COc1ccc2c(c1OC)nc1c(c2OC)CCO1,mutagenic
+O=Cc1c(O)c(O)c(c2c1c(O)c(c(c2)C)c1c(C)cc2c(c1O)c(C=O)c(c(c2C(C)C)O)O)C(C)C,non-mutagenic
+CCN(c1ccc2c(c1)oc(=O)cc2C(F)(F)F)CC,non-mutagenic
+CC(=O)Nc1ccc2-c3c(-c4c2c1ccc4)cc(cc3)O,mutagenic
+Clc1ccc(cc1)c1nc2n(c1[N+](=O)[O-])CCS2,mutagenic
+Nc1scc(n1)c1ccc(s1)[N+](=O)[O-],mutagenic
+O=c1ccc2c(o1)cc1c(c2)cco1,non-mutagenic
+COC(=O)c1oc(c(c1Cl)Cl)[N+](=O)[O-],mutagenic
+Clc1ccc(cc1)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+COC(=O)[C@@]12O[C@@]2(C)[C@@](OC1=O)(C)O,mutagenic
+CCCCN(N=O)CCCC,mutagenic
+COc1cc(O)c2c(c1OC)oc1c(c2=O)c(OC)cc2c1C1CCOC1O2,non-mutagenic
+COCCOC1(COCCOC(=O)CCCCCCC/C=C/CCCCCCCC)OCC(C1OCCOC)OCCOC,non-mutagenic
+CN(c1ccc(cc1)Cc1ccc(cc1)N(C)C)C,mutagenic
+[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])Br,mutagenic
+COc1cc(Oc2ccc(cc2Cl)Cl)cc(c1)[N+](=O)[O-],non-mutagenic
+Nc1ccccc1c1ccccc1,mutagenic
+CCc1ccc(cc1)C,non-mutagenic
+Oc1cccc2c1c(cc1c2c2c([nH]1)ccc1c2cccc1)[N+](=O)[O-],mutagenic
+Fc1ccc2c(c1)c1ncccc1cc2,mutagenic
+OC1C=Cc2c(C1O)ccc1c2ccc2c1CCC2,mutagenic
+[O-][N+](=O)c1cc(ccc1c1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+C#CCc1ccc(o1)COC(=O)[C@H]1[C@@H](C1(C)C)C=C(C)C,mutagenic
+N#N=NCC(Cn1cnc2c1nc(N)nc2Cl)O,mutagenic
+Oc1cc(O)c2c(n1)cccc2,mutagenic
+O=C(Nc1ccccc1)Nc1ccccc1,non-mutagenic
+Cc1ccc2c(c1)nc(n2C)N,mutagenic
+CCOC(=O)[C@@H]1O[C@H]1c1ccccc1,non-mutagenic
+OC(=O)CBr,mutagenic
+Clc1cc(cc(c1)Cl)NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+OCCC#N,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1cccc(c1cc2)[N+](=O)[O-],mutagenic
+CN(C(=O)Cl)C,mutagenic
+ClCCN(c1ccc(cc1)c1[nH]c2c(n1)cc(cc2)c1nc2c([nH]1)ccc(c2)N1CCN(CC1)C)CCCl,non-mutagenic
+Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl,non-mutagenic
+CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F,mutagenic
+[O-][n+]1ncc2c(c1)cccc2,non-mutagenic
+CCC(C(=O)NC(=O)N)(CC)Br,non-mutagenic
+CCOC(=O)CSc1ccc2-c3ccccc3C(=O)c3c2c1ccc3,mutagenic
+CC(=O)Nc1ccc(cc1)[C@H]1O[C@H]1C(=O)c1ccccc1,mutagenic
+OCCCN(N=O)CC,mutagenic
+Nc1ccn(c(=O)n1)CC(CN=N#N)O,mutagenic
+C=Cc1ccc(cc1)C,non-mutagenic
+O=CC1=C2CC(CC2C(C2(C1(C=O)C2)C)OC(=O)C)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)ccc1c2ccc2c1cccc2,mutagenic
+Nc1ccc2c(c1)nc1c(n2)ccc(c1)N,mutagenic
+Cc1ccc2-c3c([C@H](c2c1)C)cccc3,mutagenic
+Nc1ccc(c(c1)[N+](=O)[O-])Cc1ccc(cc1[N+](=O)[O-])N,mutagenic
+COc1ccc2c(c1)c(CC(=O)O)c(n2C(=O)c1ccc(cc1)Cl)C,non-mutagenic
+[O-][N+](=O)c1ccc2-c3ccc(cc3CCc2c1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc2c(c1)c(Cn1cncc1)c(n2Cc1ccccc1)C,mutagenic
+O=C(c1csc(c1)[N+](=O)[O-])Nc1cccc(c1)[N+](=O)[O-],mutagenic
+OCCCBr,mutagenic
+CCCOC(=O)C(=C)C,non-mutagenic
+Oc1cccc2c1ccc1c2cc2c(n1)ccc1c2cccc1,non-mutagenic
+CCCC[C@H](COP(OC[C@@H](CCCC)CC)OC[C@@H](CCCC)CC)CC,non-mutagenic
+[O-][N+](=O)c1cc2CCc3c4c2c(c1)ccc4cc(c3)[N+](=O)[O-],mutagenic
+CCC(c1ccc(cc1)O)(C)C,non-mutagenic
+ClC(=C(Cl)Cl)Cl,non-mutagenic
+OC(=O)C(Cn1cncc1)N,mutagenic
+CC(c1ccc(cc1)OP(=O)(Oc1ccccc1)Oc1ccccc1)C,non-mutagenic
+c1ccc2c(c1)c1ccc3c4c1c(c2)C1OC1c4ccc3,mutagenic
+Cc1c2ccccc2cc2c1cccc2,mutagenic
+CCCCOC(=O)CCCCCCCCC(=O)OCCCC,non-mutagenic
+O=C(NC(C(=O)O)C)COc1ccc(cc1Cl)Cl,non-mutagenic
+C1Cc2ccc3c4c2c(C1)cc1c4c2c(c3)CCCc2cc1,mutagenic
+CCCCCCCC(=O)CCc1ccc(c(c1)OC)O,non-mutagenic
+[O-][N+](=O)c1cnc(s1)NC(=O)NCCCl,mutagenic
+CCCCOC(=O)c1ccccc1C(=O)OC1CCCCC1,non-mutagenic
+CCc1[nH]c2c(n1)c1c(cc2)ccc2c1cc(O)cc2,mutagenic
+ClC(=O)c1ccccc1C(=O)Cl,mutagenic
+CCc1cccc2c1nccc2,mutagenic
+O=C(N(C)C)Nc1ccc(c(c1)Cl)Cl,mutagenic non-mutagenic
+Nc1ccc(c(c1)Cl)C,mutagenic
+[O-][N+](=O)c1ccc2c3c1cccc3CC2,mutagenic
+Nc1ccc2c(c1)nc1c(c2)ccc(c1)N,mutagenic
+CC(=O)NC1=NC(=NOC1)c1ccc(o1)[N+](=O)[O-],mutagenic
+COc1c2cccc(c2nc2c1cco2)O,mutagenic
+OC1C=CC=CC1O,mutagenic
+Oc1ccc(cc1)C(c1ccccc1)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)c2c(n1)cccc2,mutagenic
+Ic1cc(Cl)c2c(c1O)nccc2,non-mutagenic
+Fc1cccc(n1)F,non-mutagenic
+Oc1ccc2c(c1)[nH]c1c2ccnc1C,mutagenic
+Oc1ccc(c(c1)C)Cl,non-mutagenic
+CCCCN(CC(=O)CC)N=O,mutagenic
+Oc1ccc(cc1)c1ccc(cc1)O,non-mutagenic
+c1ccc(cc1)c1ccccc1OCC1CO1,mutagenic
+COc1c(C/C=C(/CCC(=O)O)\C)c(O)c2c(c1C)COC2=O,mutagenic non-mutagenic
+OCc1ccc(cc1)Br,non-mutagenic
+OCCN(c1ccc(cc1)N=Nc1cccnc1)CCO,non-mutagenic
+ClCCSCC(C(=O)NCC(=O)OC)NC(=O)CCC(C(=O)O)N,mutagenic
+Nc1ccc2c(c1)[n+](C)c1c(c2)ccc(c1)N,mutagenic
+Oc1ccc2c(c1)c1c(cc2)ccc2c1oc(n2)C,mutagenic
+[O-][N+](=O)c1ccc2c(c1)nc1c(n2)cc(cc1)[N+](=O)[O-],mutagenic
+O=Nc1ccc(cc1)Sc1ccccc1,mutagenic
+c1ccc2c(c1)cc1c(c2)cc2c(c1)cccc2,mutagenic
+OCC(CO)(CO)CO,non-mutagenic
+CC(=O)OC1C(OC2OC(C)C(C(C2O)OC(=O)C)O)C(OC(=O)C2CCC3C(C2)OC2(C43CO4)OCC(C(C2)OC(=O)/C=C/c2ccccc2)C)OC(C1O)C,non-mutagenic
+CC(CC(O)C)C,non-mutagenic
+Cc1cc(C)c(c(c1)C)CN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+Cc1cc([N+](=O)[O-])c(c2c1n(C)c1c2cccc1)C,mutagenic
+COc1cc2c(cc1OC)nc1c(c2OC)cco1,mutagenic
+CCCOO,mutagenic
+COc1c(OCC2OC2(C)C)ccc2c1nc1occc1c2OC,non-mutagenic
+OCCCCN(N=O)C,mutagenic
+CN(CCNC(=O)c1cccn2c1nc1ccccc1c2=O)C,mutagenic
+[O-][N+](=O)c1cc2c(O)cccc2c2c1c(cc1c2OCO1)C(=O)O,mutagenic
+Cc1ccc(c(c1)O)C(C)C,non-mutagenic
+CN1CC(CC2C1Cc1c[nH]c3c1c2ccc3)C(=O)NC1(OC2(N(C1=O)C(Cc1ccccc1)C(=O)N1C2CCC1)O)C(C)C,non-mutagenic
+CNc1ccc(cc1)N=Nc1ccc2c(c1)scn2,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C/C(=O)OCCCCC,mutagenic
+NNc1nncc2c1cccc2,mutagenic
+ClCCOC(=O)C=C,mutagenic
+Cc1nccnc1C,non-mutagenic
+CNc1ccccc1N,mutagenic
+[O-][N+](=O)c1ccc2-c3ccc4c(c3CCc2c1)CCCC4,mutagenic
+BrCCOC(=O)C(CC(=O)OCCBr)(CC(=O)OCCBr)O,mutagenic
+ClCCN[P@]1(=O)OCCCN1CCCl,mutagenic
+CCOC(=O)CNC(=O)CBr,non-mutagenic
+Cc1c(C)cccc1O,non-mutagenic
+CC[C@@H](CN)O,non-mutagenic
+Clc1ccc(cc1)CC1OC1,mutagenic
+COC(=O)CC(=O)C,non-mutagenic
+CCN1CCN=N1,mutagenic
+N#[N+]c1cccc2c1C(=O)c1c(C2=O)cccc1,mutagenic
+c1ccc2-c3c4c(-c2c1)cc1cccc2c1c4c(cc3)C1C2O1,mutagenic
+OC(=O)CCCOc1ccc(cc1Cl)Cl,non-mutagenic
+CC(CCCC1(C)CCc2c(O1)c(C)c(c(c2C)O)C)CCCC(CCCC(C)C)C,non-mutagenic
+CC(=O)CCC1C2C1(C)CC1C(C2)C(=C)C(=O)O1,non-mutagenic
+CN(CCN(c1ccccn1)Cc1ccc(s1)Cl)C,non-mutagenic
+CC([N+](=O)[O-])(Cl)C,mutagenic
+O=C(c1ccccc1)OCc1ccc(cc1)[N+](=O)[O-],mutagenic
+CCCCC/C=C/C(=O)CCc1ccc(c(c1)OC)O,mutagenic
+Nc1ccc(cc1)S(=O)(=O)N,non-mutagenic
+Nc1ccccn1,non-mutagenic
+CCc1cccc(c1N)C,mutagenic
+OC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+COc1cc2OC3C(c2c2c1c1CCC(=O)c1c(=O)o2)(O)C=CO3,mutagenic
+ClCCN(CCCNc1c2ccccc2nc2c1cccc2OC)CC,mutagenic
+CCN(c1ccccc1)N=O,non-mutagenic
+O=Cc1ccc(cc1)N=Nc1ccc(cc1)N(C)C,mutagenic
+ClCCSCC(NC(=O)CC(=O)O)NC(=O)CCC(C(=O)O)N,mutagenic
+NC(=N)c1ccc(cc1)c1cc2c([nH]1)cc(cc2)C(=N)N,non-mutagenic
+Oc1ccc(cc1Sc1cc(Cl)ccc1O)Cl,non-mutagenic
+CC(=O)OCc1ccc(cc1)N=Nc1ccc(cc1)N(C)C,mutagenic
+CC(=O)Nc1ccc2c(c1)c1c(C)c3cnccc3c(c1[nH]2)C,non-mutagenic
+CC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)C,mutagenic
+CC(=O)OC1(CCC2C1(C)CCC1C2C2CC2(C2=CC(=O)C3C(C12C)C3)Cl)C(=O)C,non-mutagenic
+OS(=O)(=O)OCc1cc2ccccc2c2c1c1ccccc1cc2,mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)c1ccc2c(c1O)C(=O)c1c(C2=O)cccc1,mutagenic
+COc1ccc(cc1)CON(C(=O)c1ccccc1)OC(=O)C,mutagenic
+CC(CCCCCCOC(=O)CCCCC(=O)OCCCCCCC(C)C)C,non-mutagenic
+Nc1ccc2c(c1)scn2,mutagenic
+CCOP(=O)(Oc1ccc(cc1)[N+](=O)[O-])OCC,mutagenic
+OCc1cccc2-c3c4c(-c12)cccc4ccc3,non-mutagenic
+O=NN(C(=O)N)CCCC(=O)O,mutagenic
+c1ccc2c(c1)snc2,non-mutagenic
+O=CN(c1ccc(cc1)/C=C/c1ccccc1)O,mutagenic
+CN1CC[C@H](C1)CN1c2ccccc2Sc2c1cccc2,non-mutagenic
+Oc1c2ccccc2c2c3c1ccc1c3c(cc2)ccc1,mutagenic
+CCCCN(CC(=O)C)N=O,mutagenic
+NCC(=O)O,non-mutagenic
+CCCCCCCCCCCC(=O)C,non-mutagenic
+OC1C(O)C=Cc2c1ccc1c2cc2c(c1)c1C=CC(C(c1cc2)O)O,non-mutagenic
+COC(=O)/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C)\C)/C)/C,non-mutagenic
+Nc1nc2c(n1C)c(C)cc1c2nccn1,mutagenic
+O=C1CC(=NN1c1ccccc1)C,non-mutagenic
+CN1CCN(CC1)c1c(F)c(C(=O)O)c2c3c1OC[C@H](n3ccc2=O)C,mutagenic
+C#CC1(CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C)OC(=O)C,non-mutagenic
+O=C1CCc2c1c1ccc3c(c1cc2)cccc3,mutagenic
+CN(CCNC(=O)c1cc2ccccc2c2c1nccc2)C,mutagenic
+Nc1ccc(c(c1)N=[N+](c1cc(N)ccc1C)[O-])C,mutagenic
+C1CCC=CC1,non-mutagenic
+O=C(C1(C)OC1)NCc1ccccc1,mutagenic
+Fc1ccc2-c3c(-c4c2c1ccc4)ccc1c3cccc1,mutagenic
+O=C(Nc1ccc(cc1)C)CC(=O)C,non-mutagenic
+COC(=O)C12Oc3ccc(c(c3C(=C2C(=O)CC(C1O)C)O)O)c1ccc2c(c1O)C(=C1C(O2)(C(=O)OC)C(O)C(CC1=O)C)O,non-mutagenic
+C[C@H]1C[C@@H](OC(=O)c2ccccc2O)CC(C1)(C)C,non-mutagenic
+C=CCOC(=O)C=C,non-mutagenic
+ClC(=O)c1ccccc1F,mutagenic
+C=CCn1c(=O)n(CC=C)c(=O)n(c1=O)CC=C,non-mutagenic
+Nc1ccc2c(n1)no[n+]2[O-],mutagenic
+Fc1ccc(cc1)Cn1c(/C=N/OCc2cccc(c2)[N+](=O)[O-])nc2c1ccc(c2)[N+](=O)[O-],non-mutagenic
+Cc1ccc2c(c1)cc1-c3cccc4c3c(-c1n2)ccc4,non-mutagenic
+CCC[C@](COC(=O)N)(COC(=O)NC(C)C)C,non-mutagenic
+CC(Nc1cccc2c1C(=O)c1ccccc1C2=O)C,mutagenic
+O=CN(C)C,non-mutagenic
+S=C=Nc1ccc(cc1)Nc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+Oc1cc2ccc(c3c2c2c1cccc2cc3)[N+](=O)[O-],mutagenic
+COC(=O)c1oc(c(c1c1ccccc1)c1ccccc1)NOC(=O)C,non-mutagenic
+CCN(N=O)C=O,mutagenic
+ClN(S(=O)(=O)c1ccc(cc1)C(=O)O)Cl,mutagenic
+O=c1oc2cc(ccc2cc1c1ccccc1)n1nc2c(n1)c1ccccc1cc2,non-mutagenic
+O=C(NC(C(=O)O)Cc1c[nH]c2c1cccc2)COc1ccc(cc1Cl)Cl,non-mutagenic
+CC(=C)c1ccccc1,non-mutagenic
+OC(=O)Cn1c(C)ncc1[N+](=O)[O-],mutagenic
+CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1,non-mutagenic
+CCCCOC(=O)C(=C)C,non-mutagenic
+COc1cc2OC3C(c2c2c1c1CCOC(=O)c1c(=O)o2)CCO3,non-mutagenic
+O=C1C=CC(=O)C(=C1)C,non-mutagenic
+ClC(C1=C(Cl)C(=O)O[C@H]1O)Cl,mutagenic
+C/C=C/1\CC(C)C(C)(O)C(=O)OCC2=CCN3C2C(OC1=O)CC3,non-mutagenic
+OC1CC2C(C1(C)CC2)(C)C,non-mutagenic
+Cc1cc2c(NC(=O)CCl)snc2cc1,mutagenic
+ClCCN(c1ccc(cc1)c1[nH]c2c(n1)cc(cc2)c1nc2c([nH]1)ccc(c2)N1CCN(CC1)C)CC,non-mutagenic
+COc1cc2OC3(C(c2c2c1c1CCC(=O)c1c(=O)o2)(C)C1C(O3)O1)C,non-mutagenic
+CCCC[C@H](COC(=O)c1cc(ccc1C(=O)OC[C@@H](CCCC)CC)C(=O)OC[C@@H](CCCC)CC)CC,non-mutagenic
+O=C1c2ccccc2-c2c3c1cccc3c(cc2)Oc1ccc(cc1)S(=O)(=O)O,mutagenic
+COc1c(OC)c2occc2c2c1ccc(=O)o2,non-mutagenic
+OCC1OC(OC2C(OC(C(C2O)O)C(=O)O)OC2CCC3(C(C2(C)CO)CCC2(C3CC=C3C2(C)CCC2(C3CC(C)(C)CC2O)C)C)C)C(C(C1O)O)OC1OC(C)C(C(C1O)O)O,non-mutagenic
+N#C[Se]Cc1ccccc1,mutagenic
+C=COc1ccc(cc1)[N+](=O)[O-],mutagenic
+CCC(=O)N(c1ccc2c(c1)cccc2)O,mutagenic
+COC=O,non-mutagenic
+Nc1ccc(cc1)c1[n+](C)c2cc(N)ccc2c2c1cc(N)cc2,mutagenic
+[O-][N+](=O)c1ccc2c(c1)cns2,mutagenic
+CCOC(=O)[C@@H](O)C,non-mutagenic
+COc1cc2O[C@@H]3[C@H](c2c2c1c1CCC(=O)c1c(=O)o2)C=CO3,mutagenic
+NC(=O)NCC=C,mutagenic
+CCCCCCCCCc1ccc(cc1)OP(=O)(Oc1ccccc1)Oc1ccccc1,non-mutagenic
+ClC(c1ccccc1)Cl,mutagenic
+c1ccc2c(c1)c(CCC1CO1)ccc2,mutagenic
+O=NN1CCC(=O)CC1,mutagenic
+Cc1ccnc2c1cccc2,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)nc2c1cccc2,mutagenic
+NC(=N)c1ccc(cc1)OCCCCCOc1ccc(cc1)C(=N)N,non-mutagenic
+CCOC(=O)c1ccccc1c1c2-c(oc3c1cc(C)c(c3)NCC)cc(=NCC)c(c2)C,non-mutagenic
+C[N+]1(C)CCOCC1,non-mutagenic
+CC[N+](=C1C=CC(=C(c2ccccc2S(=O)(=O)O)c2ccc(cc2)N(Cc2cccc(c2)S(=O)(=O)O)CC)C=C1)Cc1cccc(c1)S(=O)(=O)O,mutagenic
+OCC=O,non-mutagenic
+O[C@@H]1[C@H]2O[C@H]2c2c([C@@H]1O)c1ccc3c4c1c(c2)ccc4ccc3,mutagenic
+OC[C@H]1O[C@@H](ON(c2ccc(cc2)Oc2ccc(cc2)Cl)C(=O)C)[C@@H]([C@H]([C@@H]1O)O)O,mutagenic
+[O-][N+](=O)c1cc(C)c2c(c1)cccc2,mutagenic
+O=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C)\C)/C)/C,non-mutagenic
+O=c1c2ccc(c3c2c2c(c1=O)cccc2cc3)[N+](=O)[O-],mutagenic
+O=C(NCCC(CC(CNC(=O)OCCOC(=O)C(=C)C)(C)C)C)OCCOC(=O)C(=C)C,non-mutagenic
+CC(C(=O)O)Cl,non-mutagenic
+CC(=C)C(=O)OCC(C)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(c3c2CCCC3)ccc1,mutagenic
+COc1nc2cc(cc(c2nc1OC)CBr)[N+](=O)[O-],mutagenic
+C/C=C\1/CC(C)C(C)(OC(=O)C)C(=O)OCC2=CCN(CCC(OC1=O)C2=O)C,mutagenic
+CC1(OC1)c1ccc(cc1)Cl,mutagenic
+C/C=C(/C(=C/C)/c1ccc(cc1)O)\c1ccc(cc1)O,non-mutagenic
+O=C1c2cc(cc(c2-c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+CCCC[C@H](CNC[C@@H](CCCC)CC)CC,non-mutagenic
+CCOC(=O)[C@@H]1O[C@]1(C)c1ccccc1,non-mutagenic
+CC(=O)C1=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C,non-mutagenic
+[O-][N+](=O)c1cc2ccc3c4c2c(c1O)ccc4ccc3,mutagenic
+CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCO,non-mutagenic
+CC(Cc1nccs1)C,mutagenic
+[O-][N+](=O)c1cc2c(snc2cc1)C(C(=O)OCC)(C#N)C,mutagenic
+BrCC(=O)Nc1ccccc1,non-mutagenic
+Nc1[nH]cc2-c(n1)ncn2,non-mutagenic
+OC(COC(=O)C(=C)C)COc1ccc(cc1)C(c1ccc(cc1)OCC(COC(=O)C(=C)C)O)(C)C,non-mutagenic
+COc1ccc(cc1)Nc1c2ccccc2nc2c1cccc2,mutagenic
+OCC(=O)N(c1ccc(cc1)Cl)O,non-mutagenic
+O=C/C=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+NC(C(=O)O)CSCCCl,mutagenic
+Nc1ccc2c3c1ccc1c3c(cc2)c2c(c1)cccc2,mutagenic
+OC1c2ccccc2-c2c(C1O)c(C)c1c(c2)cccc1,mutagenic
+CCOCC=O,non-mutagenic
+Br/C=C/Br,mutagenic
+Brc1cccc(c1)c1ccccc1,non-mutagenic
+c1cc2ccc3c4c2c(c1)ccc4cc1c3[C@@H]2O[C@@H]2C=C1,mutagenic
+[O-][N+](=O)O[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2O,non-mutagenic
+O=C/C=C/c1ccc(cc1)[N+](=O)[O-],mutagenic
+O=Nc1c(nc2n1ccs2)c1ccc(cc1)[N+](=O)[O-],mutagenic
+ClC/C=C\Cl,mutagenic
+S=c1ssc(c1C)c1cnccn1,non-mutagenic
+N#N=Nc1nc2c(n1C)c1cccnc1cc2,mutagenic
+COC1=CC(=O)C[C@H]([C@@]21Oc1c(C2=O)c(OC)cc(c1Cl)OC)C,non-mutagenic
+[O-][N+](=O)c1cc2cc(cc(c2c(c1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+CCC[C@H](C[C@H]([C@H](OC(=O)C[C@H](C(=O)O)CC(=O)O)C[C@@H](CCCCCC[C@@H](C[C@@H]([C@H](N)C)O)O)C)OC(=O)C[C@H](C(=O)O)CC(=O)O)C,non-mutagenic
+CCC(COC(=O)CCCCC(=O)O)CCC(=O)C,non-mutagenic
+OC(=O)CC(C(=O)O)N,non-mutagenic
+BrCCCBr,non-mutagenic
+CC(=O)C=C,mutagenic
+O=C1CC=C(O1)C,non-mutagenic
+NNc1scc(n1)c1ccc(cc1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc(c(c1)N)C,mutagenic
+OCC(C(=O)O)N,non-mutagenic
+OCC(=O)O,non-mutagenic
+COc1cc(ccc1N=Nc1cc(c2c(c1O)cccc2)S(=O)(=O)O)c1ccc(c(c1)OC)N=Nc1cc(c2c(c1O)cccc2)S(=O)(=O)O,non-mutagenic
+C1CCOCO1,mutagenic
+Cc1ncc(nc1)C,non-mutagenic
+Clc1cc2ccccc2c2c1cccc2,mutagenic
+c1ccc2-c3c([C@H]4[C@@H](c2c1)N4)ccc1c3cccc1,mutagenic
+C/C=C/c1ccc(cc1)OC,non-mutagenic
+[O-][N+](=O)c1c(O)cc2-c3c(-c4c2c1ccc4)cccc3,mutagenic
+Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)C(=O)O,non-mutagenic
+CN(c1nc2c(n1C)ccc1c2cccn1)C,mutagenic
+CN(CCCN1c2ccccc2CCc2c1cccc2)C,non-mutagenic
+Cn1cc2c(n1)c(ccc2)[N+](=O)[O-],mutagenic
+c1ccc2c(c1)c1cccc3c1c1c2cccc1cc3,mutagenic
+CC(=O)c1cc(cc2c1CCC2(C)C)C(C)(C)C,non-mutagenic
+C=CC(=O)OCCCCCC(C)C,non-mutagenic
+O=C1NC(=O)c2c1cc(cc2)[N+](=O)[O-],mutagenic
+Cc1ccc2c(c1)ccc1c2cccc1,mutagenic
+OCc1ccc(cc1N)[N+](=O)[O-],mutagenic
+Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1,non-mutagenic
+COc1cc(CNCC(COc2ccc3c(c2)ccc(n3)O)O)ccc1OC,non-mutagenic
+CCC(CC(CC(Cl)C)Cl)Cl,non-mutagenic
+Brc1cc2cccnc2c(c1)C(=O)O,non-mutagenic
+[O-][N+](=O)NC(=N)N(N=O)CCCCC,mutagenic
+CN(CCCNc1c2ccccc2nc2c1c(ccc2N(C)C)[N+](=O)[O-])C,mutagenic
+OOC1(C)c2ccccc2-c2c1cccc2,mutagenic
+Clc1nc2ccccc2nc1Cl,non-mutagenic
+OC1C2OC2c2c(C1O)ccc1c2ccc2c1cccc2,mutagenic
+[O-][N+](=O)c1ccc2-c3c(Cc2c1)cc(cc3)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccc(c(c1)C(=O)O)[N+](=O)[O-],mutagenic
+CNc1snc2c1cccc2,non-mutagenic
+O=C1CCC(N1)C(=O)N1CSCC1C(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc2-c3c(-c4c2c1c(cc4)[N+](=O)[O-])cccc3,mutagenic
+CCCOc1cc2C(=O)CCc2c2c1c1ccccc1cc2,non-mutagenic
+O=NN(c1ncn(c1C(=O)NC)C)C,non-mutagenic
+COc1cc(cc(c1O)OC)C1C2C(=O)OCC2C(c2c1cc1OCOc1c2)OC1OC2COC(OC2C(C1O)O)C,non-mutagenic
+OC(=O)C/C(=C/C(=O)O)/C(=O)O,non-mutagenic
+OC1C=Cc2c(C1O)nccc2,non-mutagenic
+OC1C=CC2C(C1O)O2,mutagenic
+O=C1C(=O)C2(C(C1CC2)(C)C)C,non-mutagenic
+Clc1ccc(cc1)/C=N/n1nnc2-c(c1O)nc1c2cccc1,mutagenic
+ClCCN(c1cccc(c1)/C=C/C(=O)OC1CCC2(C(C1)CCC1C2CCC2(C1CCC(=O)N2)C)C)CCCl,mutagenic
+ClC(C(=O)C)Cl,mutagenic
+C[C@H](CN(C[C@H](O)C)N=O)O,mutagenic
+O=C1Nc2c(C1=O)cc(cc2)S(=O)(=O)O,mutagenic
+CCCC(=O)OCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+CN(CCNC(=O)c1cccc2c1cc1ccccc1c2)C,mutagenic
+OC1OC(=O)C(=C1C)Cl,mutagenic
+c1ccc2c(c1)[nH]c1c2ccnc1,mutagenic
+N[C@@H](C(=O)O)CS,mutagenic
+ClCc1cccc(c1)[N+](=O)[O-],mutagenic
+CCN(CCC[C@H](Nc1cc(OC)cc2c1nccc2)C)CC,mutagenic
+O=CCC(c1ccc(cc1)C(C)(C)C)C,non-mutagenic
+O=Nc1ccc2c3c1ccc1c3c(cc2)c2c(c1)cccc2,mutagenic
+CCc1nc(N)nc(c1c1ccc(cc1)Cl)N,non-mutagenic
+O=C/C(=C/c1ccccc1)/Br,mutagenic
+COC(=O)CCCCC(=O)OC,non-mutagenic
+OS(=O)(=O)Oc1ccc2c3c1ccc1c3c(cc2)c2c(c1)cccc2,non-mutagenic
+CN(c1ccc(cc1)C(=N)c1ccc(cc1)N(C)C)C,mutagenic
+Oc1c(cc(cc1[N+](=O)[O-])c1ccccc1)[N+](=O)[O-],mutagenic
+Oc1ccc2c(c1)ccc1c2ccc2c1cccc2,mutagenic
+O=Nc1ccc(cc1)c1ccc(cc1)C(C)(C)C,mutagenic
+Cc1cc2ncccc2c2c1n(C)c(n2)N,mutagenic
+Clc1cc(Cl)nc(n1)Cl,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)N=Nc1c(N)c2c(cc1S(=O)(=O)O)cc(c(c2O)N=Nc1ccccc1)S(=O)(=O)O,mutagenic
+CCOc1ccccc1[N+](=O)[O-],mutagenic
+c1ccc2-c3cc4ccccc4cc3C3C(c2c1)N3,mutagenic
+C=C[C@H]1CO1,mutagenic
+S=C(NC1CCCCC1)NC1CCCCC1,non-mutagenic
+CCN(CC#CCOC(=O)C(c1ccccc1)(C1CCCCC1)O)CC,non-mutagenic
+CCC(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)CC,mutagenic
+Oc1ccc(cc1N)S(=O)(=O)O,non-mutagenic
+CCCCCCCCCCCCCCCCCCOC(=O)CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C,non-mutagenic
+CCOc1ccc(cc1NC(=O)C(=O)Nc1ccccc1CC)C(C)(C)C,non-mutagenic
+ON=C,non-mutagenic
+Clc1cc(Cl)c2c(c1O)nccc2,non-mutagenic
+OCCc1c(nc(n2c1ncn2)N)c1ccccc1,non-mutagenic
+Brc1cc(Br)cc(c1OCCOc1c(Br)cc(cc1Br)Br)Br,non-mutagenic
+ClC1C2C(Cl)C(C(C1Cl)(C2(C)C(Cl)Cl)C(Cl)Cl)Cl,non-mutagenic
+Nc1ccc2c(n1)c1ccccc1cc2,mutagenic
+ClC(=C1OC(=O)C(=C1Cl)Cl)Cl,mutagenic
+C=C1CC23CC1CCC3C1(C(CC2)C(C)(CCC1)C(=O)O)C,non-mutagenic
+N#Cc1ccc2c(c1)n(C)c(n2)N,mutagenic
+N#Cc1cc(Br)c(c(c1)Br)O,non-mutagenic
+CC(N(C(C)C)N)C,mutagenic
+CC1NCCN(C1)c1cc2c(c(c1F)C)c(=O)c(cn2C1CC1)C(=O)O,non-mutagenic
+C=C1CC(=O)O1,non-mutagenic
+CC(=O)Nc1ccc(cc1)Oc1ccc(cc1)N(C(=O)C)O,mutagenic
+CCCC[C@H](COCCCN)CC,non-mutagenic
+OCC1(CO)CO[C@H](N1)c1ncc(n1C)[N+](=O)[O-],mutagenic
+O=NN(C(=O)c1c(NC)ncn1C)C,mutagenic
+C[Si](O)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)O)[N+](=O)[O-],mutagenic
+COc1cc(ccc1N)c1ccc(c(c1)OC)N,mutagenic
+CCOc1ccc(cc1N)N,mutagenic
+[O-][N+](=O)c1cc2ccccc2c2c1c(ccc2)[N+](=O)[O-],mutagenic
+O=C1C(=C)C2(CC31CCC1C(C3CC2)(C)CCCC1(C)C(=O)O)O,mutagenic
+Cn1c(N)nc2c1cc1cnccc1n2,non-mutagenic
+c1ccc(nc1)c1cccnc1,mutagenic
+CCOCCc1c(nc(n2c1ncn2)N)c1ccccc1,non-mutagenic
+COC(=O)c1ccc(cc1)CN(N=O)C,non-mutagenic
+O=CCCC(N(C(=O)OCC)N=O)c1cccnc1,mutagenic
+O=C1CCC(N1C)c1cccnc1,non-mutagenic
+Nc1cc2c(c(c1)S(=O)(=O)O)cccc2S(=O)(=O)O,non-mutagenic
+OC(=O)CCC(=O)O,non-mutagenic
+Nc1cc(Cl)c(c(c1)Cl)Cl,non-mutagenic
+CCNCC#CC(OC(=O)C(c1ccccc1)(C1CCCCC1)O)(C)C,non-mutagenic
+CN1CCN(CC1)C,non-mutagenic
+O/N=C(/c1cc(O)c(c(c1)O)O)\N,mutagenic
+CNC,non-mutagenic
+Brc1c(C)c(Br)c(c(c1Br)Br)Br,non-mutagenic
+[O-][N+](=O)c1ccc2-c3c([C@H](c2c1)O)cccc3,mutagenic
+OCCCN=N,mutagenic
+CC=O,non-mutagenic
+OC(=O)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,non-mutagenic
+c1cc2C3OC3c3c2c(c1)c1cc2ccccc2cc1c3,mutagenic
+OCC#C,mutagenic
+[O-][N+](=O)c1cc2CCc3c4-c2c(c1)CCc4cc(c3)[N+](=O)[O-],mutagenic
+OCCCCN(CCO)N=O,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=N/c1snc2c1cccc2,mutagenic
+OCC(Cc1ccccc1)CN=N#N,mutagenic
+Brc1ccc2c(c1)C=CC1C2CCCC1,non-mutagenic
+Cc1nsc(c1)N,mutagenic
+CON(C(=O)Nc1ccc(c(c1)Cl)Cl)C,mutagenic
+OC(CN=N#N)Cn1ccc(=O)[nH]c1=O,mutagenic
+O=NN(c1ccccc1)c1ccccc1,non-mutagenic
+S=C1SSC2=NCCN12,non-mutagenic
+COC(=O)[C@@H](c1ccccc1)[C@H]1CCCCN1,non-mutagenic
+Cc1ccc(cc1)CC1OC1,mutagenic
+O=C1CCCCCN1,non-mutagenic
+Nc1nc2c(n1C)ccc1c2cccn1,mutagenic
+CN(N=O)C[C@H](O)C,mutagenic
+Oc1cc2cccc3c2c2c1ccc(c2cc3)[N+](=O)[O-],mutagenic
+C1=COc2c(C=C1)c1ccccc1c1c2cc2ccccc2c1,mutagenic
+OC(=O)C1NC(c2ccccc2)c2c(C1)c1ccccc1[nH]2,non-mutagenic
+CC(=O)Nc1ccc(cc1Cl)Cc1ccc(c(c1)Cl)NC(=O)C,mutagenic
+ClCCOC/C(=C\Cl)/Cl,mutagenic
+O=Cc1cccc(c1)c1ccccc1,non-mutagenic
+CC(Cc1cc(N)cc(c1N)[N+](=O)[O-])O,non-mutagenic
+COC(=O)NC(=S)Nc1ccccc1NC(=S)NC(=O)OC,mutagenic
+COC(=O)CC(=O)OC,non-mutagenic
+Clc1ccc(c(c1)N)O,mutagenic
+Nc1sc2c(n1)cc(c(c2)C)C,mutagenic
+SCC(C(=O)O)NC(=O)C(S)(C)C,non-mutagenic
+c1ccc2c(c1)ccc1c2ccc2c1c1ccccc1cc2,mutagenic
+Clc1cc(ccc1Cl)NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+Cc1nc2c(nc1C)ccc1c2nc(n1C)N,mutagenic
+[O-][N+](=O)c1ccccc1N,non-mutagenic
+c1ccc[nH]1,non-mutagenic
+FC(I)(F)F,mutagenic
+Cc1nc2c(nc1C)ccc(c2C)N,mutagenic
+COC1=CC(=O)C(=O)C(=C1)C(C)(C)C,non-mutagenic
+[O-][N+](=O)c1cc(N)c(c(c1)N)C,mutagenic
+O[C@H]1C[C@@H](O)[C@]2([C@H](C1)[C@@H](C)C[C@@H]1[C@H](C2)[C@@H](C)C(=O)O1)C,mutagenic
+N#Cc1cc(c2ccncc2)c(nc1O)C,non-mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c2c3c1ccc1c3c(cc2)ccc1,mutagenic
+OCc1ccc(cc1)NNC(=O)C,mutagenic
+Clc1c(Cl)c(Cl)c(c2c1c(Cl)c(c(c2Cl)Cl)Cl)Cl,non-mutagenic
+CC(=O)OC1Cc2c3c1ccc1c3c3c(c2)cccc3cc1,mutagenic
+Cc1cc(ccc1N=Nc1ccc(c(c1)C(=O)O)O)c1ccc(c(c1)C)N=Nc1c(N)c(C)cc(c1N)S(=O)(=O)O,mutagenic
+NNc1ccc(cc1)[N+](=O)[O-],mutagenic
+CC[C@H]([C@@H](CO)C)C,non-mutagenic
+[O-][n+]1ncc2c(c1)cccn2,non-mutagenic
+Nc1ccc(cc1Cl)c1cc(Cl)c(c(c1)Cl)N,mutagenic
+[O-][n+]1cccc2c1C=CC1C2O1,non-mutagenic
+Cl/C=C\Cl,non-mutagenic
+CC(=O)Nc1cccc(c1)O,non-mutagenic
+O=C1CCC(N1)C(=O)NC(C(=O)N1CCCC1C(=O)N)Cc1nc[nH]c1,non-mutagenic
+Oc1ccc(cc1)/C=N/c1snc2c1cccc2,mutagenic
+O=Nc1ccc(cc1)C(=O)C,mutagenic
+OCc1cc2CC[C@H](Nc2cc1[N+](=O)[O-])CNC(C)C,mutagenic
+OOC(c1ccccc1)(C)C,mutagenic
+Nc1ccc(c2c1C(=O)c1c(C2=O)cccc1[N+](=O)[O-])N,mutagenic
+OC(=O)CN(CC(=O)O)CC(=O)O,non-mutagenic
+COC1=C(OC)C(=O)C(=C(C1=O)C/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)\C)\C)\C)\C)\C)\C)\C)C,non-mutagenic
+C[C@@H](c1ccccc1)CCc1ccccc1,non-mutagenic
+Nc1cc2nc3c(nc2cc1C)ccc(c3N)C,mutagenic
+CS(=O)C,non-mutagenic
+CNC(=O)c1ccccc1,non-mutagenic
+O=CNNc1scc(n1)c1ccc(o1)[N+](=O)[O-],mutagenic
+COCCOC,mutagenic
+Oc1cccc2c1ccc1c2c2c([nH]1)ccc1c2cccc1,mutagenic
+COP(=O)(O)O,non-mutagenic
+CCCCOC(=O)C,non-mutagenic
+ClC1=C(Cl)C(=C(C1(Cl)C1(Cl)C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)Cl,mutagenic
+[O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)c2c(c1)CCCC2,mutagenic
+OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F,non-mutagenic
+ClCc1ccc(cc1)OC,non-mutagenic
+ClC(C(=O)C(Cl)Cl)Cl,mutagenic
+O=C1Cc2cc3cc(ccc3cc2C(C1O)O)[N+](=O)[O-],non-mutagenic
+CC[C@H]1CO1,mutagenic
+Cc1nc2c(nc1C)c(C)c(c1c2nc(n1C)N)C,mutagenic
+C=CN=Nc1ccccc1,mutagenic
+CN1C[C@@H](c2ccccc2)c2c(C1)c(N)ccc2,non-mutagenic
+CCOC(=O)c1cc2cc3CCCN4c3c(c2oc1=O)CCC4,non-mutagenic
+Oc1ccc(cc1)/C=C/C(=O)c1ccccc1,non-mutagenic
+O=C(NC(C(=O)O)CC(=O)O)COc1ccc(cc1Cl)Cl,non-mutagenic
+Oc1ccc(c(c1)O)O,mutagenic
+CNC=O,non-mutagenic
+Fc1cccc2c1ccc1c2nccc1,mutagenic
+OCC1OC(CC1O)n1cc(O)c(nc1=O)N,non-mutagenic
+O=c1oc2c3c4c1cccc4ccc3ccc2[N+](=O)[O-],mutagenic
+CC(C(=O)NCc1ccccc1)NCc1ccccc1,non-mutagenic
+O=C(C(C)(C)C)C1C(=O)c2c(C1=O)cccc2,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)C)C,mutagenic
+Cc1ccc2c(c1O)NC(O)C1N(C2=O)C=C(C1)/C=C/C(=O)N,mutagenic
+COC(=C1C(=NC(=C([C@@H]1c1ccccc1[N+](=O)[O-])C(=O)OCC(=O)C)C)C)O,non-mutagenic
+N#N=Nc1ccc2c(c1)nc1c(c2Nc2ccc(cc2)NS(=O)(=O)C)ccc(c1)N=N#N,mutagenic
+O=Cc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Oc1ccc2c(c1)c1ccccc1c1c2cc2ccccc2c1,mutagenic
+C1CCc2c(C1)c1-c3ccccc3-c3c1c(c2)c1ccccc1c3,mutagenic
+OC(=O)C1OC(O/N=C(/c2ccccc2)\N)C(C(C1O)O)O,non-mutagenic
+CN/C(=C/[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C,non-mutagenic
+O=Nc1c2ccc3c4c2c(c2c1cccc2)ccc4ccc3,mutagenic
+Clc1ccc(c(c1)C(=O)O)Cl,non-mutagenic
+CCOC(=O)[C@@H](N[C@H](C(=O)N(C1Cc2c(C1)cccc2)CC(=O)O)C)CCc1ccccc1,non-mutagenic
+[O-][N+](=O)c1cccc2-c3c4c(-c12)cccc4ccc3,mutagenic
+ClCc1ccc(cc1)OC(=O)C,mutagenic
+Oc1[nH]cnc2-c1cnn2,non-mutagenic
+Nc1ccccc1O,mutagenic
+O=NN1CCSCC1,mutagenic
+CC1(CO1)C=C,non-mutagenic
+CNC1Cc2cccc3c2c(C1)ccc3,mutagenic
+Nc1ccc2c(c1)cc1c([n+]2C)cccc1,mutagenic
+Oc1cc2ccccc2c2c1c1ccccc1cc2,non-mutagenic
+C=CCn1cc2c3c1cccc3[C@H]1[C@@H](C2)N(C)CC(=C1)CO,mutagenic
+Nc1ncnc2c1ncn2Cc1ccccc1,mutagenic
+Nc1ccc(cc1)Cc1ccc(c(c1)Cc1ccc(cc1)N)N,mutagenic
+CC(CON=O)C,mutagenic
+ClCCN(c1cc(ccc1C)C(P(=O)(O)O)(P(=O)(O)O)O)CCCl,mutagenic
+CCOC(/C=C(\CCC=C(C)C)/C)OCC,non-mutagenic
+CCCc1ccc2c(c1)OCO2,non-mutagenic
+OC(=O)C[C@@H](C[C@H](/C=C/c1c(c2ccc(cc2)F)c2c(n1C(C)C)cccc2)O)O,non-mutagenic
+CC[N+](=c1ccc2-c(c1)oc1c(n2)c2ccccc2c(c1)N)CC,mutagenic
+Nc1ccc(c2c1cccc2)N,mutagenic
+Cl/C=C(/C(Cl)Cl)\Cl,mutagenic
+CCOC(=O)C(Oc1ccc(cc1)Cl)(C)C,non-mutagenic
+ClCCN(C(=O)NC(C(C(C(CO)O)O)O)C=O)N=O,mutagenic
+Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1O)O,mutagenic
+Oc1cccc(c1)O,non-mutagenic
+CC(=O)OCc1c2ccccc2cc2c1ccc1c2cccc1,mutagenic
+Cc1cc(cc(c1N)C)c1cc(C)c(c(c1)C)N,non-mutagenic
+O=Cc1ccc2-c1cc(ccc2C)C(=C)C,mutagenic
+COc1ccc2c(c1)c1oc(=O)ccc1c(c2)[N+](=O)[O-],mutagenic
+OC1C=C2CC=C3C(C2(CC1O)C)CC(C1(C3CC=C1C(=O)C)C)O,non-mutagenic
+OC(=O)c1c(Cl)cccc1Cl,non-mutagenic
+O=C(NC(C(=O)NCC(=O)O)CSC(=O)NC(C)(C)C)CCC(C(=O)O)N,non-mutagenic
+CC(=O)Nc1ccc(cc1)C(=O)O,non-mutagenic
+[O-][N+](=O)OCC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-],non-mutagenic
+[O-][N+](=O)/C=C/c1ccco1,non-mutagenic
+COC1=CC(=O)C=CC1=O,non-mutagenic
+O=C(c1ccc(cc1)[N+](=O)[O-])OC[C@@H]1OC1,mutagenic
+CN(c1ccc(cc1)N=Nc1ccccc1)OC(=O)C,mutagenic
+C/C=C/c1ccc(cc1OC)OC,non-mutagenic
+BrCC1=C(Cl)C(=O)OC1,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c(C)ccc2,mutagenic
+ClCCN([P@]1(=O)OCC[C@H](N1)O)CCCl,mutagenic
+N#CC1(O)CCCCC1,non-mutagenic
+ONC(=O)c1ccc(c(c1)O)O,mutagenic
+CC(CC1NC(=O)CNC1=O)C,non-mutagenic
+c1ccc(cc1)/C=C/c1ccccc1,non-mutagenic
+[O-][N+](=Nc1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C,mutagenic
+Nc1nc(nc2c1ncn2c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-],mutagenic
+Brc1c(O)c(Br)c(c(c1Br)Br)Br,non-mutagenic
+C[C@H](COC(C)(C)C)O,mutagenic
+O=C1N[C@@H](C(C)C)C(=O)N2CCC[C@H]2C(=O)N(C)CC(=O)N([C@H](C(=O)O[C@H]([C@@H]1NC(=O)c1c2-c(oc3c(n2)c(ccc3C)C(=O)N[C@H]2[C@@H](C)OC(=O)[C@@H](C(C)C)N(C)C(=O)CN(C(=O)[C@H]3N(C(=O)[C@@H](NC2=O)C(C)C)CCC3)C)c(c(=O)c1N)C)C)C(C)C)C,non-mutagenic
+O=NN1CCCCCCC1,mutagenic
+Oc1ccc(cc1)S(=O)(=O)c1ccc(cc1)O,non-mutagenic
+O=C1NC(=O)NC(=O)C1(O)O,non-mutagenic
+OC(=O)C(c1ccc2c(c1)[nH]c1c2cc(cc1)Cl)C,non-mutagenic
+CC[C@H]([N+](=O)[O-])CO,non-mutagenic
+ClCCNc1ccc(cc1)CCCC(=O)O,mutagenic
+Cc1ccc(cc1)Cl,non-mutagenic
+OC(COc1cccc2c1c(=O)cc(o2)C(=O)O)COc1cccc2c1c(=O)cc(o2)C(=O)O,non-mutagenic
+Fc1cc2cccnc2c2c1cccn2,mutagenic
+Cc1cc(C)c2c(c1N)nsn2,mutagenic
+ONc1cccc(c1)c1ccccc1,non-mutagenic
+Nc1ccc2c(c1S(=O)(=O)O)cccc2,mutagenic
+OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl,non-mutagenic
+OC(=O)CCCc1c[nH]c2c1cccc2,non-mutagenic
+C1C=Cc2c(C1)ccc1c2cc2c(n1)ccc1c2cccc1,mutagenic
+Oc1cc2c3c4c1cccc4ccc3ccc2[N+](=O)[O-],mutagenic
+Clc1cc(Cl)c(c(c1)Cl)O,non-mutagenic
+Cc1ccco1,non-mutagenic
+C=CCNCC=C,non-mutagenic
+[O-][N+](=O)c1cc(C)c(c(c1)[N+](=O)[O-])O,non-mutagenic
+OC1COC(C(C1O)O)Nc1ccc(cc1)C(=O)O,non-mutagenic
+O=C1C=Cc2c(C31OC3(C)C(=O)C)cccc2,non-mutagenic
+CCc1c2ccc3c(c2c(c2c1cccc2)CC)cccc3,non-mutagenic
+CC(=O)c1ccc[nH]1,mutagenic
+COc1cc(N)c(cc1N)OC,mutagenic
+c1ccc2c(c1)Sc1c(O2)cccc1,non-mutagenic
+[O-][N+](=O)c1ccc2-c3c4c(-c2c1)nc1ccccc1c4c1c(n3)cccc1,mutagenic
+COc1cc2C(=O)c3cc(C)cc(c3C(=O)c2c(c1O)O)O,mutagenic
+C=Cc1cccnc1,non-mutagenic
+O=C(Cc1ccccc1)N[C@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C,non-mutagenic
+Nc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+CCCCCC[C@@H](C/C=C\CCCCCCCC(=O)O)O,non-mutagenic
+OCCSN=O,mutagenic
+O=NN1CCNC1=O,mutagenic
+CCC1(OCCc2c1[nH]c1c2cccc1CC)CC(=O)O,non-mutagenic
+C/C=C/Cl,mutagenic
+Nc1c(N=Nc2ccc(cc2)c2ccc(cc2)N=Nc2cc(c3c(c2N)cccc3)S(=O)(=O)O)cc(c2c1cccc2)S(=O)(=O)O,mutagenic
+[O-][N+](=O)c1ccc(cc1)OC[C@@H]1OC1,mutagenic
+c1ccc2c(c1)c1sc3c(c1cc2)cccc3,mutagenic
+[O-][N+](=O)c1cc(ccc1Nc1ccccc1O)[N+](=O)[O-],mutagenic
+c1cc2ccc3c4c2c(c1)ccc4ccc3[C@H]1OC1,mutagenic
+CC([N+](=O)[O-])C,mutagenic
+OCC(COP(=O)(O)O)O,non-mutagenic
+O=C(c1cc(O)c(c(c1)O)OC(=O)c1cc(O)c(c(c1)O)O)OC1OC(COC(=O)c2cc(O)c(c(c2)O)O)C(C(C1OC(=O)c1cc(O)c(c(c1)O)O)OC(=O)c1cc(O)c(c(c1)O)O)OC(=O)c1cc(O)c(c(c1)O)O,non-mutagenic
+CCN(N=O)CC,mutagenic
+CC(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+COc1c(O)c2N(CCc2c2c1[nH]c(c2)C(=O)N1CC2C3(C1=CC(=O)c1c3c(C)c[nH]1)C2)C(=O)c1cc2c([nH]1)c(OC)c(c1c2CCN1C(=O)N)O,non-mutagenic
+COC12OOC2(C)Oc2c1cccc2,mutagenic
+COc1cc2c(CCNC(=O)C)c[nH]c2cc1O,non-mutagenic
+O=NN(C(=O)N)C[Si](C)(C)C,mutagenic
+BrCC(CBr)Cl,mutagenic
+Cc1ccc(cc1)Nc1ccc(cc1)[N+](=O)[O-],mutagenic
+CC(OC(=O)C[C@](C(=O)O)(CC(=O)O)O)C,non-mutagenic
+OC[C@@H]([C@H]1OC(=C(C1=O)O)O)O,non-mutagenic
+O[C@@H]1[C@@H](O)C=C2c3c1cccc3-c1c2ccc2c1cccc2,mutagenic
+CN(CNc1nnc(o1)/C=C/c1ccc(o1)[N+](=O)[O-])C,mutagenic
+C1COC1=O,mutagenic
+NC(=O)c1ccccc1O,non-mutagenic
+CC1CCN(CC1)N=O,mutagenic
+C[Si](c1ccc(cc1)[Si](CCCOCC1OC1)(C)C)(CCCOCC1OC1)C,mutagenic
+CC(OC[C@@H]1OC1)(C)C,mutagenic
+Clc1ccc(c(c1)Cl)C(=O)Cl,mutagenic
+Cc1ccc(c(c1)C)O,mutagenic
+CC(=O)ON(c1ccc2-c3c(Cc2c1)cccc3)C(=O)C,mutagenic
+NCCCCCCCCCCC(=O)O,non-mutagenic
+NCCCl,mutagenic
+[O-][n+]1cccc2c1c(O)ccc2,non-mutagenic
+CCCCc1ccc(cc1)/N=C\c1ccc(cc1)OC,mutagenic
+Cn1cnc2c1c(=O)[nH]c(=O)n2C,non-mutagenic
+CC(CC(=O)Nc1ccc(cc1)O)O,non-mutagenic
+OC(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+OC(=O)C1(C)CCCC2(C1CCC13C2CCC(C3)(C(C1)C)O)C,non-mutagenic
+O=C1CCCCC1=O,mutagenic
+CCC/C=C/C=O,mutagenic
+[O-][N+](=O)c1cccc(c1)NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+OC(=O)C(CCl)Cl,non-mutagenic
+C=CC=O,mutagenic
+O=C(c1csc(c1)[N+](=O)[O-])Nc1ccccc1Br,mutagenic
+CCCCCCCCCCCCCCCC(=O)OCC(C1OC(=C(C1=O)O)O)O,non-mutagenic
+OCCNC(=O)c1c(I)c(C(=O)NCC(CO)O)c(c(c1I)N(C(=O)C)CC(CO)O)I,non-mutagenic
+O=C1OCCN1P(=O)(N1CCOC1=O)Cl,mutagenic
+ClC1=C(Cl)C(=O)OC1,mutagenic
+Clc1cc2Oc3cc(ccc3Oc2cc1Cl)[N+](=O)[O-],mutagenic
+NC(C(=O)O)CSC(C(C(F)F)(F)F)(F)F,non-mutagenic
+COP(=O)(O/C(=C\C(=O)O[C@H](c1ccccc1)C)/C)OC,non-mutagenic
+COC(=O)c1ccco1,non-mutagenic
+OCc1ccc(cc1)O,non-mutagenic
+CCCC[C@H](COP(=O)(Oc1ccccc1)Oc1ccccc1)CC,non-mutagenic
+c1ccc(nc1)c1cccc(n1)c1ccccn1,mutagenic
+Nc1ccc(cc1)/C=C/c1cccc(c1)Cl,mutagenic
+Clc1ccc(cc1)S(=O)(=O)C,non-mutagenic
+C[n+]1cccc(c1)OC(=O)N(C)C,non-mutagenic
+CC(C(Cc1ccc(c(c1)O)O)C)Cc1ccc(c(c1)O)O,non-mutagenic
+c1ccc2c(c1)c1c(cn2)cnc2c1cccc2,non-mutagenic
+C=CC#N,mutagenic
+COC(=O)Nc1nc2c([nH]1)ccc(c2)O,non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NO,mutagenic
+CCN(c1ccc(cc1)N=Nc1ccccc1)CC,non-mutagenic
+CCOCCOC(=O)/C=C\c1ccc(cc1)OC,non-mutagenic
+Nc1nc2c([nH]1)cccc2,non-mutagenic
+OC(=O)[C@@H](Cc1c[nH]c2c1cccc2)N,non-mutagenic
+O=C(OC(C)(C)C)CN=N#N,mutagenic
+[O-][N+](=O)c1ccc2c(c1)nc1c(n2)cccc1,mutagenic
+[O-][N+](=O)c1cccc(c1N)N,mutagenic
+CCN(c1ccc2-c3c(Cc2c1)cccc3)C(=O)C,mutagenic
+OC[C@@H]1CO[C@H](O1)[C@@H](I)C,mutagenic
+Cc1cc([N+](=O)[O-])c(c2c1[nH]c1c2cccc1)C,mutagenic
+O=C1C2OC2C2c3c1c(O)ccc3C1c3c2ccc(c3C(=O)C2C1O2)O,mutagenic
+CCCCCCOC(=O)C(=C)C,non-mutagenic
+CS(=O)(=O)OCCc1ccc(cc1)OCc1ccccc1,mutagenic
+O=CC1C(=CCC2C1(C)CCCC2(C)C)C=O,non-mutagenic
+Nc1ccc(cc1)Br,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)N=Nc1ccc(c(c1)C(=O)O)O,mutagenic
+Cc1ccc2c(c1)c(C)c1c(-c3ccccc3C(C1O)O)n2,non-mutagenic
+Nc1cc2c(c3c1cccc3)ccc1c2cccc1,mutagenic
+CCCCON(C(=O)c1ccc(cc1)[N+](=O)[O-])OC(=O)C,mutagenic
+NC(C(=O)O)CSc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl,non-mutagenic
+Cc1ccccn1,non-mutagenic
+Clc1ccc(c(c1)Cl)NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O,non-mutagenic
+Cn1c(N)nc2c1cc(cn2)c1ccccc1,mutagenic
+Cc1ccc2c(c1)nc1c(c2)ccc2c1cccc2,mutagenic
+CNCCCC(=O)O,non-mutagenic
+O=C/C=C\c1ccccc1,mutagenic
+ClC(Cl)(Cl)Cl,non-mutagenic
+OC/C=C/c1ccccc1,non-mutagenic
+O=C1CCCO1,non-mutagenic
+Cc1ccc2c(c1C)c1ccccc1cc2,non-mutagenic
+OC(COc1cccc2c1CC(O)C(C2)O)CNC(C)(C)C,non-mutagenic
+Cc1cn(CC(CN=N#N)O)c(=O)nc1OC,mutagenic
+[O-][N+](=O)NC,non-mutagenic
+CC(=CCC1CCCC1=O)C,non-mutagenic
+Fc1ccc2c(c1F)cccn2,mutagenic
+Nc1cc(C(=O)O)c(c(c1)S(=O)(=O)O)O,non-mutagenic
+CC(c1ccc(cc1)O)(c1ccc(cc1)O)C,non-mutagenic
+Cc1c(C)c2ccccc2c2c1c(N)c1ccccc1n2,mutagenic
+O=CC1C(=CCC2C1(C)C(OC(=O)C)CC1C2(C)CCC2C1(C)CCCC2(C)C)C=O,non-mutagenic
+ClCCSCc1ccccc1,mutagenic
+ONc1cc(C)cc(c1)C,mutagenic
+Fc1cnc2c(c1)c(N)ccc2,mutagenic
+ClCCN(c1ccc(cc1)CCCNc1c2ccccc2nc2c1cccc2)CC,mutagenic
+C1CNCCO1,non-mutagenic
+Cc1ccc(cc1)N=Nc1c(O)ccc2c1cccc2,non-mutagenic
+O=Nc1cc2c(c3c1cccc3)ccc1c2cccc1,mutagenic
+S=C=Nc1cccc2c1cccc2,mutagenic
+CNC(=O)Oc1cc2ccccc2c2c1cccc2,mutagenic
+Oc1cc2C[C@@]3([C@@H](c2cc1O)c1ccc(c(c1OC3)O)O)O,non-mutagenic
+c1ccc2c(c1)cc1c(c2)c2ccccc2c2c1cccc2,mutagenic
+Clc1ccc(c(c1)Cl)S(=O)(=O)n1ncc(c(c1=O)Cl)Cl,non-mutagenic
+OC(COc1ccc(cc1)NC(=O)C)CNC(C)C,non-mutagenic
+O=C(C(=C)C)OCC(COC(=O)C(=C)C)(C)C,non-mutagenic
+OCC1OC(OC23C=C(C)C4(C(C3C(=O)C(C2)(C)C)(C)O)CC4)C(C(C1OC(=O)/C=C/c1ccc(cc1)O)O)OC(=O)C,mutagenic
+CO/C(=C\C(=O)O)/C(=O)C(=C)C,mutagenic non-mutagenic
+O=C1CCc2c1c1c(cc2)ccc2c1cccc2,non-mutagenic
+CCCCOCCCC,non-mutagenic
+CCNC(=N)N([N+](=O)[O-])N=O,mutagenic
+CNc1ccc2c(c1C)nc(cn2)c1ccccc1,mutagenic
+CCCCOCCOP(=O)(OCCOCCCC)OCCOCCCC,non-mutagenic
+Cn1cnc2c1c(=O)n(C)c(=O)n2C,non-mutagenic
+CN1CCc2c3C1C(O)c1ccccc1-c3c1c(c2)OCO1,mutagenic
+CC(=C)C,non-mutagenic
+O=c1cc(C)c2c(o1)c1OC3(C(c1cc2)(C)OO3)C,mutagenic
+O=Cc1ccc(cc1)Cl,non-mutagenic
+CCCC(=O)OCc1ccc(cc1)[N+](=O)[O-],mutagenic
+O=C(C(Br)C)NC(C)(C)C,non-mutagenic
+OC1CCC2(C(=CCC3C2CCC2(C3CC3C2C(C)C2N3CC(CC2)C)C)C1)C,non-mutagenic
+Oc1cccc2c1ccc1c2c2c([nH]1)cc(c1c2cccc1)[N+](=O)[O-],mutagenic
+OC1C=Cc2c(C1O)cc1c3c2-c2ccccc2-c3cc2c1cccc2,mutagenic
+Oc1cc2ccc3c4c2c(c1)ccc4cc1c3cccc1,mutagenic
+Oc1c2-c3ccccc3-c3c2c2c4c1cccc4ccc2cc3,non-mutagenic
+NNC(=O)c1[nH]c2c(c1N)cccc2,mutagenic
+CCN(CCNc1ccc2c3c1c(=O)c1cc(O)ccc1n3cn2)CC,mutagenic
+C[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C,non-mutagenic
+CCN(c1cc(NC(=O)C)c(cc1OC)N=Nc1c(Br)cc(cc1[N+](=O)[O-])[N+](=O)[O-])CC,mutagenic
+CC(=O)OCC12CCC(=CC1OC1C3(C2(C)C(OC(=O)C)C1O)CO3)C,non-mutagenic
+CCN(CCCN(C1Cc2c(C1)cccc2)c1ccccc1)CC,non-mutagenic
+CCOP(=S)(Oc1ccc2c(c1)oc(=O)c(c2C)Cl)OCC,non-mutagenic
+Clc1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+Nc1ccc2c(c1)[nH]c1c2cccc1,mutagenic
+N[C@@H](c1ccccc1)C(=O)N[C@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)ccc1c2cc2ccc3c(c2c1)cccc3,mutagenic
+CC(=C)C1CO1,non-mutagenic
+CCn1cc(C(=O)O)c(=O)c2c1nc(N1CCNCC1)c(c2)F,mutagenic
+O=C1c2ccccc2-c2c1c1ccccc1cc2,non-mutagenic
+C[C@]12CC[C@H](CC1)C(O2)(C)C,non-mutagenic
+CCN(C(=S)SSC(=S)N(CC)CC)CC,non-mutagenic
+CN1C(=O)CN=C(c2c1ccc(c2)[N+](=O)[O-])c1ccccc1F,mutagenic
+BrCC(=O)c1oc(c(c1Cl)Cl)[N+](=O)[O-],mutagenic
+Oc1cc(C)c2c(c1)oc(=O)c1c2cc(O)cc1O,non-mutagenic
+CN(c1[nH]cnc2-c1ncn2)C,mutagenic
+ClC(C(C(F)(F)F)(F)F)Cl,non-mutagenic
+O=C(NS(=O)(=O)c1ccc(cc1)C)NN1CCCCCC1,non-mutagenic
+Nc1cccc2c1nc1cccc(c1n2)N,mutagenic
+ClCCN(C(=O)NCc1cnc(nc1N)C)N=O,mutagenic
+CC(=O)Nc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+C1=C[C@H]2[C@@H](C1)[C@@H]1C=C[C@H]2C1,non-mutagenic
+COCCOCCOCCOC,mutagenic
+OCC1OC(OC2CCC3(C(=CCC4C3CCC3(C4CC4C3C(C)C(O4)(OC)CCC(COC3OC(CO)C(C(C3O)O)O)C)C)C2)C)C(C(C1OC1OC(C)C(C(C1O)O)O)O)OC1OC(C)C(C(C1O)O)O,non-mutagenic
+COC(=O)C(CSCCCl)N,mutagenic
+c1ccc(cc1)N=Nc1ccccc1,mutagenic
+Nc1ccccc1Cl,non-mutagenic
+ClCCOP(=O)(OCCCl)OCCCl,non-mutagenic
+OC(=O)[C@H]1[C@H]2[C@]3([C@@H]4[C@]51CC(=C)[C@](C5)(O)CC4)C=C[C@@H]([C@@]2(C)C(=O)O3)O,non-mutagenic
+CCC1=C(CC2NCCc3c2cc(OC)c(c3)OC)CC2N(C1)CCc1c2cc(c(c1)OC)OC,non-mutagenic
+Clc1ccc2c(c1)c1ccccc1o2,mutagenic
+OC(=O)COc1ccc(cc1Cl)Cl,non-mutagenic
+CCn1cc(C(=O)O)c(=O)c2c1nc(C)cc2,non-mutagenic
+CCCCCCCCOc1ccc(cc1)C(=O)O,non-mutagenic
+ClCCl,mutagenic
+Cc1cccc2c1-c1cc3ccccc3cc1C1C2N1,mutagenic
+N#CCc1cn(c2c1cccc2)N=O,mutagenic
+CC(CC(=O)C)C,non-mutagenic
+OC(=O)COc1ccc(cc1)Cl,non-mutagenic
+COc1ccc(cc1)c1nc(c([nH]1)c1ccc(cc1)OC)c1ccc(cc1)OC,mutagenic
+ClC(=O)c1ccc(cc1)C(=O)Cl,mutagenic
+CCCCCCCCC(=O)OCC=C,non-mutagenic
+Clc1cccc(c1)C(=O)/N=c/1\sn(c2c1cc(cc2)[N+](=O)[O-])C(=O)c1cccc(c1)Cl,mutagenic
+OC(=O)c1cccc(c1N)O,non-mutagenic
+ClC1c2cc3ccccc3c3c2c2c1cccc2cc3,mutagenic
+COC(=O)c1nc(c2ccc3c(n2)C(=O)C=CC3=O)c2c(c1)c1ccccc1[nH]2,mutagenic
+c1ccc2c(c1)ccc1c2cccn1,mutagenic
+ClCCN(CCCNc1c2ccc(cc2nc2c1nc(OC)cc2)Cl)CC,mutagenic
+C[C@H](C[N+](NC(=O)C(=C)C)(C)C)O,non-mutagenic
+ClCC(OP(=O)(OC(CCl)CCl)OC(CCl)CCl)CCl,mutagenic
+COc1cc2cccnc2c(c1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)C(CC)CCOCN1C=CN(C1/C=N/O)C,non-mutagenic
+CN(CCN(c1ccccn1)Cc1cscc1)C,non-mutagenic
+CCOC(=O)C(=O)C,non-mutagenic
+Clc1ccc(cc1)Br,non-mutagenic
+CCC(=O)C,non-mutagenic
+COC(=O)C1c2cc3c(c(c2C(CC1(O)CC)OC1OC(C)C(C(C1)N(C)C)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)O)O)C(=O)c1c(C3=O)c(O)ccc1O,mutagenic
+O=C1CCc2c(O1)cccc2,non-mutagenic
+N#C/C=C\C#N,non-mutagenic
+Brc1ccc(cc1)C(=O)C1OC1c1ccccc1,non-mutagenic
+OC[C@@H](CI)O,mutagenic
+CCCCC[C@H](OC(=O)c1cccc(c1)C(=O)O[C@@H](CCCCC)CC)CC,non-mutagenic
+COC(=O)[C@@]1(O[C@@]1(C)[C@@H](C(C)C)O)C(=O)N,mutagenic
+Cc1cccc(c1)NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+c1ccc2c(c1)Oc1c(O2)cccc1,non-mutagenic
+[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Cc1cccc2c1ccc1c2cccc1,mutagenic
+Cc1ccc(c(c1)C)N=Nc1c2ccc(cc2cc(c1O)S(=O)(=O)O)S(=O)(=O)O,mutagenic
+OOCc1cn(C2CC(C(O2)CO)O)c(=O)[nH]c1=O,mutagenic
+OCc1c2cc(C)ccc2nc2c1ccc1c2cccc1,mutagenic
+OC(=O)c1ccccc1N,non-mutagenic
+OCC(=O)C1(O)CC(OC2CC(N)CC(O2)C)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC,mutagenic
+[O-][N+](=O)c1cccc(c1O)N,non-mutagenic
+COc1c(O)cc2c3c1-c1ccccc1CC3N(CC2)C,mutagenic
+CC1(C)C2CC3C(C1C2)(C)O3,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)n(C)c1c2cccc1,mutagenic
+CC(=O)Nc1ccc2c(c1)cccn2,mutagenic
+Oc1cccc2c1C(=O)c1cccc(c1C2=O)O,mutagenic
+OC(=O)C1CC(N(C1(C)C)O)(C)C,non-mutagenic
+OCCN(c1ccc(cc1)N=Nc1ccc(nc1)N(CCO)CCO)CCO,non-mutagenic
+CCCCCN(CCCCC)CCCCC,non-mutagenic
+COc1cc(OC)c2c(c1)OC1C2C2OC2O1,mutagenic
+Clc1nncc2c1nccc2,mutagenic
+CC(CCCCCOC(=O)c1ccccc1C(=O)OCCCCCC(C)C)C,non-mutagenic
+Cc1cccc(c1)C,non-mutagenic
+O[C@@H](COc1cccc2c1cccc2)CNC(C)C,non-mutagenic
+OCc1ccc2c(c1)nc1c(c2CO)ccc2c1cccc2,non-mutagenic
+Clc1ccc(c(c1)[N+](=O)[O-])N,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C/C(=O)NCCCCC,mutagenic
+BrCc1ccc(cc1)CBr,non-mutagenic
+O=CNc1ccc(cc1)Oc1ccc(cc1Cl)Cl,mutagenic
+OCC(=O)[C@@]1(O)[C@H](C)CC2[C@]1(C)C[C@H](O)[C@]1(C2CCC2=CC(=O)C=C[C@]12C)F,non-mutagenic
+Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(O)nc2c1cccc2,non-mutagenic
+Clc1nncc2c1cncc2,non-mutagenic
+Sc1ccccc1,non-mutagenic
+Clc1cccnc1,non-mutagenic
+Clc1ccc(cc1)SCc1ccc(cc1)Cl,non-mutagenic
+C/C(=N/O)/C(=O)C,non-mutagenic
+BrCBr,mutagenic
+NCCCN(CC)CC,non-mutagenic
+N#C/C(=C\C(C(C(c1ccc(cc1)F)C#N)c1ccccc1)C)/c1ccc(cc1)F,non-mutagenic
+COc1c(Cl)c(Cl)c(c(c1Cl)Cl)[N+](=O)[O-],non-mutagenic
+O=C1C=C(N2CC2)C(=O)c2c1[nH]c(C)c1-c2nc2c1cccc2,mutagenic
+CC(C(CBr)Br)Cl,mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1O)[N+](=O)[O-])O,non-mutagenic
+CN(c1nc(nc(n1)N(C)C)N(C)C)C,non-mutagenic
+C1CCCCC1,non-mutagenic
+OCC(C(C(C1SCCN1N=O)O)O)O,non-mutagenic
+CN(CCO[C@](c1ccccn1)(c1ccccc1)C)C,non-mutagenic
+c1ccc2-c3cc4c(nc3C3C(c2c1)O3)ccc1c4cccc1,mutagenic
+Cc1ccc(cc1)N=NN(C)C,mutagenic
+C=C[C@@](OC(=O)c1ccccc1N)(CCC=C(C)C)C,non-mutagenic
+Oc1ccc2c3c1ccc1c3c(cc2)c(cc1)[N+](=O)[O-],mutagenic
+O=NN(Cc1cccc(c1)C#N)C,mutagenic
+c1nccs1,mutagenic
+Cc1cc2cccc3-c4c(-c(c1)c23)cc1ccccc1c4,mutagenic
+Clc1ccncc1,non-mutagenic
+C[C@H](COC[C@H](O)C)O,non-mutagenic
+CC(=O)Nc1ccc2-c3c(Cc2c1OC(=O)c1ccccc1)cccc3,non-mutagenic
+O=C1CCc2c1c(C)c(C)c1c2ccc2c1cccc2,mutagenic
+NC[C@H](N)C,non-mutagenic
+CCC(=C)C(=O)c1ccc(c(c1Cl)Cl)OCC(=O)O,non-mutagenic
+OC1C=Cc2c(C1O)c(Br)c1c(c2)c2ccccc2cc1,non-mutagenic
+OC(=O)c1cc(c(cc1NCc1ccco1)Cl)S(=O)(=O)N,non-mutagenic
+Oc1cccc2c1c1cc3ccccc3cc1c1c2cccc1,non-mutagenic
+OCC1OC(OC(C(C(=O)NC(C(C(C(=O)NC(C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCCN(CCCNC(=N)CC2CCC(CC2)Cl)C)C(O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)C(C(=O)N)CNCC(C(=O)N)N)c2c[nH]cn2)C(C(C1O)O)OC1OC(CO)C(C(C1O)OC(=O)N)O,mutagenic
+CC[N+](=C1C=CC(=C(c2ccc(cc2S(=O)(=O)O)O)c2ccc(cc2)N(Cc2cccc(c2)S(=O)(=O)O)CC)C=C1)Cc1cccc(c1)S(=O)(=O)O,non-mutagenic
+Fc1cccc2c1cccn2,mutagenic
+Clc1ccc(c(c1)N)C,non-mutagenic
+O1CCOCCOCCOCCOCCOCCOCC1,non-mutagenic
+OC(COc1ccccc1C1CCCC1)CNC(C)(C)C,mutagenic
+S1CC1,mutagenic
+C1OC(=O)C=C1,non-mutagenic
+O=NN(C1OCC(C(C1O)O)O)CCc1c[nH]c2c1cccc2,mutagenic
+NNC(=O)CN(c1ccc2c(c1)cccc2)C,non-mutagenic
+COc1nsc2c1ccc(c2)[N+](=O)[O-],mutagenic
+CC/C(=C(\c1ccc(cc1)OP(=O)(O)O)/c1ccc(cc1)OCCN(C)C)/c1ccc(cc1)C(C)C,non-mutagenic
+[O-][N+](=Nc1ccc2-c3c(Cc2c1)cccc3)c1ccc2-c3c(Cc2c1)cccc3,non-mutagenic
+CCC(=O)C(=O)C,non-mutagenic
+CCCCC#N,non-mutagenic
+ON(c1ccc(cc1)Br)C(=O)C,non-mutagenic
+ONc1c(C)cccc1C,mutagenic
+Cc1cc(O)c(c(=O)o1)C(=O)C,non-mutagenic
+c1ccc2-c3c([C@H]4[C@@H](c2c1)O4)ccc1c3cccc1,mutagenic
+CC(C[C@H](Nc1ccc(cc1)Nc1ccccc1)C)C,non-mutagenic
+BrCc1c2ccc3c(c2cc2c1cccc2)cccc3,mutagenic
+C1Cc2c(C1)c1ccc3c(c1cc2)cccc3,non-mutagenic
+CC(C1CCC2(CC1)OC2)(C)C,non-mutagenic
+[O-][N+](=O)c1ccc2c(c1)cccc2C,mutagenic
+COc1cc(cc(c1OC)OC)C1OCC2C1COC2c1cc(OC)c(c(c1)OC)OC,non-mutagenic
+CCC(COC(=O)c1ccccc1C(=O)O)CCC(O)C,non-mutagenic
+CC1c2ccccc2-c2c1cc(C)c(c2)C,mutagenic
+Cc1c2ccccc2c(c2c1cccc2)C,mutagenic
+OC(=O)Cc1c[nH]c2c1cc(O)cc2,non-mutagenic
+N#CSCSC#N,non-mutagenic
+Nc1nc(C)c2c(c1C)[nH]c1c2cccc1,mutagenic
+[O-][N+](=O)c1cccc2c1nc1cccc(c1n2)[N+](=O)[O-],non-mutagenic
+[N-]=[N+]=NC[C@H](Cn1cnc2c1ncnc2N)O,mutagenic
+COc1ccc(cc1)/C=C/c1ccc(cc1)N,mutagenic
+OC1C(O)C(OC(C1O)C(=O)O)Oc1c2ccccc2c2c3c1ccc1c3c(cc2)ccc1,non-mutagenic
+Oc1ccc2c(c1)c1c(cc2)[nH]c2c1c1ccccc1c(c2)[N+](=O)[O-],mutagenic
+O=C(c1ccccc1)ON=C1C=CC(=NOC(=O)c2ccccc2)C=C1,mutagenic
+O=C1c2ccccc2-c2c3c1nccc3cc1c2OCO1,mutagenic
+BrCC#C,mutagenic
+Cc1ccncc1,non-mutagenic
+NCCC(N)C,non-mutagenic
+CCCC(C(=O)O)CCC,non-mutagenic
+CC(=O)Oc1cc([N+](=O)[O-])c2c3c1ccc1c3c(cc2)ccc1,mutagenic
+CCSCCOP(=S)(OC)OC,non-mutagenic
+CC(COS(=O)(=O)c1ccccc1)C,mutagenic
+N#N=NCCC(c1ccccc1)c1ccccc1,mutagenic
+[O-][N+](=O)c1ccc2c(c1)cccc2,mutagenic
+CN1CCN(CC1)c1c(F)cc2c3c1OCN(n3cc(c2=O)C(=O)O)C,mutagenic
+CCNC(=S)NCC,non-mutagenic
+CCCC[C@H](CO)CC,non-mutagenic
+Oc1ccc(cc1)OP1(Oc2ccc(cc2)O)NP(Oc2ccc(cc2)O)(Oc2ccc(cc2)O)NP(N1)(Oc1ccc(cc1)O)Oc1ccc(cc1)O,non-mutagenic
+ClCCNC(=O)Sc1[nH]cnc2-c1ncn2,mutagenic
+CCCCCCCCCCCCC=C,non-mutagenic
+N#CC(=C1C=C(/C=C/c2ccc(cc2)N(C)C)OC(=C1)C)C#N,mutagenic
+O=C(c1[nH]c2c(c1N)cccc2)N/N=C/c1ccccc1,non-mutagenic
+CCOC1=CC(c2ccccc2)(c2ccccc2)N(c2c1cccc2)O,non-mutagenic
+CN(CCCNc1c2ccccc2nc2c1c(ccc2C)[N+](=O)[O-])C,mutagenic
+[O-][N+](=O)c1cccc2c1[nH]c1c2cccc1,mutagenic
+CCON(C(=O)c1ccccc1)OC(=O)C,mutagenic
+Nc1cccc2c1cc1ccccc1n2,mutagenic
+O=c1oc2cccc3c2c2c1cc1ccccc1c2cc3,mutagenic
+Brc1ccc(cc1)NC(=O)c1cc(Br)cc(c1O)Br,non-mutagenic
+O=Cc1ccccc1,non-mutagenic
+CCCCCCCCCCCC=C,non-mutagenic
+CC(CN(CC(O)C)CCN(CC(O)C)CC(O)C)O,non-mutagenic
+CC(c1ccc2c(c1)c(=O)c1c(o2)nc(c(c1)C(=O)O)N)C,non-mutagenic
+CC(=O)OCc1ccccc1,non-mutagenic
+OCCNc1ccc(cc1)N=Nc1ccc(cc1)NCCO,mutagenic
+COc1ccc(cc1)N=Nc1ccc(cc1)N(C)C,mutagenic
+COC(=O)c1ccccc1C(=O)OC,non-mutagenic
+BrCc1cccc(c1)CBr,non-mutagenic
+c1ccc(cc1)[Se][Se]c1ccccc1,mutagenic
+Clc1cccc(c1O)Cl,non-mutagenic
+Cc1cc2cc3ccccc3cc2c2c1cccc2,mutagenic
+ClC(C(=O)N1CCN(C1=O)c1ncc(s1)[N+](=O)[O-])Cl,mutagenic
+OC(CO)CN=N#N,mutagenic
+Nc1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C,mutagenic
+CCc1ccc2-c3c(-c4c2c1ccc4)cccc3,non-mutagenic
+O=C1CCc2c1cc(c1c2ccc2c1cccc2)C(F)(F)F,mutagenic
+O=C1NC(=O)[C@@H]2[C@H]1CC=CC2,non-mutagenic
+CN1CCC[C@@H]1c1cccnc1,non-mutagenic
+Oc1cc(O)c2c(c1)oc1c(c2=O)cc(cc1)O,mutagenic
+NC(=S)c1c(Cl)cccc1Cl,mutagenic
+CC(=O)N(c1snc2c1cccc2)C,non-mutagenic
+c1ccc(cc1)/C=N/c1snc2c1cccc2,non-mutagenic
+c1cc(OCC2CO2)c2c(c1)cns2,mutagenic
+OCNC(=O)NCO,mutagenic
+OC1C(O)C(O)COC1N(c1ccc(cc1)C)N=O,mutagenic
+CN(c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+CCNCC,non-mutagenic
+C1O[C@H]1C=O,mutagenic
+COc1cc(ccc1NC(=O)C)NC(=O)C,non-mutagenic
+CC(c1ccc(cc1)OC[C@@H]1OC1)(c1ccc(cc1)OC[C@@H]1OC1)C,mutagenic
+[O-][N+](=O)c1ccc2-c3c4c(-c2c1)cc1ccccc1c4ccc3,mutagenic
+CN([C@H]1C(=O)C(=C([C@]2([C@H]1[C@H](O)[C@H]1C(=C2O)C(=O)c2c([C@]1(C)O)cccc2O)O)O)C(=O)N)C,non-mutagenic
+CC1(CO1)C1CO1,mutagenic
+ClCc1ccc(cc1)C,non-mutagenic
+COC1=CC(=O)C=C/C/1=N\c1c2ccccc2nc2c1cccc2,non-mutagenic
+CN1CCC2OC(=O)C3(OC3C)CC(C(C(=O)OCC(=CC1)C2=O)(C)O)C,mutagenic
+CC(c1ccccc1)(OOC(c1ccccc1)(C)C)C,non-mutagenic
+OC[C@@H](CBr)Br,mutagenic
+Nc1ccc(c(c1)O)[N+](=O)[O-],mutagenic
+ClCc1ccc2c3c1-c1ccccc1-c3ccc2,mutagenic
+Oc1ccc(cc1)N=Nc1ccc(cc1)c1ccc(cc1)N=Nc1c(N)c2c(cc1S(=O)(=O)O)cc(c(c2O)N=Nc1ccccc1)S(=O)(=O)O,mutagenic
+Nc1ccc2c(c1)nc1c(n2)cccc1,mutagenic
+O[C@H](C(=O)c1ccccc1)c1ccccc1,non-mutagenic
+OCCOC(=O)C=C,non-mutagenic
+CC(=O)CCC(=O)C,non-mutagenic
+[O-][N+](=O)c1cccc2c1cccc2C,mutagenic
+OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](OC(=O)[C@@]34CC[C@H]([C@@H]([C@H]4C4=CC[C@H]5[C@@]([C@@]4(CC3)C)(C)CC[C@@H]3[C@]5(C)C[C@H]([C@@H]([C@@]3(C)CO)O)O)C)C)[C@@H]([C@H]([C@@H]2O)O)O)[C@@H]([C@H]([C@@H]1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)O)O,non-mutagenic
+O=NN(Cc1ccccc1)Cc1ccccc1,non-mutagenic
+COc1ccc(cc1N)NOS(=O)(=O)O,mutagenic
+O1CCN(CC1)Sc1nc2c(s1)cccc2,non-mutagenic
+CC[C@]1(OCCc2c1n(C)c1c2cccc1)CC(=O)O,non-mutagenic
+NC(C(S)(C)C)C(=O)O,mutagenic
+O[C@@H](COc1cccc2c1OC[C@H](C2)O[N+](=O)[O-])CNC(C)C,non-mutagenic
+O=C1CCCCC1,non-mutagenic
+ClCCNC(=O)N(CCCl)N=O,mutagenic
+c1ccc2-c3ncsc3CCc2n1,non-mutagenic
+COC(=O)/C(=C(/c1ccc(cc1Cl)Cl)\OP(=O)(OC)OC)/Br,non-mutagenic
+O=C(c1ccccc1)Nc1ccc2-c3c(Cc2c1)cccc3,mutagenic
+CC(c1ccccc1)Cl,non-mutagenic
+CN(CCNC(=O)c1cccc2c1Nc1ccccc1O2)C,mutagenic
+N1CCc2c(C1)cccc2,non-mutagenic
+CCCCc1cc(C)cc(c1O)CCCC,non-mutagenic
+C1CCC2C(C1)c1ccccc1CC2,non-mutagenic
+CC(CC1NC(=O)C(C)N(C)C(=O)CNC(=O)/C(=C\c2ccccc2)/N(C1=O)C)C,non-mutagenic
+COC(=O)C(NC(=O)C)CSCC(Br)C,mutagenic
+OCCN(c1ccc(c(c1)C)N=Nc1cccnc1)CCO,non-mutagenic
+CN(CCNC(=O)c1cccc2c1nc1ccccc1c2N)C,mutagenic
+ONc1ccc(c(c1)[N+](=O)[O-])C,non-mutagenic
+COc1cc(C=C)ccc1O,non-mutagenic
+CCc1cccc2c1oc(c2)[C@@H](CNC(C)(C)C)O,non-mutagenic
+CCCCC(COC(=O)c1ccc(cc1)N(N=O)C)CC,non-mutagenic
+COP(=O)(OC)O,non-mutagenic
+[O-][N+](=O)c1ccccc1C(=O)C,non-mutagenic
+Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C,mutagenic
+OC(c1c(C)cccc1[N+](=O)[O-])O,mutagenic
+Clc1ccc2c(c1)C(=NCC(=O)N2C)c1ccccc1,non-mutagenic
+Oc1[nH]nc2c1cccc2,non-mutagenic
+CN1CCNCC1,non-mutagenic
+O=c1c2ccc3c4c2c(c2n1c1ccccc1n2)ccc4c(=O)n1c3nc2c1cccc2,mutagenic
+c1ccc2c(c1)ccc1c2ccc2c1ccnc2,mutagenic
+[O-][N+](=O)c1cc(cc(c1Nc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Cc1ccc2c(c1)cccc2,non-mutagenic
+[O-][N+](=O)c1ccc2-c3ccccc3CCc2c1,mutagenic
+CCCCCCCCCCCCCC(=O)ON(c1ccc2-c3c(Cc2c1)cccc3)C(=O)C,mutagenic
+CCCCOC(=O)c1ccccc1C(=O)OCc1ccccc1,non-mutagenic
+OCN=N,mutagenic
+CN(C)C,non-mutagenic
+NC1CCCCC1,non-mutagenic
+CCc1ccc(cc1)C(c1ccc(cc1)CC)C(Cl)Cl,mutagenic
+CCN(C(=S)SSCC(C(=O)O)NC(=O)C)CC,non-mutagenic
+COc1cc(Cc2cnc(nc2N)N)cc(c1OC)OC,non-mutagenic
+O=C(c1ccccc1)Nc1cccc2c1C(=O)c1ccc3c(c1C2=O)[nH]c1c3cc(c2c1C(=O)c1ccccc1C2=O)NC(=O)c1ccccc1,non-mutagenic
+C(C1OC1)CC1OC1,mutagenic
+CCCCCN(CCCCO)N=O,mutagenic
+CC(=O)Nc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+Clc1ccc2c(c1)cc1c(c2)cccc1,mutagenic
+[O-][N+](=O)[CH-]CCCC,non-mutagenic
+Cc1cc2c(nc1N)[nH]c1c2cccc1,mutagenic
+COc1ccc(cc1)CN(c1ncccn1)CCN(C)C,non-mutagenic
+CC(C(=O)N)Br,mutagenic
+Nc1cc2ccc3c4c2c(c1)ccc4ccc3,mutagenic
+NC(=N)N,non-mutagenic
+OC1C=Cc2c(C1O)cc1c3c2ccc2c3c(cc1)ccc2[N+](=O)[O-],mutagenic
+NC(=O)CI,non-mutagenic
+Nc1cc(N)c(c(c1)[N+](=O)[O-])C,mutagenic
+CC(CNC(=O)/C=C/c1ccc(o1)[N+](=O)[O-])C,mutagenic
+CCCn1cc2c3c1cccc3C1C(C2)N(C#N)CC(C1)C,mutagenic
+O=Nc1cccc(c1)C,non-mutagenic
+COC(=O)Nc1[nH]c2c(n1)cc(cc2)C(=O)c1ccccc1,mutagenic
+OCC1=C[C@@H]2CC(C[C@H]2[C@]2([C@]1(C=O)C2)C)(C)C,mutagenic
+OC(=O)c1occ(c1c1ccccc1)c1ccccc1,non-mutagenic
+O=C(c1ccccc1)Nc1snc2c1cccc2,mutagenic
+[O-][N+](=O)c1ccc(cc1)Oc1ccccc1,mutagenic
+CC(C(=O)O)Oc1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+O=C(OC(C)(C)C)Sc1nc(C)cc(n1)C,non-mutagenic
+Fc1ccc(c2c1ccc1c2nccc1)F,mutagenic
+CCOC(=O)CBr,mutagenic
+Cc1ccc(cc1)O,non-mutagenic
+COc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Cc1cccc2c1c1cc3ccccc3cc1cc2,mutagenic
+[O-][N+](=O)c1cc(ccc1n1cnc2c1ncnc2N)[N+](=O)[O-],mutagenic
+Cc1c2ccccc2c(c2c1cccc2)[C@@H]1CO1,mutagenic
+CN(c1ccc(cc1)N)C,mutagenic
+N1[C@@H]([C@H]1c1ccccc1)c1ccccc1,mutagenic
+COc1ccc(c2c1nc1ccccc1c2NCCCN(C)C)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1c(N)ccc2c1c1ccccc1[nH]2,mutagenic
+CCCCN(CCO)N=O,mutagenic
+O=CC=O,mutagenic
+O=C1C=Cc2c(C1=O)ccc1c2cc2ccccc2c1,non-mutagenic
+OC(=O)C(=O)O,non-mutagenic
+CC[C@H](Nc1ccc(cc1)N[C@@H](CC)C)C,non-mutagenic
+O=C1CCc2c1cc(C)c1c2ccc2c1cccc2,mutagenic
+O=CCCCC=O,mutagenic
+OCC(=O)[C@@]1(O)C[C@H](O[C@H]2C[C@H](N)[C@H]([C@@H](O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2,mutagenic
+NC(=O)OCc1ncc(n1C)[N+](=O)[O-],mutagenic
+OCC1(CO1)C12OC2C2(C(=CC1=O)CCC(C2C)O)C,mutagenic
+ClCCN(CCCl)C,mutagenic
+O=C1C=CC(=O)c2c1cccc2,mutagenic
+OC(=O)Cc1cccc2c1cccc2,non-mutagenic
+O=C1CCC2(C(=C1)C1CC1C1C2CCC2(C1C1CC1C12CCC(=O)O1)C)C,non-mutagenic
+CNc1ccc2c(c1N)nc(cn2)C,non-mutagenic
+CN(C(=S)SSC(=S)N(C)C)C,mutagenic
+OCc1ccccc1,non-mutagenic
+Oc1c2c(ccc3c2OCCO3)nc2c1cccc2,mutagenic
+OCCCNC(=O)C(C(CO)(C)C)O,non-mutagenic
+BrCC(C)(C)C,non-mutagenic
+CCCCN([C@H](OC(=O)C)CCC)N=O,mutagenic
+OC1C2OC2c2c(C1O)cccn2,non-mutagenic
+c1ccc2c(c1)c(ccc2)CC1CO1,mutagenic
+CC(=O)Nc1cnc2c(c1)cccc2,non-mutagenic
+CCC(=O)n1ncc(c(c1=O)Cl)Cl,non-mutagenic
+Clc1nncc2c1cccc2,non-mutagenic
+Cc1ccc(c(c1)[N+](=O)[O-])N,mutagenic
+CCN(c1ccc(cc1)N)CC,mutagenic
+CC1CCCC1,non-mutagenic
+Cc1cc(O)c2c(c1)C(=O)C(=CC2=O)c1c(C)cc2c(c1O)C(=O)C=CC2=O,non-mutagenic
+O[C@H]1C=Cc2c([C@@H]1O)c1ccc3c4c1c(c2)ccc4c(cc3)[N+](=O)[O-],mutagenic
+c1ccc2c(c1)ccc1-c3c4c(-c21)cccc4ccc3,mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/SCC(CO)O,non-mutagenic
+COc1cc(ccc1OC)c1nc(c([nH]1)c1ccccc1)c1ccccc1,mutagenic
+O=NN1CCSC1C(C(C(C(O)C)O)O)O,non-mutagenic
+CCCCOCCOC(=O)COc1ccc(cc1Cl)Cl,non-mutagenic
+CC(=CC1C(C1(C)C)C(=O)O)C,non-mutagenic
+Clc1cc(Cl)c(c(c1Cl)O)Cl,non-mutagenic
+COP(=O)(NC(=O)C)SC,non-mutagenic
+c1cnc2c(c1)ccc1c2cccn1,mutagenic
+COC(=O)COc1ccc(cc1Cl)Cl,non-mutagenic
+Oc1cccc2c1c(O)c1c(c2)cccc1O,non-mutagenic
+OC(=O)c1cccnc1Nc1cccc(c1)C(F)(F)F,non-mutagenic
+O=NN1CCNCC1,mutagenic
+BrCc1ccc2-c3c(-c4c2c1ccc4)cccc3,mutagenic
+CC(Cl)Cl,non-mutagenic
+[O-][N+](=O)c1ccc(o1)/C=N/N1CCCNC1=O,mutagenic
+O=C/C=C\c1ccccc1OC,mutagenic
+CCNc1snc2c1cccc2,non-mutagenic
+O=C1C=Cc2c(C1=O)ccc1c2c(C)c2ccccc2c1C,non-mutagenic
+CC(NCC(c1ccc(cc1)NS(=O)(=O)C)O)C,non-mutagenic
+CCOC(=O)Cc1c(C(=O)O)c2c(n1C)cccc2,non-mutagenic
+C=C[C@H](c1ccc(cc1)OC)OC(=O)C,mutagenic
+C/C=C/c1cc2OC(C)C(C(=O)c2c(=O)o1)O,non-mutagenic
+CC(=O)C(=O)C,mutagenic
+CC(=O)Nc1cc2Cc3c(-c2cc1Cl)cccc3,mutagenic
+OC(=O)/C=C\C(=O)O,non-mutagenic
+O=C1CCCC2=C1C(C)(C)C(C2(C)C)C,non-mutagenic
+ClCCCBr,mutagenic
+O=c1cc(n(n1c1ccccc1)C)C,non-mutagenic
+CC1(O)C=Cc2c3C1(O)CCc3c1c(c2)c2ccccc2cc1,mutagenic
+Cc1cc(C)cc(c1)O,non-mutagenic
+Clc1c(Cl)cnn(c1=O)S(=O)(=O)C,mutagenic
+C1CCC(CC1)NSc1nc2c(s1)cccc2,non-mutagenic
+OCC1NC(Cc2c1[nH]c1c2cccc1)C(=O)O,non-mutagenic
+COC(=O)C1=C(C)C(OC1=O)(C)O,non-mutagenic
+Nc1scc(n1)/C=C\c1ccc(o1)[N+](=O)[O-],mutagenic
+CN(CCNC(=O)c1cccc2c1nc1ccccc1c2)C,mutagenic
+Clc1cc(Cl)cc(c1)Cl,non-mutagenic
+CCOP(=S)(SCCl)OCC,non-mutagenic
+Oc1cnc2c(c1)cccc2,non-mutagenic
+CCCCCO,non-mutagenic
+OCc1ccc2c(c1)c(C)c1c(n2)c2C=CC(C(c2cc1)O)O,mutagenic
+Oc1ccc2c(c1)cc[nH]2,non-mutagenic
+COC1=C(CC)C(=O)c2c(C1=O)c(O)c(c(c2O)OC)OC,non-mutagenic
+CC(=O)NS(=O)(=O)c1ccc(cc1)N,non-mutagenic
+OCc1cc(ccc1O)C(CN(C(C)(C)C)Cc1ccccc1)O,mutagenic
+O/N=C/C(=O)Nc1ccccc1,non-mutagenic
+CC(C(=O)NCc1ccccc1)Br,mutagenic
+c1cc2cccc3c2c(c1)c1cccc2c1c3ccc2,mutagenic
+Oc1c2ccccc2nc2c1cccc2,non-mutagenic
+CC(=O)Nc1ccc(c(c1)N=Nc1cc(ccc1C)NC(=O)C)C,non-mutagenic
+O[C@H]1Cc2c(C1=O)cc(c1c2ccc2c1cccc2)C,mutagenic
+Nc1ccc(c(c1)[N+](=O)[O-])O,mutagenic
+CC#N,non-mutagenic
+O=C1C=Cc2c3c1ccc1c3c(cc2)C=CC1=O,mutagenic
+Oc1ccc(c2c1nccc2)S(=O)(=O)O,mutagenic
+CCC(C(N(C(=O)C(C(C)C)NC(=O)C(N(C)C)C(C)C)C)C(CC(=O)N1CCCC1C(C(C(=O)NC(c1nccs1)Cc1ccccc1)C)OC)OC)C,non-mutagenic
+O=C1CCC(=O)N1c1ccc(c(c1Cl)Cl)Cl,non-mutagenic
+Clc1ccc2-n3cnnc3CN=C(c2c1)c1ccccc1,non-mutagenic
+Cl/C=C(/SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)\Cl,mutagenic
+CC(CCCCCOC(=O)Cc1ccc(cc1Cl)Cl)C,non-mutagenic
+O1CC1Cc1ccccc1,mutagenic
+N[C@H](C(=O)O)CS/C(=C/Cl)/Cl,mutagenic
+C=CCOC(=O)c1ccccc1C(=O)OCC=C,non-mutagenic
+CCC(=O)Nc1ccc(c(c1)Cl)Cl,non-mutagenic
+Cc1cccc2c1c1ccc3c(c1cc2)cccc3,mutagenic
+CC(=O)Nc1scc(n1)/C=C\c1ccc(o1)[N+](=O)[O-],mutagenic
+NC(=O)Cc1cccc2c1cccc2,mutagenic non-mutagenic
+[O-][N+](=O)c1ccc(cc1)n1cnc2c1ncnc2N,mutagenic
+Cc1cc2n(C)c(nc2c2c1nccn2)N,mutagenic
+O=C(N(C)C)Nc1ccc(c(c1)Cl)C,non-mutagenic
+O[C@H]1C=Cc2c([C@@H]1O)cc1-c3cccc4c3c(-c1c2)ccc4,mutagenic
+ClC[Si](C=C)(C)C,non-mutagenic
+c1ccc2c(c1)cc1c3c2[C@@H]2O[C@@H]2c2c3c(cc1)ccc2,mutagenic
+ONc1cccc(c1)C,mutagenic
+CCNc1nc(NCC)nc(n1)Cl,non-mutagenic
+C1CC2CCc3c(C42C(C1)O4)cccc3,non-mutagenic
+CNC(=O)Oc1ccccc1,non-mutagenic
+Oc1ccc(cc1)C1(OC(=O)c2c1cccc2)c1ccc(cc1)O,non-mutagenic
+Fc1c(F)c(F)c(c(c1Cl)F)Cl,non-mutagenic
+C=Cc1ccc(cc1)N,mutagenic
+COc1ccc2c(c1)[nH]c1c2CCN2[C@@H]1C[C@H]1[C@H](C2)C[C@H]([C@@H]([C@H]1C(=O)OC)OC)OC(=O)c1cc(OC)c(c(c1)OC)OC,non-mutagenic
+OC(C(F)(F)F)C(F)(F)F,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)Nc1ncnc2c1ncn2c1ccc(cc1)[N+](=O)[O-],mutagenic
+CC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-],non-mutagenic
+Cc1cccc(c1N=Nc1c(O)ccc2c1cccc2)C,non-mutagenic
+C/C=C/C1OC(=O)C=CC1O,non-mutagenic
+[O-][N+](=O)c1cc(ccc1C(=O)O)[N+](=O)[O-],mutagenic
+C1CCSCS1,mutagenic
+CN(c1ccc(cc1)C1(OC(=O)c2c1ccc(c2)N(C)C)c1ccc(cc1)N(C)C)C,non-mutagenic
+Oc1c2ccccc2nc2c1cco2,non-mutagenic
+CN(CCNC(=O)c1cccc2c1nc(cc2)c1ccccc1)C,mutagenic
+[O-][N+](=O)c1c(N)ccc2c1[nH]c1c2cccc1,mutagenic
+C(Sc1ccccc1)CSc1ccccc1,non-mutagenic
+Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C,non-mutagenic
+Oc1c(N=Nc2ccc(cc2)S(=O)(=O)O)c2ccc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,mutagenic
+[O-][N+](=O)c1ccc2c(c1)cn[nH]2,mutagenic
+ClC(=O)OCC1c2ccccc2-c2c1cccc2,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2c(C)cc2c1cccc2,mutagenic
+O=NN(CCCC(c1cccnc1)O)C,mutagenic
+O=C1N(CCN2C(=O)c3c(C2=O)c(Br)c(c(c3Br)Br)Br)C(=O)c2c1c(Br)c(c(c2Br)Br)Br,non-mutagenic
+OCC1OC(OC23CCC4C(C2)(CC3=C)CCC2C4(C)CCCC2(C)C(=O)O)C(C(C1O)O)O,mutagenic
+O=NN1CCN([C@H](C1)C)N=O,mutagenic
+c1cccnc1,non-mutagenic
+ClCCBr,mutagenic
+c1cc2ccc3c4c2c2c1ccc1c2c2c4c(cc3)ccc2cc1,mutagenic
+ClC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+N#CCc1ccccc1[N+](=O)[O-],mutagenic
+NC(=O)Nc1cc(ccc1O)C(CNC(C)(C)C)O,non-mutagenic
+OCCC(CCC=C(C)C)C,non-mutagenic
+OCc1c(O)cc2c(c1O)C(=O)c1c(C2=O)cccc1,mutagenic
+CCOC(=O)C,non-mutagenic
+CC(CN(C(=N)N[N+](=O)[O-])N=O)C,mutagenic
+OC(=O)Cc1c[nH]c2c1cccc2,non-mutagenic
+O=C1C=CC(=O)C(=C1)Cl,non-mutagenic
+ClCc1ccc(cc1)[N+](=O)[O-],mutagenic
+CCC#N,non-mutagenic
+CC(=O)Nc1nc2c(s1)CCC1C2=CCCN1CC=C,non-mutagenic
+O1C=CC2C(C=C1)O2,non-mutagenic
+Nc1nc2c(n1C)ccc1c2nccc1,mutagenic
+COc1ccc2c(c1)[nH]c1c2CCN2[C@@H]1C[C@H]1[C@H](C2)C[C@H]([C@@H]([C@H]1C(=O)OC)OC)OC(=O)/C=C/c1cc(OC)c(c(c1)OC)OC,non-mutagenic
+CC(NC(=O)NS(=O)(=O)c1cnccc1Nc1cccc(c1)C)C,non-mutagenic
+O1OC2c3c(C1c1c2cccc1)cccc3,non-mutagenic
+ClCc1cc2cc3ccccc3c3c2c2c1cccc2cc3,mutagenic
+CCC/C=N\O,mutagenic
+COC(=O)c1cc(ccc1N)c1ccc(c(c1)C(=O)OC)N,mutagenic
+CSC(/C=N\O)(C)C,non-mutagenic
+ClCC(=C)Br,mutagenic
+c1ccc2c(c1)c1cc3C=Cc4c3c(c1cc2)ccc4,mutagenic
+BrC[C@H]([C@@H]1CC[C@H]([C@H](C1)Br)Br)Br,non-mutagenic
+c1ccc2c(c1)scn2,non-mutagenic
+COCCOC(=O)c1ccccc1C(=O)OCCOC,mutagenic
+COC1OC1(C)C,mutagenic
+OCC1OC(O)C(C(C1O)OP1(=NP(=NP(=N1)(OC1C(O)C(O)OC(C1O)CO)OC1C(O)C(O)OC(C1O)CO)(OC1C(O)C(O)OC(C1O)CO)OC1C(O)C(O)OC(C1O)CO)OC1C(O)C(O)OC(C1O)CO)O,non-mutagenic
+CC(=O)NC(C(=O)O)CS/C(=C(/C(F)(F)F)\F)/F,non-mutagenic
+CC(OC1OC(=O)C(=C1Cl)Cl)C,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C/C(=O)OC,mutagenic
+CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCC(O)C,non-mutagenic
+[O-][N+](=Nc1ccc(c(c1)Cl)Cl)c1ccc(c(c1)Cl)Cl,non-mutagenic
+O=NN(C[C@]1(O)OC[C@H]([C@H]([C@H]1O)O)O)CC(=O)O,non-mutagenic
+Nc1ccc(cc1)S(=O)(=O)Nc1onc(c1C)C,non-mutagenic
+BrCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+c1ccc2c(c1)cc(cc2)[C@@H]1CO1,mutagenic
+OCC1OC(C(C1O)O)n1cnc2c1ncnc2NCc1ccc(cc1)[N+](=O)[O-],mutagenic
+CCCCCCCCCCSCn1cc[n+](c1)C,mutagenic
+[O-][N+](=O)c1cc2c3cc(nc(c3[nH]c2c(c1)[N+](=O)[O-])C)[N+](=O)[O-],mutagenic
+Nc1ccc2c(c1)C(=O)c1c(C2=O)cc(cc1)N,mutagenic
+Oc1ccc2c(n1)ccc1c2nc(n1C)N,mutagenic
+COP(=S)(Oc1nc(Cl)c(cc1Cl)Cl)OC,non-mutagenic
+CC(Br)(C)C,mutagenic
+CN(CCNC(=O)c1cccc2c1nc([nH]2)c1ccccc1)C,mutagenic
+CC(=O)C1(C)OC21C=Cc1c(C2=O)cccc1,non-mutagenic
+COc1ccc(cc1)/C=C/C(=O)c1ccccc1,non-mutagenic
+OC(=O)CCC(C1CCC2C1(C)CCC1C2CCc2c1ccc(c2)O)C,non-mutagenic
+NCCCN(C)C,non-mutagenic
+CC(=O)OCc1c2ccccc2c(c2c1cccc2)C,mutagenic
+OC(=O)C1OC(Oc2ccc3c4c2ccc2c4c(cc3)cc3c2cccc3)C(C(C1O)O)O,non-mutagenic
+CCN(c1ccc2c(c1)oc(=O)c(c2)c1nc2c(n1C)cccc2)CC,non-mutagenic
+COc1cc(cc(c1OC)OC)C(=O)OCCCN1CCCN(CC1)CCCOC(=O)c1cc(OC)c(c(c1)OC)OC,non-mutagenic
+O=C(OC(C)(C)C)OC(=O)OC(C)(C)C,non-mutagenic
+O=CNc1scc(n1)c1ccc(o1)[N+](=O)[O-],mutagenic
+COc1cc(O)c2c(c1)c1c(C)cc(cc1oc2=O)O,non-mutagenic
+CC(=O)C1C(=O)C=C2C(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O,non-mutagenic
+CCOC(=O)c1cccc2c1nccc2,non-mutagenic
+CCN(c1ccc(cc1)N=O)CC,mutagenic
+OC(=O)c1oc(c(c1c1ccccc1)c1ccccc1)[N+](=O)[O-],mutagenic
+[O-][N+](=O)c1ccccc1[N+](=O)[O-],mutagenic
+CCCC[C@H](COC(=O)CCCCC(=O)O)CC,non-mutagenic
+C=CN1CCCC1=O,non-mutagenic
+O=c1ccoc(c1O)C,mutagenic
+Nc1ccc2c(n1)cccc2,mutagenic
+C=CCc1ccc2c(c1)OCO2,non-mutagenic
+O1CCOCC1,non-mutagenic
+Cc1c2ccccc2c(c2c1c1ccccc1cc2)COS(=O)(=O)O,mutagenic
+OC(=O)C(Oc1ccc(cc1Cl)Cl)C,non-mutagenic
+CC(=O)OCN(N=O)CCCl,mutagenic
+COC(=O)CC1OC(=O)c2c(C1)cc1c(c2O)c(O)c(c(c1)OC)c1c(OC)cc2c(c1O)c(O)c1c(c2)CC(OC1=O)CC(=O)OC,non-mutagenic
+Cc1ccc2c(c1)cc1c(n2)c2ccccc2cc1,mutagenic
+Nc1ccc(cc1Cl)c1ccc(c(c1)Cl)N,mutagenic
+CCCC1(O)CCC2C1(C)CCC1C2CCC2C1(C)C(C)CC(=O)C2,non-mutagenic
+CCOS(=O)(=O)c1ccc(cc1)C,mutagenic
+CC(=O)OC(=O)C,non-mutagenic
+Oc1ccc2c(c1)c(N)c1c(n2)cccc1,mutagenic
+OCC1OC(CC1O)n1cc(CC)c(=O)[nH]c1=O,non-mutagenic
+O=C(c1ccc(cc1)c1ccccc1)/C=C/c1ccccc1,non-mutagenic
+COc1cc2c3CCC(=O)c3cc(c2c2c1cccc2)C,mutagenic
+Oc1ccc2c(c1)OCO2,non-mutagenic
+c1ccc2c(c1)nccc2,mutagenic
+NC(=O)c1cc(N2CC2)c(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+CC(=C)C(=O)OC[C@@H](CBr)Br,mutagenic
+CC/C=C/[C@H](C=O)CC,non-mutagenic
+ClCc1c2ccc3c4c2c(c2c1cccc2)ccc4ccc3,non-mutagenic
+C1CCC(CC1)NC1CCCCC1,non-mutagenic
+CC(=O)Nc1cc(O)c2c3c1ccc1c3c(cc2)ccc1,mutagenic
+NNc1ccc(cc1)C(=O)O,non-mutagenic
+CCOP(=O)(N1C2C1c1ccccc1-c1c2cccc1)OCC,mutagenic
+CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+OC(COc1ccc(cc1)CC(=O)N)CNC(C)C,non-mutagenic
+N#Cc1cccc(c1)C,non-mutagenic
+CCCCC/C=C/C/C=C/CCCCCCCC(=O)O,non-mutagenic
+COC(=O)CCl,non-mutagenic
+Clc1cccc(c1)C(=O)O,non-mutagenic
+Clc1ccc(cc1)Cl,non-mutagenic
+OCc1cc2c([nH]1)c1ncccc1cc2,non-mutagenic
+CCN(CCNc1ccc(c2c1c(=O)c1c(s2)cccc1)COS(=O)(=O)C)CC,mutagenic
+[O-][N+](=O)c1c(O)ccc2c1[nH]c1c2cccc1,non-mutagenic
+O=Cc1ccc(cc1Cl)Cl,non-mutagenic
+Oc1ccc2-c3c4c(-c2c1)cc1ccccc1c4cc1c3cccc1,mutagenic
+ClC(=O)c1ccccc1Cl,mutagenic
+ClCCCN(COC(=O)C)N=O,mutagenic
+COc1cc(O)c2c(c1OC)oc1c(c2=O)c(OC)cc2c1[C@@H]1C=CO[C@H]1O2,mutagenic
+COc1c(OC)ccc2c1cc1N(C)C(=O)C(=O)c3c1c2c1OCOc1c3,mutagenic
+CC(c1ccc(cc1)OP(=O)(Oc1ccccc1)Oc1ccccc1)(C)C,non-mutagenic
+BrC[C@H](Br)C,mutagenic
+Nc1cc2nc3ccccc3nc2cc1O,mutagenic
+Cc1cccc2c1cc1c(c2)ccc2c1cccc2,mutagenic
+BrCCC(CCBr)(CO)CO,mutagenic
+OC(=O)C(Cl)(Cl)Cl,non-mutagenic
+OS(=O)(=O)OCc1ccc2c3c1ccc1c3c(cc2)ccc1,mutagenic
+O=C(c1ccccc1)/C=C/c1ccccc1[N+](=O)[O-],non-mutagenic
+Nc1ccc2c(c1)c(O)c(c(c2)S(=O)(=O)O)N=Nc1ccc(cc1)c1ccc(cc1)N=Nc1c(O)c2c(N)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,mutagenic
+CCCCCCCCCC[C@@H]1OC1,non-mutagenic
+ClC1OC1CBr,mutagenic
+Cc1ccc2c(c1C)cccc2,non-mutagenic
+Nc1ccc(cc1C)c1ccc(c(c1)C)N,mutagenic
+CCC1(C(=O)NC(=O)NC1=O)c1ccccc1,mutagenic
+[O-][N+](=O)c1ccc2c(-c3ccccc3C2)c1,mutagenic
+ClCC(COc1ccc(cc1)C(c1ccc(cc1)OCC(CCl)O)(C)C)O,non-mutagenic
+O=C1CCc2c1ccc1c2ccc2c1cccc2,mutagenic
+c1ccc(cc1)c1nc(c([nH]1)c1ccccc1)c1ccccc1,mutagenic
+O=Nc1ncn(c1c1ccccc1)C,mutagenic
+OC1C(=C)C2(CC31CCC1C(C3CC2)(C)CCCC1(C)C(=O)O)O,non-mutagenic
+O=CC1=CCC(CC1)C(=C)C,non-mutagenic
+Clc1c(O)c(Cl)c(c(c1Cl)Cl)Cl,non-mutagenic
+OCCCO/C=C/C=C/C=C/C=C/C=C/CC,mutagenic
+CC(Nc1snc2c1cccc2)C,non-mutagenic
+COc1ccc(cc1)CC1OC1,mutagenic
+NNc1nncc2c1nccc2,mutagenic
+CCN(c1cccc(c1)O)CC,mutagenic
+OCNC(=O)C=C,non-mutagenic
+COc1cc2nc3cc(N)c(cc3nc2cc1N)OC,mutagenic
+[O-][N+](=O)c1cnc2c(c1C)nc1n2cccc1C,mutagenic
+[O-][N+](=O)c1cccc(c1O)c1ccccc1,non-mutagenic
+OCc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+O=CNc1ccc(cc1)Oc1c(Cl)cc(cc1Cl)Cl,mutagenic
+COC1=CC(=O)c2c(C1=O)[nH]cc1-c2nc2c1CCCC2,mutagenic
+CCCOC(=O)/C=C/c1ccc(o1)[N+](=O)[O-],mutagenic
+CCCC(=C)C=O,mutagenic
+CC(N)C,non-mutagenic
+CCCCN([N+](=O)[O-])CCO[N+](=O)[O-],mutagenic
+c1ccc(cc1)c1ccc(cc1)OCC1OC1,mutagenic
+Nc1sc2c(n1)c(C)ccc2,non-mutagenic
+Cc1cccc(c1)c1nc2c(o1)cccc2,non-mutagenic
+CCn1c(N)nc2c1ccc1c2nc(cn1)C,mutagenic
+O=c1n(C[C@@H]2OC2)c(=O)n(c(=O)n1C[C@@H]1OC1)C[C@@H]1OC1,mutagenic
+O=c1c2cc3ccccc3c3c2c2c1cccc2cc3,mutagenic
+COC(C1Cc2cc3cc(OC4CC(OC5CC(O)C(C(O5)C)OC)C(C(O4)C)OC(=O)C)c(c(c3c(c2C(=O)C1OC1CC(OC2CC(OC3OC(C)C(C(C3)(C)O)OC(=O)C)C(C(O2)C)O)C(C(O1)C)O)O)O)C)C(=O)C(C(O)C)O,non-mutagenic
+CCn1c(N)nc2c1ccc1c2cccn1,mutagenic
+FC(OC(C(Cl)F)(F)F)F,non-mutagenic
+Cl/C=C(/c1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl)\Cl,non-mutagenic
+COC(=O)Nc1[nH]c2c(n1)cc(cc2)OS(=O)(=O)c1ccc(cc1)F,non-mutagenic
+COc1cc(N)cc(c1N)OC,non-mutagenic
+ClCCCC(=O)/N=c/1\sn(c2c1cccc2)C(=O)CCCCl,non-mutagenic
+CC(Cl)(Cl)C,non-mutagenic
+CCOC(=O)[C@@H](C[C@](C(=O)O)(C[C@H](C(=O)OCC)C[C@@](C(=O)O)(CC)C)C)C[C@](C(=O)O)(C[C@@H](C(=O)OCC)C)C,mutagenic
+Clc1ccc(cc1Cl)C(Cl)(Cl)Cl,mutagenic
+O=NOC(C)(C)C,mutagenic
+O=Nc1ccc(cc1)O,mutagenic
+NC1=C[C@H]2[C@@H](C(=N1)C)Nc1c2cccc1,mutagenic
+C/C=C/1\CC(C)C(C)(O)C(=O)OCC2=CC[N+]3(C2(C(OC1=O)CC3)O)C,mutagenic
+CC(=CCC1=C(O)C(=O)c2c(C1=O)cccc2)C,non-mutagenic
+OCc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)O,mutagenic
+Nc1ccc(cc1)Oc1c(Cl)cc(cc1Cl)Cl,mutagenic
+Cc1nc2c(nc1C)cc(c1c2nc(n1C)N)C,mutagenic
+CC(=O)Nc1cc2Cc3c(-c2cc1OC(=O)c1ccccc1)cccc3,non-mutagenic
+CCNc1cc2oc(=O)cc(c2cc1C)C,non-mutagenic
+O=NN1CSCC1C(=O)O,non-mutagenic
+CN(c1ccncc1)C,non-mutagenic
+Oc1ccc(cc1)Nc1c2ccccc2nc2c1cccc2,mutagenic
+Clc1ccc2-n3nc(nc3CN=C(c2c1)c1ccccc1Cl)C(=O)N(C)C,non-mutagenic
+OC(=O)CS,non-mutagenic
+CCCCCCCC(=O)OC(COC(=O)CCCCCCC)COC(=O)CCCCCCC,mutagenic
+O=C1OC(=O)c2c1cc(cc2)[N+](=O)[O-],mutagenic
+NC(=O)C[C@H]1CO1,mutagenic
+COc1cc(CNC(=O)CCCCCCC(C)C)ccc1O,mutagenic
+O[C@@H](c1ccccc1)C#N,non-mutagenic
+CC(=O)Nc1ccc2c(n1)cccc2,non-mutagenic
+OC1=C(C)CCC1=O,non-mutagenic
+CCCCCCCCCCCCCCCCCC(=O)NCCNC(=O)CCCCCCCCCCCCCCCCC,non-mutagenic
+Clc1cc(Cl)nc(n1)N,non-mutagenic
+[O-][N+](=O)c1cccc2c1snc2Cl,mutagenic
+CCN(C(=O)c1cc(ccc1N)Cc1ccc(c(c1)C(=O)N(CC)CC)N)CC,non-mutagenic
+CC(C(=O)NCc1ccccc1)Cl,non-mutagenic
+OCC12SSC3(N(C1=O)C1C(O)C=CC=C1C3)C(=O)N2C,non-mutagenic
+NC1C=CC(=C(c2ccc(c(c2)C)N)c2ccc(cc2)N)C=C1,mutagenic
+OC(=O)c1cc(ccc1N)Cc1ccc(c(c1)C(=O)O)N,non-mutagenic
+C=C[C@H](c1ccc2c(c1)OCO2)OC(=O)C,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1cc(ccc1cc2)[N+](=O)[O-],mutagenic
+OC(=O)C1=CC2=CCC3C(C2(CC1)C)CCC1(C3CCC1C(=O)NC(C)(C)C)C,non-mutagenic
+CCn1cc(C(=O)O)c(=O)c2c1c(F)c(c1ccncc1)c(c2)F,non-mutagenic
+OCc1cc2c3ccccc3cc3c2c2c1cccc2cc3,non-mutagenic
+Clc1ccc(c(c1)O)Cl,non-mutagenic
+[O-][N+](=O)c1c(nc2n1ccs2)c1ccc(cc1)[N+](=O)[O-],mutagenic
+CCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](C)[C@]2(O)[C@H]([C@@H]3[C@@]1(OC(=O)C)C3(C)C)C=C(C[C@@]1([C@H]2C=C(C1=O)C)O)CO,non-mutagenic
+CCCCC(C(C(OC(=O)CC(C(=O)O)CC(=O)O)CC(CC(CCCCCCC(C(N)C)O)O)C)OC(=O)CC(C(=O)O)CC(=O)O)C,non-mutagenic
+OCC1OC(OC2CCC3(C(=CCC4C3CCC3(C4CC4C3C(C)C3(O4)CCC(CO3)C)C)C2)C)C(C(C1OC1OC(C)C(C(C1O)O)O)O)OC1OC(C)C(C(C1O)O)O,non-mutagenic
+C1CC2OC2CCC2C1O2,non-mutagenic
+O=Cc1cccc2c1nccc2,mutagenic
+[O-][N+](=O)c1cc(Br)c(c(c1)[N+](=O)[O-])N,mutagenic
+OC1C(O)C(OC1n1ccc(=O)[nH]c1=O)COP(=O)(O)O,non-mutagenic
+Clc1cc(Cl)c(c(c1)S(=O)(=O)c1cc(Cl)cc(c1O)Cl)O,non-mutagenic
+Cc1cn(CC(CN=N#N)O)c(=O)[nH]c1=O,mutagenic
+Nc1ccc(c(c1)C)C,mutagenic
+O=C1CCC2(C(=C1)C(C)CC1C2CCC2(C1CCC2(OC(=O)C)C(=O)C)C)C,non-mutagenic
+OC(=O)c1cc(O)c2c(n1)cccc2,non-mutagenic
+N#N=NCC(C(C(C(C(=O)O)O)O)O)O,mutagenic
+CCCCN=NC(OO)(C)C,mutagenic
+[O-][n+]1c2ccccc2nc2c1cccc2,mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c2c3c1-c1ccccc1-c3ccc2,mutagenic
+CC(=C)[C@@H]1Oc2c(C1)c1c(c(c2)O)c(=O)c2c(n1C)cccc2,mutagenic
+COC1=C(N)C(=O)c2c(C1=O)ccc(n2)c1nc(C(=O)O)c(c(c1N)c1ccc(c(c1O)OC)OC)C,mutagenic
+CC([C@](C(=O)O)([C@H](O)C)O)C,non-mutagenic
+OC(=O)C1=NN(C(=O)[C@H]1N=Nc1ccc(cc1)S(=O)(=O)O)c1ccc(cc1)S(=O)(=O)O,non-mutagenic
+NC(=O)C12OC2C(NC1=O)(O)c1ccccc1,non-mutagenic
+Clc1cc(ccc1N=Nc1c(O)ccc2c1cccc2)[N+](=O)[O-],mutagenic
+CC(=O)Nc1ccc2c3c1ccc1c3c(cc2)ccc1O,mutagenic
+c1ccc(cc1)c1ccc(cc1)c1ccccc1,non-mutagenic
+CCCC[C@H](COS(=O)(=O)O)CC,non-mutagenic
+c1ccco1,non-mutagenic
+c1ccc2c(c1)c1ccc3c4c1c(c2)C1NC1c4ccc3,mutagenic
+OCCNC(=O)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N,non-mutagenic
+CCOC(=O)N(CCCC(=O)c1cccnc1)N=O,mutagenic
+CC(=O)Nc1cc2Cc3c(-c2cc1OC(=O)C)cccc3,non-mutagenic
+CCCn1cc2c3c1cccc3C1C(C2)N(C)CC(=C1)C,mutagenic
+Oc1cc(O)c2c(c1)oc1c(c2=O)c(O)ccc1O,mutagenic
+BrC(C(=O)O)Br,mutagenic
+OC(=O)c1cc2ccccc2c(c1O)N=Nc1ccc(c(c1)S(=O)(=O)O)C,non-mutagenic
+NCCN(c1c2ccccc2nc2c1ccc1c2cccc1)CCCl,mutagenic
+C1CCNC(=O)N1N=O,mutagenic
+S=C(Nc1ccccc1)Nc1ccccc1,non-mutagenic
+CCCC(=O)c1cc(O)c(cc1O)O,mutagenic
+CN(CCNC(=O)c1cccc2c1oc1ccccc1c2=O)C,mutagenic
+CC(CCCC(C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OC(=O)C)C)C,non-mutagenic
+CCCCCCCCCCCCCCCC(=O)OC/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C)\C,non-mutagenic
+O=C1C=Cc2c(C1=O)ccc1c2c(C)c2c(c1)cccc2,mutagenic
+COc1ccc(cc1OC)c1[nH]c(c(n1)c1ccc(cc1)C)c1ccc(cc1)C,mutagenic
+O(Cc1cccc2c1cccc2)CC1CO1,mutagenic
+[O-][N+](=O)CCC(=O)O,mutagenic
+[O-][N+](=O)c1c2ccc3c4c2c(c2c1cccc2)ccc4ccc3,mutagenic
+O=c1n(CC2CO2)sc2c1cccc2,non-mutagenic
+O=CNc1ccc2-c3c(Cc2c1)cccc3,mutagenic
+CN(c1ccc(cc1)C(=C1C=CC(=N)C=C1)c1ccc(cc1)N(C)C)C,non-mutagenic
+Nc1cc([N+](=O)[O-])c(cc1C)N,mutagenic
+Oc1ccc2c(c1N)cccc2,non-mutagenic
+COc1cccc2c1ccc1c2c2OCOc2cc1C(=O)O,mutagenic
+OCCN(C(=O)Nc1ccc(c(c1)Cl)Cl)C,non-mutagenic
+CCn1c(N)nc2c1c(C)cc1c2cccn1,mutagenic
+C[n+]1c2ccccc2cc2c1cccc2N,mutagenic
+ClCCN(c1cccc(c1)/C=C/C(=O)O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CCC(=O)N2)C)C1)C)CCCl,mutagenic
+CN(CCNC(=O)c1ccc2c(n1)c1ncccc1cc2)C,mutagenic
+OS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+c1ccc2c(c1)c1cc3c(cc1cc2)ccc1c3cncc1,mutagenic
+NCCCCC(C(=O)O)N,mutagenic
+[O-][N+](=O)c1cc2CCc3c4-c2c(c1)CCc4ccc3,mutagenic
+COc1ccc(cc1)C(=O)C1OC1c1ccccc1,non-mutagenic
+FC(C(C(Cl)(F)F)(F)F)Cl,non-mutagenic
+COc1cc2OC3C(c2c2c1c1C(O)CC(=O)c1c(=O)o2)C=CO3,mutagenic
+O=CC1(C)OC21CC1(C)C(C)C(OC(=O)C)C3C(C1=CC2=O)O3,mutagenic
+Cc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)C)c1ccc(cc1C)C,mutagenic
+Oc1cc([N+](=O)[O-])c2c3c1ccc1c3c(cc2)ccc1,mutagenic
+CN(N=O)CCCC,mutagenic
+COc1cc(C)cc2c1C(=O)C=C(C2=O)c1c(C)cc2c(c1OC)C(=O)C=CC2=O,non-mutagenic
+O=Cc1ccco1,mutagenic
+CCN(C(=N)N[N+](=O)[O-])N=O,mutagenic
+Cl/C=C/c1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl,non-mutagenic
+Oc1cc(Cl)c(c(c1)Cl)Cl,non-mutagenic
+CCCCOCN(c1c(CC)cccc1CC)C(=O)CCl,mutagenic
+ON1CN(Cl)CN(C1)Cl,non-mutagenic
+CCCC[C@H](C=O)CC,non-mutagenic
+COC(=O)C1=CCCN(C1)N=O,mutagenic
+OCCN(C(=O)Nc1ccccc1)C,non-mutagenic
+CCSCCSP(=S)(OC)OC,non-mutagenic
+O=C1C=Cc2c(C1=O)ccc1c2cc2ccccc2c1C,mutagenic
+OC(COc1cccc2c1cc[nH]2)CNC(C)C,non-mutagenic
+OC1C=Cc2c(C1O)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+CC/C(=C(/c1ccccc1)\c1ccc(cc1)OCCN(C)C)/c1ccccc1,non-mutagenic
+O=C1C=Cc2c3c1cccc3ccc2,mutagenic
+CCCCCCN(C(=O)N)N=O,mutagenic
+CCOC(=O)C(=C)C,non-mutagenic
+CC1C(C)(C)Nc2c(C1(C)C1C(C)(C)Nc3c(C1(C)C)cccc3)cccc2,non-mutagenic
+CC(=O)Nc1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-],mutagenic
+CNC(=O)Oc1ccc2c(c1)C1(C)CCN(C1N2C)C,non-mutagenic
+N#Cc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+CC(Nc1ccccc1)C,non-mutagenic
+O=C1C(=CC(=O)c2c1nc(C)c1c2[nH]c2c1cccc2)N1CC1,mutagenic
+CC(=O)n1cncc1,non-mutagenic
+O=C=NC[C@@]1(C)C[C@H](N=C=O)CC(C1)(C)C,non-mutagenic
+Nc1nc2c(n1C)ccc1c2ccnc1,mutagenic
+O=C/C=C(\CCC=C(C)C)/C,non-mutagenic
+COc1cc2c(cc1O)CCN[C@@]12CSC2c3c(OC(=O)C)c(C)c4c(c3[C@H](COC1=O)N1[C@@H]2[C@@H]2N([C@H]([C@@H]1O)Cc1c2c(O)c(c(c1)C)OC)C)OCO4,mutagenic
+c1ccc2-c3cc4ccccc4cc3C3C(c2c1)O3,mutagenic
+BrC(C1=C(Br)C(=O)OC1)Br,mutagenic
+CC1(CO1)C(=O)N,mutagenic
+c1ccc(cc1)Nc1ccccc1,non-mutagenic
+OCc1c2ccc3c(c2cc2c1cccc2)cccc3,mutagenic
+Cc1ccc(cc1N=[N+](c1cc(ccc1C)[N+](=O)[O-])[O-])[N+](=O)[O-],non-mutagenic
+C[C@@H]1CNC(=O)N1c1ncc(s1)[N+](=O)[O-],mutagenic
+CCCC[C@H](COP(=O)(OC[C@@H](CCCC)CC)OC[C@@H](CCCC)CC)CC,non-mutagenic
+ONc1ccc(cc1)N=O,mutagenic
+O=CNc1ccc(cc1)Oc1ccc(cc1)Cl,mutagenic
+ClCC1=C(Cl)C(=O)OC1O,mutagenic
+[O-][N+](=O)c1c(O)c(Cl)cc(c1Cl)Cl,non-mutagenic
+[O-][N+](=O)c1c(O)ccc2c1cccc2,mutagenic
+CCOP(=S)(Oc1ccc(cc1)[N+](=O)[O-])OCC,non-mutagenic
+Nc1[nH]ccc2-c1c1ccccc1n2,mutagenic
+O=NN(CCCC(=O)c1cccnc1)C,mutagenic
+CCOC(=O)C(C(=O)C)Cl,non-mutagenic
+O=c1cc(C)c2c(o1)ccc1c2C2(C)OOC2(O1)C,mutagenic
+C1CCC(CC1)N=C=NC1CCCCC1,non-mutagenic
+CC1CCC2CC1C2(C)C,non-mutagenic
+[O-][N+](=O)c1cccc2c1ncc1c2c2ccccc2nc1,mutagenic
+CCOc1ccc2c(c1)C(=CC(N2)(C)C)C,non-mutagenic
+C[n+]1ccsc1N=Nc1c(c2ccccc2)n(c2c1cccc2)C,mutagenic
+CCCCC1C(=O)N(N(C1=O)c1ccccc1)c1ccccc1,non-mutagenic
+Nc1ccc(cc1Br)c1ccc(c(c1)Br)N,mutagenic
+CC(Cc1ccc(cc1)C(C(=O)O)C)C,non-mutagenic
+CCc1c2ccccc2c(c2c1c1ccccc1cc2)C,non-mutagenic
+Clc1ccc(c(c1)Cl)Oc1ccc(cc1)[N+](=O)[O-],mutagenic
+CNCC(c1ccc(c(c1)O)O)O,non-mutagenic
+Cc1cnccn1,non-mutagenic
+c1ccc2c(c1)cc1c(c2[C@@H]2CO2)cccc1,mutagenic
+c1ccc2c(c1)ccc1c2nccc1,mutagenic
+c1ccc(cc1)Nc1ccc2c(c1)cccc2,non-mutagenic
+OCCN(c1ccc(cc1)N=Nc1ccc(cc1)C)CCO,non-mutagenic
+CNC(=O)N(C(=O)C)O,mutagenic
+Oc1ccc2c(c1)CCC1C2CCC2(C1CC(C2O)O)C,non-mutagenic
+CCC(OC)(C)C,non-mutagenic
+CC/C=C/C=O,mutagenic
+OCc1ccc(cc1)C,non-mutagenic
+CCCCON(C(=O)c1ccc(cc1)Cl)OC(=O)C,mutagenic
+CCCCC(COC(=O)c1ccc(cc1)C(=O)O)CC,non-mutagenic
+CO[C@@H]1C[C@](C)(O)Cc2c1c(O)c1c(c2)C(=O)c2c(C1=O)c(O)cc1c2O[C@@H]2O[C@@]1(C)[C@@H]([C@H]([C@H]2O)N(C)C)O,mutagenic
+CCOc1cc(C=O)ccc1O,non-mutagenic
+CNc1ccc(cc1)C(=C1C=CC(=NC)C=C1)c1ccc(cc1)N(C)C,non-mutagenic
+CN(CCNC(=O)c1cccc2c1nc1ccccc1c2O)C,mutagenic
+O=NN1CC(=O)NC1=O,mutagenic
+Cc1cn2c(s1)nc(c2[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-],mutagenic
+OC(=O)CCCCC(=O)O,non-mutagenic
+C=CCN=C=S,mutagenic
+COc1cc(cc(c1OC)OC)C1C2C(=O)OCC2C(c2c1cc1OCOc1c2)O,non-mutagenic
+COC(=O)CCC(=O)OC,non-mutagenic
+COc1ccc(cc1)C(=O)/C=C/c1ccccc1,non-mutagenic
+Clc1ccc2-n3c(CN=C(c2c1)c1ccccc1Cl)nnc3C,non-mutagenic
+OOC(N=NC)(C)C,mutagenic
+O=C(Nc1ccccc1C)CC(=O)C,non-mutagenic
+CCOC(=O)C1=C(C)N=C(C(=C(OCC2COC3(O2)CCCC3)O)C1c1cccc(c1)Cl)C,non-mutagenic
+Cc1ccc2c(c1)C1C(C)c3cc(C)ccc3N(C1=N2)C,mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/OCC(c1ccccc1)O,mutagenic
+CCCCOC(=O)C(OC(=O)C)(CC(=O)OCCCC)CC(=O)OCCCC,non-mutagenic
+CC(c1cc(cc(c1N)C(C)C)c1ccccc1)C,non-mutagenic
+O=S1(=O)c2cc3ccccc3c3c2c2c1cccc2cc3,mutagenic
+O=Cc1ccc(cc1)C(=O)ON(C(=O)c1ccccc1)OCc1ccccc1,mutagenic
+O=CC1=C2CC(CC2(O)C(C2(C1(C=O)C2)C)O)(C)C,mutagenic
+Brc1cccc(c1)[N+](=O)[O-],mutagenic
+Cc1nc(C)cc(c1)c1cc2c(cc1F)n1c(n2C2CC2)cc(=O)n(c1=O)O,mutagenic
+ClCCN(c1ccc(cc1)c1[nH]c2c(n1)cc(cc2)CCCCCCc1nc2c([nH]1)ccc(c2)N1CCN(CC1)C)CCCl,non-mutagenic
+Cn1c(N)nc2c1cc1ncccc1n2,non-mutagenic
+COC(=O)C[C@H]1[C@@]2(C)[C@H](OC3C2=C(C)[C@@H](C3)c2cocc2)[C@H]2C3[C@]1(C)C(=O)C=C[C@@]3(C)C(=O)O2,non-mutagenic
+N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)C1C(C1(C)C)C=C(Cl)Cl,non-mutagenic mutagenic
+OC1CC=Cc2c1cc1ccc3c4c1c2ccc4ccc3,mutagenic
+COc1ccc(cc1)C(C=C)O,non-mutagenic
+BrCC(=O)N(Cc1ccccc1)C,non-mutagenic
+Oc1ccc2c(c1)cccn2,non-mutagenic
+S=C=S,non-mutagenic
+CCO[Si](OCC)(OCC)C,non-mutagenic
+O=CN(c1ccc(cc1)c1ccccc1)O,mutagenic
+OCC1=CCN2[C@H]1[C@H](O)CC2,non-mutagenic
+CCOC(=O)c1[nH]c2c(c1/N=C/c1ccc(cc1)[N+](=O)[O-])cccc2,mutagenic
+CC(=O)OC1C(OCC(C1OC(=O)C)OC(=O)C)Nc1ccc(cc1)C(=O)O,non-mutagenic
+CCN(C(=O)N)N=O,mutagenic
+[O-][N+](=O)c1cc2[nH]c3c(c2c2c1cccc2)c1ccccc1c(c3)[N+](=O)[O-],mutagenic
+Cc1cccc2c1cc1ccc3c(c1n2)cccc3,mutagenic
+c1ccc2c(-c3cc4C5OC5c5c(-c4cc3C3C2O3)cccc5)c1,mutagenic
+BrC([N+](=O)[O-])(Br)Br,mutagenic
+OCC1OC(CC1O)n1cnc2c1ncn1c2ncc1,non-mutagenic
+O=C(C(=C)C)OCCOCCOCCOC(=O)C(=C)C,non-mutagenic
+NC(=O)OC1CO1,mutagenic
+Clc1cccc(c1)NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+[O-][N+](=O)c1cnc(n1C)C,mutagenic
+CCOc1ccc(cc1N)NC(=O)C,mutagenic
+CN(Cc1ccccc1)C,non-mutagenic
+C[C@H]1OC=C2C(=C(C)C(=O)C(=C2O)C(=O)O)[C@@H]1C,non-mutagenic
+CCCCCCCCCC/C=C/[C@H]1CC(=O)OC1=O,non-mutagenic
+O=C1NCNC(=O)N1,mutagenic
+ClC1=C(Cl)[C@@]2(C([C@@]1(Cl)[C@@H]1[C@H]2[C@H]2C[C@@H]1[C@@H]1[C@H]2O1)(Cl)Cl)Cl,non-mutagenic
+CNc1ccc2c(c1C)nc(c(n2)C)C,mutagenic
+ONc1oc(c(c1c1ccccc1)c1ccccc1)C(=O)OC,non-mutagenic
+OC1c2cc3ccccc3c3c2c2c1cccc2cc3,mutagenic
+COC(=O)c1oc(c(c1Cl)Cl)N,non-mutagenic
+C1CC2=CC3C(C=C(C1)O2)O3,non-mutagenic
+CC[N+](=NC)[O-],non-mutagenic
+O=C(C1C(=O)NC(=S)NC1=O)Nc1ccccc1,non-mutagenic
+CCCNc1c(ccc(c1C(=O)O)Cl)[N+](=O)[O-],non-mutagenic
+c1ccc2c(c1)c1ccccc1c1c2cccc1,mutagenic
+O=CCC1CC(C)C(O)/C=C\C=C/CC(OC(=O)CC(C(C1OC1OC(C)C(C(C1O)N(C)C)OC1OC(C)C(C(C1)(C)OC(=O)CC)OC(=O)CCC)OC)O)C,non-mutagenic
+OCc1c(N)cccc1[N+](=O)[O-],non-mutagenic
+[O-][N+](=O)c1c(O)cccc1[N+](=O)[O-],mutagenic
+ClCCOCCCl,mutagenic
+O=CNc1scc(n1)c1ccc(cc1)[N+](=O)[O-],mutagenic
+Cc1ccc2c(c1)nc1c(c2C)ccc2c1cccc2,mutagenic
+[O-][N+](=O)c1cccc2c1nsc2,mutagenic
+[O-][N+](=O)c1cc(C)c(c(c1)[N+](=O)[O-])C,non-mutagenic
+CC(CO)Cl,mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/OC,mutagenic
+CCCCCN1C2C1c1ccccc1-c1c2cccc1,mutagenic
+CCCCN(CCC(=O)C)N=O,mutagenic
+Cc1ccc2c3c1ccc1c3c(cc2)cc2c1cccc2,mutagenic
+COC1=CC(=O)c2c(C1=O)c1-c(c([nH]2)C)c2c(n1)cccc2,mutagenic
+[O-][N+](=O)C1=Cc2c3c1cc1cccc4c1c3c(cc2)cc4,mutagenic
+ONS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+COc1c2c(O[C@H]3[C@H]2C=CO3)cc2c1c(=O)c1c(o2)c(CCC(O)(C)C)ccc1O,mutagenic
+O=C1c2ccccc2C(=O)c2c1ccc(c2N)N,mutagenic
+O=NN1CCCC[C@H]1C,mutagenic
+Clc1ccc(c(c1)C(=O)Nc1ccc(cc1Cl)[N+](=O)[O-])O,mutagenic
+OCC1OC(C(C1O)O)n1cnc2c1ncn1c2ncc1,non-mutagenic
+ONc1cc(ccc1C)[N+](=O)[O-],non-mutagenic
+Cc1cccc2c1nn[nH]2,non-mutagenic
+[O-][N+](=O)C(C(O)C)C,non-mutagenic
+CC(=C)OC(=O)C,non-mutagenic
+NCCNC(=O)c1ccc(cn1)Cl,non-mutagenic
+CN([C@@H]1C(=O)C(=C([C@@]2([C@@H]1C[C@H]1C(=C2O)C(=O)c2c([C@@]1(C)O)cccc2O)O)O)C(=O)N)C,non-mutagenic
+c1cc2C=Cc3c2c(c1)cc1c3c2ccccc2cc1,mutagenic
+CC(=O)Nc1cccc2c1-c1ccccc1C2,mutagenic
+Cc1c(C)c(Br)c(c(c1Br)Br)Br,non-mutagenic
+ClCCN(c1ccc(c2c1oc(c2)[N+](=O)[O-])OC)CCCl,mutagenic
+ONc1ccc(cc1)Oc1ccc(cc1)NC(=O)C,mutagenic
+OCC1OC(SC(=S)N(CC)CC)C(C(C1O)O)O,non-mutagenic
+O=CN(c1ccccc1)O,non-mutagenic
+CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC,mutagenic
+Clc1ccc2c(c1)N(C(=O)CC(=O)N2C)c1ccccc1,non-mutagenic
+CC(=O)O[C@@]1(CC[C@@H]2[C@]1(C)C[C@H](O)[C@]1([C@H]2C[C@H](C2=CC(=O)C(=C[C@]12C)Br)F)F)C(=O)COC(=O)C,non-mutagenic
+CC(=C)C(=O)OCCO,non-mutagenic
+OC(COc1cccc2c1OCC(C2)O)CNC(C)C,non-mutagenic
+Nc1ccn(c(=O)n1)[C@@H]1CC[C@@H](O1)CO,mutagenic
+Clc1cccc(c1)c1nc2c(o1)cccc2,non-mutagenic
+Nc1cccc(c1)O,mutagenic
+CCOS(=O)(=O)c1ccccc1,mutagenic
+COc1ccc(cc1N=Nc1c(O)c(cc2c1cccc2)C(=O)Nc1cccc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Fc1cc2cccnc2c2c1cccc2,mutagenic
+N/N=C/1\N=NC=C2[C@@H]1C=CC=C2,mutagenic
+[O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])Cl,mutagenic
+CCC(C)C,non-mutagenic
+[N-]=[N+]=NCCC(C(=O)O)N,mutagenic
+OC1C(OC2OC(C(=O)O)C(C(C2O)O)O)C(OC(C1O)C(=O)O)OC1CCC2(C(C1(C)C)CCC1(C2C(=O)C=C2C1(C)CCC1(C2CC(C)(CC1)C(=O)O)C)C)C,non-mutagenic
+NNc1nncc2c1ccnc2,mutagenic
+[O-][N+](=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+Nc1cccc2c1C(=O)c1ccccc1C2=O,mutagenic
+[O-][N+](=O)c1ccc2c(c1)/c(=N/C(=O)c1ccccc1[N+](=O)[O-])/sn2C(=O)c1ccccc1[N+](=O)[O-],mutagenic
+Brc1cc(Br)c(c(c1)c1cc(Br)cc(c1O)Br)OP(=O)(O)O,non-mutagenic
+Cc1cc(C)c2c(c1)c(C)c1c(n2)c2ccccc2cc1,mutagenic
+CCCC[C@H](COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC,non-mutagenic
+COc1ccc(cn1)N=Nc1ccc(cc1)N(C)C,mutagenic
+O=c1oc2cccc3c2c2c1cccc2cc3,non-mutagenic
+NC1=N[C@@H](CS1)C(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])I,mutagenic
+Nc1nc2-c3cccnc3CCc2s1,mutagenic
+Nc1c(C)cccc1O,non-mutagenic
+Nc1ccc2c3c1ccc1c3c(cc2)cc2c1cccc2,mutagenic
+[O-][N+](=O)c1ncc2c(c1)c1cc(cc(c1[nH]2)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+OCCOCCOCCO,mutagenic
+CCCCCCCCOP(=O)(OCCCCCCCC)OCCCCCCCC,non-mutagenic
+CCCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCCCC,non-mutagenic
+CCCCCCCCCCCC(=O)NCCO,non-mutagenic
+CC(C1=CC2=CCC3C(C2CC1)(C)CCCC3(C)C(=O)O)C,non-mutagenic
+Cc1cccc2c1c1ccc3c4c1c(c2)ccc4ccc3,mutagenic
+CNc1ccc(cc1)N=Nc1ccccc1,mutagenic
+Nc1cc(C)c(c(c1C)[N+](=O)[O-])N,mutagenic
+CN(C(=O)Nc1ccc(cc1)Cl)C,non-mutagenic
+[O-][N+](=O)O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2O[N+](=O)[O-],non-mutagenic
+CCOC(=O)C(NC(C(=O)N1C2CCCCC2CC1C(=O)O)C)CCc1ccccc1,non-mutagenic
+ClC(C(c1ccc(cc1)Cl)c1ccc(cc1)Cl)Cl,non-mutagenic
+C1CC[C@@H](NC1)CC(C1CCCCC1)C1CCCCC1,non-mutagenic
+ClC1=C(Cl)C(=O)C(C1=O)(Cl)Cl,non-mutagenic
+CCOC(=O)C(=NNc1ccc(cc1Cl)c1ccc(c(c1)Cl)NN=C(C(=O)OCC)C(=O)OCC)C(=O)OCC,non-mutagenic
+CN(c1ccc(cc1)/C=C/c1ccccc1)C,mutagenic
+Nc1cc(nn1C)C1CC1,mutagenic
+OC(=O)[C@H](Oc1ccc(cc1C)Cl)C,non-mutagenic
+OCCCCN(N=O)CC,mutagenic
+O=C(NS(=O)(=O)c1ccc(cc1)C(=O)C)NC1CCCCC1,non-mutagenic
+[O-][N+](=O)c1ccc2c3c1c1ccccc1c1c3c([C@H]3[C@@H]2O3)ccc1,mutagenic
+CCOC(=O)C(=C)C#N,non-mutagenic
+OCCNc1nc(nc2c1cccc2)c1ccc(s1)[N+](=O)[O-],mutagenic
+Cc1ccc(cc1)NN=NCc1ccc(cc1)[N+](=O)[O-],mutagenic
+CC(N=C=NC(C)C)C,non-mutagenic
+Nc1ccc(cc1)/C=C/c1ccc(cc1)Cl,mutagenic
+c1ccc(cc1)Nc1cccc2c1cccc2,non-mutagenic
+N#[N+]c1nc[nH]c1C(=O)N,mutagenic
+c1ccc2c(c1)c(OCC1CO1)ccc2,mutagenic
+Oc1ccc2c(c1N=Nc1ccc(c(c1)S(=O)(=O)O)C)cccc2,non-mutagenic
+O=C1NC2(C(=O)N1CCN1CC1)CCCCC2,mutagenic
+OC1C2OC2c2c(C1O)ccc1c2cccn1,non-mutagenic
+OC[C@@H](CCl)O,mutagenic
+CC(=O)OCC1=CO[C@H]([C@H]2C1=C[C@@H]([C@]12OC1)OC(=O)CC(C)C)OC(=O)CC(C)C,mutagenic
+CC(=O)c1ccc(c(c1Cl)Cl)Cl,mutagenic
+Cn1c(N)nc2c1cccc2,mutagenic
+OC1COC2(C1OC(=O)C2(O)Cc1c[nH]c2c1cccc2)O,non-mutagenic
+c1ccc2c(c1)cc1c3c2cccc3C=C1,mutagenic
+O=Cc1ccc2c(c1)OCO2,non-mutagenic
+COc1ccc2-c3c4OCOc4cc4c3c(C(=O)c2c1)ncc4,mutagenic
+CC(=O)Nc1cc(ccc1N=Nc1cccnc1)N(C)C,non-mutagenic
+CCN(CCN1C(=O)CN=C(c2c1ccc(c2)Cl)c1ccccc1F)CC,non-mutagenic
+BrCCCCCCCC(=O)O,mutagenic
+Nc1ccc(cc1F)c1ccc(c(c1)F)N,mutagenic
+O=C(c1ccccc1N)OCCc1ccccc1,non-mutagenic
+Nc1c(Oc2ccccc2)cc(c2c1C(=O)c1ccccc1C2=O)O,mutagenic
+Cc1ccc(c(c1)C)N=Nc1c(O)ccc2c1cccc2,mutagenic
+OCc1c2ccc3c4c2c(c2c1cccc2)ccc4ccc3,mutagenic
+OC1C=Cc2c(C1O)cc1c(c2)c2ccccc2cc1C,mutagenic
+Clc1ccc2c(c1)nc1c(n2)cc(c(c1)N)N,mutagenic
+Clc1ccc(cc1Cl)N=Nc1ccc(c(c1)Cl)Cl,non-mutagenic
+Nc1cccc2c1snc2Cl,mutagenic
+c1ccc2c(c1)cc(cc2)OCC1CO1,mutagenic
+O=NN(CCN(C)C)C,mutagenic
+Cc1ccc2-c3c(Cc2c1)cc(cc3)C,non-mutagenic
+COC(=O)c1ccccc1,non-mutagenic
+O=NN(Cc1cccc(c1)C(F)(F)F)C,mutagenic
+O=Cc1cccc(c1Cl)Cl,non-mutagenic
+CCOc1ccc(cc1)NC(=O)N,non-mutagenic
+OCc1ccc(cc1[N+](=O)[O-])N,mutagenic
+O=CN(c1ccc(c(c1)Cl)Cl)O,non-mutagenic
+Cc1ccc(c(c1)S(=O)(=O)O)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)N,mutagenic
+Oc1ccc2c3c1ccc1c3c(cc2)ccc1[N+](=O)[O-],mutagenic
+O=C1C=C(C)C2(C(=C1)CCC1C2CCC2(C1CCC2=O)C)C,non-mutagenic
+N#N=NCC(Cn1cnc2c1ncnc2Cl)O,mutagenic
+O=C1c2ccccc2-c2c3c1ccc1-c4ccccc4C(=O)c(c31)cc2,non-mutagenic
+OCc1ccc2c(c1)nc1c(c2C)ccc2c1cccc2,mutagenic
+[O-][N+](=O)c1ccc2c(c1)c1c(C)ccc(c1[nH]2)C,mutagenic
+COc1ccc(cc1)C(=O)n1ncc(c(c1=O)Cl)Cl,non-mutagenic
+CCC1OC1c1ccccc1,non-mutagenic
+CC(Oc1ccc(cc1)Nc1ccccc1)C,non-mutagenic
+[O-][N+](=O)c1ccc(o1)/C=N/n1cccn1,mutagenic
+O=C1CC[C@@H]2c3c1c(O)ccc3-c1c3[C@@]2(O)[C@H](O)CC(=O)c3c(cc1)O,mutagenic
+[O-][N+](=O)C1=Cc2c3c1cccc3cc1c2ccc2c1cccc2,mutagenic
+OC(=O)Cc1ccc(c(c1)O)O,mutagenic
+ONC(=O)CNC(=O)c1ccccc1,mutagenic
+FC(=C(F)F)Cl,non-mutagenic
+CN1[C@@H](CSCC(F)(F)F)Nc2c(S1(=O)=O)cc(c(c2)Cl)S(=O)(=O)N,non-mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)ccc1c2cc([N+](=O)[O-])c2c1cccc2,mutagenic
+O1CCN(CC1)SSN1CCOCC1,non-mutagenic
+CC(C(=O)N(c1ccc(cc1)Cl)O)C,mutagenic
+OCCN(c1nc(nc2c1cccc2)c1cccs1)CCO,non-mutagenic
+OCCNCCn1c2-c3ccccc3C(=O)c2c2c(c1=O)cccc2,non-mutagenic
+CCOC(=O)CNC(=O)C=[N+]=[N-],mutagenic
+Nc1ccc2c(c1)ccc1c2cccc1,mutagenic
+C1C[C@H]2[C@@H]([C@H]1O[C@H]1CC[C@H]3[C@@H]1O3)O2,non-mutagenic
+Nc1ccc(cc1)Oc1ccccc1,mutagenic
+NCCCN1CCN(CC1)CCCN,non-mutagenic
+CCOC(=O)N(C)C,mutagenic
+Cc1cccs1,non-mutagenic
+Cl[Si](Cl)(Cl)Cl,non-mutagenic
+CO,non-mutagenic
+Nc1ccc(c(c1)C(F)(F)F)Cl,non-mutagenic
+CC=C,mutagenic
+BrCC(=O)Nc1ccc(cc1)C,non-mutagenic
+CC(NC(=O)/C=C\c1ccc(o1)[N+](=O)[O-])C,mutagenic
+COc1cc(CNC(=O)C(Br)C)ccc1OC,mutagenic
+Oc1cccc2c1ccc1c2cc2c3c1C=Cc3ccc2,mutagenic
+[N-]=[N+]=NC[C@H](C(=O)O)N,mutagenic
+CC(=C/C(=N/Nc1nncc2c1cccc2)/C)C,mutagenic
+CC(=O)NC(C(=O)O)CSCCCl,mutagenic
+[O-][N+](=O)c1ccc2-c3c4c(-c2c1)ccc(c4ccc3)[N+](=O)[O-],mutagenic
+CCCCCCCCCCCCCCCCCC(=O)O,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)SSc1ccc(cc1)[N+](=O)[O-],mutagenic
+CCc1ccco1,non-mutagenic
+Cl/C(=C(\C(=C(Cl)Cl)Cl)/Cl)/SCc1ccccc1,mutagenic
+OC1CCN2C1C(=CC2)COC(=O)C(C(O)C)(C(C)C)O,non-mutagenic
+c1ccc2c(c1)cc(cc2)Nc1ccc(cc1)Nc1ccc2c(c1)cccc2,mutagenic
+N#CC(=Cc1ccccc1Cl)C#N,mutagenic
+Brc1ccc(cc1)C1OC1C(=O)c1ccccc1,non-mutagenic
+ClCCN(P1(=O)OCCC(=O)N1)CCCl,mutagenic
+BrCC(c1ccccc1)Br,mutagenic
+O1CCOC2CCCCC2OCCOCCOCCOC2C(OCC1)CCCC2,non-mutagenic
+[O-][N+](=O)c1c(C)c([N+](=O)[O-])c(c(c1C(C)(C)C)[N+](=O)[O-])C,non-mutagenic
+Cc1c(N)c(C)c(c(c1C)N)C,non-mutagenic
+c1ncc[nH]1,non-mutagenic
+Cc1ccccc1NS(=O)(=O)c1cccc2c1nccc2,non-mutagenic
+OCc1c2ccc3c(c2c(c2c1cccc2)CO)cccc3,mutagenic
+BrCC(=O)c1cccc(c1)OC,non-mutagenic
+O[C@@H]1C=Cc2c([C@@H]1O)c1cc3ccc(c4c3c(c1cc2)CC4)C,mutagenic
+CC(=O)Nc1cccc2c1ncc(c2)F,mutagenic
+Nc1ccc(cc1)/C=C/c1cccc(c1)N,mutagenic
+CC(OC(=O)/C=C/c1ccc(o1)[N+](=O)[O-])C,mutagenic
+O=C1C=C(O)c2c(C1=O)cccc2,mutagenic non-mutagenic
+Cl/C=C\C[N+]12CN3CN(C2)CN(C1)C3,mutagenic
+[O-][N+](=O)c1cc(ccc1C)C(=O)O,mutagenic
+ClCCN(c1ccc(cc1)CC(=O)O[C@H]1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC(=O)N2)C)C)CCCl,mutagenic
+On1nnc2c1cccc2,non-mutagenic
+CCc1c(Br)c(Br)c(c(c1Br)Br)Br,non-mutagenic
+O=C1C=CC(=O)C=C1,non-mutagenic
+ClCl,non-mutagenic
+Oc1cccc2c1cccc2,non-mutagenic
+Oc1c(C)cc(c2c1C(=O)c1ccccc1C2=O)O,mutagenic
+O=Cc1ccc2-c1cocc2COC(=O)CC(C)C,mutagenic
+O[C@@H]1[C@@H](O)[C@H]2O[C@]32c2c1cccc2-c1c3ccc2c1cccc2,mutagenic
+CCCCOCCOCCOCc1cc2OCOc2cc1CCC,non-mutagenic
+Cc1cccc(c1)OP(=O)(Oc1cccc(c1)C)Oc1cccc(c1)C,non-mutagenic
+ClCC(CCl)(CCl)CCl,non-mutagenic
+OC1C=Cc2c(C1O)c1sc3c(c1cc2)cccc3,non-mutagenic
+C=Cc1ccncc1,non-mutagenic
+CCCCCCCCC(CCC(CC(C(C(CC(=O)OC)Cl)Cl)Cl)Cl)Cl,non-mutagenic
+COP(=O)(Oc1ccc(c(c1)C)[N+](=O)[O-])OC,mutagenic
+CC(NCC(c1ccc2c(c1)cccc2)O)C,non-mutagenic
+N[C@@H]1CC[C@H](CC1)N,non-mutagenic
+ONc1nc(N)nc2c1[nH]cn2,mutagenic
+[O-][N+](=O)c1cccc2c1oc(=O)c1c2cccc1,mutagenic
+Cl[C@]12C(Cl)(Cl)[C@@]3([C@@]4([C@@]1(Cl)[C@@]1([C@@]2(Cl)[C@]3([C@]4(C1(Cl)Cl)Cl)Cl)Cl)Cl)Cl,non-mutagenic
+NC(C(=O)NCC(=O)O)CS,mutagenic
+CNC(=O)ONC(=O)C,mutagenic
+Cc1ccc(c(c1)N)[N+](=O)[O-],non-mutagenic
+Cc1ccc2c3c1CCc3c1c(-c3ccccc3C3C1N3)c2,mutagenic
+Fc1ccnc2c1cccc2,mutagenic
+CCN(CCNc1ccc(c2c1c(=O)c1c(s2)cccc1)C)CC,mutagenic
+Cc1cccc(c1O)C,non-mutagenic
+COCOC,non-mutagenic
+NCCCS(=O)(=O)Nc1ccc(cc1)Nc1c2ccc(cc2nc2c1ccc(c2)N=N#N)N=N#N,mutagenic
+CCOC(=O)CNC(=O)C(Br)(C)C,non-mutagenic
+Oc1ccc(nn1)O,non-mutagenic
+Cc1c(C)cccc1N,mutagenic
+Oc1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+N#Cc1ccccc1C,non-mutagenic
+COc1ccc(cc1)CC=C,non-mutagenic
+COc1cccc2c1C(=O)c1c(O)c3[C@@H](O[C@H]4C[C@H](N)[C@@H]([C@@H](O4)C)O)C[C@](Cc3c(c1C2=O)O)(O)/C(=N/NC(=O)c1ccccc1)/C,mutagenic
+CCOC(=O)NNc1nncc2c1cccc2,mutagenic
+[O-][N+](=O)c1ccc(o1)/C=C/C(=O)NCCCC,mutagenic
+CC(=O)OC1(CCC2C1(C)CCC1C2C=C(C2=CC(=O)C3C(C12C)C3)Cl)C(=O)C,non-mutagenic
+OCC(CO)O,non-mutagenic
+O=Nc1ccc(cc1C)OP(=S)(OC)OC,mutagenic
+O/N=C/C1N(COCCC([N+](=O)[O-])(C)C)C=CN1C,non-mutagenic
+O=C(C1OC1c1ccc(cc1)Oc1ccccc1)c1ccccc1,non-mutagenic
+CN(N=Nc1ccc(cc1)Cl)C,mutagenic
+CCCCCCCCCCCCCCCCCCCC,non-mutagenic
+OC(=O)c1ccccc1Cl,non-mutagenic
+NCC(=O)NCc1nc(nn1c1ccc(cc1C(=O)c1ccccc1Cl)Cl)C(=O)N(C)C,non-mutagenic
+CCCC/C=C/C=C/C=C/C=C/C=C/OC,mutagenic
+CCCCOS(=O)(=O)C,mutagenic
+[O-][N+](=O)c1ccc2c3c1CCc3ccc2,mutagenic
+Nc1ccccc1,non-mutagenic
+Oc1ccc2c(-c3ccc(c4c3c(C2=O)ccc4)O)c1,mutagenic
+N#CC1=C(C#N)C(=O)C(=C(C1=O)Cl)Cl,non-mutagenic
+CCOC(=O)N,mutagenic
+c1ccc(cc1)CN1CCN=N1,mutagenic
+O/N=C/C1N(CCS(=O)(=O)C)C=CN1C,non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc(nc1=O)N,mutagenic
+BrC(C#N)Br,mutagenic
+Clc1ccc(cc1)c1nc2n(c1[N+](=O)[O-])ccs2,mutagenic
+CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCNCC1,mutagenic
+O=NN1CCCCCC1,mutagenic
+Nc1ccc2c3c1ccc1c3c(cc2)ccc1[N+](=O)[O-],mutagenic
+FC(c1ccc(cc1)Cl)(F)F,non-mutagenic
+O=CC(=O)C,mutagenic
+Clc1ccc(c(c1)Cl)[N+](=O)[O-],mutagenic
+CN(c1ccc(cc1)C(=C1C=CC(=[N+](C)C)C=C1)c1c2ccc(cc2cc(c1O)S(=O)(=O)O)S(=O)(=O)O)C,non-mutagenic
+CC(=O)Oc1c(OC(=O)C)c2c(ccc3c2c2c1cccc2c1c3cccc1)[N+](=O)[O-],mutagenic
+CCCCCCCCCCCCc1ccccc1,non-mutagenic
+COCN(c1c(CC)cccc1CC)C(=O)CO,non-mutagenic
+CC(=C)C1CCC(=C)C2C1C=C(C)C(=O)C1=C2C(=O)C(C1)C,non-mutagenic
+Clc1cccc(c1)[N+](=O)[O-],non-mutagenic
+OCc1occ(c(=O)c1)O,mutagenic
+Oc1ccc(cc1)Cl,non-mutagenic
+O=C([C@H]1O[C@@H]1c1ccccc1)c1ccccc1,mutagenic
+ONc1ccc(cc1)Cl,non-mutagenic
+O=C(Nc1ccccc1)N[C@@H]1CCCC[C@H]1C,non-mutagenic
+Clc1cccc2c1oc1c2cccc1,non-mutagenic
+[O-][N+](=O)c1cc(Cl)c(c(c1)Cl)Cl,mutagenic
+CC(=O)Nc1ccc2-c3c(Cc2c1)cc(cc3)O,mutagenic
+COC1OCC(C(C1OS(=O)(=O)O)OS(=O)(=O)O)COCC1OCC(C(C1OS(=O)(=O)O)OS(=O)(=O)O)OC,non-mutagenic
+O=Nn1cc(c2c1cccc2)CC(C(=O)O)O,mutagenic
+COC(=O)Nc1nc2c([nH]1)cccc2,mutagenic
+ClCc1cccc2-c3c4c(-c12)cccc4ccc3,mutagenic
+CCCN(N=O)CCC,mutagenic
+c1ccc(cc1)CNc1ncnc2c1[nH]cn2,non-mutagenic
+OS(=O)(=O)O.Oc1cccc2c1nccc2.Oc1cccc2c1nccc2,mutagenic
+CO[C@H]1C[C@H](O[C@H]2[C@@H](C)/C=C/C=C/3\CO[C@H]4[C@]3(O)[C@@H](C=C([C@H]4O)C)C(=O)O[C@H]3C[C@@H](C/C=C/2\C)O[C@]2(C3)C=C[C@@H]([C@H](O2)[C@H](CC)C)C)O[C@H]([C@@H]1O[C@H]1C[C@H](OC)[C@H]([C@@H](O1)C)O)C,non-mutagenic
+N#C[C@H](c1cccc(c1)Oc1ccccc1)OC(=O)[C@@H]1[C@@H](C1(C)C)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F,non-mutagenic
+Clc1cc(N)c(c(n1)C(=O)O)Cl,non-mutagenic
+COc1nc(nc(c1)O)NC(=O)NS(=O)(=O)c1n(C)ncc1c1nnn(n1)C,non-mutagenic
+COc1cc(OC)nc(n1)N,non-mutagenic
+Cn1nnc(n1)c1cnn(c1S(=O)(=O)N)C,non-mutagenic
+O=C1NS(=O)(=O)Cc2c1cccc2,non-mutagenic
+COc1cc(OC)nc(n1)NC(=O)NS(=O)(=O)Cc1ccccc1C(=O)O,non-mutagenic
+COC(=O)c1ccccc1CS(=O)(=O)N,non-mutagenic
+CC(OC(=O)N[C@@H](C(=O)N[C@@H](c1nc2c(s1)cc(cc2)F)C)C(C)C)C,mutagenic
+OC(C(C)(C)C)C(n1cncn1)Oc1ccc(cc1)c1ccccc1,non-mutagenic
+Fc1ccc(c(c1)c1ccc(c(c1)Cl)Cl)NC(=O)c1cn(nc1C(F)F)C,non-mutagenic
+Brc1ccc(cc1)c1ccc(cc1)C(CC(c1c(=O)oc2c(c1O)cccc2)c1ccccc1)O,non-mutagenic
+BrC1COC(C1)(Cn1cncn1)c1ccc(cc1Cl)Cl,non-mutagenic
+CCCCc1c(C)nc(nc1OS(=O)(=O)N(C)C)NCC,non-mutagenic
+CCCCc1c(=O)nc([nH]c1C)NCC,non-mutagenic
+CC(N1C(=NC(C)(C)C)SCN(C1=O)c1ccccc1)C,non-mutagenic
+CCOP(=O)(SC(CC)C)SC(CC)C,non-mutagenic
+ClC(SN1C(=O)C2C(C1=O)CC=CC2)(Cl)Cl,mutagenic
+Cc1ccc(c2c1cccc2)C,non-mutagenic
+CC1=CC1,non-mutagenic
+[O-]C(=O)Cc1cccc2c1cccc2.[Na+],non-mutagenic
+COC1CC(OC2C(C)C=CC=C3COCC4C3(O)C(C=C(C4O)C)C(=O)OC3CC(CC=C2C)OC2(C3)C=CC(C(O2)C(CC)C)C)OC(C1OC1CC(OC)C(C(O1)C)O)C,non-mutagenic
+CO[C@H]1C[C@H](OC[C@]2(C)C=CC=C3CO[C@H]4[C@]3(O)[C@@H](C=C([C@H]4O)C)C(=O)O[C@H]3C[C@@H](CC=C2C)O[C@]2(C3)C=C[C@@H]([C@H](O2)[C@H](CC)C)C)O[C@H]([C@@H]1O[C@H]1C[C@H](OC)[C@H]([C@@H](O1)C)O)C,non-mutagenic
+CCCCCCCCCCCCC1=C(OC(=O)C)C(=O)c2c(C1=O)cccc2,non-mutagenic
+CCCCCCCCCCC(=O)C(=O)c1ccccc1C(=O)O,non-mutagenic
+CSC(=O)c1cccc2c1snn2,non-mutagenic
+OC(=O)c1cccc2c1snn2,mutagenic
+OC(=O)c1ccc(c2c1snn2)O,non-mutagenic
+Oc1cc2nnsc2c(c1)C(=O)O,non-mutagenic
+Clc1c(ccc(c1N)[N+](=O)[O-])Oc1ccccc1,non-mutagenic
+N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)C1C(C1(C)C)/C=C\C(=O)O,non-mutagenic
+OC(=O)/C=C\C1C(C1(C)C)C(=O)O,non-mutagenic
+[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].O.O.O.O.O.O.O.O.O.O.O.O.[NH4+],non-mutagenic
+[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3],non-mutagenic
+P,non-mutagenic
+[Al]#P,non-mutagenic
+COc1cc(OC)nc(n1)NC(=O)NS(=O)(=O)N(S(=O)(=O)C)C,non-mutagenic
+COc1nc(nc(c1)O)NC(=O)NS(=O)(=O)N(S(=O)(=O)C)C,non-mutagenic
+Oc1cc(=O)[nH]c(n1)N,non-mutagenic
+CCNC(=O)C(OC(=O)Nc1ccccc1)C,non-mutagenic
+Fc1ccc2c(c1)n(c(c2Br)C)S(=O)(=O)c1ncn(n1)S(=O)(=O)N(C)C,non-mutagenic
+Cc1c(Br)c2c(n1S(=O)(=O)C1=NN=C[N]1)cc(cc2)F,non-mutagenic
+CO/C=C(\c1ccccc1Oc1ncnc(c1)Oc1ccccc1C#N)/C(=O)OC,non-mutagenic
+N#Cc1ccccc1Oc1ncnc(c1)Oc1ccccc1/C(=C/C(=O)C)/C(=O)O,non-mutagenic
+OCC(C1OC(=O)C(=C1O)O)O,non-mutagenic
+C/C=C(/C(=O)OC1CC(OC(=O)C)C2(C3C41COC(C4C(C)(C(C3OC2)O)C12OC2(C)C2CC1OC1C2(O)C=CO1)(O)C(=O)OC)OC(=O)C)\C,non-mutagenic
+CCCCN(c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])CC,non-mutagenic
+COc1cc(OC)nc(n1)NC(=O)NS(=O)(=O)c1n(C)ncc1c1nnn(n1)C,non-mutagenic
+CCOC(=O)CCN(C(C)C)SN(C(=O)Oc1cccc2c1OC(C2)(C)C)C,non-mutagenic
+COc1nc(nc(c1)OC)NC(=O)NS(=O)(=O)Cc1ccccc1C(=O)OC,non-mutagenic
+CC(N1C(=O)c2ccccc2[N-]S1(=O)=O)C.[Na+],non-mutagenic
+CC(N1C(=O)c2cccc(c2NS1(=O)=O)O)C,non-mutagenic
+COC(=O)C(N(c1c(C)cccc1C)C(=O)Cc1ccccc1)C,non-mutagenic
+COC(=O)C(N(c1c(C)cccc1C)C(=O)CC(=O)O)C,non-mutagenic
+CC(N(c1c(C)cccc1C)C(=O)CC(=O)O)C(=O)O,non-mutagenic
+Fc1ccc2c(c1)sc(n2)O,non-mutagenic
+Fc1ccc2c(c1)sc(n2)C(O)C,non-mutagenic
+Fc1ccc2c(c1)sc(n2)C(=O)C,mutagenic
+CC(OC(=O)NC(C(=O)NC(c1sc2c(n1)cc(c(c2)F)O)C)C(C)C)C,non-mutagenic
+C#CCOC(=O)[C@H](Oc1ccc(cc1)Oc1ncc(cc1F)Cl)C,non-mutagenic
+O=C1N(OCC1(C)C)Cc1ccccc1Cl,non-mutagenic
+O=C1NOCC1(C)C,non-mutagenic
+COC(=O)C(Oc1ccc(cc1)Oc1ccc(cc1Cl)Cl)C,non-mutagenic
+COc1nc(nc(n1)C)NC(=O)NS(=O)(=O)c1ccccc1Cl,non-mutagenic
+Clc1ccccc1S(=O)(=O)N,non-mutagenic
+O=C(NS(=O)(=O)c1ccccc1Cl)NC(=N)/N=C(/O)\N,non-mutagenic
+Clc1ccc(c(n1)C(=O)O)Cl,non-mutagenic
+CCCCOC(=O)C(Oc1ccc(cc1)Oc1ccc(cc1F)C#N)C,non-mutagenic
+CC(C(=O)NC(=O)O)OC(=O)Nc1ccccc1,non-mutagenic
+O=S1CCOC(=C1C(=O)N)C,non-mutagenic
+OC(=O)[C@H](Oc1ccc(cc1Cl)Cl)C,non-mutagenic
+Fc1ccc(c(c1)F)NC(=O)c1cccnc1Oc1cccc(c1)C(F)(F)F,non-mutagenic
+OC(=O)c1cccnc1Oc1cccc(c1)C(F)(F)F,non-mutagenic
+Nc1nc(NC2CC2)nc(n1)N,non-mutagenic
+CCCCCCCCCC[N+](CCCCCCCCCC)(C)C.[Cl-],non-mutagenic
+Clc1ccccc1c1nnc(nn1)c1ccccc1Cl,non-mutagenic
+CCNC(=O)NC(=O)/C(=N/OC)/C#N,non-mutagenic
+O=C1NCC[n+]2c1cccc2,non-mutagenic
+CC1OC(C)CN(C1)C1CCCCCCCCCCC1.CC(=O)O,non-mutagenic
+CC(=O)O.CCCCCCCCCCCCNC(=N)N,non-mutagenic
+Fc1ccc(cc1)C1(Cn2cncn2)OC1c1ccccc1Cl,non-mutagenic
+COc1c(Cl)cc(c(c1C(=O)O)Cl)O,non-mutagenic
+N#CC(C(c1ccc(cc1)Cl)C(C)C)c1cccc(c1)Oc1ccccc1,non-mutagenic
+NC(=O)C(c1cccc(c1)Oc1ccccc1)OC(=O)C(c1ccc(cc1)Cl)C(C)C,non-mutagenic
+CCOc1snc(n1)C(Cl)(Cl)Cl,non-mutagenic
+CCOc1nc(ns1)C(=O)O,non-mutagenic
+O=C(N=C(c1c(F)c(F)ccc1C(F)(F)F)NOCC1CC1)Cc1ccccc1,non-mutagenic
+N/C(=N\OCC1CC1)/c1c(F)c(F)ccc1C(F)(F)F,non-mutagenic
+NC(=N)c1c(F)c(F)ccc1C(F)(F)F,non-mutagenic
+NC(=O)c1c(F)c(F)ccc1C(F)(F)F,non-mutagenic
+O=C(N/C(=N\OCC1CC1)/c1c(F)c(F)ccc1C(F)(F)F)CC(=O)O,non-mutagenic
+O=C(N/C(=N/OCC1CC1)/c1c(F)c(F)ccc1C(F)(F)F)Cc1ccccc1,non-mutagenic
+OC(=O)C1CC1,non-mutagenic
+OCC1CC1,non-mutagenic
+CC(C(c1ccc(cc1)Cl)(Cn1ncnc1)O)C1CC1,non-mutagenic
+OC(=O)/C=C/C(C(c1ccc(cc1)Cl)(Cn1cncn1)O)C,non-mutagenic
+OC(=O)CC(C(C(c1ccc(cc1)Cl)(Cn1cncn1)O)C)O,non-mutagenic
+Cc1nc(Nc2ccccc2)nc(c1)C1CC1,non-mutagenic
+Cc1cc(nc(n1)N)C1CC1,non-mutagenic
+Cc1nc(Nc2cccc(c2)O)nc(c1)C1CC1,non-mutagenic
+OCc1nc(N)nc(c1)C1CC1,non-mutagenic
+Cc1cc(nc(n1)O)C1CC1,non-mutagenic
+OCc1nc(Nc2ccccc2)nc(c1)C1CC1,non-mutagenic
+COc1cc(ccc1OC)/C(=C/C(=O)N1CCOCC1)/c1ccc(cc1)Cl,non-mutagenic
+COCCN(c1c(C)cccc1C)C(=O)CCl,non-mutagenic
+COCCN(c1c(C)cccc1C)C(=O)C(=O)O,non-mutagenic
+COCCN(c1c(C)cccc1C)C(=O)CS(=O)(=O)O[Na],non-mutagenic
+[Na]OS(=O)(=O)CC(=O)Nc1c(C)cccc1C,non-mutagenic
+COC(=O)CN(c1c(C)cccc1C)C(=O)CS(=O)(=O)O[Na],non-mutagenic
+OCC(=O)N(c1c(C)cccc1C)CCSCC(C(=O)O)O,non-mutagenic
+COCCN(c1c(C)cccc1C(=O)O)C(=O)CO,non-mutagenic
+CCOc1cc(ccc1OCC)NC(=O)OC(C)C,non-mutagenic
+CCOc1ccc(cc1)C(COCc1cccc(c1)Oc1ccccc1)(C)C,non-mutagenic
+CCOc1ccc(cc1)C(COC(=O)c1cccc(c1)Oc1ccccc1)(C)C,non-mutagenic
+CON=C(c1ccccc1COc1cc(C)ccc1C)C(=O)NC,non-mutagenic
+CO/N=C(\c1ccccc1CO)/C(=O)NC,non-mutagenic
+[O-]P(=O)=O.[Na+].[Na+],non-mutagenic
+O=C(C1C(C1(C)C)/C=C(/C(F)(F)F)\Cl)OCc1cccc(c1C)c1ccccc1,non-mutagenic
+Oc1cccc2c1OC(C2)(C)C,non-mutagenic
+CNC(=O)Oc1cccc2c1OC(C2O)(C)C,non-mutagenic
+COc1nc(Oc2cccc(c2C(=O)[O-])Oc2nc(OC)cc(n2)OC)nc(c1)OC.[Na+],non-mutagenic
+COc1cc(OC)[nH]c(=O)n1,non-mutagenic
+COc1cc(=O)[nH]c(=O)[nH]1,non-mutagenic
+COc1cc(OC)nc(n1)Oc1cccc(c1C(=O)O)Oc1nc(OC)c(c(n1)OC)O,non-mutagenic
+COc1nc(nc(c1)O)Oc1cccc(c1C(=O)[O-])O.[Na+],non-mutagenic
+COc1cc(OC)nc(n1)Oc1cccc(c1C(=O)O)O,non-mutagenic
+COc1cc(O)nc(n1)Oc1cccc(c1C(=O)[O-])Oc1nc(OC)cc(n1)OC.[Na+],non-mutagenic
+Fc1ccc2c(c1)sc(n2)c1nc2c(s1)cc(cc2)F,mutagenic
+Cl/C=C/CO/N=C(/C1=C(O)CC(CC1=O)CC(SCC)C)\CC,mutagenic
+CCC(=N)C1=C(O)CC(CC1=O)CC(S(=O)(=O)CC)C,non-mutagenic
+Cl/C=C/CO/N=C(/C1=C(O)CC(CC1=O)(O)CC(S(=O)(=O)CC)C)\CC,non-mutagenic
+Cl/C=C/CO/N=C(/C1=C(O)CC(CC1=O)CC(S(=O)(=O)CC)C)\CC,mutagenic
+CCc1oc2c(n1)C(=O)CC(C2)CC(S(=O)(=O)CC)C,non-mutagenic
+CCOc1nc(NC(=O)N)nc(n1)NC,non-mutagenic
+CCOc1nc(NC)nc(n1)N,non-mutagenic
+CCOc1nc(nc(n1)NC)NC(=O)NS(=O)(=O)c1ccccc1C(=O)O,non-mutagenic
+CNc1nc(nc(n1)O)NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC,non-mutagenic
+COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nc(N)nc(n1)O,non-mutagenic
+CCOc1nc(nc(n1)N)NC(=O)NS(=O)(=O)c1ccccc1C(=O)O,non-mutagenic
+OC(=O)c1ccccc1S(=O)(=O)N,non-mutagenic
+CCOc1nc(N)nc(n1)N,non-mutagenic
+CCCSP(=O)(SCCC)OCC,non-mutagenic
+N#Cc1sc2=c(sc1C#N)c(=O)c1c(c2=O)cccc1,non-mutagenic
+COC(=O)c1c(Cl)c(Cl)c(c(c1Cl)Cl)C(=O)OC,non-mutagenic
+OC(=O)c1c(Cl)c(Cl)c(c(c1Cl)Cl)C(=O)O,non-mutagenic
+COC(=O)c1c(Cl)c(Cl)c(c(c1Cl)Cl)C(=O)O,non-mutagenic
+COC(=O)[C@H](N(c1c(C)cccc1C)C(=O)Cc1ccccc1)C,non-mutagenic
+N#Cc1cc(C)c(c(c1)C(=O)NC)NC(=O)c1cc(nn1c1ncccc1Cl)Br,non-mutagenic
+CNC(=O)c1cc(cc(c1NC(=O)c1cc(nn1c1ncccc1Cl)Br)C)C(=O)O,non-mutagenic
+Brc1nn(c(c1)c1nc(=O)c2c([nH]1)c(C)cc(c2)C(=O)O)c1ncccc1Cl,non-mutagenic
+CNC(=O)C1=NN=C([CH]1)Br,non-mutagenic
+N#Cc1cc(C)c2c(c1)c(=O)n1c(n2)c(Cl)ccc1,non-mutagenic
+OCC=C(CCC=C(C)C)C,non-mutagenic
+CNC(=O)c1cc(Cl)cc(c1NC(=O)c1cc(nn1c1ncccc1Cl)Br)C,non-mutagenic
+Clc1cc(C)c2c(c1)c(=O)n(c(n2)c1cc(nn1c1ncccc1Cl)Br)C,non-mutagenic
+Clc1cc(C)c2c(c1)c(=O)n(c(n2)C1=NN=C([CH]1)Br)C,non-mutagenic
+Clc1cc(C)c2c(c1)c(=O)n1c(n2)c(Cl)ccc1,non-mutagenic
+CCCCN(SN(C(=O)Oc1cccc2c1OC(C2)(C)C)C)CCCC,non-mutagenic
+Nc1cn[nH]c(=O)c1Cl,non-mutagenic
+Cn1ncc(c(c1=O)Cl)N,non-mutagenic
+Cc1cc(C)cc(c1)C(=O)N(C(C)(C)C)NC(=O)c1ccc2c(c1C)CCCO2,non-mutagenic
+Cc1cc(C)cc(c1)C(=O)N(C(C)(C)C)NC(=O)c1ccc2c(c1C)C(O)CCO2,non-mutagenic
+O=C1CCc2c(O1)ccc(c2C)C(=O)NN(C(C)(C)C)C(=O)c1cc(C)cc(c1)C,non-mutagenic
+Cc1cc(cc(c1)C(=O)O)C(=O)N(C(C)(C)C)NC(=O)c1ccc2c(c1C)C(O)CCO2,non-mutagenic
+ClCC[N+](C)(C)C.[Cl-],non-mutagenic
+COCCOC(=O)C(C(=O)c1ccccc1C(F)(F)F)(c1ccc(cc1)C(C)(C)C)C#N,non-mutagenic
+OC(=O)c1ccccc1C(F)(F)F,non-mutagenic
+NC(=O)c1ccccc1C(F)(F)F,mutagenic
+CCOC(=O)C(Cc1cc(c(cc1Cl)F)n1nc(n(c1=O)C(F)F)C)Cl,non-mutagenic
+OC(=O)C(Cc1cc(c(cc1Cl)F)n1nc(n(c1=O)C(F)F)C)Cl,non-mutagenic
+Fc1cc(Cl)c(cc1n1nc(n(c1=O)C(F)F)C)C(=O)O,non-mutagenic
+OC(=O)CCc1cc(c(cc1Cl)F)n1nc(n(c1=O)C(F)F)C,non-mutagenic
+OC(=O)/C=C/c1cc(c(cc1Cl)F)n1nc(n(c1=O)C(F)F)C,non-mutagenic
+OC(=O)C(Cc1cc(c(cc1Cl)F)n1ncn(c1=O)C(F)F)Cl,non-mutagenic
+OC(=O)C(S(=O)(=O)O)Cc1cc(c(cc1Cl)F)n1nc(n(c1=O)C(F)F)C,non-mutagenic
+FC(n1c(C)n[nH]c1=O)F,non-mutagenic
+OCc1nn(c(=O)n1C(F)F)c1cc(C(=O)O)c(cc1F)Cl,non-mutagenic
+COc1cc(c(cc1Cl)F)n1nc(n(c1=O)C(F)F)C,non-mutagenic
+OC(=O)c1cc(c(cc1Cl)F)n1nc(n(c1=O)C(F)F)C(=O)O,non-mutagenic
+Clc1cccc(c1)NC(=O)N(C)C,non-mutagenic
+CN(C(=O)Nc1cc(Cl)cc(c1)Cl)C,non-mutagenic
+CCO/N=C(/C1=C(O)CC(CC1=O)C1CCCSC1)\CCC,non-mutagenic
+CCO/N=C(/C1=C(O)CC(CC1=O)(O)C1CCCS(=O)C1)\CCC,non-mutagenic
+CCO/N=C(/C1=C(O)CC(CC1=O)C1CCCS(=O)C1)\CCC,non-mutagenic
+OC(=O)CC(C1CCCS(=O)(=O)C1)CC(=O)O,non-mutagenic
+OC(=O)CC(C1CCCS(=O)C1)CC(=O)O,non-mutagenic
+CCOC1Oc2c(C1(C)C)cc(cc2)OS(=O)(=O)C,non-mutagenic
+OC(=O)C(c1cc(ccc1O)OS(=O)(=O)C)(C)C,non-mutagenic
+Clc1[nH]c(=O)c(cc1Cl)Cl,non-mutagenic
+COC(=O)Nc1nc2c([nH]1)cc(cc2)O,non-mutagenic
+CC(c1ccc(cc1)CCOc1ncnc2c1cccc2)(C)C,non-mutagenic
+CC(c1ccc(cc1)C(C)(C)C)O,non-mutagenic
+O=c1nc[nH]c2c1cccc2,non-mutagenic
+Cc1nn(c(c1/C=N/OCc1ccc(cc1)C(=O)OC(C)(C)C)Oc1ccccc1)C,non-mutagenic
+CN=C=S,non-mutagenic
+CCCCOC(=O)[C@H](Oc1ccc(cc1)Oc1ccc(cn1)C(F)(F)F)C,non-mutagenic
+O=c1ccc(c[nH]1)C(F)(F)F,mutagenic
+Nc1ncn[nH]1,mutagenic
+N#Cc1c[nH]cc1c1cccc2c1OC(O2)(F)F,non-mutagenic
+OC(=O)c1cccc2c1OC(O2)(F)F,non-mutagenic
+N#CC1=C(C(=O)NC1=O)c1cccc2c1OC(O2)(F)F,non-mutagenic
+NC(=O)C(c1cccc2c1OC(O2)(F)F)O,non-mutagenic
+N#CC1C(=O)NC(=O)C1c1cccc2c1OC(O2)(F)F,non-mutagenic
+N#CC1(OC1(C(=O)N)c1cccc2c1OC(O2)(F)F)C(=O)O,non-mutagenic
+OC(=O)C1C2C3(C4C51CC(=C)C(C5)(O)CC4)C=CC(C2(C)C(=O)O3)O,non-mutagenic
+ClOCl.[Cu+2],mutagenic
+[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-],mutagenic
+[Cu].[Cu].O,non-mutagenic
+[O-]S(=O)(=O)[O-].[Cu+2].O.O.O.O.O,non-mutagenic
+[O-]c1cccc2c1nccc2.[O-]c1cccc2c1nccc2.[Cu+2],mutagenic
+[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[OH-].[OH-],non-mutagenic
+Cl[Cu]Cl,non-mutagenic
+O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(cc1F)Oc1ccc(cc1Cl)C(F)(F)F,non-mutagenic
+NC(=O)Nc1ccc(cc1F)Oc1ccc(cc1Cl)C(F)(F)F,non-mutagenic
+Clc1cc(ccc1Oc1ccc(c(c1)F)N)C(F)(F)F,mutagenic
+CNC(=O)Nc1cccc(c1)C(F)(F)F,non-mutagenic
+[O-]P(=O)(OC)O,non-mutagenic
+CC1COC(O1)(Cn1cncn1)c1ccc(cc1Cl)Oc1ccc(cc1)Cl,non-mutagenic
+Clc1ccc(cc1)Oc1ccc(c(c1)Cl)C(=O)O,non-mutagenic
+c1ncn[nH]1,non-mutagenic
+Clc1ccc(cc1)Oc1ccc(c(c1)Cl)C(=O)Cn1cncn1,non-mutagenic
+Clc1ccc(cc1)Oc1ccc(c(c1)Cl)C(Cn1cncn1)O,non-mutagenic
+CNC(=O)CSP(=O)(OC)OC,mutagenic
+O=C(NC(=O)c1c(F)cccc1F)Nc1cc(Cl)c(c(c1F)Cl)F,non-mutagenic
+Fc1c(N)cc(c(c1Cl)F)Cl,non-mutagenic
+NC(=O)Nc1cc(Cl)c(c(c1F)Cl)F,non-mutagenic
+[O-]C(=O)C(CCP(=O)(O)C)N.[NH4+],non-mutagenic
+CC(=O)NC(C(=O)O)CCP(=O)(O)C,non-mutagenic
+OC(=O)CCP(=O)(O)C,non-mutagenic
+OC(=O)CP(=O)(O)C,non-mutagenic
+COc1nc(nc(c1)OC)NC(=O)NS(=O)(=O)c1n(C)nc(c1C(=O)OC)Cl,non-mutagenic
+OC(=O)c1c(Cl)nn(c1S(=O)(=O)N)C,non-mutagenic
+COc1cc(OC)nc(n1)Cc1n(C)nc(c1C(=O)O)Cl,non-mutagenic
+Clc1ccc(c(c1)Cl)C(Cn1cncn1)COC(C(F)F)(F)F,non-mutagenic
+OC(=O)C(c1ccc(cc1Cl)Cl)Cn1cncn1,non-mutagenic
+OC(=O)Cn1cncn1,non-mutagenic
+Clc1ccc(c(c1)Cl)C(Cn1cncn1)COC(C(=O)O)(F)F,non-mutagenic
+Clc1cc(cnc1CNC(=O)c1c(Cl)cccc1Cl)C(F)(F)F,mutagenic
+NC(=O)c1c(Cl)cccc1Cl,non-mutagenic
+OC(=O)c1ncc(cc1Cl)C(F)(F)F,non-mutagenic
+NC(=O)c1c(Cl)ccc(c1Cl)O,non-mutagenic
+CS(=O)c1cc(cnc1C(=O)O)C(F)(F)F,non-mutagenic
+OC(=O)c1ccc(cc1S(=O)(=O)O)C(F)(F)F,non-mutagenic
+Oc1ncc(cc1S(=O)(=O)C)C(F)(F)F,non-mutagenic
+O=C1CCCC(=O)C1C(=O)c1ccc(c(c1Cl)COCC(F)(F)F)S(=O)(=O)C,non-mutagenic
+OC(=O)c1ccc(c(c1Cl)COCC(F)(F)F)S(=O)(=O)C,non-mutagenic
+O=C1C(O)CC(C(=O)C1C(=O)c1ccc(c(c1Cl)COCC(F)(F)F)S(=O)(=O)C)O,non-mutagenic
+OCc1c(Cl)c(ccc1S(=O)(=O)C)C(=O)O,non-mutagenic
+O=C1CCCc2c1c(=O)c1c(o2)c(COCC(F)(F)F)c(cc1)S(=O)(=O)C,non-mutagenic
+Cn1nc(c(c1)C(=O)Nc1ccccc1c1cc(F)c(c(c1)F)F)C(F)F,non-mutagenic
+Cn1nc(c(c1)C(=O)O)C(F)F,non-mutagenic
+FC(C1=C(C=N[N]1)C(=O)O)F,non-mutagenic
+OC[C@H]1O[C@@H](On2nc(c(c2)C(=O)Nc2ccccc2c2cc(F)c(c(c2)F)F)C(F)F)[C@@H]([C@H]([C@@H]1O)O)O,non-mutagenic
+COc1nc(nc(n1)C)NC(=O)NS(=O)(=O)c1ccsc1C(=O)OC,non-mutagenic
+COc1nc(C)nc(n1)N,non-mutagenic
+OC(=O)c1sccc1S(=O)(=O)N,non-mutagenic
+COc1nc(nc(n1)C)NC(=O)NS(=O)(=O)c1ccsc1C(=O)O,non-mutagenic
+NC(=O)Nc1nc(C)nc(n1)C(=O)C,non-mutagenic
+O=C1NS(=O)(=O)c2c1scc2,non-mutagenic
+Cc1nc(nc(n1)O)NC(=O)NS(=O)(=O)c1ccsc1C(=O)O,non-mutagenic
+COC(=O)c1sccc1S(=O)(=O)N,non-mutagenic
+[O-][N+](=O)/N=C\1/N(Cc2cnc(s2)Cl)COCN1C,non-mutagenic
+[O-][N+](=O)NC(=NC)NCc1cnc(s1)Cl,non-mutagenic
+CN1COCN(C1=N)Cc1cnc(s1)Cl,non-mutagenic
+COc1ncc(c2n1nc(n2)S(=O)(=O)Nc1c(F)cccc1F)F,non-mutagenic
+Fc1cccc(c1NS(=O)(=O)c1nn2c(n1)c(F)cnc2O)F,non-mutagenic
+OC(=O)c1n[nH]c(n1)S(=O)(=O)N,non-mutagenic
+NS(=O)(=O)c1ncn[nH]1,non-mutagenic
+Oc1cccc2c1OC(C2O)(C)C,non-mutagenic
+Clc1ccc(c(c1)Cl)C1(C=CCO1)Cn1cncn1,non-mutagenic
+N#Cc1ccccc1Oc1ncnc(c1)Oc1ccccc1C(=O)O,non-mutagenic
+COC(=O)[C@H](N(c1c(C)cccc1C)C(=O)CC(=O)O)C,non-mutagenic
+COC(=O)C(N(c1c(C)cccc1C(=O)O)C(=O)CC(=O)O)C,non-mutagenic
+OC(=O)CC(=O)N(c1c(C)cccc1C(=O)O)C(C(=O)O)C,non-mutagenic
+CC(N1C(=O)SCN(C1=O)c1ccccc1)C,non-mutagenic
+CC(N(C(=O)NC(C)(C)C)C(=O)Nc1ccccc1)C,non-mutagenic
+CC(NC(=O)Nc1ccccc1)C,non-mutagenic
+CC(N(C(=S)NC(C)(C)C)C(=O)Nc1ccccc1)C,non-mutagenic
+OCc1nn(c(=O)n1C(F)F)c1cc(CCC(=O)O)c(cc1F)Cl,non-mutagenic
+CCS(=O)C(CC(CC(=O)O)CC(=O)O)C,non-mutagenic
+CCS(=O)(=O)C(CC(CC(=O)O)CC(=O)O)C,non-mutagenic
+Brc1nn(c(c1)C(=O)N)c1ncccc1Cl,non-mutagenic
+C[C@H](C(=O)O)Oc1ccc(cc1)Oc1ccc(cc1F)C(=O)O,non-mutagenic
+C=CCOC(c1ccc(cc1Cl)Cl)Cn1cncc1,non-mutagenic
+CC(C1(C)N=C(NC1=O)c1nc2ccccc2cc1C(=O)O)C,non-mutagenic
+[O-][N+](=O)/N=C/1\NCCN1Cc1ccc(nc1)Cl,non-mutagenic
+CC(C1CCC(C1(O)Cn1ncnc1)Cc1ccc(cc1)Cl)C,non-mutagenic
+CO/N=C(\c1ccccc1COc1ccccc1C)/C(=O)OC,non-mutagenic
+CO/N=C(\c1ccccc1COc1ccccc1CO)/C(=O)O,non-mutagenic
+CO/N=C(\c1ccccc1COc1ccc(cc1C)O)/C(=O)O,non-mutagenic
+CO/N=C(\c1ccccc1COc1cc(O)ccc1C)/C(=O)O,non-mutagenic
+CC(OC(=O)NC(C(=O)NC(c1ccc(cc1)C)C)C(C)C)C,non-mutagenic
+CCC(c1noc(c1)NC(=O)c1c(OC)cccc1OC)(CC)C,non-mutagenic
+Cc1ccc(cc1)C(N)C,non-mutagenic
+[O-][N+](=O)NC1=NCC(N1Cc1ccc(nc1)Cl)O,non-mutagenic
+[O-][N+](=O)NC1=NC(CN1Cc1ccc(nc1)Cl)O,non-mutagenic
+[O-][N+](=O)Nc1nccn1Cc1ccc(nc1)Cl,non-mutagenic
+O=N/N=C/1\NCCN1Cc1ccc(nc1)Cl,non-mutagenic
+CCc1noc(c1)NC(=O)c1c(OC)cccc1OC,non-mutagenic
+COc1cccc(c1C(=O)N)OC,non-mutagenic
+O=c1[nH]c2CCCc2c(=O)n1C1CCCCC1,non-mutagenic
+[O-]S(=O)(=O)[O-].[Fe+2],non-mutagenic
+CO/N=C(\c1ccccc1COc1ccccc1C)/C(=O)O,non-mutagenic
+CC(C1C2CCC1c1c2cccc1NC(=O)c1cn(nc1C(F)F)C)C,non-mutagenic
+Cn1nc(c(c1)C(=O)Nc1cccc2c1[C@@H]1CC[C@H]2[C@@H]1C(O)(C)C)C(F)F,non-mutagenic
+Cn1nc(c(c1)C(=O)Nc1cccc2c1[C@H]1CC[C@@H]2[C@H]1C(O)(C)C)C(F)F,non-mutagenic
+CCOC(=O)CC(C(=O)OCC)SP(=S)(OC)OC,non-mutagenic
+CC1OC(C)OC(OC(O1)C)C,non-mutagenic
+Fc1ccc(cc1)NC(=O)c1cccc(n1)Oc1cccc(c1)C(F)(F)F,non-mutagenic
+O=C(N(C)C)Nc1ccc(cc1)C(C)C,mutagenic
+OC(=O)c1nc(Cl)c(c(c1Cl)N)Cl,non-mutagenic
+CC(Oc1ccccn1)COc1ccc(cc1)Oc1ccccc1,non-mutagenic
+CCCN(C(=O)SCc1ccccc1)CCC,non-mutagenic
+COc1c(OC)cc(c(c1OC)C(=O)c1c(OC)ncc(c1C)Cl)C,non-mutagenic
+[CH2]OC1C(=C(O)C=C([C]1C(=O)c1c(OC)ncc(c1C)Cl)C)OC,non-mutagenic
+O=c1c(Cl)c(SCc2ccc(cc2)C(C)(C)C)cnn1C(C)(C)C,non-mutagenic
+OC(=O)C(c1ccc(cc1)CSc1cnn(c(=O)c1Cl)C(C)(C)C)(C)C,non-mutagenic
+CCCCCCC(c1cc(cc(c1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-])C,non-mutagenic
+C[N+]1(C)CCCCC1.[Cl-],non-mutagenic
+OC1CC[N+](CC1)(C)C.[Cl-],non-mutagenic
+CNC(=O)O/N=C(/C(=O)N(C)C)\SC,non-mutagenic
+CN(C(=O)C#N)C,non-mutagenic
+CCOC(=O)COc1cc(c(cc1Cl)F)c1nn(c(c1Cl)OC(F)F)C,non-mutagenic
+CNC(=O)ON=C(SC)C,non-mutagenic
+COc1c(OC)cc(c(c1OC)C(=O)c1c(OC)ccc(c1C)Br)C,non-mutagenic
+CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2],non-mutagenic
+CCCn1c(OCCC)nc2c(c1=O)cc(cc2)I,non-mutagenic
+CCCn1c(OCCC)nc2c(c1=O)cccc2,non-mutagenic
+Cc1cc(C)nc(n1)Nc1ccccc1,non-mutagenic
+Cc1cc(C)nc(n1)N,non-mutagenic
+CC(Oc1cc(c(cc1Cl)Cl)n1nc(oc1=O)C(C)(C)C)C,mutagenic
+CNC(=O)Oc1cc(C)c(c(c1)C)SC,non-mutagenic
+C=CC=CCC1=C(C)C(CC1=O)OC(=O)C1C(C1(C)C)C=C(C)C.C=CC=CCC1=C(C)C(CC1=O)OC(=O)C1C(C1(C)C)C=C(C(=O)OC)C,non-mutagenic
+Cc1nnc(c(=O)n1N)c1ccccc1,non-mutagenic
+Cc1n[n+]([O-])c(c(=O)n1N)c1ccccc1,mutagenic
+COCC(=O)N(c1c(C)cccc1C)C(C(=O)OC)C,non-mutagenic
+C#CCOC(c1ccc(cc1)Cl)C(=O)NCCc1ccc(c(c1)OC)OCC#C,non-mutagenic
+C#CCOC(c1ccc(cc1)Cl)C(=O)NCCC(=O)O,non-mutagenic
+O=C(NC(=O)c1c(F)cccc1F)Nc1cc(Cl)c(cc1Cl)OC(C(C(F)(F)F)F)(F)F,non-mutagenic
+FC(C(Oc1cc(Cl)c(cc1Cl)N)(F)F)C(F)(F)F,non-mutagenic
+COc1cc(OC)n2c(n1)nc(n2)S(=O)(=O)Nc1c(Cl)ccc(c1Cl)C,non-mutagenic
+NC1=NN=C([N]1)S(=O)(=O)Nc1c(Cl)ccc(c1Cl)C,non-mutagenic
+COc1cc(O)n2c(n1)nc(n2)S(=O)(=O)Nc1c(Cl)ccc(c1Cl)C,non-mutagenic
+Oc1cc(O)n2c(n1)nc(n2)S(=O)(=O)Nc1c(Cl)ccc(c1Cl)C,non-mutagenic
+N#Cc1ccc(cc1)CC(=NNC(=O)Nc1ccc(cc1)OC(F)(F)F)c1cccc(c1)C(F)(F)F,non-mutagenic
+N#Cc1ccc(cc1)C1(O)N(C(=O)NN=C1c1cccc(c1)C(F)(F)F)c1ccc(cc1)OC(F)(F)C,non-mutagenic
+OC(=O)c1cccc(c1)C(F)(F)F,non-mutagenic
+N#Cc1ccc(cc1)CC(=O)c1cccc(c1)C(F)(F)F,non-mutagenic
+N#Cc1ccc(cc1)C(=O)O,non-mutagenic
+COc1cc(OC)n2c(n1)nc(n2)NS(=O)(=O)c1c(OC)nccc1C(F)(F)F,non-mutagenic
+COc1nc2nc(nn2c(c1Cl)O)NS(=O)(=O)c1c(OC)nccc1C(F)(F)F,non-mutagenic
+COc1nccc(c1S(=O)(=O)O)C(F)(F)F,non-mutagenic
+COc1nccc(c1S(=O)(=O)N)C(F)(F)F,non-mutagenic
+Clc1ccccc1CC(C1(Cl)CC1)(Cn1[nH]cnc1=S)O,non-mutagenic
+Clc1ccccc1CC(C1(Cl)CC1)(Cn1nccc1S(=O)(=O)O)O,non-mutagenic
+Clc1ccccc1CC(C1(Cl)CC1)(Cn1nc[nH]c1=O)O,non-mutagenic
+Clc1ccccc1C(C(C1(Cl)CC1)(Cn1cncn1)O)O,non-mutagenic
+CC(=O)OC(C(C1(Cl)CC1)(Cn1cncn1)O)c1ccccc1Cl,non-mutagenic
+OCC(C1(Cl)CC1)(Cc1ccccc1Cl)O,non-mutagenic
+COc1ncc(c2n1nc(n2)NS(=O)(=O)c1c(cccc1C(F)(F)F)OCC(F)F)OC,non-mutagenic
+COc1cnc(n2c1nc(n2)NS(=O)(=O)c1c(cccc1C(F)(F)F)OCC(F)F)O,non-mutagenic
+FC(COc1cccc(c1S(=O)(=O)Nc1nnc([nH]1)C(=O)O)C(F)(F)F)F,non-mutagenic
+FC(COc1cccc(c1S(=O)(=O)NC1=NN=C[N]1)C(F)(F)F)F,non-mutagenic
+CCCCCCCCSC(=O)Oc1cc(Cl)nnc1c1ccccc1,non-mutagenic
+Clc1nnc(c(c1)O)c1ccccc1,non-mutagenic
+COc1cc(Cl)nnc1c1ccccc1,non-mutagenic
+COc1nc(nc(n1)C)NC(=O)NS(=O)(=O)c1ccccc1CCC(F)(F)F,non-mutagenic
+NC(=N)NC(=O)NS(=O)(=O)c1ccccc1CCC(F)(F)F,non-mutagenic
+FC(CCc1ccccc1S(=O)(=O)N)(F)F,non-mutagenic
+ClC(=CCOc1cc(Cl)c(c(c1)Cl)OCCCOc1cccc(n1)C(F)(F)F)Cl,non-mutagenic
+O=c1[nH]cc(cc1O)C(F)(F)F,mutagenic
+CCCN(c1c(cc(cc1[N+](=O)[O-])S(=O)(=O)N)[N+](=O)[O-])CCC,non-mutagenic
+N#C[C@H](c1cccc(c1)Oc1ccccc1)OC(=O)[C@@H]1[C@@H](C1(C)C)/C=C(/C(F)(F)F)\Cl,non-mutagenic
+Cl/C(=C\[C@H]1[C@H](C1(C)C)C(=O)O)/C(F)(F)F,non-mutagenic
+Cl/C(=C\[C@@H]1[C@@H](C1(C)C)C(=O)O)/C(F)(F)F,non-mutagenic
+NC(=O)C(c1cccc(c1)Oc1ccccc1)OC(=O)C1C(C1(C)C)/C=C(/C(F)(F)F)\Cl,non-mutagenic
+N#CC(c1cccc(c1)Oc1ccccc1)O,non-mutagenic
+OCc1cccc(c1)Oc1ccccc1,non-mutagenic
+OC(=O)C(c1cccc(c1)Oc1ccccc1)O,non-mutagenic
+CC1=NNC(=O)N(C1)N=Cc1cccnc1,non-mutagenic
+CC1=NNC(=O)N(C1)N,non-mutagenic
+O=Cc1cccnc1,non-mutagenic
+O=C([C@H](Oc1ccc(cc1)Oc1cnc2c(n1)ccc(c2)Cl)C)OCCO/N=C(\C)/C,non-mutagenic
+CCCOC(=O)NCCC[NH+](C)C.[Cl-],non-mutagenic
+CSc1nnc(c(=O)n1N)C(C)(C)C,non-mutagenic
+O=c1[nH]c(=O)[nH]nc1C(C)(C)C,non-mutagenic
+NC(C(=O)O)Cc1ncn[nH]1,non-mutagenic
+CCCN(C(=O)n1cncc1)CCOc1c(Cl)cc(cc1Cl)Cl,non-mutagenic
+CCCN(C(=O)N)CCOc1c(Cl)cc(cc1Cl)Cl,non-mutagenic
+CCCN(C(=O)NC=O)CCOc1c(Cl)cc(cc1Cl)Cl,non-mutagenic
+CN(C(=O)Oc1nc(nc(c1C)C)N(C)C)C,non-mutagenic
+CNc1nc(C)c(c(n1)O)C,non-mutagenic
+CN(c1nc(C)c(c(n1)O)C)C,non-mutagenic
+CCN(c1nc(cc(n1)C)OP(=S)(OC)OC)CC,mutagenic
+O=C(c1ccc(cc1S(=O)(=O)C)C(F)(F)F)c1cnoc1C1CC1,non-mutagenic
+N#CC(C(=O)c1ccc(cc1S(=O)(=O)C)C(F)(F)F)C(=O)C1CC1,non-mutagenic
+OC(=O)c1ccc(cc1S(=O)(=O)C)C(F)(F)F,non-mutagenic
+CCc1cc(C)cc(c1c1c(OC(=O)C(C)(C)C)n2n(c1=O)CCOCC2)CC,non-mutagenic
+CCc1cc(C)cc(c1C1(O)C(=O)N2N(C1=O)CCOCC2)CC,non-mutagenic
+CCc1cc(cc(c1c1c(O)n2n(c1=O)CCOCC2)CC)C(=O)O,non-mutagenic
+CCc1cc(CO)cc(c1C1(O)C(=O)N2N(C1=O)CCOCC2)CC,non-mutagenic
+Clc1ccc(cc1)CN(C(=O)Nc1ccccc1)C1CCCC1,non-mutagenic
+Clc1ccc(cc1)CNC1CCCC1,non-mutagenic
+Clc1ccc2c(c1)oc1-c(n2)cc(c(=O)c1)N,mutagenic
+CC(CC(c1ccccc1NC(=O)c1c(C)nn(c1F)C)C)C,non-mutagenic
+CC(c1ccccc1NC(=O)c1c(C)nn(c1F)C)CC(O)(C)C,non-mutagenic
+O=C(c1c(C)nn(c1F)C)Nc1ccccc1C(=O)C,non-mutagenic
+CCOc1cc(ccc1[N+](=O)[O-])Oc1ccc(cc1Cl)C(F)(F)F,mutagenic
+OC(C(C)(C)C)C(n1ncnc1)Cc1ccc(cc1)Cl,non-mutagenic
+OC(C(=O)O)Cn1cncn1,non-mutagenic
+COc1cc(OC)nc(n1)NC(=O)NS(=O)(=O)Nc1ccccc1C(=O)N(C)C,non-mutagenic
+O=C(c1ccccc1NS(=O)(=O)O)N(C)C,non-mutagenic
+COc1nc(NC(=O)N)nc(c1)OC,non-mutagenic
+COc1nc(NC(=O)NOS(=O)Nc2ccccc2C(=O)N(C)C)nc(c1)O,non-mutagenic
+[O-]P([O-])[O-].[K+].[K+].[K+],non-mutagenic
+[O-][P+](=O)OCC.[O-][P+](=O)OCC.[O-][P+](=O)OCC.[Al+3],non-mutagenic
+OP(O)O,non-mutagenic
+CCCCC(c1ccc(cc1)Cl)(Cn1cncn1)C#N,non-mutagenic
+N#CC(c1ccc(cc1)Cl)(Cn1cncn1)CC(=O)O,non-mutagenic
+ClCC(=O)N(c1c(C)cccc1C)Cn1cccn1,non-mutagenic
+NC(=O)C(=O)N(c1c(C)cccc1C)Cn1cccn1,non-mutagenic
+O=C(N(c1c(C)cccc1C)Cn1cccn1)CS(=O)(=O)O,non-mutagenic
+[Na]OS(=O)(=O)CC(=O)N(c1c(C)cccc1C)Cn1cccn1,non-mutagenic
+O=S(CC(=O)N(c1c(C)cccc1C)Cn1cccn1)CC(=O)O,non-mutagenic
+CS(=O)CC(=O)N(c1c(C)cccc1C)Cn1cccn1,non-mutagenic
+OC(=O)C(=O)N(c1c(C)cccc1C(=O)O)Cn1cccn1,non-mutagenic
+O=S(CC(C(=O)O)O)CC(=O)N(c1c(C)cccc1C)Cn1cccn1,non-mutagenic
+CCCC(c1ccc(cc1Cl)Cl)Cn1cncn1,non-mutagenic
+OC1(Cn2ncnc2)C(CCC1(C)C)Cc1ccc(cc1)Cl,non-mutagenic
+O=C1CCCC(=O)C1C(=O)c1ccc(cc1[N+](=O)[O-])S(=O)(=O)C,mutagenic
+O=N(=O)c1cc(ccc1C(=O)O)S(=O)(=O)C,non-mutagenic
+OC(=O)c1ccc(cc1N)S(=O)(=O)C,non-mutagenic
+[S-]C(=S)NC.[Na+],mutagenic
+CCN(C(=O)C(Oc1cccc2c1cccc2)C)CC,non-mutagenic
+OC(=O)C(Oc1cccc2c1cccc2)C,non-mutagenic
+CC1=CC[C@@H](CC1)C(=C)C,non-mutagenic
+CNC(=O)Nc1ccc(cc1)C(C)C,non-mutagenic
+COc1nc(nc(n1)C)NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC,non-mutagenic
+COC(=O)c1ccccc1S(=O)(=O)NC(=O)N,non-mutagenic
+COC(=O)c1ccccc1S(=O)(=O)N,non-mutagenic
+COc1cc(OC)nc(n1)NC(=O)NS(=O)(=O)c1ncccc1C(=O)N(C)C,non-mutagenic
+CN(C(=O)c1cccnc1S(=O)(=O)N)C,non-mutagenic
+NC(=N)NC(=O)NS(=O)(=O)c1ncccc1C(=O)N(C)C,non-mutagenic
+O=C(NS(=O)(=O)c1ncccc1C(=O)N(C)C)NC(=O)N,non-mutagenic
+CNC(=O)c1cccnc1S(=O)(=O)N,non-mutagenic
+COc1nc(nc(c1)O)NC(=O)NS(=O)(=O)c1ncccc1C(=O)N(C)C,non-mutagenic
+COCC(=O)N(c1c(C)cccc1C(=O)O)C(C(=O)O)C,non-mutagenic
+COCC(=O)N(c1c(C)cccc1C)C(C(=O)O)C,non-mutagenic
+COCC(=O)Nc1c(C)cccc1C,non-mutagenic
+CCNc1nc(Cl)nc(n1)NC(C)(C)C,non-mutagenic
+Nc1nc(nc(n1)O)NC(C)(C)C,non-mutagenic
+CCNc1nc(O)nc(n1)NC(C)(C)C,non-mutagenic
+Nc1nc(nc(n1)Cl)NC(C)(C)C,non-mutagenic
+Oc1nc2NC(C(n2c(=O)n1)O)(C)C,non-mutagenic
+CC(Nc1nc(O)nc(n1)O)(C)C,non-mutagenic
+Cn1c(O)nc(nc1=O)NC(C)(C)C,non-mutagenic
+CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC,non-mutagenic
+COP(=S)(SC(C(=O)O)CC(=O)O)OC,non-mutagenic
+CCOC(=O)CC(C(=O)OCC)SP(=S)(OC)O,non-mutagenic
+CNC(=O)Nc1ccc(cc1)Br,non-mutagenic
+NC(=O)Nc1ccc(cc1)Br,non-mutagenic
+CONC(=O)Nc1ccc(cc1)Br,non-mutagenic
+COc1cc(O)nc(n1)NC(=O)N,non-mutagenic
+OCC(c1ccc(cc1)NC(=O)N(C)C)C,non-mutagenic
+O=C(N(C)C)Nc1ccc(cc1)C(O)(C)C,non-mutagenic
+CC(c1ccc(cc1)NC(=O)N)C,non-mutagenic
+CC(c1ccc(cc1)NC(=O)N(C)C)C(=O)O,non-mutagenic
+ClCCP(=O)(O)O,non-mutagenic
+OCCP(=O)(O)O,non-mutagenic
+OC(=O)/C=C(\C=C\[C@@]1(O)C(=CC(=O)CC1(C)C)C)/C,non-mutagenic
+[O-]Cl.[Na+],mutagenic
+FS(=O)(=O)F,non-mutagenic
+O=C1CCCC(=O)C1C(=O)c1ccc(cc1Cl)S(=O)(=O)C,mutagenic
+OC(=O)c1ccc(cc1Cl)S(=O)(=O)C,non-mutagenic
+COc1cc(OC)nc(n1)NC(=O)NS(=O)(=O)c1n2ccccc2nc1S(=O)(=O)CC,non-mutagenic
+CCS(=O)(=O)c1nc2n(c1S(=O)(=O)NC(=O)NC(=N)N)cccc2,non-mutagenic
+CCS(=O)(=O)c1nc2n(c1S(=O)(=O)NC(=O)NC(=O)N)cccc2,non-mutagenic
+Clc1ccc(cc1)CCC(C(C)(C)C)(Cn1cncn1)O,non-mutagenic
+CCc1nn(c(c1Cl)C(=O)NCc1ccc(cc1)C(C)(C)C)C,non-mutagenic
+CCc1nn(c(c1Cl)C(=O)Nc1ccc(cc1)C(C(=O)O)(C)C)C,non-mutagenic
+CCc1nn(c(c1Cl)C(=O)N)C,non-mutagenic
+COP(=S)(Oc1c(Cl)cc(cc1Cl)C)OC,non-mutagenic
+Cc1c(ccc(c1C1=NOCC1)S(=O)(=O)C)C(=O)c1c[nH]n(c1=O)C,mutagenic
+OC(=O)c1ccc(c(c1C)C1=NOCC1)S(=O)(=O)C,non-mutagenic
+Clc1ccc2c(c1)[n+]([O-])nc(n2)n1cncc1,non-mutagenic
+COc1nc(C)nc(n1)N(C(=O)NS(=O)(=O)c1ccccc1C(=O)OC)C,non-mutagenic
+COP(=O)(C(C(Cl)(Cl)Cl)O)OC,non-mutagenic
+OC(=O)COc1nc(Cl)c(cc1Cl)Cl,non-mutagenic
+CCCCOCCOC(=O)COc1nc(Cl)c(cc1Cl)Cl,non-mutagenic
+CCCOCC(=Nc1ccc(cc1C(F)(F)F)Cl)n1cncc1,non-mutagenic
+CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1,non-mutagenic
+OC(=O)C(CC(=O)O)CC(=O)O,non-mutagenic
+O=C(/C=C(/C1CC1)\O)CC(C(=O)O)CC(=O)O,non-mutagenic
+O=C(c1c(O)cc(cc1O)C(=O)O)C1CC1,non-mutagenic
+OC1(Cn2ncnc2)C(=Cc2ccc(cc2)Cl)CCC1(C)C,non-mutagenic
+O[C@@H](C1/C(=C/c2ccc(cc2)Cl)/[C@@H](CC1(C)C)O)Cn1cncn1,non-mutagenic
+OC1(Cn2ncnc2)/C(=C/c2ccc(cc2)Cl)/CCC1(C)C,non-mutagenic
+COC(=O)CC(c1ccc(cc1)Cl)NC(=O)[C@H](C(C)C)NC(=O)OC(C)C,non-mutagenic
+OC(=O)CC(c1ccc(cc1)Cl)NC(=O)[C@H](C(C)C)NC(=O)OC(C)C,non-mutagenic
+COCCOc1cccc2c1c(=O)c(nn2c1ccc(cc1)Cl)C(=O)O,non-mutagenic
+OCCOc1cccc2c1c(=O)c(nn2c1ccc(cc1)Cl)C(=O)O,non-mutagenic
+ClCCOc1ccccc1S(=O)(=O)NC(=O)Nc1nc(C)nc(n1)OC,non-mutagenic
+COc1nc(nc(n1)C)NC(=O)NS(=O)(=O)O,non-mutagenic
+CCONC(=C1C(=O)CC(CC1=O)c1c(C)cc(cc1C)C)CC,non-mutagenic
+COc1cc(OC)nc(n1)NC(=O)NS(=O)(=O)c1ncccc1S(=O)(=O)CC,non-mutagenic
+CCS(=O)(=O)c1cccnc1S(=O)(=O)N,non-mutagenic
+COc1cc(OC)nc(n1)N(c1ncccc1S(=O)(=O)CC)C(=O)N,non-mutagenic
+CCO[C@H]1[C@@H](OC)[C@H](OC2C[C@@H]3[C@@H](C2)[C@@H]2C=C4C([C@@H]2CC3)CC(=O)O[C@@H](CC)CCC[C@@H]([C@H](C4=O)C)O[C@H]2CC[C@@H]([C@H](O2)C)N(C)C)O[C@H]([C@@H]1OC)C,non-mutagenic
+CCO[C@H]1[C@@H](OC)[C@H](O[C@@H]2C[C@@H]3[C@@H](C2)[C@@H]2C=C4[C@H]([C@@H]2CC3)CC(=O)O[C@@H](CC)CCC[C@@H]([C@H](C4=O)C)OC2CC[C@@H]([C@H](O2)C)NC)O[C@H]([C@@H]1OC)C,non-mutagenic
+O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC1CCC[C@H](CC)OC(=O)C[C@@H]2C(=C[C@@H]3[C@H]2CC[C@H]2[C@H]3C[C@@H](C2)OC2O[C@@H](C)[C@@H]([C@H]([C@H]2OC)OCC)OC)C(=O)[C@@H]1C,non-mutagenic
+O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC1CCC[C@H](CC)OC(=O)C[C@@H]2C(=C[C@@H]3[C@H]2C=C([C@H]2[C@H]3C[C@@H](C2)OC2O[C@@H](C)[C@@H]([C@H]([C@H]2OC)OCC)OC)C)C(=O)[C@@H]1C,non-mutagenic
+NC1=C(Cl)C(=O)c2c(C1=O)cccc2,non-mutagenic
+ClC(=C(Cl)Cl)CS(=O)(=O)O,non-mutagenic
+COC(=O)c1csc(c1S(=O)(=O)NC(=O)n1nc(n(c1=O)C)OC)C,non-mutagenic
+COc1nn(c(=O)n1C)C(=O)NS(=O)(=O)c1c(C)scc1C(=O)O,non-mutagenic
+COC(=O)c1csc(c1S(=O)(=O)N)C,non-mutagenic
+COC(=O)c1csc(c1S(=O)(=O)NC(=O)n1nc([nH]c1=O)OC)C,non-mutagenic
+O=C(NC(=O)c1ccccc1Cl)Nc1ccc(cc1)OC(F)(F)F,non-mutagenic
+FC(Oc1ccc(cc1)N)(F)F,non-mutagenic
+O=C1OC(C(=O)N1Nc1ccccc1)(C)c1ccc(cc1)Oc1ccccc1,non-mutagenic
+CCOC(=O)[C@H](Oc1ccc(cc1)Oc1cnc2c(n1)ccc(c2)Cl)C,non-mutagenic
+Clc1ccc2c(c1)ncc(n2)Oc1ccc(cc1)OC(C(=O)OCC1CCCO1)C,non-mutagenic
+O=CNc1ccc(c(c1)S(=O)(=O)NC(=O)Nc1nc(OC)cc(n1)OC)C(=O)N(C)C,non-mutagenic
+N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)[C@@H](C(C)C)Nc1ccc(cc1Cl)C(F)(F)F,non-mutagenic
+Nc1ccc(cc1Cl)C(F)(F)F,non-mutagenic
+CC(C(C(=O)O)Nc1ccc(cc1Cl)C(F)(F)F)C,non-mutagenic
+N#CC(C(C(C)C)Nc1ccc(cc1Cl)C(F)(F)F)c1cccc(c1)Oc1ccccc1,non-mutagenic
+COc1ccc(cc1[O-])[N+](=O)[O-].[Na+],non-mutagenic
+[O-][N+](=O)c1ccccc1[O-].[Na+],non-mutagenic
+[O-]c1ccc(cc1)[N+](=O)[O-].[Na+],non-mutagenic
+CCC(C(=O)OC1=C(C(=O)OC21CCCCC2)c1cc(Cl)cc(c1)Cl)(C)C,non-mutagenic
+OC[C@H]1O[C@@H](OCc2ccc(cc2)NS(=O)(=O)N(C)C)C[C@@H]([C@@H]([C@@H]1O)O)O,non-mutagenic
+Cc1ccc(cc1)N(S(=O)(=O)N(C)C)SC(Cl)(Cl)F,non-mutagenic
+OCc1ccc(cc1)NS(=O)(=O)N(C)C,non-mutagenic
+OCC1OC(Oc2cc(C)ccc2NS(=O)(=O)N(C)C)C(C(C1O)O)O,non-mutagenic
+Cc1ccc(c(c1)O)NS(=O)(=O)N(C)C,non-mutagenic
+O=C(CC(C)(C)C)OC1=C(C(=O)OC21CCCC2)c1c(C)cc(cc1C)C,non-mutagenic
+CCCN(CC1COC2(O1)CCC(CC2)C(C)(C)C)CC,non-mutagenic
+CCC[N+](CC1COC2(O1)CCC(CC2)C(C)(C)C)(CC)[O-],non-mutagenic
+O=C(C1(C)CCCCC1)Nc1ccc(c(c1Cl)Cl)O,non-mutagenic
+CCOC(=O)OC1=C(C(=O)NC21CCC(CC2)OC)c1cc(C)ccc1C,non-mutagenic
+COC1CCC2(CC1)NC(=O)C(C2=O)(O)c1cc(C)ccc1C,non-mutagenic
+OC1CCC2(CC1)NC(=O)C(C2=O)(O)c1cc(C)ccc1C,non-mutagenic
+OC1CCC2(CC1)NC(=O)C(C2O)(O)c1cc(C)ccc1C,non-mutagenic
+COC1CCC2(CC1)NC(=O)C(C2O)c1cc(C)ccc1C,non-mutagenic
+Clc1cc(cnc1Nc1c(cc(c(c1[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F,non-mutagenic
+Clc1cc(cnc1Nc1c(cc(c(c1[N+](=O)[O-])O)C(F)(F)F)[N+](=O)[O-])C(F)(F)F,mutagenic
+Clc1cc(cnc1Nc1c(cc(c(c1N)Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F,non-mutagenic
+CSC1=NC(C(=O)N1Nc1ccccc1)(C)c1ccccc1,non-mutagenic
+O=C1NC(=O)N[C@@]1(C)c1ccccc1,non-mutagenic
+O=C1N[C@@](C(=O)N1Nc1ccccc1)(C)c1ccccc1,non-mutagenic
+CSC1=N[C@@](C(=O)N1)(C)c1ccccc1,non-mutagenic
+CCOC(=O)NCCOc1ccc(cc1)Oc1ccccc1,non-mutagenic
+CCOP(=O)(Oc1ccc(c(c1)C)SC)NC(C)C,non-mutagenic
+CC(c1ccccc1)(C[Sn](O[Sn](CC(c1ccccc1)(C)C)(CC(c1ccccc1)(C)C)CC(c1ccccc1)(C)C)(CC(c1ccccc1)(C)C)CC(c1ccccc1)(C)C)C,non-mutagenic
+CC(Cc1ccc(cc1)C(C)(C)C)CN1C[C@H](C)O[C@@H](C1)C,non-mutagenic
+O=C(c1cccc(c1C(=O)NC(CS(=O)(=O)C)(C)C)I)Nc1ccc(cc1C)C(C(F)(F)F)(C(F)(F)F)F,non-mutagenic
+O=C(c1ccccc1C(=O)Nc1ccc(cc1C)C(C(F)(F)F)(C(F)(F)F)F)NC(CS(=O)(=O)C)(C)C,non-mutagenic
+O=C(c1cccc(c1C(=O)NC(CS(=O)(=O)C)(C)C)O)Nc1ccc(cc1C)C(C(F)(F)F)(C(F)(F)F)F,non-mutagenic
+N#CCNC(=O)c1cnccc1C(F)(F)F,non-mutagenic
+OC(=O)c1cnccc1C(F)(F)F,non-mutagenic
+NC(=O)c1cnccc1C(F)(F)F,non-mutagenic
+O=C(c1cnccc1C(F)(F)F)NCC(=O)O,non-mutagenic
+O=C(c1cnccc1C(F)(F)F)NCC(=O)N,non-mutagenic
+Oc1ncc(c(c1)C(F)(F)F)C(=O)O,non-mutagenic
+CO/N=C(\c1ccccc1Oc1ncnc(c1F)Oc1ccccc1Cl)/C1=NOCCO1,non-mutagenic
+CO/N=C(\c1ccccc1Oc1ncnc(c1F)O)/C1=NOCCO1,non-mutagenic
+CC(Cc1ccc(cc1)C(C)(C)C)CN1CCCCC1,non-mutagenic
+CC(C[N+]1([O-])CCCCC1)Cc1ccc(cc1)C(C)(C)C,non-mutagenic
+Clc1ccc(c(c1)Cl)n1c(nc2c(c1=O)cc(cc2)F)n1cncn1,non-mutagenic
+Clc1ccc(c(c1)Cl)n1c(=O)[nH]c2c(c1=O)cc(cc2)F,non-mutagenic
+C#CCN1C(=O)COc2c1cc(c(c2)F)N1C(=O)C2=C(C1=O)CCCC2,non-mutagenic
+Cc1cnc2c(c1)ccc(c2C(=O)O)Cl,non-mutagenic
+OC(=O)c1c(Cl)ccc2c1nc(O)c(c2)C,non-mutagenic
+OC(=O)c1cnc2c(c1)ccc(c2C(=O)O)Cl,mutagenic
+N#CN=S(=O)(C(c1ccc(nc1)C(F)(F)F)C)C,non-mutagenic
+NC(=O)N=S(=O)(C(c1ccc(nc1)C(F)(F)F)C)C,non-mutagenic
+CC(c1ccc(nc1)C(F)(F)F)O,non-mutagenic
+CCc1ccc(nc1)C(F)(F)F,non-mutagenic
+CC(S(=O)(=N)C)c1ccc(nc1)C(F)(F)F,non-mutagenic
+CC(S(=O)(=O)C)c1ccc(nc1)C(F)(F)F,non-mutagenic
+ClCC1CN(C(=O)C1Cl)c1cccc(c1)C(F)(F)F,non-mutagenic
+CNC(=O)Oc1cccc(c1)N=CN(C)C.Cl,non-mutagenic
+c1coc(c1)c1nc2c([nH]1)cccc2,non-mutagenic
+CCOC(=O)[C@H](Oc1ccc(cc1)Oc1nc2c(o1)cc(cc2)Cl)C,non-mutagenic
+CCOC(=O)C(Oc1ccc(cc1)Oc1nc2c(o1)cc(cc2)Cl)C,non-mutagenic
+CCCCCCC(OC(=O)COc1nc(F)c(c(c1Cl)N)Cl)C,non-mutagenic
+[O-]P(=O)([O-])[O-].[Fe+3],non-mutagenic
+Cn1nc(c(c1)C(=O)Nc1ccccc1C1CC1C1CC1)C(F)F,non-mutagenic
+CC(Oc1cccc(c1)NC(=O)c1ccccc1C(F)(F)F)C,non-mutagenic
+Clc1cc(cnc1CCNC(=O)c1ccccc1C(F)(F)F)C(F)(F)F,non-mutagenic
+C[C@@H]1N(C(=O)NC2CCCCC2)C(=O)S[C@H]1c1ccc(cc1)Cl,non-mutagenic
+C[C@@H]1N(C(=O)N)C(=O)S[C@H]1c1ccc(cc1)Cl,non-mutagenic
+O=C1CCCC(C1)NC(=O)N1C(=O)SC(C1C)c1ccc(cc1)Cl,non-mutagenic
+O[C@H]1CCCC[C@@H]1NC(=O)N1C(=O)S[C@H]([C@@H]1C)c1ccc(cc1)Cl,non-mutagenic
+O[C@@H]1CC[C@H](CC1)NC(=O)N1C(=O)S[C@@H]([C@H]1C)c1ccc(cc1)Cl,non-mutagenic
+OC1CCCC(C1)NC(=O)N1C(=O)SC(C1C)c1ccc(cc1)Cl,non-mutagenic
+C[C@@H]1NC(=O)S[C@H]1c1ccc(cc1)Cl,non-mutagenic
+O[C@@H]1CC[C@@H](CC1)NC(=O)N1C(=O)S[C@H]([C@@H]1C)c1ccc(cc1)Cl,non-mutagenic
+O=C1CCC(CC1)NC(=O)N1C(=O)S[C@@H]([C@H]1C)c1ccc(cc1)Cl,non-mutagenic
+N#CC(c1ccccc1)(Cn1cncn1)CCc1ccc(cc1)Cl,non-mutagenic
+Clc1ccc(cc1)[C@H]1OC(=O)[C@@](C1)(Cn1cncn1)c1ccccc1,non-mutagenic
+Clc1ccc(cc1)[C@@H]1OC(=O)[C@@](C1)(Cn1cncn1)c1ccccc1,non-mutagenic
+COc1nc(nc(c1)OC)[N-]C(=O)NS(=O)(=O)c1nc(ccc1C(=O)OC)C(F)(F)F.[Na+],non-mutagenic
+COc1cc(OC)nc(n1)n1c(=O)[nH]c(=O)c2c1nc(cc2)C(F)(F)F,non-mutagenic
+COc1cc(O)nc(n1)n1c(=O)[nH]c(=O)c2c1nc(cc2)C(F)(F)F,non-mutagenic
+OC(=O)c1ccc(nc1S(=O)(=O)N)C(F)(F)F,non-mutagenic
+COC(=O)c1ccc(nc1S(=O)(=O)N)C(F)(F)F,non-mutagenic
+CCc1ccc(cc1)C(=O)NN(C(C)(C)C)C(=O)c1cc(C)cc(c1)C,non-mutagenic
+Cc1cc(C)cc(c1)C(=O)N(C(C)(C)C)NC(=O)c1ccc(cc1)C(=O)C,non-mutagenic
+O=C(c1ccc(cc1)C(=O)O)NN(C(C)(C)C)C(=O)c1cc(C)cc(c1)C,non-mutagenic
+CCc1ccc(cc1)C(=O)NN(C(C)(C)C)C(=O)c1cc(C)cc(c1)CO,non-mutagenic
+O=C(c1ccc(cc1)C(=O)C)NN(C(C)(C)C)C(=O)c1cc(cc(c1)C(=O)O)C(=O)O,non-mutagenic
+OC(=O)Cc1ccc(cc1)C(=O)NN(C(C)(C)C)C(=O)c1cc(C)cc(c1)C,non-mutagenic
+Cc1cc(C)cc(c1)C(=O)N(C(C)(C)C)NC(=O)c1ccc(cc1)C(O)C,non-mutagenic
+CCc1ccc(cc1)C(=O)NN(C(C)(C)C)C(=O)c1cc(C)cc(c1)C=O,non-mutagenic
+O=C(C1C(C1(C)C)/C=C(/C(F)(F)F)\Cl)OCc1c(F)c(F)c(c(c1F)F)C,non-mutagenic
+N#Cc1nn(c(c1S(=O)C(F)(F)F)N)c1c(Cl)cc(cc1Cl)C(F)(F)F,non-mutagenic
+N#Cc1nn(c(c1SC(F)(F)F)N)c1c(Cl)cc(cc1Cl)C(F)(F)F,non-mutagenic
+N#Cc1nn(c(c1S(=O)(=O)C(F)(F)F)N)c1c(Cl)cc(cc1Cl)C(F)(F)F,non-mutagenic
+N#Cc1nn(c(c1C(F)(F)F)N)c1c(Cl)cc(cc1Cl)C(F)(F)F,non-mutagenic
+N#Cc1nn(c(c1S(=O)(=O)O)N)c1c(Cl)cc(cc1Cl)C(F)(F)F,non-mutagenic
+OC(=O)c1nn(c(c1S(=O)C(F)(F)F)N)c1c(Cl)cc(cc1Cl)C(F)(F)F,non-mutagenic
+NC(=O)c1nn(c(c1S(=O)C(F)(F)F)N)c1c(Cl)cc(cc1Cl)C(F)(F)F,non-mutagenic
+Cc1cc(=O)[nH]o1,non-mutagenic
+OC(C(C)(C)C)C(n1ncnc1)Oc1ccc(cc1)Cl,non-mutagenic
+Fc1ccc(cc1)C(c1ccccc1F)(Cn1cncn1)O,non-mutagenic
+C=CCSC(=O)n1c(N)c(c(=O)n1C(C)C)c1ccccc1C,non-mutagenic
+Cc1ccccc1c1c(N)[nH]n(c1=O)C(C)C,non-mutagenic
+OC(=O)[C@H](Oc1ccc(cc1)Oc1ncc(cc1Cl)C(F)(F)F)C,non-mutagenic
+COC(=O)C(Oc1ccc(cc1)Oc1ncc(cc1Cl)C(F)(F)F)C,non-mutagenic
+O=c1[nH]cc(cc1Cl)C(F)(F)F,non-mutagenic
+Cn1cc(cc(c1=O)Cl)C(F)(F)F,non-mutagenic
+COC(=O)c1cccc(c1S(=O)(=O)NC(=O)Nc1nc(OCC(F)(F)F)nc(n1)N(C)C)C,non-mutagenic
+Nc1nc(OCC(F)(F)F)nc(n1)N(C)C,non-mutagenic
+CNc1nc(OCC(F)(F)F)nc(n1)N,non-mutagenic
+FC(COc1nc(N)nc(n1)N)(F)F,non-mutagenic
+O=C1NS(=O)(=O)c2c1cccc2C,non-mutagenic
+NCP(=O)(O)O,non-mutagenic
+CNC1=C(c2cccc(c2)C(F)(F)F)C(=O)C(O1)c1ccccc1,non-mutagenic
+OC(=O)C(F)(F)F,non-mutagenic
+CSC(=NOC(=O)N(SN(C(=O)ON=C(SC)C)C)C)C,non-mutagenic
+OC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)[C@@]1(C)Cn1ccnn1,non-mutagenic
+Oc1cc2O[C@@H](Cc2c2c1c(=O)c1c(n2C)cccc1)[C@@]1(C)CO1,mutagenic
+C[C@H]1CCC[C@@]2([C@]1(O)CCCC2)C,non-mutagenic
+COC1=CC(=O)c2c(C1=O)ncc1c2[nH]c2c1cncc2,mutagenic
+N1[C@@H]2[C@H]1c1cscc1-c1c2csc1,mutagenic
+CCCC[C@H](COC(=O)COc1ccc(cc1Cl)Cl)CC,non-mutagenic
+CCN(CC#CC(OC(=O)[C@@](c1ccccc1)(C1CCCCC1)O)(C)C)CC.Cl.O,non-mutagenic
+F[C@H](C(C(Cl)(F)F)(F)F)Cl,non-mutagenic
+Nc1cc(N)c(cc1/N=N/c1ccccc1)C,mutagenic
+Nc1ccc2c(c1)nc1c(c2)ccc(c1)N.Cl,mutagenic
+C[C@@H]([C@@H](Cc1ccc(c(c1)O)O)C)Cc1ccc(c(c1)O)O,non-mutagenic
+OC(=O)C1=CC2=CC[C@@H]3[C@@H]([C@]2(CC1)C)CC[C@]1([C@H]3CC[C@H]1C(=O)NC(C)(C)C)C,non-mutagenic
+OC(=O)COc1ccc(cc1Cl)Cl.OCCNCCO,non-mutagenic
+C[C@H]1CCCC(=O)CCC/C=C/c2c(C(=O)O1)c(O)cc(c2)O,non-mutagenic
+OC(=O)CC[C@@H](C(=O)O)N.[K+].O,non-mutagenic
+Cc1nccc2c1[nH]c1c2cccc1.Cl,mutagenic
+O=NN1CCO[C@H](C1)O,mutagenic
+O1CCO[C@@H]2CCCC[C@H]2OCCOCCO[C@H]2[C@H](OCC1)CCCC2,non-mutagenic
+COc1cc(ccc1/N=N/c1c(O)c2ccc(cc2cc1S(=O)(=O)O)N)c1ccc(c(c1)OC)/N=N/c1cc(c2c(c1O)cccc2)S(=O)(=O)O,mutagenic
+CC([C@H]1c2cc(C(=O)C)c(cc2C([C@@H]1C)(C)C)C)C,non-mutagenic
+CO[C@H]1[C@@H](N)C[C@@H](O[C@H]1C)O[C@H]1C[C@@](O)(Cc2c1c(O)c1c(c2O)C(=O)c2c(C1=O)c(OC)ccc2)C(=O)CO,mutagenic
+CN1CCN(CC1)C1=CC(=O)c2c(C1=O)c1[nH]c3c(c1c(n2)C)cccc3,mutagenic
+O=C1c2ccccc2C(=O)c2c1ccc(c2O)C,mutagenic
+C[C@H]1OC(=O)c2c(C1)ccc(c2O)C(=O)N[C@H](C(=O)O)Cc1ccccc1,non-mutagenic
+CCCC[C@H]1CO1,non-mutagenic
+O=C1[C@@H]2O[C@@H]2[C@@H]2c3c1c1=C(O)C=C[C@H]4c1c(c3=C(C=C2)O)C(=O)[C@H]1[C@@H]4O1,mutagenic
+COc1ccc(cc1N)N,mutagenic
+OC[C@@H]([C@H]1OC(=O)C(=C1O)O)O.[Na+],non-mutagenic
+[O-][N+](=C1CCCC1)[O-],mutagenic
+CCN1CCN(C(=O)C1=O)C(=O)N[C@@H](C(=O)N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C)c1ccccc1.[Na+],non-mutagenic
+O[C@H]1[C@H](O)[C@@H]2O[C@@H]2c2c1ccc1c2nc2c(c1)ccc1c2cccc1,mutagenic
+O[C@@H](COc1cccc2c1C[C@H](O)[C@@H](C2)O)CNC(C)(C)C,non-mutagenic
+OC(=O)[C@H](CC(=O)c1cccc(c1N)O)N,non-mutagenic
+NCC[C@H](N)C,non-mutagenic
+Nc1nc(C)c2c(c1)[nH]c1c2cccc1,mutagenic
+OC(=O)[C@H]1N[C@@H](C)c2c(C1)c1ccccc1[nH]2,non-mutagenic
+C/C=C/C=O,mutagenic
+Nc1ccc2c(c1)cc1c([n+]2C)cccc1.Cl,mutagenic
+CCCCNCCCNCCCNC(=O)c1csc(n1)c1csc(n1)CCNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([C@@H]([C@H](NC(=O)[C@H]([C@H](c1nc[nH]c1)O[C@@H]1O[C@@H](CO)[C@@H]([C@@H]([C@@H]1O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)OC(=O)N)O)O)O)NC(=O)c1nc(nc(c1C)N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)C)O)C,mutagenic
+CCOc1ccc(cc1)/N=[N+](/c1ccc(cc1)OCC)\[O-],non-mutagenic
+O=CC1=C[C@]2(O)CC(C[C@@H]2[C@H](C=C1C=O)C)(C)C,mutagenic
+c1ccc2c(c1)c1ccc3c4c1c(c2)ccc4ccc3,mutagenic
+Nc1ccc(c(c1)C)N,mutagenic
+COc1ccc(c(c1)/N=N/c1c(O)ccc2c1cccc2)OC,mutagenic
+CN(c1ccc(cc1)/N=N/c1cccc2c1cccc2)C,mutagenic
+O=c1[nH]c(=O)n(cc1F)[C@H]1CCCO1,non-mutagenic
+O=C(N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C)COc1ccccc1.[K+],non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O[P@@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(nc1=O)N)O)O)n1cnc2c1ncnc2N,non-mutagenic
+c1ccc2-c3ccc4c(c3[C@@H]3[C@H](c2c1)O3)cccc4,mutagenic
+Br[C@H]([C@H](Br)C)CO[P@](=O)(OC[C@@H]([C@H](Br)C)Br)OC[C@@H]([C@H](Br)C)Br,mutagenic
+OC[C@H]1O[C@H](C(=O)[C@@H]1O)n1cnc2=C(NCN=c12)N,non-mutagenic
+OC(=O)C[C@H](C(=O)O)O,non-mutagenic
+C=CCc1ccccc1OC[C@@H](CNC(C)C)O,non-mutagenic
+O=C(Cc1cnc(nc1N)C)N/C(=C(/SC(=O)c1ccccc1)\CCOC(=O)c1ccccc1)/C.Cl,non-mutagenic
+OC(=O)/C=C\C(=O)O.[Na+].[Na+],non-mutagenic
+COC(=O)/C(=C\c1ccc(o1)[N+](=O)[O-])/[N+](=O)[O-],mutagenic
+CN(c1ccc(cc1)/N=N/c1ccc(cc1)N(C)C)C,non-mutagenic
+ON1c2ccccc2C(=O)[C@@]1(C)c1ccccc1,non-mutagenic
+c1ccc(cc1)CN1[C@@H]2[C@H]1c1ccccc1-c1c2cccc1,mutagenic
+O[C@H]1[C@H](O)c2ccc(c3c2c2c1cccc2c1c3cccc1)[N+](=O)[O-],mutagenic
+Cl[C@@H](c1ccccc1)C(=O)NCc1ccccc1,mutagenic
+O(C[C@@H]1OC1)CCOC[C@@H]1OC1,mutagenic
+OC(=O)c1ccc(cc1)/C=N/n1nnc2c(c1=O)[nH]c1c2cccc1,mutagenic
+N#CC(/N=N/C(C#N)(C)C)(C)C,non-mutagenic
+CCC(=O)O.[Na+],non-mutagenic
+CN(c1c(C)n(n(c1=O)c1ccccc1)C)CS(=O)(=O)O.[Na+].O,mutagenic
+Br[C@H]1[C@H](Cl)[C@H](Br)[C@@H]([C@H]([C@H]1Br)Br)Br,non-mutagenic
+Cl[C@H]1O[C@H]1CBr,mutagenic
+CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](CN([C@@H]([C@@H]([C@]1(C)O)O)C)C)C)(C)O,non-mutagenic
+CNP1(=NP(=NP(=N1)(NC)NC)(NC)NC)NC,non-mutagenic
+CCOS(=O)(=O)C,mutagenic
+OC(=O)[C@H](CC[S@](=O)(=N)C)N,non-mutagenic
+[N-]=[N+]=CC(=O)NCC(=O)NN,mutagenic
+CC(=O)Nc1cccc(c1)N,mutagenic
+Nc1cccc(c1C)N.Cl.Cl,mutagenic
+OC(=O)[C@H](Cc1c[nH]c2c1cc(O)cc2)N,non-mutagenic
+[N-]=[N+]=Nc1ccc(c(c1)[N+](=O)[O-])F,mutagenic
+COC1=CC(=O)c2c(C1=O)nc(c1c2[nH]c2c1cncc2)C,mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/OC[C@@H](CO)O,mutagenic
+ClC/C=C/Cl,mutagenic
+Nc1ccccc1c1ccccc1.Cl,mutagenic
+N[C@H](C(=O)O)CS/C=C/Cl,non-mutagenic
+CNC1Cc2cccc3c2c(C1)ccc3.Cl,mutagenic
+c1ccc2c(n1)[C@@H]1O[C@@H]1[C@@H]1[C@H]2O1,non-mutagenic
+CCCn1cc2c3c1cccc3[C@@H]1[C@@H](C2)N(C)CC(=C1)C,mutagenic
+[O-][N+](=O)c1cccc2c1[nH]nc2,mutagenic
+OC(=O)c1cc2ccccc2cc1O,non-mutagenic
+O=C(N[C@H](C(=O)O)CC(=O)O)COc1ccc(cc1Cl)Cl,non-mutagenic
+N#C[C@H](c1cccc(c1)Oc1ccccc1)OC(=O)[C@H](c1ccc(cc1)Cl)C(C)C,non-mutagenic
+NC(=O)Nc1cc(ccc1O)[C@@H](CNC(C)(C)C)O.Cl,non-mutagenic
+O=CC(=C(C)C)Cl,mutagenic
+OC(=O)C([C@@](C([C@](C(Cl)(F)F)(Cl)F)(F)F)(Cl)F)(F)F,non-mutagenic
+[O-][N+](=O)c1cccc(c1C)/N=[N+](/c1cccc(c1C)[N+](=O)[O-])\[O-],non-mutagenic
+Cc1ccc(c(c1)C)/N=N/c1c(O)ccc2c1cccc2,mutagenic
+c1ccc2-c3c4c(-c2c1)cccc4ccc3,mutagenic
+Fc1ccc2-c3c([C@H](c2c1)C)cccc3,mutagenic
+ClCCN([P@]1(=O)OCCCN1CCCl)CCCl,mutagenic
+OCCN(c1ccc(cc1)/N=N/c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])CCO,mutagenic
+ONc1nc(N)nc2c1nc[nH]2,mutagenic
+OC(=O)C/C(=C\C(=O)O)/C(=O)O,non-mutagenic
+O=NN(C)C,mutagenic
+CNC(=O)O/N=C/C(SC)(C)C,non-mutagenic
+O=Cc1c2ccccc2cc2c1cccc2,non-mutagenic
+OS(=O)(=O)O.COc1ccc(cc1N)N,mutagenic
+CCCCCN(C(=O)[C@@H](NC(=O)c1ccc(c(c1)Cl)Cl)CCC(=O)O)CCCOC,non-mutagenic
+CCc1c2ccc3c(c2cc2c1cccc2)[C@@H]1O[C@@H]1[C@@H]([C@H]3O)O,mutagenic
+[O-][N+](=O)[C@@H](CC)C,non-mutagenic
+O=C1CC[C@H](N1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N)Cc1nc[nH]c1,non-mutagenic
+Cc1ccc(cc1)/N=N/NCc1ccccc1,mutagenic
+CCC/C=C(/C=O)\CC,non-mutagenic
+OC[C@H]1O[C@@H](O[C@@]23C=C(C)C4([C@]([C@@H]3C(=O)C(C2)(C)C)(C)O)CC4)[C@@H]([C@H]([C@@H]1OC(=O)/C=C/c1ccc(cc1)O)O)OC(=O)C,mutagenic
+Oc1ccc(cc1)/N=N/c1ccc(cc1)c1ccc(cc1)/N=N/c1c(N)c2c(cc1S(=O)(=O)O)cc(c(c2O)/N=N/c1ccccc1)S(=O)(=O)O.[Na+].[Na+],mutagenic
+N[C@@H]1CCC[C@H](C1)N,non-mutagenic
+O=C1c2ccccc2N/C/1=C\1/Nc2c(C1=O)cccc2,mutagenic
+C1CCC(CC1)N1[C@@H]2[C@H]1c1ccccc1-c1c2cccc1,mutagenic
+Cl[C@@H](C=C)CCl,non-mutagenic
+COc1ccccc1N.Cl,mutagenic
+BrC[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3,mutagenic
+C/N=N/O.[K+],mutagenic
+CN(c1ccc(cc1)/N=N/c1ccc2c(c1)scn2)C,mutagenic
+C/C(=C\C(=O)OCC(=O)[C@@]1(O)CC[C@@H]2[C@]1(C)C[C@@H](O)[C@H]1[C@H]2CCC2=CC(=O)C=C[C@]12C)/CC/C=C(\CCC=C(C)C)/C,non-mutagenic
+O[C@H]([C@H](C(=O)O)O)C(=O)O.[Na+].[Na+],non-mutagenic
+OS(=O)(=O)c1cc2ccc(c(c2c(c1)S(=O)(=O)O)/N=N/c1ccc(cc1C)c1ccc(c(c1)C)/N=N/c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)O.[Na+].[Na+],mutagenic
+C=CS(=O)(=O)C,non-mutagenic
+CC(C[C@H](O)C)C,non-mutagenic
+COC(=O)c1ccc(cc1)/C=N/n1nnc2c(c1=O)[nH]c1c2cccc1,mutagenic
+O=C/C=C/c1ccccc1,non-mutagenic
+Brc1ccccc1c1ccccc1,non-mutagenic
+COc1ccc(cc1)CNC(=O)[C@H](Br)C,mutagenic
+CSCC[C@@H](C(=O)O)NC(=O)COc1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+Cc1cc(ccc1N)/N=N/c1ccccc1C,mutagenic
+[N-]=[N+]=Nc1ccc2c(c1)nc1c(c2Nc2ccc(cc2)C(=O)O)cccc1,mutagenic
+OC(=O)CN(CC(=O)O)CC(=O)O.[Na+].[Na+].[Na+].O,non-mutagenic
+C[C@]1(OC1)c1ccccc1,mutagenic
+C[C@@H]1c2ccccc2-c2c1cc(C)c(c2)C,mutagenic
+CCCCCC[C@@H]1OC1,non-mutagenic
+O=C1C=CC(=[N+]=[N-])C=C1,mutagenic
+COC1(CCCC1)O[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC[C@@H]2[C@]1(C)C[C@H]1S[C@H]1C2,non-mutagenic
+CN(/N=N/c1ccc(cc1)[N+](=O)[O-])C,mutagenic
+OC[C@H](COP(=O)(O)O)O.[K+].[K+],non-mutagenic
+COc1cc(ccc1O)C[C@H]1CO1,mutagenic
+N[C@H](C(=O)O)CS/C(=C(/C(Cl)(Cl)Cl)\Cl)/Cl,mutagenic
+O[C@H]1C=CC=C[C@@H]1O,mutagenic
+CC/N=N/O.[K+],mutagenic
+OCC(=O)[C@@]1(O)C[C@H](O[C@H]2C[C@H](N)C[C@@H](O2)C)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC,mutagenic
+CC(=O)OCc1ccc(cc1)/N=N/c1ccc(cc1)COC(=O)C,mutagenic
+C1COCCO[C@@H]2CCCC[C@H]2OCCOCCOCCO[C@H]2[C@H](OCCO1)CCCC2,non-mutagenic
+CCCCCCCCCCCCCC[N+](Cc1ccccc1)(C)C.Cl,non-mutagenic
+O[I](=O)(=O)=O.NCC(=O)NCC(=O)NCC(=O)NCC(=O)O,non-mutagenic
+CCc1cc2ccccc2c2c1c1[C@@H]3O[C@@H]3[C@@H]([C@H](c1cc2)O)O,mutagenic
+NC[C@@H](C(=O)N[C@@H]1C[C@@H](N)[C@H]([C@@H]([C@H]1O[C@H]1OC[C@]([C@@H]([C@H]1O)NC)(C)O)O)O[C@H]1O[C@H](CN)[C@H]([C@@H]([C@H]1O)O)O)O,non-mutagenic
+C[C@H]1CN(C)[C@H]2[C@H](C1)c1cc(Br)cc3c1c(C2)cn3CC1CC1,non-mutagenic
+OS(=O)(=O)O.OC[P+](CO)(CO)CO,non-mutagenic
+Fc1ccc2-c3c(-c4c2c1ccc4)c1ccccc1cc3,mutagenic
+Oc1ccc2c(c1)c(cc(c2)S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+],non-mutagenic
+COC1=CC(=O)c2c(C1=O)c1[nH]c3c(c1c(n2)C)cccc3,mutagenic
+O=C1OC[C@]2(C(=C1)C(=C[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@]2(OC(=O)C)C(=O)C)C)Cl)C,non-mutagenic
+Cc1ccc(cc1)/N=N/c1c(O)ccc2c1cccc2,non-mutagenic
+O=C(c1ccccc1)OCC(COC(=O)c1ccccc1)(COC(=O)c1ccccc1)COC(=O)c1ccccc1,non-mutagenic
+OS(=O)(=O)O.Nc1ccc2c(c1)nc1c(c2)ccc(c1)N,mutagenic
+CCCCCCCCCCSCn1cc[n+](c1)C.Cl,mutagenic
+Nc1c2ccccc2nc2c1cccc2,mutagenic
+CC(=O)[C@H](C(=O)Nc1ccccc1)/N=N/c1ccc(cc1Cl)c1ccc(c(c1)Cl)/N=N/[C@@H](C(=O)Nc1ccccc1)C(=O)C,non-mutagenic
+COC(=O)C1=C(C)NC(=C([C@@H]1c1ccccc1[N+](=O)[O-])C(=O)OC)C,non-mutagenic
+O/C=C\1/C[C@@]2(C)[C@H](CC1=O)CC[C@@H]1[C@@H]2CC[C@]2([C@@H]1CC[C@]2(C)O)C,non-mutagenic
+OC[C@H]1O[C@H](C[C@@H]1O)n1c(O)nc2c1nc(N)[nH]c2=O,non-mutagenic
+O/N=C/1\C=C/C(=N/O)/C=C1,mutagenic
+COc1cc2O[C@@H]3[C@H](c2c2c1c1CCC(=O)c1c(=O)o2)CCO3,mutagenic
+c1ccc(nc1)c1ccccn1,mutagenic
+[O-][N+](=O)CC,non-mutagenic
+CC(=O)O[C@@H]1Cc2c3c1c1ccc4c(c1cc3ccc2C)cccc4,mutagenic
+Nc1ccc(cc1)Cl.Cl,mutagenic
+ClC(/C(=C(\C(=O)O)/Cl)/C(=O)O)Cl,mutagenic
+O=C(C1c2ccccc2Oc2c1cccc2)OCC[N+](C(C)C)(C(C)C)C.Br,non-mutagenic
+NC1CCCCC1.OCCCN[P@](=O)(N(CCCl)CCCl)O,mutagenic
+O=C([C@H](Cc1c[nH]cn1)NC(=O)[C@@H](CS(=O)(=O)C(C)(C)C)Cc1ccccc1)N[C@H]([C@H]([C@H](C1CC1)O)O)CC1CCCCC1,non-mutagenic
+ClCCc1cn([C@H]2C[C@@H]([C@H](O2)CO)O)c(=O)[nH]c1=O,non-mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)cc1c(c2)cc(cc1)[N+](=O)[O-],mutagenic
+COc1ccc2c3c1C(=O)N(C)C(=O)c3ccc2,non-mutagenic
+[O-]/[N+](=N\c1ccc2-c3c(Cc2c1)cccc3)/c1ccc2-c3c(Cc2c1)cccc3,non-mutagenic
+Cc1cc(O)c(c(=O)o1)C(=O)C.[Na+],non-mutagenic
+O[C@H]1[C@@H]2O[C@@H]2c2c([C@@H]1O)ccc1c2nc2ccc3c(c2c1)cccc3,mutagenic
+OS(=O)(=O)c1ccc2c(c1)c(/N=N/c1ccc(c(c1)C(=O)O)O)ccc2/N=N/c1ccc(cc1)c1ccc(cc1)/N=N/c1ccc(c(c1)C(=O)O)O,mutagenic
+O=CCC=O,mutagenic
+Cc1nsc(c1)N.Cl,mutagenic
+CCCCN1[C@@H]2[C@H]1c1ccccc1-c1c2cccc1,mutagenic
+O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)O)C)C)C,non-mutagenic
+CCOC(=O)O[C@H](c1ccnc2c1cc(OC)cc2)[C@@H]1C[C@@H]2CCN1C[C@@H]2C=C,non-mutagenic
+OS(=O)(=O)O.OC[C@@H]1O[C@@H](O[C@H]([C@@H](C(=O)N[C@@H]([C@@H]([C@H](C(=O)N[C@@H](C(=O)NCCc2scc(n2)c2ncc(s2)C(=O)NCCC[S+](C)C)[C@@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)c2nc[nH]c2)[C@H]([C@@H]([C@@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@H]([C@@H]1O)OC(=O)N)O.OC[C@@H]1O[C@@H](O[C@H]([C@H](C(=O)N[C@@H]([C@@H]([C@@H](C(=O)N[C@@H](C(=O)NCCc2scc(n2)c2ncc(s2)C(=O)NCCC[S+](C)C)[C@@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)c2nc[nH]c2)[C@H]([C@@H]([C@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@H]([C@@H]1O)OC(=O)N)O,mutagenic
+O[C@@H]1C[C@@]2(C)[C@H]([C@]([C@@H]1O)(C)C(=O)O)CC[C@@]1([C@@H]2CC=C2[C@]1(C)CC[C@]1([C@H]2CC(C)(C)CC1)C(=O)O)C,non-mutagenic
+CN(CCN(c1ccccn1)Cc1cscc1)C.Cl,non-mutagenic
+Cc1ccc(cc1/N=[N+](/c1cc(ccc1C)[N+](=O)[O-])\[O-])[N+](=O)[O-],non-mutagenic
+c1ccc2c(c1)cc(cc2)OC[C@H]1CO1,mutagenic
+O=C1c2cc3ccccc3cc2-c2c1cccc2,mutagenic
+CNc1ccc(cc1)/N=N/c1ccccc1,mutagenic
+CCN(c1ccc(c(c1)O)N=O)CC.Cl,non-mutagenic
+C[C@@H](c1ccccc1)Br,non-mutagenic
+COc1cc(CNC(=O)[C@H](Br)C)ccc1O,mutagenic
+OC(=O)c1ccccc1.[Na+],non-mutagenic
+OC(=O)[C@@H]1CC(N(C1(C)C)O)(C)C,non-mutagenic
+Cc1ccc2c(-c3ccccc3[C@H]2C)c1,mutagenic
+O=C1CC[C@]2(C(=C1)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2([C@H]1[C@@H]1C[C@@H]1[C@]12CCC(=O)O1)C)C,non-mutagenic
+CC[C@H]([C@@H](N(C(=O)[C@@H](C(C)C)NC(=O)[C@H](N(C)C)C(C)C)C)[C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C(=O)N[C@@H](c1nccs1)Cc1ccccc1)C)OC)OC)C,non-mutagenic
+[O-][N+](=O)c1ccc(cc1)/C=N/n1nnc2c(c1=O)[nH]c1c2cccc1,mutagenic
+O=c1cn[nH]c(=O)[nH]1.OCCNCCO,mutagenic
+CNC[C@H](c1ccc(c(c1)O)O)O.Cl,non-mutagenic
+CC(=O)Nc1ccc(c2c1c(O)c(/N=N/c1ccc(c3c1cc(cc3)S(=O)(=O)O)/N=N\c1ccc(cc1)S(=O)(=O)O)c(c2)S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+].[Na+].[Na+],non-mutagenic
+Nc1ccc2c(c1)oc1-c(c2c2ccccc2C(=O)O)ccc(=N)c1,non-mutagenic
+c1ccc(cc1)c1ccc(cc1)C[C@H]1CO1,mutagenic
+BrC[C@H](c1ccccc1)Br,mutagenic
+CCC/N=N/O.[K+],mutagenic
+NCC(=O)NCc1nc(nn1c1ccc(cc1C(=O)c1ccccc1Cl)Cl)C(=O)N(C)C.Cl.O.O,non-mutagenic
+OCc1c(O[C@H]2O[C@H](CO[C@@H]3OC[C@H]([C@@H]([C@H]3O)O)O)[C@H]([C@@H]([C@H]2O)O)O)cc2c(c1O)C(=O)c1c(C2=O)cccc1,mutagenic
+CCC(=O)c1c2cccc(c2c(c2c1cccc2O)O)O,mutagenic
+c1ccc2c(c1)c(OC[C@H]1CO1)ccc2,mutagenic
+OOCc1cn([C@H]2C[C@H]([C@H](O2)CO)O)c(=O)[nH]c1=O,mutagenic
+OCC[C@H](CCC=C(C)C)C,non-mutagenic
+C[C@H]([C@@H](CBr)Br)Cl,mutagenic
+Oc1nc(=O)n(c(=O)n1Cl)Cl.[Na+],non-mutagenic
+COC1=CC(=O)c2c(C1=O)ncc1c2[nH]c2c1CCCC2,mutagenic
+CS(=O)(=O)O.CCN(CCNc1ccc(c2c1c(=O)c1c(s2)cccc1)CO)CC,mutagenic
+COC(=O)[C@@H](NC(=O)C)CSC[C@H](Br)C,mutagenic
+O=[S@@]1OC[C@H]2[C@H](CO1)[C@]1(C([C@]2(Cl)C(=C1Cl)Cl)(Cl)Cl)Cl,non-mutagenic
+ClCC(=O)NCc1ccccc1,mutagenic
+Fc1ccc2c(c1)ccc1-c3c4c(-c21)cccc4ccc3,mutagenic
+O=C1C=C(N2CC2)C(=O)c2c1nc(C)c1c2[nH]c2c1cccc2,mutagenic
+C[C@H](C(=O)NCc1ccc(cc1)Cl)Br,mutagenic
+OS(=O)(=O)O.CN[C@H]([C@@H](c1ccccc1)O)C.CN[C@H]([C@@H](c1ccccc1)O)C,non-mutagenic
+O=C(OC(C)(C)C)N/N=C/c1c[n+]([O-])c2c([n+]1[O-])cccc2,mutagenic
+Cc1ccc(cc1)C[C@@H]1OC1,mutagenic
+COc1cc(N)ccc1N,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)ccc1c2nccc1,mutagenic
+C[C@H](C=O)CC,non-mutagenic
+OCC(=O)[C@@]1(O)C[C@H](O[C@H]2C[C@H](N)[C@H]([C@@H](O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC,mutagenic
+OC(=O)c1ccc(cc1)/N=N/c1ccc(c(c1)C(=O)O)O,non-mutagenic
+OS(=O)(=O)O.OCc1c2ccc3c(c2cc2c1cccc2)cccc3.[Na+],mutagenic
+CCCCCCCC/C=C/CCCCCCCC(=O)O.NCCO,non-mutagenic
+OC(=O)[C@@H]1CSSC(C(=O)N1)(C)C,non-mutagenic
+CC(=O)Nc1ccc2-c3c(Cc2c1)cccc3,mutagenic
+CCCCCCCOc1ccccc1NC(=O)O[C@@H](CN(CC)CC)C.Cl,non-mutagenic
+COc1ccc(cc1)N.Cl,mutagenic
+O[C@@H]1CC[C@]2([C@@H](C1)C[C@@H]([C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)O)C)C)O)C,non-mutagenic
+O=C1CC[C@H](C(=O)N1)N1C(=O)c2c(C1=O)cccc2,non-mutagenic
+CN(c1ccc(cc1)/N=N/c1cccnc1)C,non-mutagenic
+N[C@H](C(=O)O)CCCCNC[C@@H](C(=O)O)N,non-mutagenic
+COc1c(O)c2N(CCc2c2c1[nH]c(c2)C(=O)N1C[C@@H]2[C@]3(C1=CC(=O)c1c3c(C)c[nH]1)C2)C(=O)c1cc2c([nH]1)c(OC)c(c1c2CCN1C(=O)N)O,non-mutagenic
+OC(=O)CCC(=O)O.[Na+].[Na+],non-mutagenic
+O=C1CCC2=C3C=C[C@]4([C@H]([C@@H]3CCC2=C1)CC[C@@H]4O)C,non-mutagenic
+Cc1c2[C@H]3O[C@H]3c3c(-c2cc2c1cccc2)cccc3,mutagenic
+Nc1ncnc2c1nc[nH]2,mutagenic
+C1CCCCC[C@H]2[C@H](CCCC1)O2,non-mutagenic
+C[C@H]1CC(C)(C)c2c(C1(C)C)cc(c(c2)C(=O)C)C,non-mutagenic
+O[C@@H]1[C@@H]2O[C@@H]2c2c([C@H]1O)ccc1c2cc2cccc3c2c1C=C3,mutagenic
+CN[C@@H](C(=O)N([C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C)[C@H](c1ccc(cc1)O)C(=O)N)CC(=O)O,non-mutagenic
+N#C[C@H](c1cccc(c1)Oc1ccccc1)OC(=O)[C@@H]1[C@H](C1(C)C)C=C(Cl)Cl,non-mutagenic
+Nc1nc(N)c2c(n1)[nH]cn2,non-mutagenic
+OC(=O)[C@@H]1N[C@@H](c2ccccc2)c2c(C1)c1ccccc1[nH]2,non-mutagenic
+CC(C[C@@H](C(=O)O)NC(=O)COc1cc(Cl)c(cc1Cl)Cl)C,non-mutagenic
+O=CC[C@H]1C[C@@H](C)[C@H](O)/C=C/C=C/C[C@H](OC(=O)C[C@@H]([C@@H]([C@H]1O[C@@H]1O[C@@H](C)[C@@H]([C@@H]([C@H]1O)N(C)C)O[C@@H]1O[C@H](C)[C@H]([C@](C1)(C)OC(=O)CC)OC(=O)CCC)OC)O)C,non-mutagenic
+O=C/C(=C(/C(=O)O)\Cl)/C(Cl)Cl,mutagenic
+[O-][N+](=O)c1cc2c(c3c1cccc3)ccc1c2cccc1,mutagenic
+Cc1cccc(c1)N.Cl,non-mutagenic
+O[C@@H]1C[C@H]2C([C@]1(C)CC2)(C)C,non-mutagenic
+CC(=O)N(c1ccc(cc1)/N=N/c1ccc(cc1)N(C)C)C,mutagenic
+O=C1c2ccccc2-c2c(C1=O)c1ccccc1cc2,non-mutagenic
+ClCCNCCCNc1c2ccccc2nc2c1ccc1c2nccc1.Cl.Cl,mutagenic
+CC(=C[C@H]1[C@H](C1(C)C)C(=O)O)C,non-mutagenic
+Oc1ccc(c2c1c(=O)c1c(o2)cc2c(c1O)[C@]1(O)C=CO[C@@H]1O2)CCC(O)(C)C,mutagenic
+Cc1ccc(cc1)/N=N/N(C)C,mutagenic
+COc1ccc(cc1)C[C@@H]1OC1,mutagenic
+COc1cc(CNC(=O)[C@H](Br)C)ccc1OC,mutagenic
+n1ccc(cc1)c1ccncc1,mutagenic
+O[C@@H]1OC(=O)C=C1CCl,mutagenic
+Cc1cccc2c1-c1ccccc1[C@@H]2C,mutagenic
+O=c1n(/N=C/c2ccccc2)nnc2c1[nH]c1c2cccc1,mutagenic
+Clc1ccc(cc1)O[C@@H](C(=O)C(C)(C)C)n1cncc1,non-mutagenic
+OC[C@H]1O[C@H](C[C@H]1O)n1cc(CC)c(=O)[nH]c1=O,non-mutagenic
+OC(=O)[C@H](c1ccc(cc1)Oc1nccs1)C,non-mutagenic
+CCNCC#CC(OC(=O)[C@@](c1ccccc1)(C1CCCCC1)O)(C)C.Cl,non-mutagenic
+C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](c1ccnc2c1cc(OC)cc2)O.Cl.Cl,non-mutagenic
+OCCNc1ccc(cc1)/N=N/c1ccc(cc1)NCCO,mutagenic
+CC(=C[C@H]1[C@@H](C1(C)C)C(=O)OCc1cccc(c1)Oc1ccccc1)C,mutagenic
+CC[C@H](OS(=O)(=O)C)C,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)ccc1c2cc2ccc3c(c2c1)cccc3,mutagenic
+COC(=O)[C@]12Oc3ccc(c(c3C(=O)C2=C(C[C@H]([C@H]1O)C)O)O)c1ccc2c(c1O)C(=O)C1=C(O)C[C@H]([C@H]([C@]1(O2)C(=O)OC)O)C,non-mutagenic
+Oc1ccc2c(c1/N=N/c1ccc(cc1)S(=O)(=O)O)ccc(c2)S(=O)(=O)O.[Na+].[Na+],non-mutagenic
+N#[N+]c1cccc2c1C(=O)c1c(C2=O)cccc1.Cl,mutagenic
+c1ccc(cc1)Cc1ccccc1OC[C@H]1CO1,mutagenic
+OCCNC(=O)[C@H](O)C,mutagenic
+O=CC[C@H](CCC=C(C)C)C,non-mutagenic
+Cc1ccc(cc1)S(=O)(=O)O.CCOC[C@H](COc1ccc(cc1)NC(=O)CC[S+](C)C)O,non-mutagenic
+COc1cc2-c3c4OCOc4cc4c3[C@@H](Cc2cc1OC)N(C)CC4,mutagenic
+Fc1ccc(cc1)[C@@H]1O[C@H]1C(=O)c1ccccc1,non-mutagenic
+C1C[C@@H]2O[C@H]2CC[C@@H]2[C@H]1O2,non-mutagenic
+ONc1ncnc2c1nc[nH]2,mutagenic
+N#C/C=C/C#N,non-mutagenic
+OC[C@@]12SS[C@@]3(N(C1=O)[C@@H]1[C@@H](O)C=CC=C1C3)C(=O)N2C,non-mutagenic
+Nc1cccc2c1cccn2,mutagenic
+N[C@@H]1C[C@@H](O[C@@H]([C@H]1O)C)O[C@@H]1C[C@@](O)(Cc2c1c(O)c1c(c2O)C(=O)c2c(C1=O)c(O)ccc2)C(=O)C,mutagenic
+COc1ccc(cc1)CC[C@@H]1OC1,mutagenic
+Cc1ccccc1O.Cc1cccc(c1)O.Cc1ccc(cc1)O,non-mutagenic
+O[C@@H]1[C@@H]2O[C@@H]2c2c([C@H]1O)ccc1c2nccc1,mutagenic
+CO[C@@H]1OC(=O)C(=C1C(Cl)Cl)Cl,mutagenic
+ClCCN([P@@](=O)(OCCC(=O)O)N)CCCl,mutagenic
+COc1ccc(cc1)/C(=C\C(=O)O)/Br.[Na+],mutagenic
+CC(=O)Nc1ccc(cc1)/N=N/c1ccc(cc1)N(C)C,mutagenic
+O=CC1=C[C@@]2(O)CC(CC2[C@]23[C@@]1(C2)[C@H](O)OC3=O)(C)C,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)ccc1c2cc2ccccc2c1Cl,mutagenic
+O[C@H]1C=Cc2c([C@@H]1O)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+C[C@H]([C@H]1C(=O)N2[C@H]1SC(=C2C(=O)O)[C@H]1CCCO1)O.[Na+],non-mutagenic
+S=C=NCCc1ccccc1,mutagenic
+CC/C=C/C=C/C=C/C=C/OC[C@@H](CO)O,mutagenic
+CC(C1=C/C(=C/C=C/2\C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)/C=C(C1=O)C(C)(C)C)(C)C,non-mutagenic
+CC[C@]1(OCCc2c1[nH]c1c2cccc1[C@H](O)C)CC(=O)O,non-mutagenic
+C=C1CC[C@H]2C[C@@H]1C2(C)C,non-mutagenic
+C[C@H](CN(C[C@H](O)C)C[C@H](O)C)O.OC(=O)COc1ccc(cc1Cl)Cl,non-mutagenic
+OC/C(=C(/CO)\Br)/Br,mutagenic
+O[C@@H]1C=C[C@@H]2[C@H]([C@H]1O)O2,mutagenic
+O=c1oc(c(o1)CN1CCN(CC1)c1cc2c(cc1F)c(=O)c(c1n2[C@H](C)S1)C(=O)O)C,non-mutagenic
+N#Cc1ccc(cc1)[C@]1(C)OC1,mutagenic
+CCCCOc1ccc2c(n1)c(NCCCN(CCCl)CC)c1c(n2)cc(cc1)Cl.Cl.Cl.O,mutagenic
+OC/C=C/Cl,mutagenic
+Cn1sc(cc1=O)Cl.Cn1sccc1=O,mutagenic
+c1ccc2c(c1)c(OC[C@H]1CO1)ns2,mutagenic
+CN(c1ccc(cc1)/N=N/c1ccc(cc1)N(C(=O)C)C)C(=O)C,non-mutagenic
+O1C[C@@H]1COc1ccc(cc1)Cc1ccccc1,mutagenic
+CN(c1ccc(cc1)/N=N/c1ccccc1)CCC#N,mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)cc1c3c2-c2ccccc2-c3cc2c1cccc2,mutagenic
+CO/N=C(/c1csc(n1)N)\C(=O)N[C@@H]1C(=O)N2[C@H]1SCC(=C2C(=O)OCOC(=O)C(C)(C)C)/C=C\c1scnc1C,non-mutagenic
+CC(=CCc1ccc(c2c1oc1cc3O[C@@H]4[C@@](c3c(c1c2=O)O)(O)C=CO4)O)C,mutagenic
+CC(=O)OC/C=C(\C=C\C=C(\C=C\C1=C(C)CCCC1(C)C)/C)/C,non-mutagenic
+O=CC1=C2CC(C[C@@H]2[C@H]([C@@]2([C@@]1(C=O)C2)C)O)(C)C,mutagenic
+Nc1ccc(c(c1)N)C,mutagenic
+COc1nsc2c1cc(OC[C@H]1CO1)cc2,mutagenic
+Cc1cc(C)c(cc1/N=N/c1cc(c2c(c1O)cccc2)S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+],non-mutagenic
+Clc1ccc(cc1)/C=N/n1nnc2c(c1=O)[nH]c1c2cccc1,mutagenic
+[N-]=[N+]=CC(=O)NCC(=O)N,mutagenic
+N#Cc1cc(c2ccncc2)c([nH]c1=O)C,non-mutagenic
+CCOP(=O)(O/C(=C/Br)/c1ccc(cc1Cl)Cl)OCC,non-mutagenic
+OC(=O)COc1ccc(cc1Cl)Cl.CNC,non-mutagenic
+OC(=O)CN(CC(=O)O)CC(=O)O.[Na+].[Na+].[Na+],non-mutagenic
+COc1cc(ccc1OC)Cc1cnc(nc1N)N,mutagenic
+CCOC(=O)CNC(=O)CCCCSc1ncnc2c1nc[nH]2,non-mutagenic
+CCOCCOC(=O)/C=C/c1ccc(cc1)OC,non-mutagenic
+C[C@@]1(CO1)[C@H]1CO1,mutagenic
+NC(=O)[C@H]1CO1,mutagenic
+NC(=N)N/N=C/1\C=C/C(=N\NC(=S)N)/C=C1,mutagenic
+Cl[C@@H](c1ccccc1)C(=O)Cl,mutagenic
+Nc1ccc(cc1)/N=N/c1ccc(cc1)N,mutagenic
+OC/C=C(\CCC=C(C)C)/C,non-mutagenic
+Clc1ccc(c(c1)C)N,mutagenic
+OC(=O)[C@H](CSC(=C(Cl)Cl)Cl)N,mutagenic
+Br/C=C/c1cn([C@H]2C[C@@H]([C@H](O2)CO)O)c(=O)[nH]c1=O,non-mutagenic
+BrCc1cc(=O)oc2c1ccc(c2)OC(=O)C,non-mutagenic
+C[n+]1ccsc1/N=N/c1c(c2ccccc2)n(c2c1cccc2)C.Cl,mutagenic
+CCNC(=O)Nc1ccc(c(c1)C(=O)C)OC[C@@H](CNC(C)(C)C)O,non-mutagenic
+O[C@@H]1CC[C@]2([C@H](C1)CC(=O)[C@H]1[C@H]2CC[C@@]2([C@@H]1CC[C@@H]2[C@@H](CCC(=O)O)C)C)C,non-mutagenic
+OCc1c2ccccc2c(c2c1c1ccccc1cc2)COS(=O)(=O)O.[Na+],mutagenic
+OCCCCCl,mutagenic
+Nc1ccc2c(c1/N=N/c1ccc(cc1)c1ccc(cc1)/N=N/c1cc(c3c(c1N)cccc3)S(=O)(=O)O)c(O)cc(c2)S(=O)(=O)O,mutagenic
+N[C@H](C(=O)NCC(=O)O)CS,mutagenic
+[O-][N+](=O)c1ccc(cc1)COc1ccccc1,non-mutagenic
+O/N=c/1\[nH]c2c(n1C)cc(cn2)c1ccccc1,mutagenic
+Clc1cc(ccc1/N=N/c1c2ccc(cc2cc(c1N)S(=O)(=O)O)S(=O)(=O)O)c1ccc(c(c1)Cl)/N=N/c1c2ccc(cc2cc(c1N)S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+].[Na+].[Na+],non-mutagenic
+C[C@]12CC[C@@H](C2(C)C)C[C@@]1(C)O,non-mutagenic
+ClC[C@](CBr)(Br)C,non-mutagenic
+COc1cc2O[C@@H]3[C@H](c2c2c1c1[C@@H](O)CC(=O)c1c(=O)o2)C=CO3,mutagenic
+Oc1ccc2c(c1/N=N/c1ccc3c(c1S(=O)(=O)O)cccc3)cccc2.[Na+],non-mutagenic
+[O-][N+](=O)C,non-mutagenic
+O=C(Nc1ccc(cc1)[N+](=O)[O-])CC[C@@H](C(=O)O)N,non-mutagenic
+C[C@H](C(=O)N)Br,mutagenic
+Oc1c2c(O[C@@H]3[C@H]2C=CO3)cc2c1c(=O)c1c(o2)cccc1O,non-mutagenic
+C[C@H](CN1C[C@@H](OC1=O)C)O,non-mutagenic
+CN(C1Cc2cccc3c2c(C1)ccc3)C.Cl,mutagenic
+CN(c1ccc(cc1)/N=N/c1ccc2c(c1)cn[nH]2)C,mutagenic
+CC(=O)Nc1ccc(cc1)Cc1ccc(cc1)NC(=O)C,non-mutagenic
+c1cc(OC[C@H]2CO2)c2c(c1)cns2,mutagenic
+CCN(C(=O)Nc1ccc(c(c1)C(=O)C)OC[C@@H](CNC(C)(C)C)O)CC,non-mutagenic
+OCCN(c1ccc(cc1)C)CCO,mutagenic
+O=C1C2=C(N)CCC(=C2C(=O)c2c1cccc2)N,mutagenic
+CSC(/C=N/O)(C)C,non-mutagenic
+OC[C@H]1O[C@@H](O[C@H]([C@@H](C(=O)N[C@@H]([C@@H]([C@@H](C(=O)N[C@@H](C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCC[S+](C)C)[C@@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@H](C(=O)N)N)c2nc[nH]c2)[C@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)OC(=O)N)O.OC[C@H]1O[C@@H](O[C@H]([C@H](C(=O)N[C@@H]([C@@H]([C@@H](C(=O)N[C@H](C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCCCNC(=N)N)[C@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@H](C(=O)N)N)c2nc[nH]c2)[C@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)OC(=O)N)O,mutagenic
+OC(=O)CCC(=O)O.[Na+],non-mutagenic
+Br[C@@H](C=O)CBr,mutagenic
+CC(=O)/C=C/c1ccccc1,mutagenic
+Clc1ccc(cc1)OCCO/C(=C(\n1cncc1)/C)/c1ccc(cc1Cl)Cl.[O-][N+](=O)O,non-mutagenic
+Cc1cnc(c(n1)C)C,non-mutagenic
+C[C@H](NC(=O)c1cccnc1)CNC(=O)c1cccnc1,non-mutagenic
+O[C@@H]1[C@H]2O[C@H]2c2c([C@H]1O)ccc1c2c(C)cc2c1cccc2,mutagenic
+O[C@H]1C[C@H](O)C(=C)/C(=C\C=C\2/CCC[C@]3([C@H]2CC[C@@H]3[C@@H](/C=C/[C@H](C2CC2)O)C)C)/C1,non-mutagenic
+CCOC(=O)[C@H]1[C@@H](C1(C)C)C=C(C)C,non-mutagenic
+O[C@@H](COc1cccc2c1c1ccccc1[nH]2)CNC(C)C,non-mutagenic
+c1ccc2c(c1)cc1c(c2)cccc1,mutagenic
+CCCCCOc1cccc(c1)NC(=O)O[C@@H]1CCCC[C@H]1N1CCCC1,non-mutagenic
+ClCC1=C(Cl)C(=O)O[C@H]1O,mutagenic
+O=c1[nH][nH]c2c1cccc2,non-mutagenic
+CCOC(=O)[C@H](Br)C,mutagenic
+COc1nsc2c1ccc(c2)OC[C@H]1CO1,mutagenic
+COc1ccc(cc1)/C=N/n1nnc2c(c1=O)[nH]c1c2cccc1,mutagenic
+CSCC[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC=O,non-mutagenic
+OCCC[C@@]1(O)CC[C@@H]2[C@@]1(C)C[C@@H](c1ccc(cc1)N(C)C)C1=C3CCC(=O)C=C3CC[C@@H]21,non-mutagenic
+C[C@@H]1O[C@@H](C)CN(C1)N=O,mutagenic
+O=C([C@@H]1CS[C@@H](C(=O)N1)C)N[C@H](C(=O)N1CCC[C@H]1C(=O)N)Cc1c[nH]cn1,non-mutagenic
+c1ccc2c(-c3ccccc3[C@@H]3[C@H]2O3)c1,mutagenic
+c1ccc(cc1)c1ccc(cc1)OC[C@@H]1OC1,mutagenic
+O=CC1=C[C@H]2CC(C[C@@H]2[C@@]23[C@@]1(C2)[C@H](O)OC3=O)(C)C,mutagenic
+CC(=S)N,non-mutagenic
+SC[C@@H](C(=O)O)NC(=O)C(S)(C)C,non-mutagenic
+OC(=O)C(=O)Nc1cccc(c1)c1nnn[nH]1,non-mutagenic
+Nc1ccc(c(c1C)N)/N=N/c1ccccc1,mutagenic
+Nc1ccc2c(c1)c1ccccc1[nH]2,mutagenic
+OC(=O)C(CC(=O)O)(CC(=O)O)O.CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1,non-mutagenic
+O=C1CC[C@H](N1)C(=O)N1CSC[C@H]1C(=O)O,non-mutagenic
+O=NSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N,mutagenic
+c1ccc(cc1)N/N=N/c1ccccc1,mutagenic
+N#C[C@H](c1cccc(c1)Oc1ccccc1)OC(=O)C1C(C1(C)C)(C)C,non-mutagenic
+CN1C[C@@H](O)c2c3[C@H]1Cc1ccccc1-c3c1c(c2)OCO1,mutagenic
+Nc1ccc2c(c1/N=N/c1ccc(cc1S(=O)(=O)O)[N+](=O)[O-])c(O)cc(c2)S(=O)(=O)O,non-mutagenic
+[O-][N+](=O)c1cc(ccc1c1ccccc1)[N+](=O)[O-],mutagenic
+OP(=O)(O)O.COc1ccc2c3c1O[C@H]1[C@@]43CCN([C@H](C2)[C@@H]4C=C[C@@H]1O)C,non-mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)c1-c3ccccc3-c3c1c(c2)c1ccccc1c3,mutagenic
+C[C@H]1CC[C@H]2[C@@H]([C@@]3([C@@H]1C=CC3=O)C)OC(=O)C2=C,non-mutagenic
+COCCOCO/N=C\1/[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@H]([C@](C2)(C)OC)O)[C@@H](C(=O)O[C@@H]([C@@]([C@@H]([C@@H]1C)O)(C)O)CC)C,non-mutagenic
+CCN(c1ccc(cc1)/N=N/c1ccccc1)CC,non-mutagenic
+COc1ccc(c(c1)OC)N.Cl,mutagenic
+O[C@@H]1[C@H]2O[C@H]2c2c([C@H]1O)c1ccc3c(c1cc2)cccc3,mutagenic
+O[C@@H]1OC(=O)C(=C1Cl)Cl,mutagenic
+NN[C@](C(=O)O)(Cc1ccc(c(c1)O)O)C,mutagenic
+C[C@@H]1CC[C@H]([C@H](C1)OC(=O)c1ccccc1N)C(C)C,non-mutagenic
+COC(=O)[C@]12C[C@]2(C=O)C(=C[C@H]2[C@H]1CC(C2)(C)C)C=O,mutagenic
+OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1nc(nc2N)c1ccc(cc1)[N+](=O)[O-],mutagenic
+c1ccc2c(n1)c1c(cc2)CC[C@H]2[C@@H]1O2,mutagenic
+CCOP(=O)(N1[C@@H]2[C@H]1c1ccccc1-c1c2cccc1)OCC,mutagenic
+Cc1ccccc1N.Cl,mutagenic
+c1ccc2-c3cc4ccccc4cc3[C@@H]3[C@H](c2c1)O3,mutagenic
+c1ccc2-c3cc4ccccc4cc3[C@@H]3[C@H](c2c1)N3,mutagenic
+O/N=c/1\[nH]c2c(n1C)ccc1c2cccn1,mutagenic
+OC(=O)O.N.N,non-mutagenic
+O/N=C/c1cccc[n+]1COC[n+]1ccc(cc1)C(=O)N.Cl.Cl,non-mutagenic
+Nc1ccc(c(c1)S(=O)(=O)O)N,non-mutagenic
+[O-]/[N+](=N\c1ccc(c(c1)[N+](=O)[O-])C)/c1ccc(c(c1)[N+](=O)[O-])C,non-mutagenic
+COc1cc2O[C@H]3[C@H](c2c2c1c(=O)c1c(o2)cccc1O)CCO3,non-mutagenic
+Fc1cc2c(cc1N1CCNCC1)n(cc(c2=O)C(=O)O)C1CC1,mutagenic
+Nc1ccc(c(c1)Cl)Cl,non-mutagenic
+O[C@@H](COc1ccc(cc1C(=O)C)N)CNC(C)(C)C,non-mutagenic
+Clc1ccc(cc1)[S@](=O)C,non-mutagenic
+OC[C@H]1O[C@H](C[C@H]1O)n1cc(O)c(nc1=O)N,non-mutagenic
+N=C(NC(=N)N)NCCc1ccccc1,non-mutagenic
+O[C@@H]1C=Cc2c([C@@H]1O)ccc1c2cccc1,mutagenic
+CN(c1ccc(cc1)/N=N/c1ccccc1C(=O)O)C,mutagenic
+COP(=S)(SCC(=O)NCC=O)OC,non-mutagenic
+Oc1ccc(c2c1C(=O)c1ccccc1C2=O)O,mutagenic
+OC(=O)C[C@@H](C[C@H](/C=C/c1c(c2ccc(cc2)F)c2c(n1C(C)C)cccc2)O)O.[Na+],non-mutagenic
+CN(c1ccc(cc1)/N=N/S(=O)(=O)O)C.[Na+],mutagenic
+CC[C@@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H]([C@](C2)(C)OC)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O.CCCCCCCCCCCCCCCCCC(=O)O,non-mutagenic
+O[C@@H](COc1ccc(cc1C(=O)C)NC(=O)Nc1ccc(c(c1)C(=O)C)OC[C@@H](CNC(C)(C)C)O)CNC(C)(C)C,non-mutagenic
+COc1cc2c(cc1OC)OC[C@@H]1[C@H]2C(=O)c2c(O1)c1C[C@@H](Oc1cc2)C(=C)C,non-mutagenic
+O=C(COC(=O)C)NCCCOc1cccc(c1)CN1CCCCC1.Cl,non-mutagenic
+c1ccc2c(c1)c1ccc3c4c1c(c2)[C@H]1N[C@H]1c4ccc3,mutagenic
+C/N=N/O,mutagenic
+CCOC(=O)c1ccccc1c1c2-c(oc3c1cc(C)c(c3)NCC)c/c(=N\CC)/c(c2)C,non-mutagenic
+O[C@H]1[C@@H]2O[C@@H]2c2c([C@@H]1O)cc(c1c2ccc2c1cccc2)C,non-mutagenic
+CC(C[C@@H]1NC(=O)CNC1=O)C,non-mutagenic
+CCOC(=O)[C@@H](N[C@H](C(=O)N(C1Cc2c(C1)cccc2)CC(=O)O)C)CCc1ccccc1.Cl,non-mutagenic
+ClNc1nc(NCl)nc(n1)NCl,non-mutagenic
+C[C@@H]1NCCN(C1)c1cc2c(c(c1F)C)c(=O)c(cn2C1CC1)C(=O)O,non-mutagenic
+COc1c(OC)cc2c3c1-c1cc4OCOc4cc1C[C@@H]3N(CC2)C,mutagenic
+Nc1cc(cc(c1O)Cl)[N+](=O)[O-].Cl,mutagenic
+OC[C@H]1O[C@@H](O[C@H]2CC[C@]3(C(=CC[C@@H]4[C@@H]3CC[C@]3([C@H]4C[C@H]4[C@H]3[C@H](C)[C@]3(O4)CC[C@H](CO3)C)C)C2)C)[C@@H]([C@H]([C@@H]1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@@H]1O)O)O)O)O,non-mutagenic
+OC(=O)/C=C/C(=O)O,non-mutagenic
+O=NN(N(C(=O)/C(=N/O)/C(=O)C)c1ccccc1)C,mutagenic
+CC(=O)OCc1ccccc1/N=N/c1ccc(cc1)N(C)C,mutagenic
+COc1nsc2c1cccc2OC[C@H]1CO1,mutagenic
+CNNC,non-mutagenic
+[N-]=[N+]=Nc1ccc(cc1)Nc1c2ccccc2nc2c1cccc2,mutagenic
+C[C@@H](c1ccccc1)N(C)C,non-mutagenic
+OC(=O)c1cn2[C@@H](C)COc3c2c(c1=O)cc(c3C1(N)CC1)F,non-mutagenic
+CCc1cccc2c1[nH]c1c2CCO[C@@]1(C)CC,non-mutagenic
+COc1ccc2c(c1)ccc(c2)[C@@H](C(=O)O)C,non-mutagenic
+C=CCN1[C@@H]2[C@H]1c1ccccc1-c1c2cccc1,mutagenic
+O=C1CC[C@H](N1C)c1cccnc1,non-mutagenic
+CCCCC/C=C/C=C/C=O,non-mutagenic
+Clc1ccc(cc1)C[C@@H]1OC1,mutagenic
+C/C=C/C=C/C(=O)O.[K+],non-mutagenic
+O=C/C=C(/CCC=C(C)C)\C,non-mutagenic
+c1ccc2c(c1)ccc1c2cc2cccc3c2c1[C@@H]1O[C@H]31,mutagenic
+CN(c1ccc(cc1)/N=N/c1ccccc1)C,mutagenic
+OS(=O)(=O)c1cc(ccc1/C=C/c1ccc(cc1S(=O)(=O)O)Nc1nc(Nc2ccccc2)nc(n1)N1CCOCC1)Nc1nc(Nc2ccccc2)nc(n1)N1CCOCC1.[Na+].[Na+],non-mutagenic
+O=C[C@H]([C@H]([C@@H]([C@H](O)C)N)O)O.CNc1ccc(cc1)C(=O)C,non-mutagenic
+Cc1cccc2-c3c([C@H](c12)C)cccc3,mutagenic
+SC[C@@H](C(=O)O)NC(=O)C(SC)(C)C,non-mutagenic
+Clc1nc(nc(n1)Cl)Nc1ccccc1Cl,non-mutagenic
+CN1CCN(CC1)c1c(F)cc2c3c1OC[C@@H](n3cc(c2=O)C(=O)O)C.O,non-mutagenic
+O[C@H]1[C@@H](O[C@@H]([C@H]([C@@H]1O)O)CO[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)Oc1ccc2c(c1O)C(=O)c1c(C2=O)cccc1,non-mutagenic
+Nc1ccc(cc1)Oc1ccc(cc1)Oc1ccc(cc1)N,mutagenic
+COC(=O)C1=C(C)NC(=C([C@@H]1c1ccccc1[N+](=O)[O-])C(=O)OCC(=O)C)C,non-mutagenic
+NC[C@@H]1CC[C@H](CC1)C(=O)c1ccc(cc1)CCC(=O)O.Cl,non-mutagenic
+CCOC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)NCCC(C)C)CC(C)C,non-mutagenic
+Cc1ccccc1/N=N/c1ccc(cc1)N(C)C,non-mutagenic
+O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)O)C)C)C,non-mutagenic
+CCCCC[C@](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C/CCCC(=O)O)(O)C,non-mutagenic
+O=C/C=C/c1ccco1,non-mutagenic
+CCCCCCCCCCCCCCCCCC(=O)O.[Li+],non-mutagenic
+COc1cc2O[C@@H]3[C@@H](c2c2c1c1CCC(=O)c1c(=O)o2)[C@@H]1[C@H](O3)O1,mutagenic
+Cc1ccccc1/N=N/c1c(O)ccc2c1cccc2,mutagenic
+CCCC[N+](=O)[O-],non-mutagenic
+[O-][N+](=O)c1nc[nH]c1c1ccccc1,mutagenic
+N[C@H](C(=O)O)CSCCCl,mutagenic
+OC(=O)O.[Ca+2],non-mutagenic
+OS(=O)(=O)O.Cc1ccc(cc1)[N+]#N,mutagenic
+Cc1ccccc1OP(=O)(Oc1ccccc1C)Oc1ccccc1C,mutagenic
+O[Cl](=O)(=O)=O.CC[N+](=c1ccc2-c(c1)oc1c(n2)c2ccccc2c(c1)N)CC,mutagenic
+O=C1OC2(c3c1cccc3)c1cc(I)c(c(c1Oc1c2cc(I)c(c1I)O)I)O.[Na+].[Na+],non-mutagenic
+C=CC(=O)OCCOC(=O)C=C,non-mutagenic
+O[C@H]1[C@H](O)c2cccc3c2c2c1ccc(c2cc3)[N+](=O)[O-],mutagenic
+C/C=C/C=C/C=O,mutagenic
+CC(=C/C(=N/N=c/1\[nH]ncc2c1cccc2)/C)C.Cl,mutagenic
+COc1cc2O[C@H]3[C@H](c2c2c1c1CCOC(=O)c1c(=O)o2)C=CO3,mutagenic
+OC[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@@H]3[C@H](O)[C@@H](O)[C@@H]([C@@H]([C@@H]3NC(=N)N)O)NC(=N)N)O[C@H]([C@]2(O)C=O)C)[C@@H]([C@@H]([C@H]1O)O)NC,mutagenic
+Cc1cc(N)c(cc1N)C,mutagenic
+O=c1cn[nH]c(=O)[nH]1.NCCO,mutagenic
+COc1cc(c(cc1/N=N/c1c(O)ccc2c1ccc(c2)S(=O)(=O)O)C)S(=O)(=O)O.[Na+].[Na+],non-mutagenic
+O[C@H](COc1nsnc1N1CCOCC1)CNC(C)(C)C.OC(=O)/C=C\C(=O)O,non-mutagenic
+O[C@@H](COc1ccc(cc1)NC(=O)C)CNC(C)C,non-mutagenic
+O[C@H]1[C@@H]2O[C@@H]2c2c([C@@H]1O)ccc1c2c(C)ccc1C,mutagenic
+CCCCC/C(=C\c1ccccc1)/C=O,non-mutagenic
+CN(CC(=O)O)C.Cl,non-mutagenic
+Cc1ccc2c3c1CCc3c1c(-c3ccccc3[C@H]3[C@@H]1O3)c2,mutagenic
+O=C([C@]1(C)OC1)NCc1ccccc1,mutagenic
+ClCCNC(=O)SC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N,mutagenic
+Oc1ccc(c2c1c(=O)c1c(o2)cc2c(c1O)[C@@H]1C=CO[C@@H]1O2)CCC(O)(C)C,mutagenic
+O[C@@H]1CC=Cc2c1cc1ccc3c4c1c2ccc4ccc3,mutagenic
+COc1cc2O[C@@H]3[C@@](c2c2c1c1CCC(=O)c1c(=O)o2)(O)C=CO3,mutagenic
+CC(=O)OCc1ccc(cc1)/N=N/c1ccc(cc1)N(C)C,mutagenic
+Oc1cc(O)c2c(c1)oc(c(c2=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@H]([C@H]2O)O)O)[C@H]([C@H]([C@H]1O)O)O)c1ccc(c(c1)O)O,non-mutagenic
+C[C@H](C(=O)NCc1ccccc1)Br,mutagenic
+CC(=O)Nc1ccc(cc1)/C=N/n1nnc2c(c1=O)[nH]cc2,mutagenic
+Nc1c2ccccc2nc2c1cccc2.Cl.O,mutagenic
+O=C1C=C/C(=N/C(=O)C)/C=C1,non-mutagenic
+C[C@H]([C@H](O)C)O,non-mutagenic
+c1ccc2-c3c4c(-c2c1)cc1cccc2c1c4c(cc3)[C@@H]1[C@H]2O1,mutagenic
+ClCCN(C(=O)N[C@@H]1CC[C@H](CC1)C)N=O,mutagenic
+OC[C@@H]1N[C@@H](Cc2c1[nH]c1c2cccc1)C(=O)O,non-mutagenic
+ClCCN(CCCNc1c2ccccc2nc2c1ccc1c2cccc1)CC.Cl.Cl,mutagenic
+COC(=O)C1=C(C)NC(=C([C@@H]1c1cccc(c1)[N+](=O)[O-])C(=O)OC/C=C/c1ccccc1)C,non-mutagenic
+CC/N=[N+](/CC)\[O-],non-mutagenic
+Cc1cc(C)cc(c1)/N=N/c1c(O)ccc2c1cccc2,non-mutagenic
+OC[C@H]1O[C@@H](ON(c2ccc(cc2)Oc2ccc(cc2)Cl)C(=O)C)[C@@H]([C@H]([C@@H]1O)O)O.O,mutagenic
+CCCCCCC[C@@H]1CCC(=O)O1,non-mutagenic
+CC(N/C(=N\C(C)C)/OCc1ccc(cc1)[N+](=O)[O-])C,mutagenic
+CCSCCOP(=S)(OC)OC.CCSCCSP(=O)(OC)OC,non-mutagenic
+Clc1cc(ccc1/N=N/c1ccc(cc1)CCNCC[N+](C)(C)C)[N+](=O)[O-],mutagenic
+CCO[P@@](=O)(N(C)C)C#N,non-mutagenic
+CC(c1cc(/C=C/c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)cc(c1O)C(C)(C)C)(C)C,non-mutagenic
+OC(=O)CS.[Na+],non-mutagenic
+NC[C@]1(C)C[C@H](N)CC(C1)(C)C,non-mutagenic
+CCN(c1ccc(cc1)/N=N/c1ccc(cc1)[N+](=O)[O-])CC,mutagenic
+O[C@@H]1OC(=O)C(=C1C)Cl,mutagenic
+NNc1nnc(c2c1c1ccccc1[nH]2)n1nc(cc1C)C.Cl,non-mutagenic
+CCOc1ccccc1OC[C@@H]1CNCCO1.Cl,non-mutagenic
+ClN1[C@@H]2[C@H]1c1ccccc1-c1c2cccc1,mutagenic
+OC(=O)CC[C@@H](C(=O)O)N.O.N,non-mutagenic
+Sc1ncnc2c1[nH]cn2.O,mutagenic
+SCCC(=O)N1[C@@H](CS[C@H]1c1ccccc1O)C(=O)O,non-mutagenic
+COc1cc(ccc1OC)C[C@H]1CO1,mutagenic
+CCCCOc1ccc2c(n1)c(NCCCNCCCl)c1c(n2)cc(cc1)Cl.Cl.Cl.O,mutagenic
+OS(=O)(=O)OCc1c2ccccc2c2c3c1ccc1c3c(cc2)ccc1.[Na+],mutagenic
+C[n+]1c2ccccc2cc2c1cccc2N.Cl,mutagenic
+CCCn1cc2c3c1cccc3[C@@H]1[C@@H](C2)N(C#N)C[C@@H](C1)C,mutagenic
+Nc1ccc(c(c1)S(=O)(=O)O)/C=C/c1ccc(cc1S(=O)(=O)O)N,non-mutagenic
+CCOC(=O)[C@@H](N[C@H](C(=O)N1[C@H]2CCCC[C@@H]2C[C@H]1C(=O)O)C)CCc1ccccc1,non-mutagenic
+O(Cc1cccc2c1cccc2)C[C@H]1CO1,mutagenic
+CCCCCC[C@@H](OC(=O)C)C/C=C\CCCCCCCC(=O)OC,non-mutagenic
+Cc1ccc(cc1)S(=O)(=O)N1[C@@H]2[C@H]1c1ccccc1-c1c2cccc1,mutagenic
+OC(=O)CCC(=O)OC[C@@H]([C@@H](c1ccc(cc1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl.[Na+],non-mutagenic
+ClCCN(CCCNc1c2cc(OC)ccc2nc2c1ccc(c2)Cl)CC.Cl.Cl,mutagenic
+Cc1ccc(cc1)/N=N/NCc1ccc(cc1)[N+](=O)[O-],mutagenic
+CN/N=N/C,mutagenic
+CN(c1c(C)n(n(c1=O)c1ccccc1)C)CS(=O)(=O)O.[Na+],mutagenic
+O=C(NNC(=O)OCCOC(=O)C(=C)C)OCCOC(=O)C(=C)C,non-mutagenic
+C/C(=C\C)/C#N,non-mutagenic
+[N-]=[N+]=Nc1ccc2c(c1)c(Nc1ccc(cc1)NS(=O)(=O)C)c1c(n2)cccc1,mutagenic
+OC(=O)c1cc(/N=N/c2ccc(cc2)S(=O)(=O)Nc2ccccn2)ccc1O,non-mutagenic
+[O-]/[N+](=N\c1ccc(c(c1)N)C)/c1ccc(c(c1)N)C,mutagenic
+CCCCCCCC[C@@H]1O[C@H]1CCCCCCCC(=O)OC[C@@H](CCCC)CC,non-mutagenic
+Nc1ccc2c(c1/N=N/c1ccc(cc1)[N+](=O)[O-])cccc2,mutagenic
+OC(=O)C(CC(=O)O)(CC(=O)O)O.[Na+].[Na+].[Na+],non-mutagenic
+COC(=O)[C@@H]1c2cc3c(c(c2[C@@H](C[C@]1(O)CC)O[C@@H]1O[C@@H](C)[C@@H]([C@H](C1)N(C)C)O)O)C(=O)c1c(C3=O)cccc1O,mutagenic
+C=CC(c1cc2cc3C[C@H](Oc3cc2oc1=O)C(OC(=O)C)(C)C)(C)C,non-mutagenic
+O[C@H]1C=C[C@@H]2[C@@]34[C@H]1Oc1c4c(C[C@H]2N(CC3)C)ccc1O,non-mutagenic
+C[C@H]1CS1,non-mutagenic
+O[C@@H]1CC[C@]2([C@H](C1)CC[C@H]1[C@H]2CC(=O)[C@@]2([C@@H]1CC[C@@H]2[C@@H](CCC(=O)O)C)C)C,non-mutagenic
+Nc1ccc(c(c1)N)/N=N/c1ccc2c(c1)c(O)c(c(c2)S(=O)(=O)O)/N=N/c1ccc(cc1)Nc1ccc(cc1S(=O)(=O)O)/N=N/c1c(O)c2cc(/N=N/c3ccc(cc3N)N)ccc2cc1S(=O)(=O)O,mutagenic
+O=C([C@]1(C)OC1)Nc1ccccc1,mutagenic
+Oc1ccc2c(c1)CCC1C2CC[C@]2([C@]31CC[C@@]2([C@@H](C3)O)O)C,non-mutagenic
+O[C@@H]1c2ccccc2-c2c([C@H]1O)c1ccccc1cc2,non-mutagenic
+OC(=O)[C@@H](CCl)Cl,non-mutagenic
+COc1c2c(O[C@H]3[C@H]2C=CO3)cc2c1c(=O)c1c(o2)ccc(c1OC)Cl,mutagenic
+CC(NC(=O)/C=C/c1ccc(o1)[N+](=O)[O-])C,mutagenic
+OCCNc1ccc(cc1[N+](=O)[O-])N,mutagenic
+ClCCSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N,mutagenic
+C1CC[C@@H](NC1)CC(C1CCCCC1)C1CCCCC1.OC(=O)/C=C\C(=O)O,non-mutagenic
+C/C=C\c1cc(OC)c(cc1OC)OC,mutagenic
+O[C@@H]1C=Cc2c(C1)cc1c3c2ccc2c3c(cc1)ccc2,mutagenic
+CN(/N=N/c1ccc(cc1)C(=O)O)C.[K+],non-mutagenic
+O=c1n(C[C@H]2CO2)sc2c1ccc(c2)OC[C@H]1CO1,mutagenic
+CSCC[C@@H](C(=O)OCC)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)F)N)Cc1cccc(c1)N(CCCl)CCCl.Cl,mutagenic
+CN1CCc2c3[C@H]1[C@H](O)c1ccccc1-c3c1c(c2)OCO1,mutagenic
+CC(Cc1ccc(cc1)[C@@H](C(=O)O)C)C,non-mutagenic
+OO[C@]12C=C[C@@H]3[C@@H]([C@@]2(C)CC[C@@H](C1)O)CC[C@]1([C@H]3CC[C@H]1[C@@H](CCCC(C)C)C)C,mutagenic
+OC[C@H]1CCCO1,non-mutagenic
+[O-][N+](=O)c1cc(C(=O)O)c(c2c1C(=O)c1ccccc1C2=O)N,mutagenic
+O=C1CCCC2=C1C(C)(C)[C@@H](C2(C)C)C,non-mutagenic
+OCCOc1cc(O)c2c(c1)oc(c(c2=O)O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O[C@H]1O[C@@H](C)[C@@H]([C@@H]([C@@H]1O)O)O)c1ccc(c(c1)OCCO)OCCO,non-mutagenic
+Cc1ccccc1/N=N/c1ccc(c(c1N)C)N,mutagenic
+ClCCN(CCCNc1c2ccccc2nc2c1cccc2OC)CC.Cl.Cl,mutagenic
+CCN(c1ccc2c(c1)oc1-c(c2c2ccc(cc2S(=O)(=O)O)S(=O)(=O)O)ccc(=[N+](CC)CC)c1)CC.[Na+],mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)c1ccc(cc1)[N+](=O)[O-],mutagenic
+c1ccc(cc1)/N=N/c1ccccc1,mutagenic
+O[C@@H]1[C@@H](O)[C@@H]2O[C@@H]2c2c1ccc1c2cc2c(n1)ccc1c2cccc1,mutagenic
+CCCC/C=C/C=C/C=C/C=C/C=C/OC[C@@H](CO)O,mutagenic
+CN(c1ccc(cc1)/N=N/c1ccc2c(c1)cccc2)C,mutagenic
+c1cc2cc3ccc4c(c3c3c2c(c1)[C@H]1O[C@@H]31)cccc4,mutagenic
+CCOC(=O)CNC(=O)[C@H](Br)C,mutagenic
+CCCCCCCCOC(=O)C(=C)C,non-mutagenic
+Oc1ccc2c(c1/N=N/c1ccccc1)cccc2,mutagenic
+Cc1cc(ccc1/N=N/c1c(O)ccc2c1cccc2)/N=N/c1ccccc1C,mutagenic
+O[C@@H](COc1cccc2c1OC[C@H](C2)O)CNC(C)C,non-mutagenic
+Nc1ccc2c(c1)[n+](C)c1c(c2)cccc1.Cl,mutagenic
+OC(=O)COc1ccc(cc1Cl)Cl.[Na+],non-mutagenic
+COc1ccccc1/N=N/c1c(O)ccc2c1cccc2,mutagenic
+O=c1[nH]cc(cc1N)c1ccncc1,non-mutagenic
+CC(O[P@@](=O)(F)C)C,non-mutagenic
+CC(CC(C)(C)C)(CC(C)(C)C)S,non-mutagenic
+Cl/C=C(\C(Cl)Cl)/Cl,mutagenic
+Oc1cc(O)c2c(c1)oc(cc2=O)c1ccc(c(c1)O)O,non-mutagenic
+OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1ncn1c2ncc1,non-mutagenic
+O=NN1CCCC1,mutagenic
+[O-][N+](=O)c1cc(O)c(cc1Cl)N,mutagenic
+C=CCn1cc2c3c1cccc3[C@@H]1[C@@H](C2)N(C#N)C[C@@H](C1)C,mutagenic
+OC(=O)C([C@](C([C@@](C([C@@](C(Cl)(F)F)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F,non-mutagenic
+O[C@@H]1[C@H]2O[C@H]2c2c([C@H]1O)ccc1c2c(C)cc2c1cccc2C,mutagenic
+N[C@H](c1ccccc1)C(=O)N[C@@H]1C(=O)N2[C@H]1SC([C@@H]2C(=O)O)(C)C.O.O.O,non-mutagenic
+CCCCc1ccc(cc1)/N=C/c1ccc(cc1)OC,mutagenic
+O[C@H]1C[C@@H](O)C(=C)/C(=C\C=C\2/CCC[C@]3([C@H]2CC[C@@H]3[C@@H](CC[C@H](C(C)C)O)C)C)/C1,non-mutagenic
+O[Cl](=O)(=O)=O.C[N+]1=CC=C(CC1)c1ccccc1,mutagenic
+OC(=O)O.N,non-mutagenic
+COc1nsc2c1c(ccc2)[N+](=O)[O-],mutagenic
+O=NN(CC(=O)COC(=O)C)C,mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/OC[C@H](O)C,mutagenic
+CCCC[C@H](COC(=O)c1ccc(cc1)C(=O)OC[C@@H](CCCC)CC)CC,non-mutagenic
+CN(CCNC(=O)n1c2ccccc2c(=O)c2c1cccc2)C,mutagenic
+CC(=O)/C=C/c1ccc2c(c1)OCO2,non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@H]1O)O)n1cnc2c1ncnc2NC[C@@H](COc1cccc2c1cccc2)O,non-mutagenic
+CC1=CC[C@H](CC1)C(O)(C)C,non-mutagenic
+c1ccc2c(c1)cnc1c2cccc1,mutagenic
+CO[C@@H]1OC1(C)C,mutagenic
+O[C@H](CNC(C)(C)C)COc1ccc(cc1C(=O)C)NC(=O)NC(C)(C)C,non-mutagenic
+C1C/C=C/CC[C@H]2[C@H](CC/C=C/1)O2,non-mutagenic
+C([C@@H]1OC1)Cc1ccccc1,mutagenic
+C/C(=N\O)/CC,mutagenic
+c1ccc2c(c1)c1ccc3c4c1c(c2)[C@H]1O[C@H]1c4ccc3,mutagenic
+[O-][N+](=O)c1ccc2c(c1)cc(c(c2)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+O=C([C@@H]1OC1)NCc1ccccc1,mutagenic
+C/C=C\1/C[C@H](C)[C@](O)(CO)C(=O)OCC2=CC[N@@+]3([C@H]2[C@H](OC1=O)CC3)[O-].O.O,non-mutagenic
+O=NN(C(=O)[C@H](C(C)C)NC(=O)C)CC(=O)O,mutagenic
+C([C@@H]1OC1)C[C@@H]1OC1,mutagenic
+Cc1cc(ccc1/N=N/c1ccccc1)N(C)C,mutagenic
+CCOC(=O)[C@@H](C(=O)C)Cl,non-mutagenic
+OC[C@H]1O[C@@H](O[C@]23CCC4[C@@](C2)(CC3=C)CCC2[C@@]4(C)CCC[C@@]2(C)C(=O)O[C@@H]2O[C@@H](CO)C([C@H](C2O)O)O)[C@@H]([C@H](C1O)O)O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O,mutagenic
+O[C@@H]1[C@@H]2O[C@@H]2c2c([C@H]1O)ccc1c2cc(C)c2c1cccc2,non-mutagenic
+OC(=O)c1ccccc1O.CNC(=O)Oc1ccc2c(c1)[C@]1(C)CCN([C@@H]1N2C)C,non-mutagenic
+N1[C@@H]2[C@H]1c1cccc3c1-c1c2cccc1[C@H]1[C@@H]3N1,mutagenic
+CNC(=O)ON.Cl,mutagenic
+NC(=O)/N=N/C(=O)N,mutagenic
+ClCCNCCCNc1c2ccc(cc2nc2c1nc(OC)cc2)Cl.Cl.Cl.O,mutagenic
+OC[C@H](CNC(=O)c1c(I)c(N(C(=O)C)C[C@H](CN(c2c(I)c(C(=O)NC[C@@H](CO)O)c(c(c2I)C(=O)NC[C@@H](CO)O)I)C(=O)C)O)c(c(c1I)C(=O)NC[C@@H](CO)O)I)O,non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cc(O)c(nc1=O)N,non-mutagenic
+Cc1ccccc1C.Cc1cccc(c1)C.Cc1ccc(cc1)C,non-mutagenic
+O[C@H](COC(=O)C(=C)C)COc1ccc(cc1)C(c1ccc(cc1)OC[C@@H](COC(=O)C(=C)C)O)(C)C,non-mutagenic
+O=C(N[C@H](C(=O)O)C)COc1ccc(cc1Cl)Cl,non-mutagenic
+C[C@H](C(=O)Nc1ccccc1)Br,mutagenic
+O[C@@H]1COC(=C(C1=O)O)C,mutagenic
+O=[P@@]1(OCc2c(O1)cccc2)Oc1ccccc1,mutagenic
+COC(=O)C1=C(CC)[C@@H](OC1=O)C,mutagenic
+Fc1ccc(cc1)Cn1c(nc2c1cccc2)N1CCC(CC1)N(c1nccc(=O)[nH]1)C,non-mutagenic
+Oc1ccc(cc1)[C@@H]1CC(=O)c2c(O1)cc(cc2O)O,non-mutagenic
+C=C[C@H]1CN2CC[C@H]1C[C@@H]2[C@H](c1ccnc2c1cc(OC)cc2)O,non-mutagenic
+Nc1cc(N)c(cc1/N=N/c1ccccc1C)C,mutagenic
+CC[S@@](=O)CCSP(=O)(OC)OC,mutagenic
+c1cc2[C@@H]3O[C@@H]3c3c2c(c1)c1cc2ccccc2cc1c3,mutagenic
+O=C1C(=C(Cl)C(=O)c2c1c(O)ccc2O)Cl,mutagenic
+C1CCC[C@H]2[C@@H](CC1)O2,non-mutagenic
+CNc1ccc(cc1)/N=N/c1ccc(cc1)N(C(=O)C)C,mutagenic
+O=c1oc2c([nH]1)cccc2,non-mutagenic
+Nc1ccc2c(c1/N=N/c1ccccc1)cccc2,non-mutagenic
+CO[P@](=O)(NC(=O)C)SC,non-mutagenic
+CO[C@@H](C1=C(N2CC2)C(=O)C(=C(C1=O)N1CC1)C)COC(=O)N,mutagenic
+[O-][N+](=O)c1ccc2c(c1)[nH]nc2,mutagenic
+CO/N=C(/c1csc(n1)N)\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)CSC(=O)c1ccco1.[Na+],non-mutagenic
+[N-]=[N+]=C1C=NC(=O)NC1=O,mutagenic
+Cl[C@]12C(Cl)(Cl)[C@@]3([C@@]4([C@]1(Cl)[C@@]1([C@@]2(Cl)[C@@]3([C@]4(C1(Cl)Cl)Cl)Cl)Cl)Cl)Cl,non-mutagenic
+CCCCCCCOc1ccccc1NC(=O)OCCN1CCCCC1.Cl,non-mutagenic
+CCCCSCC[C@@H](C(=O)O)N,non-mutagenic
+COc1cc(ccc1/N=N/c1cc(c2c(c1O)cccc2)S(=O)(=O)O)c1ccc(c(c1)OC)/N=N/c1cc(c2c(c1O)cccc2)S(=O)(=O)O,non-mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/C=C/OC[C@@H](CO)O,mutagenic
+C[C@H](CN(C[C@H](O)C)CCN(C[C@H](O)C)C[C@H](O)C)O,non-mutagenic
+CCN/N=N/CC,mutagenic
+COc1ccc(cc1/N=N/c1c(O)c(cc2c1cccc2)C(=O)Nc1cccc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+Cc1cccc(c1)/N=N/c1ccc(cc1)N(C)C,mutagenic
+COc1ccc(cc1)/N=[N+](/c1ccc(cc1)OC)\[O-],mutagenic
+O(Cc1ccccc1)C[C@H]1OC1,mutagenic
+ON1C(C)(C)C[C@@H](C1(C)C)C(=O)N,non-mutagenic
+CC/C=C/C=C/C=C/C=C/C=C/OC[C@H](c1ccccc1)O,mutagenic
+Cc1ccc(cc1)S(=O)(=O)OC[C@@H]1OC1,mutagenic
+ClCCNCCCNc1c2ccccc2nc2c1cccc2.Cl.Cl.O,mutagenic
+OC(=O)O.[K+].[K+],non-mutagenic
+OC(=O)C[C@@H](C(=O)O)N.[Na+].[Na+],non-mutagenic
+O[C@@H]1[C@@H](N)C[C@@H](O[C@H]1C)O[C@H]1C[C@@](O)(Cc2c1c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2)C(=O)C,mutagenic
+C=CCC[C@H]1CO1,mutagenic
+Cc1ccc(c(c1)[N+](=O)[O-])/N=N/c1c(O)ccc2c1cccc2,mutagenic
+CC(=O)Oc1ccccc1C(=O)O,non-mutagenic
+CC1(C)[C@H]2CC[C@]3([C@@H]1C2)CO3,non-mutagenic
+ONc1ccc(cc1)/N=N/c1ccccc1,mutagenic
+BrCC(=O)NCc1ccccc1,mutagenic
+Nc1ccc(cc1)/N=N/c1ccccc1,mutagenic
+Oc1ccc(c(c1)O)/N=N/c1ccc(cc1)[N+](=O)[O-],non-mutagenic
+O=C([C@@H]1OC1)Nc1ccccc1,mutagenic
+OC/C=C\[C@]1(O)CC[C@@H]2[C@]1(C)C[C@@H](c1ccc(cc1)N(C)C)C1=C3CCC(=O)C=C3CC[C@@H]21,non-mutagenic
+O1[C@@H]2[C@H]1c1cscc1-c1c2csc1,mutagenic
+OC[C@@H]1O[C@@H](O[C@H]([C@@H](C(=O)N[C@@H]([C@H]([C@@H](C(=O)N[C@H](C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCCNCCCNC(=N)C[C@@H]2CC[C@H](CC2)Cl)[C@@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)c2nc[nH]c2)[C@@H]([C@@H]([C@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)OC(=O)N)O,mutagenic
+c1ccc2c(-c3cc4[C@@H]5N[C@@H]5c5c(-c4cc3[C@@H]3[C@H]2N3)cccc5)c1,mutagenic
+O=Nn1cc(c2c1cccc2)C[C@@H](C(=O)O)O,mutagenic
+Cl[C@@H]1[C@]2(Cl)C3C4C5[C@@]1(Cl)C([C@]2(Cl)C5C3C1C4O1)(Cl)Cl,mutagenic
+CCCCN(CCCCO)N=O,mutagenic
+COc1cc2O[C@H]3[C@H](c2c2c1c1CCOC(=O)c1c(=O)o2)CCO3,non-mutagenic
+O=c1cn[nH]c(=O)[nH]1.CCCCCCCC/C=C\CCCCCCCCN,mutagenic
+O[C@@H]([C@H]1CO1)CO,mutagenic
+c1ccc2c(c1)c(CC[C@H]1CO1)ccc2,mutagenic
+ClC(=C[C@H]1[C@@H](C1(C)C)C(=O)OCc1cccc(c1)Oc1ccccc1)Cl,mutagenic
+COC(=O)C1=C(C)NC(=C([C@H]1c1cccc(c1Cl)Cl)C(=O)OC(C)C)COC(=O)N,non-mutagenic
+Nc1ccc(c(c1)Cl)C.Cl,non-mutagenic
+COCN(c1c(CC)cccc1CC)C(=O)CCl,mutagenic
+CN1CCc2c3[C@H]1Cc1ccccc1-c3c1c(c2)OCO1,mutagenic
+O=C/C(=C/c1ccccc1)/C,non-mutagenic
+Oc1cc(O)cc(c1)O.O.O,non-mutagenic
+OO[C@@H]1C=C2C[C@@H](O)CC[C@@]2([C@@H]2[C@@H]1[C@@H]1CC[C@H]([C@@]1(C)CC2)[C@@H](CCCC(C)C)C)C,mutagenic
+COc1ccc(c2c1oc1c3c(O[C@H]4[C@H]3CCO4)cc(c1c2=O)OC)O,non-mutagenic
+OC[C@H]1O[C@@H](O[C@]23C[C@H](C(=O)[C@H]3[C@](C3(C(=C2)C)CC3)(C)O)C)[C@H]([C@H]([C@@H]1O)O)O,mutagenic
+c1ccc(cc1)c1ccccc1OC[C@H]1CO1,mutagenic
+BrCCSC[C@@H](C(=O)OC)NC(=O)C,mutagenic
+Cc1ccc2c3c1CCc3c1c(-c3ccccc3[C@H]3[C@@H]1N3)c2,mutagenic
+Cc1ccc(cc1)N(C)C,mutagenic
+CNC(=O)Oc1ccc(cc1)c1ccccc1,mutagenic
+C[C@@H]1CCC[C@@H](N1CCC[C@](c1ccccn1)(c1ccccc1)O)C.Cl,non-mutagenic
+BrC[C@H](CO[P@@](=O)(OC[C@@H](CBr)Br)O)Br,mutagenic
+O=Nc1ccc2c(c1)cccc2,mutagenic
+c1cc2ccc3c4c2c(c1)ccc4ccc3,mutagenic
+NCC(=O)O.Cl,non-mutagenic
+COc1cc(/N=N/c2ccccc2)ccc1N,mutagenic
+C=CCOc1ccccc1OC[C@@H](CNC(C)C)O,non-mutagenic
+C/C(=N\O)/C(=O)C,non-mutagenic
+c1ccc2c(-c3ccccc3[C@@H]3[C@H]2N3)c1,mutagenic
+COc1cc2c(cc1OC)N1[C@@H]3[C@@]42CCN2[C@H]4C[C@@H]4[C@H]3[C@H](CC1=O)OCC=C4C2,non-mutagenic
+OCc1cc(ccc1O)C(=O)CN(C(C)(C)C)Cc1ccccc1.Cl,mutagenic
+Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)O.O.O,mutagenic
+ClCc1cccc(c1)/N=N/c1ccc(cc1)N(C)C,mutagenic
+C[C@H]([C@@H](CCl)Br)Br,mutagenic
+CNCc1ccc(o1)CSCCN/C(=N/S(=O)(=O)C)/NC[C@@H](c1ccc(cc1)O)O,non-mutagenic
+COC[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C,mutagenic
+CC(=O)N[C@H](C(=O)O)CSCCCl,mutagenic
+CC([C@@H]1CC[C@@]2(CC1)OC2)(C)C,non-mutagenic
+CC(=O)/C=C/C1=C(C)CCCC1(C)C,non-mutagenic
+Cc1ccc(cc1C)S(=O)(=O)O.[Na+],non-mutagenic
+CCc1cccc2c1oc(c2)[C@@H](CNC(C)(C)C)O.Cl,non-mutagenic
+c1ccc2-c3cc4ccc5c(c4cc3[C@@H]3[C@H](c2c1)N3)cccc5,mutagenic
+CCc1cc(N)cc(c1Cc1c(C)cc(cc1CC)N)C,non-mutagenic
+CC(=O)CC(=O)C,non-mutagenic
+[CH-]1N=c2c(=C([N+]1=O)N)ncn2C,mutagenic
+C/C=C(\C=O)/Cl,mutagenic
+NC(=N)NC(=O)c1nc(Cl)c(nc1N)N.Cl,mutagenic
+O=C1CN(CCCN2CC(=O)NC(=O)C2)CC(=O)N1,non-mutagenic
+CC(c1ccc(c2-c(c1)c(C)cc2S(=O)(=O)O)C)C.[Na+],non-mutagenic
+ClC[C@@]12[C@H](Cl)[C@H]([C@H](C2(CCl)CCl)CC1(Cl)Cl)Cl,non-mutagenic
+OC(=O)COc1ccc(cc1Cl)Cl.CC(N)C,non-mutagenic
+C=C[C@@H]1CN2CC[C@H]1C[C@H]2[C@@H](c1ccnc2c1cc(OC)cc2)O.Br,non-mutagenic
+O[C@H]1[C@H]2O[C@H]2c2c([C@@H]1O)ccc1c2cc2ccccc2c1C,mutagenic
+Nc1cc(N)c(cc1/N=N/c1ccc(cc1)c1ccc(cc1)/N=N/c1ccc(c(c1)C(=O)O)O)/N=N/c1ccc(cc1)S(=O)(=O)O,mutagenic
+COc1ccc2c(c1)[nH]c1c2CCN=C1C.Cl.O.O,non-mutagenic
+Nc1ccc(cc1)Cc1ccc(cc1)N.Cl.Cl,mutagenic
+OC(=O)[C@H](CS/C(=C(/C(=C(Cl)Cl)Cl)\Cl)/Cl)N,mutagenic
+[N-]=[N+]=Nc1ccc2c(c1)nc1c(c2Nc2ccc(cc2OC)NS(=O)(=O)C)cccc1C,mutagenic
+Br[C@H](C(C)(C)C)C(=O)Nc1ccccc1,non-mutagenic
+ClCCN(CCCNc1c2ccccc2nc2c1cccc2)CC.Cl.Cl,mutagenic
+CN(c1cc/c(=N\N)/[nH]n1)C[C@H](O)C,mutagenic
+CC[C@]1(OCCc2c1[nH]c1c2cccc1CC)CC(=O)O,non-mutagenic
+C[C@H](CO)Cl,mutagenic
+Cc1ccc(cc1N)/N=N/c1ccc(c(c1)N)C,mutagenic
+CCC(=O)O[C@@]1([C@H](C)C[C@@H]2[C@]1(C)C[C@@H](O)[C@H]1[C@H]2[C@@H](Cl)CC2=CC(=O)C=C[C@]12C)C(=O)COC(=O)CC,non-mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)cc(c1c2cc2ccccc2c1)C,mutagenic
+OC(=O)[C@H](c1cccc(c1)C(=O)c1ccccc1)C,non-mutagenic
+O=C([C@@H](c1ccccc1)N)N[C@@H]1C(=O)N2[C@H]1SC([C@@H]2C(=O)OCc1oc(=O)oc1C)(C)C.Cl,non-mutagenic
+O1C[C@@H]1Cc1ccccc1,mutagenic
+C[n+]1c2ccccc2c(c2c1cccc2)N.Cl,mutagenic
+CCCCCN1[C@@H]2[C@H]1c1ccccc1-c1c2cccc1,mutagenic
+CC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1,non-mutagenic
+O=CC1=CC[C@H](CC1)C(=C)C,non-mutagenic
+O[Cl](=O)(=O)=O.N=c1ccc2-c(c1)oc1c(n2)c2ccccc2c(c1)N,mutagenic
+C[C@@]1(CO1)C=C,non-mutagenic
+[N-]=[N+]=NCc1ccccc1,mutagenic
+CC1=C[C@@H](O)[C@@H]2C[C@H]1C2(C)C,non-mutagenic
+CCOP(=O)(OCC)OCC,non-mutagenic
+C[C@H](C(=O)O)Oc1cc(Cl)c(cc1Cl)Cl,non-mutagenic
+[N-]=[N+]=Nc1ccc2c(c1)nc1c(c2Nc2ccc(cc2OC)NS(=O)(=O)C)cccc1,mutagenic
+O[C@@H]1[C@@H](O)[C@@H](O[C@@H]1n1ccc(=N)[nH]c1=O)COP(=O)(O)O,non-mutagenic
+O=CC1=C[C@@]2(O)CC(C[C@H]2[C@]2([C@]1(C=O)C2)C)(C)C,mutagenic
+C/C=C\1/CC(=C)[C@](O)(CO)C(=O)OCC2=CCN3[C@H]2[C@H](OC1=O)CC3,mutagenic
+CC(=O)O[C@@H]1C(=O)O[C@H]2[C@H]1OC(=O)[C@@H]2OC(=O)C,non-mutagenic
+CC(=O)N/N=C/c1c[n+]([O-])c2c([n+]1[O-])cccc2,mutagenic
+OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O.[Na+].[Na+].[Na+].[Na+],non-mutagenic
+O=C1NC(=O)[C@](N1)(c1ccc(cc1)O)c1ccccc1,non-mutagenic
+BrC[C@H]([C@H](O[P@](=O)(O[C@@H]([C@@H](CBr)Br)C)O[C@@H]([C@@H](CBr)Br)C)C)Br,mutagenic
+Nc1ccc2c(c1)cc1c(c2)cccc1,mutagenic
+Br/C=C(\c1ccc(cc1Cl)Cl)/OP(=O)(OC)OC,non-mutagenic
+COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(c(c2)OC)O)ccc1O,non-mutagenic
+OCCN1CN(CCO)CN(C1)CCO,mutagenic
+O=c1c2ccccc2[nH]c2c1cccc2,non-mutagenic
+ClCC=CCCl,mutagenic
+[O-][N+](=O)c1ccc2c(c1)ccc1c2ccc(c1)[N+](=O)[O-],mutagenic
+CCC(c1cc(N2Nc3c(N2)cccc3)c(c(c1)C(CC)(C)C)O)(C)C,non-mutagenic
+C[C@]1(OC1)c1ccc(cc1)c1ccccc1,mutagenic
+O[C@@H]1C[C@@]23[C@](C1)(O3)C=CC=C2,non-mutagenic
+COc1ccccc1C[C@H]1CO1,mutagenic
+ClCC(=O)O[C@H](P(=O)(OC)OC)C(Cl)(Cl)Cl,non-mutagenic
+Oc1ccc2c(c1/N=N/c1ccc(cc1)/N=N/c1ccccc1)cccc2,mutagenic
+O=c1ccc2c([nH]1)ccc1c2nc(n1C)N,mutagenic
+ClCCN([P@](=O)(O)N)CCCl,mutagenic
+OC(=O)[C@H](c1ccc2c(c1)[nH]c1c2cc(cc1)Cl)C,non-mutagenic
+c1ccc2c(c1)c1ccccc1cc2,mutagenic
+CC(c1cc(ccc1OP1OC[C@]2(CO1)COP(OC2)Oc1ccc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)(C)C,non-mutagenic
+CCOCn1c(=O)n(cc(c1=O)F)C(=O)c1cccc(c1)C(=O)Oc1nc(ccc1C#N)OC(=O)c1ccccc1,non-mutagenic
+C1CC[C@@]2(CO1)CO2,mutagenic
+[O-]/[N+](=N\c1ccccc1)/c1ccccc1,mutagenic
+Nc1ncc2c(n1)nc[nH]2,non-mutagenic
+Cn1cnc(c1Sc1ncnc2c1nc[nH]2)[N+](=O)[O-],mutagenic
+[O-]/[N+](=N\c1ccc(c(c1)Cl)Cl)/c1ccc(c(c1)Cl)Cl,non-mutagenic
+OC(=O)/C=C\C(=O)O.CCC(=O)N([C@@H]1CCC[C@H]1N(C)C)c1ccc(c(c1)Cl)Cl,non-mutagenic
+NC(=O)O[C@H]1CO1,mutagenic
+O/N=c\1/[nH]c2c(n1C)ccc1c2nc(C)cn1,mutagenic
+COC(=O)N/N=C/c1c[n+]([O-])c2c([n+]1[O-])cccc2,mutagenic
+OS(=O)(=O)O.NNc1nnc(c2c1cccc2)NN,mutagenic
+CC/[N+](=C/1\C=C/C(=C(\c2ccc(cc2)N(Cc2cccc(c2)S(=O)(=O)O)CC)/c2ccc(cc2)N(C)C)/C=C1)/Cc1cccc(c1)S(=O)(=O)O.[Na+],mutagenic
+OC(CN=[N+]=[N-])CN=[N+]=[N-],mutagenic
+Oc1cc2O[C@H]3[C@H](c2c2c1c(=O)c1c(o2)cccc1O)CCO3,non-mutagenic
+CN(/N=N/c1ccc(cc1)Cl)C,mutagenic
+Clc1nnc(c2c1cccc2)Cl,non-mutagenic
+Cc1c2ccc3c(c2c(c2c1cccc2)C)cccc3,mutagenic
+CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCNCC1)c(c2)F,mutagenic
+CS(=O)(=O)OCCCNCCCOS(=O)(=O)C.Cc1ccc(cc1)S(=O)(=O)O,mutagenic
+O=CC1=C[C@@]2([C@]([C@H]1C=O)(C)[C@H](OC(=O)C)C[C@H]1[C@@]2(C)CC[C@@H]2[C@]1(C)CCCC2(C)C)O,non-mutagenic
+Brc1c(Oc2ccccc2)c(Br)c(c(c1Br)Br)Br,non-mutagenic
+C[n+]1c2ccccc2cc2c1cccc2.Cl,mutagenic
+COc1c(O)cc2c3c1-c1ccccc1C[C@H]3N(CC2)C,mutagenic
+OC1=CC(=O)C1=O,non-mutagenic
+[O-][N+](=O)c1cc(ccc1Nc1ccc(c(c1)S(=O)(=O)O)Nc1ccccc1)[N+](=O)[O-].[Na+],mutagenic
+O=Cc1ccc(cc1)/N=N/c1ccc(cc1)N(C)C,mutagenic
+C[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)cn3C1CCCC1,mutagenic
+OC(=O)CC[C@@H](C(=O)O)N.[K+],non-mutagenic
+CC(=O)Nc1ccc(cc1)/N=N/c1cc(C)ccc1O,mutagenic
+OCc1ccccc1/N=N/c1ccc(cc1)N(C)C,mutagenic
+CNC[C@@H](c1ccc(c(c1)O)O)O,non-mutagenic
+O[C@@H]1C=Cc2c([C@H]1O)cc1c(c2)c2ccccc2cc1C,mutagenic
+OC(=O)[C@@H]1NCc2c(C1)c1ccccc1[nH]2,non-mutagenic
+COc1cc(/N=N/c2ccc(cc2)N)c(cc1/N=N/c1c(O)c2cc(N)ccc2cc1S(=O)(=O)O)C.[Na+],mutagenic
+CSCC[C@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)CC(=O)O)CCCNC(=N)N)[C@H](CC)C)C)CCC(=O)N)CO)CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCCNC(=N)N)Cc1ccccc1)CO)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)N)CC(C)C)CCCNC(=N)N)CCCNC(=N)N)CO)CO,non-mutagenic
+COc1cc(O)c2c(c1OC)oc1c(c2=O)c(OC)cc2c1[C@@H]1CCO[C@H]1O2,non-mutagenic
+CCN1CCN(C(=O)C1=O)C(=O)N[C@@H](C(=O)N[C@@H]1C(=O)N2[C@H]1SC([C@@H]2C(=O)O)(C)C)c1ccccc1,non-mutagenic
+Cc1cc(ccc1/N=N/c1c(O)c2c(O)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O)c1ccc(c(c1)C)/N=N/c1c(O)c2c(O)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+Cc1ccc(cc1)OP(=O)(Oc1cccc(c1)C)Oc1cccc(c1)C,non-mutagenic
+O=C1C=C(O)C(=O)c2c1cccc2,mutagenic
+Clc1ccc(c(c1)Nc1ccccc1C(=O)O)C(=O)O.[Na+].[Na+],non-mutagenic
+CCCCCCCCCCCC(=O)OCCS(=O)(=O)O.[Na+],non-mutagenic
+C[C@@H](C(C)(C)C)O[P@@](=O)(Cl)C,non-mutagenic
+OC(=O)/C=C\C(=O)O.COc1ccc(cc1)CN(c1ccccn1)CCN(C)C,non-mutagenic
+Oc1ccc(cc1)/C=N/n1nnc2c(c1=O)[nH]c1c2cccc1,mutagenic
+CC(=O)[C@@H]1C(=O)C=C2[C@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O,non-mutagenic
+O=C1C(=O)[C@]2(C([C@@H]1CC2)(C)C)C,non-mutagenic
+CCC/C=C/C(=O)O[C@@H]1C(C)(C)C[C@@H]2[C@]1(O)C=C(C=O)[C@@]13[C@@]2(C1)C(=O)O[C@@H]3O,mutagenic
+C/C=C/c1ccc(c(c1)OC)O,non-mutagenic
+CC(C[C@@H](C(=O)O)NC(=O)COc1ccc(cc1Cl)Cl)C,non-mutagenic
+Cc1c2[C@H]3O[C@H]3c3c(-c2c(c2c1cccc2)C)cccc3,mutagenic
+C[N+](Cc1ccccc1)(C)C.Cl,non-mutagenic
+CN(/N=N/c1ccc(cc1)Br)C,mutagenic
+[O-][N+](=O)c1ccc(o1)/C(=N\O)/N,mutagenic
+[O-][N+](=O)c1ccc(cc1)/N=N/c1c(N)c2c(cc1S(=O)(=O)O)cc(c(c2O)/N=N/c1ccccc1)S(=O)(=O)O,mutagenic
+Oc1ccc2c(c1/N=N/c1ccccc1)ccc(c2)S(=O)(=O)O,non-mutagenic
+Oc1ccc2c(c1/N=N/c1ccccc1)c(cc(c2)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+Nc1ccc(c(c1)N)/N=N/c1ccc(cc1)c1ccc(cc1)/N=N/c1c(N)c2c(cc1S(=O)(=O)O)cc(c(c2O)/N=N/c1ccccc1)S(=O)(=O)O,mutagenic
+C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)C,non-mutagenic
+Nc1ccc2c(c1)c(O)c(c(c2)S(=O)(=O)O)/N=N/c1ccc(cc1)c1ccc(cc1)/N=N/c1c(O)c2c(N)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,mutagenic
+Nc1ccc2c(c1)c(O)c(c(c2)S(=O)(=O)O)/N=N/c1ccc(cc1)c1ccc(cc1)/N=N/c1ccc(c(c1)C(=O)O)O,mutagenic
+Nc1ccc2c(c1/N=N/c1ccc(cc1)c1ccc(cc1)/N=N/c1c(N)ccc3c1c(O)cc(c3)S(=O)(=O)O)c(O)cc(c2)S(=O)(=O)O,mutagenic
+COc1cc(ccc1/N=N/c1ccc2c(c1O)c(N)c(cc2S(=O)(=O)O)S(=O)(=O)O)c1ccc(c(c1)OC)/N=N/c1ccc2c(c1O)c(N)c(cc2S(=O)(=O)O)S(=O)(=O)O,mutagenic
+O=C(c1ccccc1)Nc1ccc2c(c1)cc(c(c2O)/N=N/c1ccc(cc1)/N=N/c1ccc(cc1)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+Oc1ccc2c(c1/N=N/c1ccc(c3c1cccc3)S(=O)(=O)O)c(cc(c2)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+CN(c1ccc(cc1)/C(=C\1/C=CC(=[N+](C)C)C=C1)/c1c2ccc(cc2cc(c1O)S(=O)(=O)O)S(=O)(=O)O)C,non-mutagenic
+Cc1cc(ccc1/N=N/c1ccc2c(c1O)c(N)c(cc2S(=O)(=O)O)S(=O)(=O)O)c1ccc(c(c1)C)/N=N/c1ccc2c(c1O)c(N)c(cc2S(=O)(=O)O)S(=O)(=O)O,mutagenic
+Nc1cc(cc2c1c(O)c(c(c2)S(=O)(=O)O)/N=N/c1ccccc1)S(=O)(=O)O,non-mutagenic
+Cc1ccc(c(c1)C)/N=N/c1c2ccc(cc2cc(c1O)S(=O)(=O)O)S(=O)(=O)O,mutagenic
+Cl/C=C/C[N@+]12CN3CN(C2)CN(C1)C3,mutagenic
+ClCCN(CCCl)CCC[C@H](Nc1c2cc(OC)ccc2nc2c1ccc(c2)Cl)C,mutagenic
+Oc1ccc(cc1)/N=N/c1ccc(cc1)c1ccc(cc1)/N=N/c1c(O)c2c(cc1S(=O)(=O)O)cc(c(c2N)/N=N/c1ccc(cc1)[N+](=O)[O-])S(=O)(=O)O,mutagenic
+ClCCCN(C)C,mutagenic
+Nc1c(/N=N/c2ccc(cc2)c2ccc(cc2)/N=N/c2cc(c3c(c2N)cccc3)S(=O)(=O)O)cc(c2c1cccc2)S(=O)(=O)O,mutagenic
+C[C@@H](CCC[C@]1(C)CCc2c(O1)c(C)c(c(c2C)O)C)CCC[C@@H](CCCC(C)C)C,non-mutagenic
+N=C1C=C/C(=C(/c2ccc(c(c2)C)N)\c2ccc(cc2)N)/C=C1,mutagenic
+Oc1ccc2c(c1/N=N/c1ccc(cc1)S(=O)(=O)O)cccc2,non-mutagenic
+Cc1cc(ccc1/N=N/c1c(O)c2c(N)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O)c1ccc(c(c1)C)/N=N/c1c(O)c2c(N)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,mutagenic
+[N-]=[N+]=CC(=O)OC[C@@H](C(=O)O)N,mutagenic
+O=c1[nH]ncc2c1cccc2,non-mutagenic
+CC(CCC[C@H]([C@@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2C[C@H]2[C@@]3([C@]1(C)CC[C@@H](C3)O)O2)C)C,mutagenic
+C/C=C\1/C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3[C@H]2[C@@H](OC1=O)CC3,non-mutagenic
+Nc1[nH]c(=O)c2c(n1)[nH]nn2,non-mutagenic
+CCCCCCCCCCCCCCCC(=O)OC[C@@H]([C@@H]1OC(=O)C(=C1O)O)O,non-mutagenic
+ClCCN(c1ccc(cc1)C[C@@H](C(=O)O)N)CCCl,mutagenic
+OC[C@H]([C@H](CO)O)O,non-mutagenic
+CC1(C)[C@@H]2C[C@H]3[C@]([C@H]1C2)(C)O3,non-mutagenic
+C/C(=C/1\C(=O)[C@H]2N(C1=O)C([C@H]1[C@@H]2c2c[nH]c3c2c(C1)ccc3)(C)C)/O,non-mutagenic
+CN(C(=O)N[C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)C=O)N=O,mutagenic
+CC(CC(=O)O[C@H]1C[C@@]2(OC(=O)C)[C@@H](C=C1C)O[C@@H]1[C@]3([C@@]2(C)[C@H](OC(=O)C)[C@H]1O)OC3)C,non-mutagenic
+CCCCCC[C@@H]([C@H]1C2=C(C[C@@H](CC3=C([C@H]1O)C(=O)OC3=O)[C@H]([C@@H]1CC=CC(=O)O1)O)C(=O)OC2=O)O,non-mutagenic
+CC(=O)OC[C@@]12CCC(=C[C@H]1O[C@@H]1[C@@]3([C@@]2(C)[C@@H](OC(=O)C)[C@@H]1O)CO3)C,non-mutagenic
+OC[C@@]12[C@H](C=C(C(=O)[C@@H]1O)C)O[C@@H]1[C@@]3([C@@]2(C)[C@H](O)[C@H]1O)OC3,non-mutagenic
+ClC[C@@H]1[C@H](CCl)[C@@]2(C([C@@]1(Cl)C(=C2Cl)Cl)(Cl)Cl)Cl,non-mutagenic
+Clc1ccc2c(c1)C(=NC=C1N2C=NN1)c1ccccc1,non-mutagenic
+C=C[C@@H]1C[C@@H]2C[C@H]1C=C2,non-mutagenic
+O=C(O[C@@H]1C[C@@](O)(C[C@H]([C@H]1O)O)C(=O)O)/C=C/c1ccc(c(c1)O)O,non-mutagenic
+Brc1cccc2c1cc1ccc3c(c1c2)cccc3,mutagenic
+COc1cc(cc(c1O)OC)[C@@H]1[C@H]2C(=O)OC[C@@H]2[C@@H](c2c1cc1OCOc1c2)O[C@@H]1O[C@@H]2CO[C@H](O[C@H]2[C@@H]([C@H]1O)O)C,non-mutagenic
+OC[C@]12O[C@@H]1[C@H]1[C@@H]3O[C@]4(O[C@]1([C@H]1[C@@]([C@@H]2O)(O)C(=O)C(=C1)C)[C@@H]([C@H]([C@@]3(O4)C(=C)C)OC(=O)/C=C/C=C/c1ccccc1)C)c1ccccc1,non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1c(O)nc2c1nc(N)[nH]c2=O,non-mutagenic
+OC[C@@]1(O)CC[C@]23C[C@H]1C[C@@H]2CC[C@@H]1[C@]3(C)CC[C@H]([C@@]1(C)CO)O,non-mutagenic
+CC(=O)O[C@@]1(CC[C@@H]2[C@]1(C)CC[C@H]1[C@@H]2C=C(C2=CC(=O)[C@H]3[C@@H]([C@]12C)C3)Cl)C(=O)C,non-mutagenic
+CN(/N=N/c1[nH]cnc1C(=O)N)C,mutagenic
+C[C@@H](CCC[C@]1(C)CCc2c(O1)c(C)c(c(c2C)OC(=O)CCC(=O)O)C)CCC[C@@H](CCCC(C)C)C,non-mutagenic
+O=c1cn[nH]c(=O)[nH]1,mutagenic
+OC(=O)[C@]1(C)CCC[C@@]2([C@H]1CC[C@@]13[C@@H]2CC[C@](C3)(C(=C)C1)O)C,non-mutagenic
+CN[C@H]1CCc2c(-c3c1cc(=O)c(cc3)OC)c(OC)c(c(c2)OC)OC,non-mutagenic
+BrC[C@H]([C@H]([C@@H]([C@@H](CBr)O)O)O)O,mutagenic
+Oc1ccc2c(c1)CC[C@@H]1[C@H]2CC[C@]2([C@H]1C[C@H]([C@@H]2O)O)C,non-mutagenic
+Sc1ncnc2c1[nH]cn2,mutagenic
+OC[C@H]1O[C@H](C[C@H]1O)n1cc(C)c(=O)[nH]c1=O,non-mutagenic
+Fc1c[nH]c(=O)[nH]c1=O,non-mutagenic
+C[C@@H]1CC[C@@]2(OC1)O[C@H]1[C@H]([C@@H]2C)[C@@]2([C@@H](C1)[C@@H]1CC=C3[C@]([C@H]1CC2)(C)CC[C@@H](C3)O)C,non-mutagenic
+OC[C@]12[C@@H](C=C(C(=O)[C@@H]1O)C)O[C@@H]1[C@]3([C@@]2(C)C[C@@H]1O)CO3,non-mutagenic
+COc1cc(cc(c1OC)OC)[C@@H]1[C@H]2C(=O)OC[C@@H]2[C@H](c2c1cc1OCOc1c2)O,non-mutagenic
+COc1ccc(cc1O)[C@@H]1CC(=O)c2c(O1)cc(cc2O)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@H]([C@H]2O)O)O)[C@@H]([C@@H]([C@@H]1O)O)O,non-mutagenic
+Nc1cccc2c1c(=O)[nH][nH]c2=O,non-mutagenic
+O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CCC2=O)C)C1)C,non-mutagenic
+OC[C@H]1O[C@H](C[C@@H]1O)n1cc(I)c(=O)[nH]c1=O,non-mutagenic
+O=C1C[C@]2([C@@H]([C@H]1C)C2)C(C)C,non-mutagenic
+OC(=O)[C@](Cc1ccc(c(c1)O)O)(N)C,non-mutagenic
+Cc1cc(=O)[nH]c(=S)[nH]1,non-mutagenic
+C#C[C@]1(O)CC[C@H]2[C@]1(C)CC[C@H]1[C@H]2CCc2c1ccc(c2)O,non-mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N,non-mutagenic
+OC(=O)CCCC[C@@H]1SC[C@H]2[C@H]1NC(=O)N2,non-mutagenic
+Clc1cc2N=CNS(=O)(=O)c2cc1S(=O)(=O)N,non-mutagenic
+OC[C@H]1O[C@H](C[C@H]1O)n1cc(Br)c(=O)[nH]c1=O,non-mutagenic
+OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)NCc1cnc2c(n1)c(=O)nc([nH]2)N,non-mutagenic
+OC(=O)[C@H](Cc1ccc(c(c1)O)O)N,mutagenic
+Cc1c[nH]c(=S)[nH]c1=O,non-mutagenic
+C/C=C/C(=O)O[C@H]1C[C@H]2[C@]3([C@]1(C)[C@@]1(C)CC(=O)C(=C[C@@H]1O2)C)CO3,non-mutagenic
+CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CCC/C/2=C\C=C/1\C[C@@H](O)CCC1=C)C)C,non-mutagenic
+N[C@@H](C(=O)O)Cc1ccccc1,non-mutagenic
+C#C[C@@]1(O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=CC(=O)CC[C@H]12,non-mutagenic
+[O-][n+]1c[nH]c2-c(c1N)ncn2,mutagenic
+CO[C@H]([C@H]1Cc2cc3cc(O[C@H]4C[C@H](O[C@H]5C[C@H](O)[C@H]([C@@H](O5)C)OC)[C@@H]([C@@H](O4)C)OC(=O)C)c(c(c3c(c2C(=O)[C@H]1O[C@H]1C[C@H](O[C@@H]2C[C@H](O[C@@H]3O[C@@H](C)[C@H]([C@@](C3)(C)O)OC(=O)C)[C@@H]([C@@H](O2)C)O)[C@@H]([C@@H](O1)C)O)O)O)C)C(=O)[C@@H]([C@@H](O)C)O,non-mutagenic
+O=C1CC[C@]2(C(=C1)[C@@H](C)C[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@]2(OC(=O)C)C(=O)C)C)C,non-mutagenic
+OC[C@@H]1C[C@H]([C@@H](O1)n1cnc2c1ncnc2N)O,mutagenic
+O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@@H]3C[C@@H]3[C@@H]2[C@H](C)[C@@H]2N3C[C@H](CC2)C)C)C1)C,non-mutagenic
+O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)O)C)C)O)C,non-mutagenic
+C/C/1=C\CCC(=C)C2C(CC1)C(C2)(C)C,non-mutagenic
+OC[C@H]([C@H]1OC(=O)C(=C1O)O)O,non-mutagenic
+Cc1n[nH]c(=O)[nH]c1=O,non-mutagenic
+OC[C@H]1O[C@H](C[C@H]1O)n1ccc(=O)[nH]c1=O,non-mutagenic
+OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1ncnc2N,non-mutagenic
+OC(=O)[C@H](O)C.CCOc1ccc2c(c1)c(N)c1c(n2)cc(cc1)N,mutagenic
+CN1C[C@@H](c2ccccc2)c2c(C1)c(N)ccc2.OC(=O)/C=C\C(=O)O,non-mutagenic
+OC(=O)CCC(=O)O.CN(CCO[C@](c1ccccn1)(c1ccccc1)C)C,non-mutagenic
+OS(=O)(=O)O.Nc1ccc(c(c1)C)N,mutagenic
+C[n+]1cccc(c1)OC(=O)N(C)C.Br,non-mutagenic
+CC[n+]1c2ccccc2nc2c1cccc2.CCOS(=O)(=O)O,mutagenic
+CC[C@@H](NCCN[C@@H](CO)CC)CO.Cl.Cl,non-mutagenic
+O[C@@H]1C2=C(C)C3([C@@](C(=O)C2=CC1(C)C)(C)O)CC3,mutagenic
+OC[C@]1(C)C=C2C(=C(C)C3([C@@](C2=O)(C)O)CC3)[C@H]1O,mutagenic
+Oc1ccc2c(c1N)cccc2.Cl,non-mutagenic
+CN1CC[C@H](C1)CN1c2ccccc2Sc2c1cccc2.Cl,non-mutagenic
+CCCCCC(=O)O[C@@]1(CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=CC(=O)CC[C@H]12)C(=O)C,non-mutagenic
+OC1=NS(=O)(=O)c2c1cccc2.[Na+],non-mutagenic
+[O-][N+](=O)N(C(=N)NN=O)CCC,mutagenic
+CN(CC[C@H](c1ccccn1)c1ccccc1)C.OC(=O)/C=C\C(=O)O,non-mutagenic
+Oc1cc2ccc(cc2cc1S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+],non-mutagenic
+O=c1ccc2c(o1)cc1c(c2)C[C@@H](O1)C(O)(C)C,mutagenic
+OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O.[Na+].[Na+],non-mutagenic
+NC(=N)c1ccc(cc1)OCCCCCOc1ccc(cc1)C(=N)N.OCCS(=O)(=O)O.OCCS(=O)(=O)O,non-mutagenic
+Nc1ccccc1.Cl,non-mutagenic
+OC(=O)CC[C@@H](C(=O)O)N.[Na+],non-mutagenic
+OS(=O)(=O)O.COc1cc2N(C)[C@H]3[C@@]4(c2cc1[C@]1(C[C@H]2CN(CCc5c1[nH]c1c5cccc1)C[C@](C2)(O)CC)C(=O)OC)CCN1[C@H]4[C@@]([C@H]([C@]3(O)C(=O)OC)OC(=O)C)(CC)C=CC1,non-mutagenic
+OC(=O)O.[Na+],non-mutagenic
+N/N=c/1\sc2c(n1C)cccc2.Cl,mutagenic
+COc1c2N(C)[C@@H]3[C@](c2cc(c1OC)Cl)(O)[C@H]([C@@]12N3C(=O)[C@@](C)(SS1)N(C2=O)C)O,non-mutagenic
+OC[C@H](C(=O)NNCc1ccc(c(c1O)O)O)N.Cl,mutagenic
+CCCCCCCCCCCCOS(=O)(=O)O.[Na+],non-mutagenic
+OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl.[Na+],non-mutagenic
+N1[C@H]([C@H]1c1ccccc1)c1ccccc1,mutagenic
+OC(=O)c1ccccc1c1c2cc(Br)c(c(c2oc2-c1cc(Br)c(=O)c2Br)Br)O.[Na+].[Na+],mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1[nH]c(=O)nc2N.O,non-mutagenic
+COc1cc(C[C@@H]2NCCc3c2cc(O)c(c3)O)cc(c1OC)OC.Cl,non-mutagenic
+OC(=O)C1=NN(C(=O)[C@H]1/N=N/c1ccc(cc1)S(=O)(=O)O)c1ccc(cc1)S(=O)(=O)O.[Na+].[Na+].[Na+],non-mutagenic
+CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1ccccc1)CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)OCc1ccccc1,non-mutagenic
+COc1cc(ccc1N)c1ccc(c(c1)OC)N.Cl.Cl,mutagenic
+CN([C@H]1C(=C(C(=O)N)C(=O)[C@]2([C@H]1[C@H](O)[C@H]1C(=C2O)C(=O)c2c([C@]1(C)O)cccc2O)O)O)C.Cl,non-mutagenic
+OS(=O)(=O)O.O=CN1c2cc(OC)c(cc2[C@]23[C@H]1[C@@](O)(C(=O)OC)[C@H](OC(=O)C)[C@]1([C@@H]3N(CC2)CC=C1)CC)[C@]1(C[C@H]2CN(CCc3c1[nH]c1c3cccc1)C[C@](C2)(O)CC)C(=O)OC,non-mutagenic
+COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)[C@@H](O[C@H]1C[C@H](N)[C@H]([C@@H](O1)C)O)C[C@](C2)(O)C(=O)C,mutagenic
+CCNc1nc(NC(C)C)[nH]c(=O)n1,non-mutagenic
+O[C@@H]1[C@@H]2C[C@@]34[C@@H]5[C@H]1[C@@]1(C(=C2O)C(=O)c2c(C1=O)c(O)c(cc2O)C)C[C@@H]([C@H]5O)C(=C3C(=O)c1c(C4=O)c(O)c(cc1O)C)O,non-mutagenic
+ON1CN(Cl)CN(C1)Cl.[K+],non-mutagenic
+Cc1cc(ccc1N)/N=N/c1ccccc1C.Cl,mutagenic
+C[N+]1(C)CCOCC1.Cl,non-mutagenic
+Cc1cc(O)c2c(c1)C(=O)[C@]13C(=C(O)[C@H]4[C@H]([C@@H]3[C@H]3[C@@H]([C@@H]1C(=C1[C@@]43C(=O)c3c(C1=O)c(O)cc(c3)C)O)O)O)C2=O,non-mutagenic
+COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)[C@@H](O[C@H]1C[C@H](N)[C@H]([C@@H](O1)C)O)C[C@](C2)(O)C(=O)C.Cl,mutagenic
+OC(=O)[C@H](CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])N,mutagenic
+Clc1ccc(cc1)CO[C@@H](c1ccc(cc1Cl)Cl)Cn1cncc1.[O-][N+](=O)O,non-mutagenic
+C=Cc1cccc(c1)C.C=Cc1ccc(cc1)C,non-mutagenic
+OCC(=O)[C@@]1(O)C[C@H](O[C@H]2C[C@H](N)[C@H]([C@@H](O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC.Cl,mutagenic
+On1nnc2c1cccc2.O,non-mutagenic
+ClCCN(P1(=O)OCC(=O)CO1)CCCl,mutagenic
+CN1CCN(CC1)C1=Nc2ccccc2Oc2c1cc(Cl)cc2.OC(=O)CCC(=O)O,non-mutagenic
+Clc1ccc2c(c1)C(=NCCN2C)c1ccccc1.Cl,non-mutagenic
+OC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)C(=O)C[C@H]1[C@H]2CC[C@H]2[C@]1(C)CCC(=O)C2)C,non-mutagenic
+C[n+]1c2ccccc2nc2c1cccc2.COS(=O)(=O)O,mutagenic
+NC(=N)C(/N=N/C(C(=N)N)(C)C)(C)C.Cl.Cl,mutagenic
+ClCC[N+](CCCl)(C)[O-].Cl,mutagenic
+N/N=C/1\N=NC=C2[C@@H]1C=CC=C2.Cl,mutagenic
+CCNC(=O)CC[C@@H](C(=O)O)N,non-mutagenic
+CC[C@H]1CN2CCc3c([C@H]2C[C@H]1C[C@H]1NCCc2c1cc(OC)c(c2)OC)cc(c(c3)OC)OC.Cl.Cl,non-mutagenic
+[O-][N+](=O)c1ccc(s1)NC(=O)NCCCl,mutagenic
+CCN(CCCN(C1Cc2c(C1)cccc2)c1ccccc1)CC.Cl,non-mutagenic
+O[C@H]1[C@H](O)[C@H](O[C@H]1n1ccc(=O)[nH]c1=O)COP(=O)(O)O.[Na+].[Na+],non-mutagenic
+NCCc1c[nH]c2c1cccc2.Cl,non-mutagenic
+CCCC(=O)Nc1ccc(c(c1)C(=O)C)OC[C@@H](CNC(C)C)O.Cl,non-mutagenic
+ClCCN(c1ccc(cc1)CC(=O)O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2[C@@H](CCCC(C)C)C)C)C1)C)CCCl,non-mutagenic
+OC(=O)c1cc2ccccc2c(c1O)Cc1c(O)c(cc2c1cccc2)C(=O)O.CN(c1ccc2c(c1)ccc([n+]2C)/C=C/c1cc(n(c1C)c1ccccc1)C)C.CN(c1ccc2c(c1)ccc([n+]2C)/C=C/c1cc(n(c1C)c1ccccc1)C)C,mutagenic
+CCCC(=O)O[C@@H]1[C@@H]2O[P@](=O)(O)OC[C@H]2O[C@H]1n1cnc2c1ncnc2NC(=O)CCC,non-mutagenic
+CNNCc1ccc(cc1)C(=O)NC(C)C.Cl,non-mutagenic
+CCOC(=O)NNc1nncc2c1cccc2.Cl,mutagenic
+O[C@@H]([C@@H](C(=O)O)O)C(=O)O.O=C([C@H]1CN(C)[C@@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@@]1(C)O[C@]2(N(C1=O)[C@H](Cc1ccccc1)C(=O)N1[C@@H]2CCC1)O.O=C([C@H]1CN(C)[C@@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)N[C@@]1(C)O[C@]2(N(C1=O)[C@H](Cc1ccccc1)C(=O)N1[C@@H]2CCC1)O,non-mutagenic
+CCCCCCC(=O)O[C@@]1(C#C)CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=CC(=O)CC[C@H]12,non-mutagenic
+ClCCN(CCCNc1c2ccc(cc2nc2c1nc(OC)cc2)Cl)CC.Cl.Cl,mutagenic
+ClCCN(CCCNc1c2ccccc2nc2c1ccc1c2nccc1)CC.Cl.Cl,mutagenic
+OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+OC(=O)[C@](Cc1ccc(c(c1)O)O)(N)C.O,non-mutagenic
+OC[C@H]1O[C@H](C[C@H]1O)n1cc(C=O)c(=O)[nH]c1=O,non-mutagenic
+O[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1nc[nH]c2=O)COP(=O)(O)O.[Na+].[Na+],non-mutagenic
+C/C=C/1\CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3[C@H]2[C@@H](OC1=O)CC3,mutagenic
+NCC(=O)Nc1ccccc1.Cl,mutagenic
+O=c1[nH]cnc2c1cccc2,non-mutagenic
+CCC1=C(C[C@H]2NCCc3c2cc(OC)c(c3)OC)C[C@@H]2N(C1)CCc1c2cc(c(c1)OC)OC,non-mutagenic
+OP(=O)(O)O.OP(=O)(O)O.CCN(CCC[C@H](Nc1ccnc2c1ccc(c2)Cl)C)CC,mutagenic
+CC(C1=CC2=CC[C@H]3[C@]([C@H]2CC1)(C)CCC[C@@]3(C)C(=O)O)C,non-mutagenic
+Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)ccc(c1)O.[Na+].[Na+],non-mutagenic
+Oc1cc(O)c2c(c1)[o+]c(c(c2)O)c1cc(O)c(c(c1)O)O.Cl,non-mutagenic
+Nc1ccc(cc1)c1ccc(cc1)N.Cl.Cl,mutagenic
+CCCCCC[C@@H](C/C=C\CCCCCCCC(=O)O)O.[Na+],non-mutagenic
+O[C@@H]1[C@@H](O[C@@H]2O[C@H](C(=O)O)[C@H]([C@@H]([C@H]2O)O)O)[C@H](O[C@@H]([C@H]1O)C(=O)O)O[C@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]1([C@@H]2C(=O)C=C2[C@@]1(C)CC[C@@]1([C@H]2C[C@](C)(CC1)C(=O)O)C)C)C.N,non-mutagenic
+OC(=O)c1ccccc1O.[Na+],non-mutagenic
+CCCOC(c1ccccc1)(c1ccccc1)C(=O)OC1CCN(CC1)C.Cl,non-mutagenic
+OS(=O)(=O)O.CNc1ccc(cc1)O.CNc1ccc(cc1)O,mutagenic
+O[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1nc(N)[nH]c2=O)COP(=O)(O)O.[Na+].[Na+],non-mutagenic
+C[C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3,mutagenic
+CNC(=O)Oc1ccc2c(c1)[C@]1(C)CCN([C@@H]1N2C)C,non-mutagenic
+CC(CCC[C@H]([C@H]1CC[C@H]2[C@@]1(C)CC[C@@H]1[C@@H]2CC=C2[C@]1(C)CCCC2)C)C,non-mutagenic
+O=C1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@H]1C)C)CC[C@]1([C@@H]3CC[C@@H]1O)C,non-mutagenic
+OCc1c(CO)cnc(c1O)C.Cl,non-mutagenic
+Nc1ccc2c(c1)[s+]c1c(n2)ccc(c1)N.Cl,mutagenic
+Cc1ccc(c(c1)S(=O)(=O)O)/N=N/c1c(O)c(cc2c1cccc2)C(=O)O.[Na+].[Na+],non-mutagenic
+NNc1ccccc1.Cl,mutagenic
+CN.Cl,non-mutagenic
+O[C@H](COc1cccc(c1C)C)CNC(C)(C)C.Cl,non-mutagenic
+NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccccc1,non-mutagenic
+Oc1ccc2c(c1)[nH]c1c2CCN=C1C.Cl,non-mutagenic
+CC(CCC[C@H]([C@@H]1CC[C@H]2[C@]1(C)CC[C@@H]1[C@@H]2CC=C2[C@]1(C)CC[C@H](C2)OC(=O)C)C)C,non-mutagenic
+CNC[C@@H](c1cccc(c1)O)O.Cl,non-mutagenic
+N=c1nc[nH][nH]1,non-mutagenic
+CCn1c2ccc(cc2c2c1cccc2)N.Cl,mutagenic
+OC[C@H]1O[C@@H](C[C@@H]1O)n1cc(I)c(=N)[nH]c1=O,non-mutagenic
+OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O.[Na+].[Na+].[Ca+2],non-mutagenic
+Nc1ccc(cc1)N.Cl.Cl,mutagenic
+OP(=O)(O)O.OP(=O)(O)O.NCCC[C@H](Nc1cc(OC)cc2c1nccc2)C,mutagenic
+COc1ccc(cc1)CN(c1ncccn1)CCN(C)C.Cl,non-mutagenic
+CC(=O)O[C@@H]1[C@@H](O[C@@H]2O[C@@H](C)[C@H]([C@H]([C@H]2O)OC(=O)C)O)[C@@H](OC(=O)[C@@H]2CC[C@@H]3[C@H](C2)O[C@@]2([C@]43CO4)OC[C@H]([C@H](C2)OC(=O)/C=C/c2ccccc2)C)O[C@H]([C@H]1O)C,non-mutagenic
+OS(=O)(=O)O.CCN(c1ccc(cc1)/C(=C/1\C=CC(=[N+](CC)CC)C=C1)/c1ccccc1)CC,mutagenic
+CN([C@@H]1C(=C(C(=O)N)C(=O)[C@@]2([C@@H]1C[C@H]1C(=C2O)C(=O)c2c([C@@]1(C)O)cccc2O)O)O)C.Cl,non-mutagenic
+COc1c(OC)cc2c(-c3ccc(c(=O)cc3[C@H](CC2)NC(=O)C)OC)c1OC,non-mutagenic
+OS(=O)(=O)c1cc2cc(c(c(c2c(c1/N=N/c1ccc(cc1)/N=N/c1ccc(cc1N)N)O)N)/N=N/c1ccc(cc1)/N=N/c1ccc(cc1N)N)S(=O)(=O)O.[Na+].[Na+],mutagenic
+OC(=O)C(Cl)(Cl)Cl.[Na+],non-mutagenic
+OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@H]2N([C@@H](C1)[C@H]1[C@@H]2O1)C.Br.O.O.O,non-mutagenic
+CN/C(=C/[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C.Cl,non-mutagenic
+Cc1cc(ccc1/N=N/c1ccc(c(c1)C(=O)O)O)c1ccc(c(c1)C)/N=N/c1c(N)c(C)cc(c1N)S(=O)(=O)O.[Na+].[Na+],mutagenic
+COC(=O)[C@@H]1c2cc3c(c(c2[C@H](C[C@]1(O)CC)O[C@@H]1O[C@@H](C)[C@@H]([C@H](C1)N(C)C)O)O)C(=O)c1c(C3=O)c(O)ccc1O,mutagenic
+Nc1ccc2-c3n(Cc2c1)c(=O)c1c(n3)cccc1,mutagenic
+c1ccc2c(c1)c(ccc2)C[C@H]1CO1,mutagenic
+OC[C@H]1O[C@H]([C@H]([C@@H]1O)O)n1ccc(nc1=O)N.Cl,non-mutagenic
+COC(=O)[C@@H]1c2cc3c(c(c2[C@H](C[C@]1(O)CC)O[C@@H]1O[C@@H](C)[C@H]([C@H](C1)N(C)C)O[C@H]1C[C@H](O)[C@@H]([C@@H](O1)C)O[C@@H]1O[C@@H](C)C(=O)C=C1N)O)C(=O)c1c(C3=O)c(O)ccc1O,mutagenic
+SC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N,mutagenic
+Oc1ncnc(n1)O,non-mutagenic
+OC1=CC(=O)C1=O.[Na+],non-mutagenic
+OC(=O)[C@H](O)C.[Na+],non-mutagenic
+Nc1ccc(c(c1)S(=O)(=O)O)/C=C/c1ccc(cc1S(=O)(=O)O)N.[Na+].[Na+],non-mutagenic
+Nc1ccc2c(c1)[n+](C)c1c(c2)ccc(c1)N.Nc1ccc2c(c1)nc1c(c2)ccc(c1)N.Cl,mutagenic
+N/N=C/1\N=NC=C2[C@H]1C=CC=C2,mutagenic
+O[C@H]([C@H](C(=O)O)O)C(=O)O.[K+],non-mutagenic
+O[C@H]([C@H](C(=O)O)O)C(=O)O.CCCn1cc2c3c1cccc3[C@@H]1[C@@H](C2)N(C)CC(=C1)C,mutagenic
+Nc1ccn(c(=O)n1)[C@@H]1C=C([C@H]([C@H]1O)O)CO,non-mutagenic
diff --git a/data/Mutagenicity-Salmonella_typhimurium.json b/data/Mutagenicity-Salmonella_typhimurium.json
new file mode 100644
index 0000000..fdff200
--- /dev/null
+++ b/data/Mutagenicity-Salmonella_typhimurium.json
@@ -0,0 +1 @@
+{"species":"Salmonella typhimurium","endpoint":"Mutagenicity","source":"http://cheminformatics.org/datasets/bursi/cas_4337.zip, http://doc.ml.tu-berlin.de/toxbenchmark/Mutagenicity_N6512.csv, https://data.europa.eu/euodp/data/storage/f/2017-07-19T142131/GENOTOX data and dictionary.xls","qmrf":{"group":"QMRF 4.10. Mutagenicity","name":"OECD 471 Bacterial Reverse Mutation Test"}}
diff --git a/data/parts/cas_4337.sdf b/data/parts/cas_4337.sdf
new file mode 100644
index 0000000..997ccc6
--- /dev/null
+++ b/data/parts/cas_4337.sdf
@@ -0,0 +1,306261 @@
+1728-95-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+    0.9930    0.7047   -0.0023 C   0  0  0

+    0.9904   -0.6797   -0.0183 C   0  0  0

+    2.1763    1.5863    0.0260 C   0  0  0

+   -0.3265    1.0961   -0.0241 N   0  0  0

+    2.1853   -1.5556   -0.0089 C   0  0  0

+   -0.2892   -1.0865   -0.0434 N   0  0  0

+    2.3543    2.5541   -0.9657 C   0  0  0

+    3.1205    1.4608    1.0477 C   0  0  0

+   -1.0833   -0.0400   -0.0522 C   0  0  0

+    2.2885   -2.5892    0.9220 C   0  0  0

+    3.2087   -1.3534   -0.9342 C   0  0  0

+    3.4621    3.3747   -0.9327 C   0  0  0

+    4.2238    2.2885    1.0680 C   0  0  0

+   -2.5600   -0.0852   -0.0822 C   0  0  0

+    3.4035   -3.4017    0.9255 C   0  0  0

+    4.3191   -2.1728   -0.9208 C   0  0  0

+    4.3964    3.2413    0.0797 C   0  0  0

+   -3.2155   -1.0263   -0.8784 C   0  0  0

+   -3.3037    0.8097    0.6903 C   0  0  0

+    4.4181   -3.1929    0.0081 C   0  0  0

+   -4.5930   -1.0652   -0.9036 C   0  0  0

+   -4.6805    0.7643    0.6595 C   0  0  0

+   -5.3289   -0.1699   -0.1384 C   0  0  0

+   -6.6864   -0.2111   -0.1663 O   0  0  0

+   -7.1490    0.8177    0.7110 C   0  0  0

+   -0.6656    2.0327    0.0000 H   0  0  0

+    1.5090    3.0812    0.0000 H   0  0  0

+    3.3725    0.4971    0.0000 H   0  0  0

+    1.4242   -3.0844    0.0000 H   0  0  0

+    3.4264   -0.3813    0.0000 H   0  0  0

+    3.2177    4.3404    0.0000 H   0  0  0

+    5.0714    1.7651    0.0000 H   0  0  0

+    3.1925   -4.3753    0.0000 H   0  0  0

+    5.1856   -1.6814    0.0000 H   0  0  0

+    5.2043    3.8240    0.0000 H   0  0  0

+   -2.7420   -1.9027    0.0000 H   0  0  0

+   -2.8955    1.7184    0.0000 H   0  0  0

+    5.2197   -3.7842    0.0000 H   0  0  0

+   -5.0058   -1.9718    0.0000 H   0  0  0

+   -5.1568    1.6392    0.0000 H   0  0  0

+   -6.2405    1.2262    0.0000 H   0  0  0

+   -7.5575    1.7262    0.0000 H   0  0  0

+   -8.0575    0.4092    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  7 12  2  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  2  0

+ 11 16  1  0

+ 12 17  1  0

+ 14 18  2  0

+ 14 19  1  0

+ 15 20  1  0

+ 18 21  1  0

+ 19 22  2  0

+ 21 23  2  0

+ 23 24  1  0

+ 24 25  1  0

+  6  9  2  0

+ 13 17  2  0

+ 16 20  2  0

+ 22 23  1  0

+  4 26  1  0

+  7 27  1  0

+  8 28  1  0

+ 10 29  1  0

+ 11 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 25 41  1  0

+ 25 42  1  0

+ 25 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91-08-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    1.2094   -0.1551   -0.0022 C   0  0  0

+   -0.0001   -0.8598   -0.0013 C   0  0  0

+    1.1979    1.3183   -0.0020 C   0  0  0

+    2.3609   -0.8109    0.0024 N   0  0  0

+   -1.2094   -0.1551   -0.0003 C   0  0  0

+   -0.0001   -2.3668   -0.0020 C   0  0  0

+   -0.0002    2.0035   -0.0010 C   0  0  0

+    3.4398   -0.1795    0.0016 C   0  0  0

+   -1.1978    1.3185   -0.0002 C   0  0  0

+   -2.3609   -0.8109    0.0001 N   0  0  0

+    4.4823    0.4306    0.0009 O   0  0  0

+   -3.4397   -0.1795    0.0009 C   0  0  0

+   -4.4823    0.4307    0.0018 O   0  0  0

+    2.0909    1.8410    0.0000 H   0  0  0

+   -1.0348   -2.3668    0.0000 H   0  0  0

+   -0.0001   -3.4015    0.0000 H   0  0  0

+    1.0346   -2.3668    0.0000 H   0  0  0

+   -0.0002    3.0382    0.0000 H   0  0  0

+   -2.0908    1.8412    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  8 11  2  0

+ 10 12  2  0

+ 12 13  2  0

+  7  9  2  0

+  3 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89786-04-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+    0.1612   -0.5127   -0.0845 C   0  0  1

+   -1.3114   -0.6982    0.3343 C   0  0  1

+    0.1698    1.2804   -0.5072 S   0  0  0

+    1.1089   -0.8112    1.0790 C   0  0  0

+    0.5013   -1.3703   -1.3051 C   0  0  0

+   -2.2274    0.2787   -0.2407 N   0  0  0

+   -1.7577   -2.0759   -0.0826 C   0  0  0

+   -1.6205    1.4722   -0.8579 C   0  0  1

+    0.5027    2.0326    0.6515 O   0  0  0

+    0.9050    1.4745   -1.7077 O   0  0  0

+    2.4812   -0.4789    0.6886 N   0  0  0

+   -3.0365    0.9487    0.6271 C   0  0  0

+   -2.7165   -2.2185   -1.0110 O   0  0  0

+   -1.2523   -3.0521    0.4188 O   0  0  0

+   -2.3182    2.2264    0.2696 C   0  0  0

+    3.1066    0.6996    0.9149 C   0  0  0

+    3.3012   -1.2596    0.0763 N   0  0  0

+   -3.9464    0.6468    1.3700 O   0  0  0

+    4.3491    0.5733    0.3933 C   0  0  0

+    4.4234   -0.6612   -0.1165 N   0  0  0

+   -0.9952    0.1786    0.0000 H   0  0  0

+    0.5464   -1.5545    0.0000 H   0  0  0

+    1.6199   -1.5907    0.0000 H   0  0  0

+   -0.3652   -1.7139    0.0000 H   0  0  0

+    0.8449   -2.2368    0.0000 H   0  0  0

+    1.3678   -1.0267    0.0000 H   0  0  0

+   -1.2021    2.3051    0.0000 H   0  0  0

+   -3.6385   -2.3556    0.0000 H   0  0  0

+   -1.7034    2.9270    0.0000 H   0  0  0

+   -3.0789    2.7651    0.0000 H   0  0  0

+    2.6673    1.5217    0.0000 H   0  0  0

+    5.0216    1.2187    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  2  0

+  3 10  2  0

+  4 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  2  0

+  8 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 12 18  2  0

+ 16 19  2  0

+ 17 20  2  0

+  6  8  1  0

+ 12 15  1  0

+ 19 20  1  0

+  2 21  1  0

+  4 22  1  0

+  4 23  1  0

+  5 24  1  0

+  5 25  1  0

+  5 26  1  0

+  8 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2439-35-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    1.6883   -0.0980    0.0613 C   0  0  0

+    0.3962    0.0818    0.4005 O   0  0  0

+    2.6228    1.0354    0.1004 C   0  0  0

+    2.0817   -1.1986   -0.2719 O   0  0  0

+   -0.5271   -1.0382    0.3618 C   0  0  0

+    3.8985    0.8579   -0.2344 C   0  0  0

+   -1.9185   -0.5670    0.7895 C   0  0  0

+   -2.3833    0.4826   -0.1272 N   0  0  0

+   -2.5682   -0.1536   -1.4383 C   0  0  0

+   -3.7166    0.8884    0.3369 C   0  0  0

+    2.2676    1.9471    0.0000 H   0  0  0

+   -0.9505   -1.9203    0.0000 H   0  0  0

+    0.2974   -1.5649    0.0000 H   0  0  0

+    4.2663   -0.0488    0.0000 H   0  0  0

+    4.4998    1.6297    0.0000 H   0  0  0

+   -2.8830   -0.7316    0.0000 H   0  0  0

+   -1.9954   -1.5424    0.0000 H   0  0  0

+   -3.5077    0.1195    0.0000 H   0  0  0

+   -2.8413   -1.0931    0.0000 H   0  0  0

+   -1.6287   -0.4267    0.0000 H   0  0  0

+   -3.4317    1.8244    0.0000 H   0  0  0

+   -4.6526    1.1733    0.0000 H   0  0  0

+   -4.0015   -0.0476    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  7  8  1  0

+  8  9  1  0

+  8 10  1  0

+  3 11  1  0

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+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-94-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -1.1979    0.6922    0.0026 C   0  0  0

+   -1.1979   -0.6922    0.0010 C   0  0  0

+    0.0002    1.3839    0.0028 C   0  0  0

+   -2.7013    1.5602   -0.0027 Cl  0  0  0

+    0.0002   -1.3839   -0.0006 C   0  0  0

+   -2.7013   -1.5602    0.0014 Cl  0  0  0

+    1.1978    0.6924    0.0013 C   0  0  0

+    1.1978   -0.6924   -0.0004 C   0  0  0

+    2.7013    1.5604    0.0009 Cl  0  0  0

+    2.7013   -1.5604   -0.0018 Cl  0  0  0

+    0.0002    2.4223    0.0000 H   0  0  0

+    0.0002   -2.4223    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  8 10  1  0

+  7  8  1  0

+  3 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120314-14-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.0162   -0.8420   -0.2140 C   0  0  0

+   -1.2620   -0.3133    0.0305 C   0  0  0

+    0.9060    0.3113   -0.4144 C   0  0  0

+    0.2070   -2.2221   -0.2297 C   0  0  0

+   -1.1473    1.0699   -0.0199 N   0  0  0

+   -2.3255   -1.1733    0.2597 C   0  0  0

+    0.1604    1.4152   -0.2877 C   0  0  0

+    2.3831    0.2597   -0.7085 C   0  0  0

+   -0.8637   -3.0621   -0.0044 C   0  0  0

+   -2.1159    1.9036    0.1560 N   0  0  0

+   -2.1224   -2.5391    0.2464 C   0  0  0

+    3.1655    0.2700    0.6063 C   0  0  0

+   -1.9075    3.1019    0.0906 O   0  0  0

+    4.5662    0.2211    0.3275 O   0  0  0

+    1.1580   -2.6065    0.0000 H   0  0  0

+   -3.2813   -0.8008    0.0000 H   0  0  0

+    0.5211    2.3755    0.0000 H   0  0  0

+    1.8535   -0.6188    0.0000 H   0  0  0

+    2.8934   -0.6301    0.0000 H   0  0  0

+   -0.7249   -4.0785    0.0000 H   0  0  0

+   -2.9313   -3.1699    0.0000 H   0  0  0

+    3.6951    1.1485    0.0000 H   0  0  0

+    2.6551    1.1598    0.0000 H   0  0  0

+    5.5914    0.1853    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

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+  8 12  1  0

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+  5  7  1  0

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+  4 15  1  0

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+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-42-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -2.3227   -0.1670    0.0877 C   0  0  0

+   -3.5568    0.5728    0.0018 C   0  0  0

+   -1.0196    0.5151    0.1363 C   0  0  0

+   -2.4176   -1.5428    0.1283 C   0  0  0

+   -4.6985   -0.1418   -0.0368 C   0  0  0

+    0.1161   -0.2062    0.2165 N   0  0  0

+   -0.9675    1.7300    0.1040 O   0  0  0

+   -4.1243   -1.8254    0.0525 S   0  0  0

+   -6.0912    0.3525   -0.1234 N   0  3  0

+    1.3575    0.4321    0.1298 C   0  0  0

+   -7.0175   -0.4381   -0.1487 O   0  0  0

+   -6.3109    1.5496   -0.1694 O   0  5  0

+    2.5243   -0.3196    0.0769 C   0  0  0

+    1.4258    1.8186    0.0907 C   0  0  0

+    3.7491    0.3142   -0.0086 C   0  0  0

+    2.6533    2.4464    0.0052 C   0  0  0

+    3.8135    1.6963   -0.0416 C   0  0  0

+    5.3386   -0.7077   -0.0801 Br  0  0  0

+   -3.5668    1.6105    0.0000 H   0  0  0

+   -1.6497   -2.2408    0.0000 H   0  0  0

+    0.0689   -1.2428    0.0000 H   0  0  0

+    2.4751   -1.3561    0.0000 H   0  0  0

+    0.5542    2.3817    0.0000 H   0  0  0

+    2.7058    3.4828    0.0000 H   0  0  0

+    4.7362    2.1710    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

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+ 10 13  1  0

+ 10 14  2  0

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+ 14 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 19  1  0

+  4 20  1  0

+  6 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+119-41-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 42                          1 V2000

+    0.7711   -0.0680   -0.0126 C   0  0  0

+    0.6596   -1.4676   -0.0791 C   0  0  0

+    1.9914    0.5074    0.0154 O   0  0  0

+   -0.3806    0.7037    0.0292 C   0  0  0

+    1.8970   -2.2693   -0.1170 C   0  0  0

+   -0.5969   -2.0722   -0.1076 C   0  0  0

+    3.1241   -0.2116   -0.0182 C   0  0  0

+   -1.6216    0.0883    0.0051 C   0  0  0

+    3.1269   -1.5696   -0.0836 C   0  0  0

+    1.8619   -3.4875   -0.1754 O   0  0  0

+   -1.7225   -1.2987   -0.0705 C   0  0  0

+    4.4177    0.5000    0.0158 C   0  0  0

+   -2.7486    0.8440    0.0465 O   0  0  0

+    5.4798   -0.0110    0.7646 C   0  0  0

+    4.5862    1.6842   -0.7055 C   0  0  0

+   -3.8541   -0.0606    0.0077 C   0  0  0

+    6.6856    0.6586    0.7915 C   0  0  0

+    5.7971    2.3432   -0.6696 C   0  0  0

+   -5.1429    0.7191    0.0510 C   0  0  0

+    6.8439    1.8339    0.0789 C   0  0  0

+   -6.3193    0.0732    0.0251 O   0  0  0

+   -5.1174    1.9257    0.1091 O   0  0  0

+   -7.5611    0.8245    0.0668 C   0  0  0

+   -8.7448   -0.1441    0.0254 C   0  0  0

+   -0.3134    1.7357    0.0000 H   0  0  0

+   -0.6762   -3.1033    0.0000 H   0  0  0

+    4.0214   -2.0886    0.0000 H   0  0  0

+   -2.6546   -1.7467    0.0000 H   0  0  0

+    5.5100   -1.0448    0.0000 H   0  0  0

+    3.7367    2.2740    0.0000 H   0  0  0

+   -4.4863   -0.8790    0.0000 H   0  0  0

+   -3.1126   -0.7816    0.0000 H   0  0  0

+    7.5398    0.0756    0.0000 H   0  0  0

+    5.7735    3.3771    0.0000 H   0  0  0

+    7.7554    2.3225    0.0000 H   0  0  0

+   -6.9289    1.6429    0.0000 H   0  0  0

+   -8.3026    1.5455    0.0000 H   0  0  0

+   -9.3997    0.6563    0.0000 H   0  0  0

+   -9.5452   -0.7990    0.0000 H   0  0  0

+   -8.0899   -0.9445    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+ 21 23  1  0

+ 23 24  1  0

+  7  9  2  0

+  8 11  2  0

+ 18 20  1  0

+  4 25  1  0

+  6 26  1  0

+  9 27  1  0

+ 11 28  1  0

+ 14 29  1  0

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+ 16 32  1  0

+ 17 33  1  0

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+ 20 35  1  0

+ 23 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+614-00-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.2205    0.1139   -0.0010 C   0  0  0

+   -1.1629    0.3028   -0.0002 N   0  0  0

+    1.0734    1.2114    0.0003 C   0  0  0

+    0.7478   -1.1716    0.0027 C   0  0  0

+   -1.9530   -0.7168   -0.0014 N   0  0  0

+   -1.7170    1.6590    0.0020 C   0  0  0

+    2.4408    1.0208   -0.0005 C   0  0  0

+    2.1167   -1.3546    0.0019 C   0  0  0

+   -3.1598   -0.5521   -0.0007 O   0  0  0

+    2.9622   -0.2604   -0.0027 C   0  0  0

+    0.6830    2.1724    0.0000 H   0  0  0

+    0.1141   -1.9928    0.0000 H   0  0  0

+   -0.7568    2.0513    0.0000 H   0  0  0

+   -2.1093    2.6192    0.0000 H   0  0  0

+   -2.6772    1.2667    0.0000 H   0  0  0

+    3.0779    1.8393    0.0000 H   0  0  0

+    2.5111   -2.3140    0.0000 H   0  0  0

+    3.9899   -0.4007    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  3 11  1  0

+  4 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77996-03-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 45                          1 V2000

+    0.3943   -0.0503   -0.0533 C   0  0  0

+   -0.9803   -0.0260    0.0944 C   0  0  0

+    1.0605    1.1964   -0.0717 C   0  0  0

+    1.0947   -1.2274   -0.1835 N   0  0  0

+   -1.6963    1.1703    0.2128 C   0  0  0

+   -1.9767   -1.1510    0.1729 C   0  0  0

+    2.5246    1.2021   -0.2161 C   0  0  0

+    0.3456    2.3959    0.0480 C   0  0  0

+    2.4672   -1.2733   -0.0349 C   0  0  0

+    0.3669   -2.4623   -0.4865 C   0  0  0

+   -3.0190    0.9401    0.3341 O   0  0  0

+   -1.0325    2.4039    0.1918 C   0  0  0

+   -3.2301   -0.4291    0.7293 C   0  0  0

+    3.2223   -0.0876   -0.0457 C   0  0  0

+    3.1347    2.2265   -0.4659 O   0  0  0

+    1.0173    3.5744    0.0230 O   0  0  0

+    3.1177   -2.4935    0.1266 C   0  0  0

+   -4.4813   -0.9728    0.0366 C   0  0  0

+    4.6088   -0.1384    0.1025 C   0  0  0

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+   -5.8342   -0.3872    0.4460 C   0  0  0

+   -5.2160   -0.0825   -0.8058 O   0  0  0

+   -4.4335   -2.4508   -0.3560 C   0  0  0

+    5.2321   -1.3559    0.2639 C   0  0  0

+   -2.5552   -2.0150    0.0000 H   0  0  0

+   -1.1536   -1.7864    0.0000 H   0  0  0

+   -0.5289   -1.9344    0.0000 H   0  0  0

+   -0.1610   -3.3581    0.0000 H   0  0  0

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+   -1.5632    3.2981    0.0000 H   0  0  0

+   -3.2886   -1.4673    0.0000 H   0  0  0

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+   -4.3999   -3.4901    0.0000 H   0  0  0

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+  1  2  1  0

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+  8 16  1  0

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+ 13 18  1  0

+ 14 19  1  0

+ 17 20  2  0

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+ 19 24  2  0

+  8 12  2  0

+  9 14  2  0

+ 11 13  1  0

+ 20 24  1  0

+ 21 22  1  0

+  6 25  1  0

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+ 21 37  1  0

+ 23 38  1  0

+ 23 39  1  0

+ 23 40  1  0

+ 24 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+123-01-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 48                          1 V2000

+    5.0094   -0.3759   -0.0078 C   0  0  0

+    5.6036   -0.0475    1.1966 C   0  0  0

+    5.6064   -0.0030   -1.1973 C   0  0  0

+    3.7141   -1.1458   -0.0238 C   0  0  0

+    6.7946    0.6536    1.2111 C   0  0  0

+    6.7978    0.6984   -1.1828 C   0  0  0

+    2.5386   -0.1667   -0.0035 C   0  0  0

+    7.3918    1.0266    0.0213 C   0  0  0

+    1.2234   -0.9484   -0.0197 C   0  0  0

+    0.0479    0.0307    0.0006 C   0  0  0

+   -1.2672   -0.7510   -0.0156 C   0  0  0

+   -2.4427    0.2282    0.0047 C   0  0  0

+   -3.7579   -0.5535   -0.0115 C   0  0  0

+   -4.9334    0.4256    0.0088 C   0  0  0

+   -6.2485   -0.3561   -0.0074 C   0  0  0

+   -7.4240    0.6230    0.0128 C   0  0  0

+   -8.7392   -0.1587   -0.0034 C   0  0  0

+   -9.9147    0.8205    0.0169 C   0  0  0

+    6.1722   -1.0441    0.0000 H   0  0  0

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+   -0.6461    0.9444    0.0000 H   0  0  0

+   -2.0965   -1.5439    0.0000 H   0  0  0

+   -0.5732   -1.6647    0.0000 H   0  0  0

+   -1.6133    1.0211    0.0000 H   0  0  0

+   -3.1367    1.1419    0.0000 H   0  0  0

+   -4.5872   -1.3464    0.0000 H   0  0  0

+   -3.0639   -1.4672    0.0000 H   0  0  0

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+   -7.0778   -1.1490    0.0000 H   0  0  0

+   -5.5545   -1.2698    0.0000 H   0  0  0

+   -6.5947    1.4159    0.0000 H   0  0  0

+   -8.1180    1.5367    0.0000 H   0  0  0

+   -9.5686   -0.9516    0.0000 H   0  0  0

+   -8.0452   -1.0724    0.0000 H   0  0  0

+   -9.1803    1.7021    0.0000 H   0  0  0

+  -10.7963    1.5549    0.0000 H   0  0  0

+  -10.6491   -0.0611    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  2  0

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+  4  7  1  0

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+ 17 18  1  0

+  6  8  2  0

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+ 17 44  1  0

+ 17 45  1  0

+ 18 46  1  0

+ 18 47  1  0

+ 18 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+53478-38-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+    2.1134    0.0362   -0.7507 C   0  0  0

+    2.5117   -1.2683   -0.3955 C   0  0  0

+    2.8791    1.1126   -0.2601 C   0  0  0

+    1.0156    0.2515   -1.5555 N   0  0  0

+    3.6518   -1.4489    0.4308 C   0  0  0

+    1.7959   -2.3899   -0.8473 C   0  0  0

+    4.0067    0.8493    0.5616 C   0  0  0

+    2.5415    2.4404   -0.5726 C   0  0  0

+   -0.2512    0.4114   -0.9827 C   0  0  0

+    4.3458   -0.4008    0.8721 N   0  0  0

+    4.0392   -2.7591    0.7786 C   0  0  0

+    2.2023   -3.6381   -0.4887 C   0  0  0

+    4.7641    1.9356    1.0457 C   0  0  0

+    3.2982    3.4608   -0.0849 C   0  0  0

+   -1.3580    0.6285   -1.7940 C   0  0  0

+   -0.4030    0.3475    0.3963 C   0  0  0

+    3.3224   -3.8200    0.3222 C   0  0  0

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+   -4.0250    0.8870    0.7232 N   0  0  0

+   -5.2427   -0.1709    0.3485 S   0  0  0

+   -4.6916   -1.7220    1.1107 C   0  0  0

+   -6.3601    0.3802    1.0317 O   0  0  0

+   -5.1803   -0.2334   -1.0698 O   0  0  0

+    1.1670    1.1922    0.0000 H   0  0  0

+    0.8508   -2.2696    0.0000 H   0  0  0

+    1.6067    2.6246    0.0000 H   0  0  0

+    4.9808   -2.9046    0.0000 H   0  0  0

+    1.5823   -4.3616    0.0000 H   0  0  0

+    5.7035    1.7767    0.0000 H   0  0  0

+    2.9682    4.3546    0.0000 H   0  0  0

+   -1.2067    1.5692    0.0000 H   0  0  0

+   -0.2733   -0.5964    0.0000 H   0  0  0

+    3.7003   -4.6946    0.0000 H   0  0  0

+    5.0644    3.8963    0.0000 H   0  0  0

+   -2.7242    1.7314    0.0000 H   0  0  0

+   -1.8065   -0.4354    0.0000 H   0  0  0

+   -4.3019    1.7987    0.0000 H   0  0  0

+   -5.5894   -2.0410    0.0000 H   0  0  0

+   -4.3726   -2.6198    0.0000 H   0  0  0

+   -3.7938   -1.4030    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

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+  9 15  1  0

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+ 13 18  2  0

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+  7 10  2  0

+ 12 17  1  0

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+ 20 21  2  0

+  4 27  1  0

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+ 20 39  1  0

+ 22 40  1  0

+ 24 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1836-75-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    1.2481    0.9392    0.8230 C   0  0  0

+    0.1853    1.7219    1.1476 O   0  0  0

+    1.6565    0.8350   -0.4998 C   0  0  0

+    1.9299    0.2479    1.8138 C   0  0  0

+   -0.9322    1.0270    0.8087 C   0  0  0

+    2.7378    0.0382   -0.8272 C   0  0  0

+    0.8099    1.7039   -1.7415 Cl  0  0  0

+    3.0098   -0.5471    1.4821 C   0  0  0

+   -2.1787    1.6298    0.8968 C   0  0  0

+   -0.8281   -0.2849    0.3684 C   0  0  0

+    3.4122   -0.6546    0.1624 C   0  0  0

+   -3.3133    0.9212    0.5511 C   0  0  0

+   -1.9655   -0.9888    0.0241 C   0  0  0

+    4.7694   -1.6550   -0.2512 Cl  0  0  0

+   -3.2072   -0.3874    0.1178 C   0  0  0

+   -4.4245   -1.1443   -0.2514 N   0  3  0

+   -4.3323   -2.2972   -0.6333 O   0  0  0

+   -5.5183   -0.6142   -0.1733 O   0  5  0

+    1.2839   -0.4984    0.0000 H   0  0  0

+    3.3864    0.7822    0.0000 H   0  0  0

+    2.5824   -1.4368    0.0000 H   0  0  0

+   -2.2319    2.6154    0.0000 H   0  0  0

+    0.0525   -0.7308    0.0000 H   0  0  0

+   -4.1952    1.3645    0.0000 H   0  0  0

+   -1.9146   -1.9745    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  5  9  2  0

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+ 16 18  1  0

+  8 11  1  0

+ 13 15  1  0

+  4 19  1  0

+  6 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+329-71-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.5145    0.1292   -0.0097 C   0  0  0

+   -0.7644   -1.0255    0.0986 C   0  0  0

+   -0.8856    1.3554   -0.1250 C   0  0  0

+   -2.9927    0.0536   -0.0085 N   0  3  0

+    0.6213   -0.9545    0.0917 C   0  0  0

+    0.4949    1.4289   -0.1321 C   0  0  0

+   -3.6547    1.0715   -0.1039 O   0  0  0

+   -3.5472   -1.0266    0.0880 O   0  5  0

+    1.2497    0.2767   -0.0241 C   0  0  0

+    1.3615   -2.0892    0.1985 O   0  0  0

+    2.7278    0.3560   -0.0323 N   0  3  0

+    3.2945    1.2271    0.6030 O   0  0  0

+    3.3773   -0.4498   -0.6744 O   0  5  0

+   -1.2339   -1.9457    0.0000 H   0  0  0

+   -1.4475    2.2223    0.0000 H   0  0  0

+    0.9617    2.3505    0.0000 H   0  0  0

+    1.9259   -2.9544    0.0000 H   0  0  0

+  1  2  2  0

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+ 11 13  1  0

+  6  9  1  0

+  2 14  1  0

+  3 15  1  0

+  6 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-64-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    1.0729   -0.2299   -0.8280 C   0  0  0

+   -0.2382   -0.5501   -0.1575 C   0  0  0

+    2.1214    0.1033    0.2353 C   0  0  0

+   -1.3116    0.2252   -0.3779 O   0  0  0

+   -0.3232   -1.5046    0.5784 O   0  0  0

+    3.5202   -0.0147   -0.3733 C   0  0  0

+    1.9025    1.5319    0.7373 C   0  0  0

+   -2.5749   -0.0833    0.2681 C   0  0  0

+   -3.6260    0.9473   -0.1490 C   0  0  0

+    0.8138   -1.1985    0.0000 H   0  0  0

+    1.7981   -0.9223    0.0000 H   0  0  0

+    2.2332   -0.8931    0.0000 H   0  0  0

+    3.4359   -1.0138    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146177-59-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.4502   -0.7688   -0.0017 C   0  0  0

+   -1.0091   -0.8344   -0.0008 C   0  0  0

+    1.0661    0.4855   -0.0013 C   0  0  0

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+   -1.7450    0.3769    0.0002 C   0  0  0

+   -1.6530   -2.0005   -0.0016 N   0  0  0

+    0.2961    1.6513   -0.0003 C   0  0  0

+    2.4289    0.2435   -0.0018 N   0  0  0

+    2.5998   -1.1093   -0.0002 C   0  0  0

+   -1.0601    1.6068    0.0010 C   0  0  0

+   -3.0814    0.3325    0.0010 N   0  0  0

+   -2.9686   -2.0192   -0.0012 C   0  0  0

+    0.9882    2.9900    0.0000 C   0  0  0

+    3.4905    1.2532   -0.0017 C   0  0  0

+    3.8182   -1.7565    0.0028 N   0  0  0

+   -1.8449    2.8933    0.0016 C   0  0  0

+   -3.6955   -0.8298    0.0007 C   0  0  0

+   -3.4699   -2.9282    0.0000 H   0  0  0

+    1.9103    2.5133    0.0000 H   0  0  0

+    1.4649    3.9121    0.0000 H   0  0  0

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+ 16 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106264-79-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+    1.2014   -0.1676   -0.0036 C   0  0  0

+    0.0001   -0.8613   -0.0027 C   0  0  0

+    1.2011    1.2266   -0.0021 C   0  0  0

+    2.7275   -1.0483    0.0009 S   0  0  0

+   -1.2015   -0.1674   -0.0004 C   0  0  0

+    0.0001    1.9198    0.0002 C   0  0  0

+    2.4161    1.9284   -0.0025 N   0  0  0

+    2.1073   -2.7530    0.0055 C   0  0  0

+   -1.2012    1.2264    0.0010 C   0  0  0

+   -2.7275   -1.0482    0.0001 S   0  0  0

+    0.0001    3.4268    0.0017 C   0  0  0

+   -2.4161    1.9281    0.0033 N   0  0  0

+   -2.1074   -2.7529   -0.0029 C   0  0  0

+    0.0001   -1.9135    0.0000 H   0  0  0

+    3.3275    1.4025    0.0000 H   0  0  0

+    2.4159    2.9806    0.0000 H   0  0  0

+    1.1185   -2.3932    0.0000 H   0  0  0

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+    3.0961   -3.1128    0.0000 H   0  0  0

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+  1  2  2  0

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+  3  7  1  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  9 12  1  0

+ 10 13  1  0

+  6  9  1  0

+  2 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88488-97-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+   -0.4255    0.5937   -0.0036 C   0  0  0

+   -0.6825   -0.7995   -0.0029 C   0  0  0

+    0.9661    1.0837   -0.0022 C   0  0  0

+   -1.4742    1.4982    0.0001 C   0  0  0

+    0.4437   -1.7528   -0.0007 C   0  0  0

+   -1.9853   -1.2687   -0.0039 C   0  0  0

+    2.0343    0.1701   -0.0005 C   0  0  0

+    1.2276    2.4552   -0.0031 C   0  0  0

+   -2.7954    1.0338    0.0043 C   0  0  0

+    1.7669   -1.2797    0.0007 C   0  0  0

+    0.2025   -3.1274    0.0004 C   0  0  0

+   -3.0534   -0.3625   -0.0058 C   0  0  0

+    3.3466    0.6432    0.0004 C   0  0  0

+    2.5277    2.9071   -0.0022 C   0  0  0

+   -3.8779    1.9341    0.0088 C   0  0  0

+    2.8248   -2.1903    0.0033 C   0  0  0

+    1.2601   -4.0101    0.0030 C   0  0  0

+   -4.3864   -0.8155   -0.0063 C   0  0  0

+    3.5875    2.0048   -0.0004 C   0  0  0

+   -5.1514    1.4571    0.0132 C   0  0  0

+    2.5662   -3.5433    0.0045 C   0  0  0

+   -5.4049    0.0855   -0.0076 C   0  0  0

+    4.8661    2.4646    0.0005 O   0  0  0

+   -1.2798    2.5267    0.0000 H   0  0  0

+   -2.1716   -2.2987    0.0000 H   0  0  0

+    0.4354    3.1393    0.0000 H   0  0  0

+   -0.7805   -3.4871    0.0000 H   0  0  0

+    4.1472   -0.0311    0.0000 H   0  0  0

+    2.7206    3.9359    0.0000 H   0  0  0

+   -3.7032    2.9661    0.0000 H   0  0  0

+    3.8131   -1.8456    0.0000 H   0  0  0

+    1.0767   -5.0406    0.0000 H   0  0  0

+   -4.5926   -1.8417    0.0000 H   0  0  0

+   -5.9536    2.1295    0.0000 H   0  0  0

+    3.3612   -4.2241    0.0000 H   0  0  0

+   -6.3945   -0.2555    0.0000 H   0  0  0

+    5.8510    2.8188    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

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+ 15 20  2  0

+ 16 21  2  0

+ 18 22  2  0

+ 19 23  1  0

+  7 10  1  0

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+ 14 29  1  0

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+ 17 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+61203-01-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    1.6947   -0.2675   -0.0016 C   0  0  0

+    0.5343    0.6242    0.0001 C   0  0  0

+    3.0873    0.3083   -0.0014 C   0  0  0

+    1.5355   -1.4702    0.0019 O   0  0  0

+    0.7095    1.9478    0.0018 C   0  0  0

+   -1.2132   -0.0983   -0.0002 Br  0  0  0

+    3.5067   -0.7060    0.0000 H   0  0  0

+    4.1016    0.7277    0.0000 H   0  0  0

+    2.6679    1.3226    0.0000 H   0  0  0

+    1.7238    2.3671    0.0000 H   0  0  0

+   -0.1608    2.6166    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112-24-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    0.6456   -0.4103    0.0000 C   0  0  0

+   -0.6456    0.4103    0.0000 C   0  0  0

+    1.8018    0.4960    0.0000 N   0  0  0

+   -1.8018   -0.4960    0.0000 N   0  0  0

+    3.0020   -0.3510    0.0000 C   0  0  0

+   -3.0020    0.3510    0.0000 C   0  0  0

+    4.2504    0.5336    0.0000 C   0  0  0

+   -4.2504   -0.5336    0.0000 C   0  0  0

+    5.4507   -0.3133    0.0000 N   0  0  0

+   -5.4507    0.3133    0.0000 N   0  0  0

+   -0.0467   -1.2674    0.0000 H   0  0  0

+    1.4190   -1.1951    0.0000 H   0  0  0

+    0.0467    1.2674    0.0000 H   0  0  0

+   -1.4190    1.1951    0.0000 H   0  0  0

+    1.7741    1.5975    0.0000 H   0  0  0

+   -1.7741   -1.5975    0.0000 H   0  0  0

+    2.2690   -1.1736    0.0000 H   0  0  0

+    3.7365   -1.1722    0.0000 H   0  0  0

+   -2.2690    1.1736    0.0000 H   0  0  0

+   -3.7365    1.1722    0.0000 H   0  0  0

+    4.9833    1.3563    0.0000 H   0  0  0

+    3.5158    1.3548    0.0000 H   0  0  0

+   -4.9833   -1.3563    0.0000 H   0  0  0

+   -3.5158   -1.3548    0.0000 H   0  0  0

+    5.3507   -1.4106    0.0000 H   0  0  0

+    6.4509    0.1488    0.0000 H   0  0  0

+   -5.3507    1.4106    0.0000 H   0  0  0

+   -6.4509   -0.1488    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

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+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2849-98-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    1.8090   -0.3825   -0.0013 C   0  0  0

+    0.6256    0.2631   -0.0003 O   0  0  0

+    3.0635    0.3828   -0.0004 C   0  0  0

+    1.8383   -1.5975    0.0022 O   0  0  0

+   -0.6139   -0.4931   -0.0011 C   0  0  0

+    3.0270    1.8894    0.0015 C   0  0  0

+    4.2317   -0.2546   -0.0014 C   0  0  0

+   -1.8005    0.4728    0.0002 C   0  0  0

+   -3.1067   -0.3240   -0.0006 C   0  0  0

+   -4.2933    0.6418    0.0007 C   0  0  0

+   -5.5994   -0.1550   -0.0001 C   0  0  0

+   -1.4119   -1.2736    0.0000 H   0  0  0

+    0.0714   -1.3742    0.0000 H   0  0  0

+    4.1429    1.9164    0.0000 H   0  0  0

+    3.0000    3.0053    0.0000 H   0  0  0

+    1.9111    1.8624    0.0000 H   0  0  0

+    4.2586   -1.3705    0.0000 H   0  0  0

+    5.1846    0.3267    0.0000 H   0  0  0

+   -1.0025    1.2533    0.0000 H   0  0  0

+   -2.4858    1.3539    0.0000 H   0  0  0

+   -3.9047   -1.1045    0.0000 H   0  0  0

+   -2.4214   -1.2051    0.0000 H   0  0  0

+   -3.4953    1.4223    0.0000 H   0  0  0

+   -4.9786    1.5229    0.0000 H   0  0  0

+   -6.1807    0.7979    0.0000 H   0  0  0

+   -6.5523   -0.7363    0.0000 H   0  0  0

+   -5.0181   -1.1079    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

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+  6  3  1  0

+  7  3  2  0

+  8  5  1  0

+  9  8  1  0

+ 10  9  1  0

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+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16423-19-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    0.0393    0.5275    0.0814 C   0  0  1

+   -0.3422   -0.9453   -0.0808 C   0  0  1

+    1.4082    0.7729   -0.5563 C   0  0  2

+   -1.0086    1.4045   -0.6070 C   0  0  0

+    0.0957    0.8547    1.4712 O   0  0  0

+    0.7057   -1.8223    0.6076 C   0  0  0

+   -1.7111   -1.1907    0.5569 C   0  0  0

+   -0.4026   -1.2957   -1.5689 C   0  0  0

+    2.4561   -0.1041    0.1320 C   0  0  0

+    1.7897    2.2457   -0.3942 C   0  0  0

+   -2.3775    1.1591    0.0308 C   0  0  0

+    2.0746   -1.5768   -0.0301 C   0  0  0

+   -2.7590   -0.3137   -0.1314 C   0  0  0

+    1.1403   -0.2352    0.0000 H   0  0  0

+   -0.1731    2.0289    0.0000 H   0  0  0

+   -1.4240    2.3613    0.0000 H   0  0  0

+    0.2729    1.8826    0.0000 H   0  0  0

+   -0.1298   -2.4467    0.0000 H   0  0  0

+    1.1211   -2.7791    0.0000 H   0  0  0

+   -2.5466   -1.8151    0.0000 H   0  0  0

+   -1.2957   -2.1475    0.0000 H   0  0  0

+   -1.4305   -1.1185    0.0000 H   0  0  0

+   -0.5798   -2.3236    0.0000 H   0  0  0

+    0.6253   -1.4729    0.0000 H   0  0  0

+    3.4163   -0.5115    0.0000 H   0  0  0

+    3.0004    0.7856    0.0000 H   0  0  0

+    2.7994    1.9842    0.0000 H   0  0  0

+    2.0512    3.2554    0.0000 H   0  0  0

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+   -2.4127    2.2015    0.0000 H   0  0  0

+   -3.4143    1.2734    0.0000 H   0  0  0

+    2.1099   -2.6192    0.0000 H   0  0  0

+    3.1114   -1.6911    0.0000 H   0  0  0

+   -3.7192    0.0937    0.0000 H   0  0  0

+   -3.3033   -1.2034    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 12 32  1  0

+ 12 33  1  0

+ 13 34  1  0

+ 13 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97-90-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    2.6930   -0.2673   -0.1628 C   0  0  0

+    1.4108   -0.4809    0.1942 O   0  0  0

+    3.3973    0.9325    0.3102 C   0  0  0

+    3.2681   -1.0696   -0.8718 O   0  0  0

+    0.7149   -1.6664   -0.2732 C   0  0  0

+    2.6861    1.9242    1.1944 C   0  0  0

+    4.6632    1.1434   -0.0422 C   0  0  0

+   -0.7147   -1.6667    0.2719 C   0  0  0

+   -1.4109   -0.4812   -0.1951 O   0  0  0

+   -2.6932   -0.2680    0.1620 C   0  0  0

+   -3.3978    0.9318   -0.3106 C   0  0  0

+   -3.2665   -1.0682    0.8748 O   0  0  0

+   -2.6869    1.9240   -1.1944 C   0  0  0

+   -4.6637    1.1422    0.0419 C   0  0  0

+    0.5434   -2.6261    0.0000 H   0  0  0

+    1.6294   -2.0042    0.0000 H   0  0  0

+    3.4783    2.4924    0.0000 H   0  0  0

+    2.1179    2.7164    0.0000 H   0  0  0

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+    5.0053    2.0563    0.0000 H   0  0  0

+   -1.6291   -2.0047    0.0000 H   0  0  0

+   -0.5429   -2.6263    0.0000 H   0  0  0

+   -1.8944    1.3562    0.0000 H   0  0  0

+   -2.1191    2.7165    0.0000 H   0  0  0

+   -3.4794    2.4918    0.0000 H   0  0  0

+   -5.0061    2.0550    0.0000 H   0  0  0

+   -5.2830    0.3893    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

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+  8 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50438-75-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+   -1.6038    0.0001    0.0295 C   0  0  0

+   -0.9156   -1.2021    0.1358 C   0  0  0

+   -0.9158    1.2021    0.1333 C   0  0  0

+   -2.9837   -0.0002   -0.1869 N   0  0  0

+    0.4495   -1.1982    0.3441 C   0  0  0

+    0.4496    1.1987    0.3416 C   0  0  0

+   -3.7078    1.2684   -0.2987 C   0  0  0

+   -3.7069   -1.2690   -0.3021 C   0  0  0

+    1.1315    0.0005    0.4469 C   0  0  0

+    2.6213    0.0008    0.6743 C   0  0  0

+    3.3430   -0.0006   -0.6748 C   0  0  0

+    4.7557   -0.0004   -0.4593 O   0  0  0

+   -1.4344   -2.0998    0.0000 H   0  0  0

+   -1.4348    2.0997    0.0000 H   0  0  0

+    0.9720   -2.0937    0.0000 H   0  0  0

+    0.9719    2.0944    0.0000 H   0  0  0

+   -2.8073    1.7824    0.0000 H   0  0  0

+   -4.2218    2.1689    0.0000 H   0  0  0

+   -4.6083    0.7544    0.0000 H   0  0  0

+   -4.6077   -0.7556    0.0000 H   0  0  0

+   -4.2203   -2.1698    0.0000 H   0  0  0

+   -2.8061   -1.7824    0.0000 H   0  0  0

+    3.1408    0.8981    0.0000 H   0  0  0

+    2.1033    0.8990    0.0000 H   0  0  0

+    2.8235   -0.8979    0.0000 H   0  0  0

+    3.8609   -0.8988    0.0000 H   0  0  0

+    5.7925   -0.0003    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  2  0

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+  8 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+126983-60-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.6345   -0.2313   -0.0015 C   0  0  0

+   -0.7632   -0.3130   -0.0013 C   0  0  0

+    1.2442    1.0321    0.0000 C   0  0  0

+    1.4686   -1.4493    0.0029 C   0  0  0

+   -1.4919    0.8978    0.0003 C   0  0  0

+   -1.6526   -1.3571   -0.0025 N   0  0  0

+    2.7241    1.1152   -0.0002 C   0  0  0

+    0.5110    2.1388    0.0019 N   0  0  0

+    2.9313   -1.3364    0.0026 C   0  0  0

+    0.9432   -2.5462    0.0064 O   0  0  0

+   -2.9128    0.5212    0.0002 C   0  0  0

+   -0.8051    2.1074    0.0021 C   0  0  0

+   -2.9479   -0.8864   -0.0016 C   0  0  0

+    3.5294   -0.1276   -0.0019 C   0  0  0

+    3.2739    2.1978    0.0006 O   0  0  0

+   -4.1092    1.2304    0.0010 C   0  0  0

+   -4.1943   -1.5093   -0.0025 C   0  0  0

+    4.8807   -0.0495   -0.0025 O   0  0  0

+   -5.2612    0.5903    0.0000 N   0  0  0

+   -5.3310   -0.7299   -0.0016 C   0  0  0

+    5.3720   -1.3914   -0.0041 C   0  0  0

+   -1.3861   -2.3657    0.0000 H   0  0  0

+    3.5153   -2.2008    0.0000 H   0  0  0

+   -1.3406    3.0026    0.0000 H   0  0  0

+   -4.0946    2.2735    0.0000 H   0  0  0

+   -4.2660   -2.5500    0.0000 H   0  0  0

+   -6.2664   -1.1916    0.0000 H   0  0  0

+    4.3924   -1.7500    0.0000 H   0  0  0

+    5.7306   -2.3710    0.0000 H   0  0  0

+    6.3516   -1.0328    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  2  0

+ 11 16  1  0

+ 13 17  1  0

+ 14 18  1  0

+ 16 19  2  0

+ 17 20  2  0

+ 18 21  1  0

+  8 12  2  0

+  9 14  2  0

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+ 19 20  1  0

+  6 22  1  0

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+ 12 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+ 20 27  1  0

+ 21 28  1  0

+ 21 29  1  0

+ 21 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89-98-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.4274    0.5159    0.0020 C   0  0  0

+   -0.4399   -0.5829    0.0001 C   0  0  0

+    1.8106    0.3054    0.0021 C   0  0  0

+   -0.1124    1.8840   -0.0023 C   0  0  0

+    0.0759   -1.8639   -0.0016 C   0  0  0

+   -2.1582   -0.3360    0.0005 Cl  0  0  0

+    2.3086   -0.9796    0.0004 C   0  0  0

+    0.6420    2.8334   -0.0006 O   0  0  0

+    1.4447   -2.0618   -0.0014 C   0  0  0

+    2.4604    1.1155    0.0000 H   0  0  0

+   -1.1396    2.0370    0.0000 H   0  0  0

+   -0.5656   -2.6806    0.0000 H   0  0  0

+    3.3352   -1.1368    0.0000 H   0  0  0

+    1.8268   -3.0275    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  7  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  7 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82-62-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.1578   -0.9136   -0.0025 C   0  0  0

+   -1.2229   -0.7878   -0.0018 C   0  0  0

+    0.9542    0.2170   -0.0014 C   0  0  0

+    0.7791   -2.2571    0.0016 N   0  3  0

+   -1.8034    0.4734    0.0001 C   0  0  0

+   -2.0074   -1.8981   -0.0025 O   0  0  0

+    0.3735    1.4738    0.0000 C   0  0  0

+    2.6832    0.0602   -0.0023 Cl  0  0  0

+    1.0338   -2.8136   -1.0514 O   0  0  0

+    1.0356   -2.8062    1.0582 O   0  5  0

+   -1.0043    1.6012    0.0012 C   0  0  0

+   -3.5320    0.6339    0.0004 Cl  0  0  0

+    1.3752    2.8917    0.0008 Cl  0  0  0

+   -2.6066   -2.7461    0.0000 H   0  0  0

+   -1.4382    2.5446    0.0000 H   0  0  0

+  1  2  2  0

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+  5 11  2  0

+  5 12  1  0

+  7 13  1  0

+  7 11  1  0

+  6 14  1  0

+ 11 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97606-15-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 23                          1 V2000

+    0.7613   -2.0826   -0.3388 C   0  0  0

+   -0.7613   -2.0826   -0.3387 C   0  0  0

+    1.4979   -0.7558   -0.1800 C   0  0  0

+    0.0002   -2.3420    0.8905 N   0  0  0

+   -1.4979   -0.7559   -0.1794 C   0  0  0

+    0.7591    0.4190   -0.0391 C   0  0  0

+    2.8668   -0.6724   -0.1698 C   0  0  0

+   -0.7591    0.4189   -0.0386 C   0  0  0

+   -2.8668   -0.6725   -0.1696 C   0  0  0

+    1.4647    1.6043    0.1032 C   0  0  0

+    3.1589    1.0690    0.0392 S   0  0  0

+   -1.4647    1.6043    0.1033 C   0  0  0

+   -3.1589    1.0690    0.0390 S   0  0  0

+    1.4600   -2.9185    0.0000 H   0  0  0

+   -1.4599   -2.9186    0.0000 H   0  0  0

+    0.0003   -3.4315    0.0000 H   0  0  0

+    3.5955   -1.4823    0.0000 H   0  0  0

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+  2 15  1  0

+  4 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91-53-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -0.6003    0.7999    0.3483 C   0  0  0

+   -0.3745   -0.5691    0.1345 C   0  0  0

+    0.4644    1.6801    0.3915 C   0  0  0

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+   -2.9837    0.8617   -1.6653 C   0  0  0

+    3.2550   -0.5961   -0.1648 O   0  0  0

+    4.1133    0.5423   -0.0693 C   0  0  0

+    5.5671    0.1017   -0.2514 C   0  0  0

+    0.2890    2.7038    0.0000 H   0  0  0

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+   -5.3403    1.1334    0.0000 H   0  0  0

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+    5.2659   -0.8923    0.0000 H   0  0  0

+    6.5611   -0.1995    0.0000 H   0  0  0

+    5.8683    1.0957    0.0000 H   0  0  0

+  1  2  2  0

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+ 15 31  1  0

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+ 16 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+117-81-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 66 66                          1 V2000

+    0.7448   -2.2612   -0.1230 C   0  0  0

+   -0.6455   -2.0949    0.0219 C   0  0  0

+    1.5661   -1.1805   -0.7091 C   0  0  0

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+   -0.6413    0.0188   -0.9725 O   0  0  0

+   -0.7966   -4.2933    0.9798 C   0  0  0

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+   -3.2437    0.5879   -0.6122 C   0  0  0

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+ 28 65  1  0

+ 28 66  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1928-43-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 43                          1 V2000

+    2.4131   -0.2786    0.0042 C   0  0  0

+    3.6000   -0.9991    0.0010 C   0  0  0

+    2.4414    1.1008   -0.1335 C   0  0  0

+    1.2246   -0.9252    0.1365 O   0  0  0

+    4.8067   -0.3399   -0.1393 C   0  0  0

+    3.5683   -2.7263    0.1726 Cl  0  0  0

+    3.6501    1.7560   -0.2736 C   0  0  0

+    0.2044    0.0748    0.1032 C   0  0  0

+    4.8318    1.0369   -0.2766 C   0  0  0

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+    6.3486    1.8628   -0.4527 Cl  0  0  0

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+ 21 42  1  0

+ 21 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129927-33-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 67                          1 V2000

+   -1.8184    2.4716   -0.5785 C   0  0  0

+   -3.0870    3.0980   -0.0595 C   0  0  0

+   -0.8826    2.1688    0.5935 C   0  0  0

+   -2.1495    1.1910   -1.3007 C   0  0  0

+   -1.1755    3.3746   -1.4803 O   0  0  0

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+   -4.7536   -3.7096    1.3200 C   0  0  0

+   -4.9606   -5.0030    0.6551 N   0  0  0

+   -5.5979   -5.8869    1.6403 C   0  0  0

+   -5.9471   -4.7772   -0.4098 C   0  0  0

+   -4.6930   -7.0920    1.9048 C   0  0  0

+   -5.4513   -5.4168   -1.7082 C   0  0  0

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+   -6.0084   -3.9000    0.0000 H   0  0  0

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+   -4.9126   -6.1118    0.0000 H   0  0  0

+   -4.7563   -4.8781    0.0000 H   0  0  0

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+ 28 63  1  0

+ 28 64  1  0

+ 28 65  1  0

+ 29 66  1  0

+ 29 67  1  0

+ 30 68  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4513-36-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+   -0.2616   -0.2836    0.0000 O   0  0  0

+   -1.5417    0.1388    0.0000 C   0  0  0

+    0.8219    0.6831    0.0000 C   0  0  0

+   -2.6382   -0.8395    0.0000 C   0  0  0

+   -1.7890    1.3287    0.0000 O   0  0  0

+    2.1627   -0.0538    0.0000 C   0  0  0

+   -3.9020   -0.4225    0.0000 C   0  0  0

+    3.3044    0.9648    0.0000 C   0  0  0

+    2.2623   -0.9315    1.2493 C   0  0  0

+    2.2623   -0.9315   -1.2492 C   0  0  0

+    1.4059    1.5084    0.0000 H   0  0  0

+    0.0679    1.3566    0.0000 H   0  0  0

+   -2.4325   -1.8293    0.0000 H   0  0  0

+   -4.1077    0.5673    0.0000 H   0  0  0

+   -4.6564   -1.0956    0.0000 H   0  0  0

+    3.9775    0.2104    0.0000 H   0  0  0

+    4.0588    1.6379    0.0000 H   0  0  0

+    2.6313    1.7192    0.0000 H   0  0  0

+    1.2578   -1.0455    0.0000 H   0  0  0

+    2.3763   -1.9360    0.0000 H   0  0  0

+    3.2668   -0.8175    0.0000 H   0  0  0

+    1.2578   -1.0455    0.0000 H   0  0  0

+    2.3763   -1.9360    0.0000 H   0  0  0

+    3.2668   -0.8175    0.0000 H   0  0  0

+  2  1  1  0

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+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+507-55-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.1350   -0.3824    0.0396 C   0  0  0

+   -1.1654    0.3824   -0.2151 C   0  0  0

+    1.3247    0.4749   -0.3970 C   0  0  0

+    0.2455   -0.6734    1.4035 F   0  0  0

+    0.1259   -1.5746   -0.6924 F   0  0  0

+   -1.1562    1.5746    0.5169 F   0  0  0

+   -1.2759    0.6734   -1.5790 F   0  0  0

+   -2.5674   -0.6279    0.2994 Cl  0  0  0

+    1.3339    1.6671    0.3351 F   0  0  0

+    2.8572   -0.4264   -0.0969 Cl  0  0  0

+    0.5304    0.8855    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5042-54-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    0.9818   -0.3097    0.0048 C   0  0  0

+    1.8433   -1.4220    0.0031 C   0  0  0

+    1.5180    0.9831    0.0028 C   0  0  0

+   -0.3674   -0.4901    0.0027 N   0  0  0

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+    1.3212   -2.7114    0.0046 N   0  0  0

+    2.8713    1.1632   -0.0008 C   0  0  0

+   -1.1547    0.5317    0.0043 N   0  0  0

+    3.7291    0.0647   -0.0026 C   0  0  0

+    3.4411    2.5584   -0.0030 C   0  0  0

+   -2.5101    0.3505    0.0022 C   0  0  0

+    5.1075    0.2615   -0.0058 N   0  0  0

+   -3.3659    1.4548    0.0040 C   0  0  0

+   -3.0459   -0.9403   -0.0074 C   0  0  0

+   -4.7321    1.2642    0.0019 C   0  0  0

+   -4.4136   -1.1153   -0.0094 C   0  0  0

+   -5.2554   -0.0166   -0.0019 C   0  0  0

+    0.8842    1.8082    0.0000 H   0  0  0

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+   -2.4143   -1.7671    0.0000 H   0  0  0

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+   -4.8139   -2.0757    0.0000 H   0  0  0

+   -6.2867   -0.1545    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+396-01-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.6741    0.8713    0.0353 C   0  0  0

+   -1.2399   -0.4761   -0.0277 C   0  0  0

+   -0.7730    1.8573    0.0847 N   0  0  0

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+    0.0611   -0.7603   -0.0378 N   0  0  0

+   -2.2243   -1.4963   -0.0785 C   0  0  0

+    0.5156    1.5670    0.0743 C   0  0  0

+   -3.8635    0.1356    0.0053 C   0  0  0

+    0.9453    0.2201    0.0113 C   0  0  0

+   -3.5009   -1.1415   -0.0646 N   0  0  0

+   -1.8616   -2.8248   -0.1412 N   0  0  0

+    1.4497    2.5847    0.1248 N   0  0  0

+   -5.2111    0.4417    0.0224 N   0  0  0

+    2.3937   -0.0920    0.0003 C   0  0  0

+    3.0143   -0.5754    1.1515 C   0  0  0

+    3.1406    0.0913   -1.1633 C   0  0  0

+    4.3637   -0.8643    1.1351 C   0  0  0

+    4.4889   -0.2010   -1.1674 C   0  0  0

+    5.1004   -0.6751   -0.0202 C   0  0  0

+   -2.5666   -3.5365    0.0000 H   0  0  0

+   -0.8927   -3.0795    0.0000 H   0  0  0

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+   -5.8917   -0.2934    0.0000 H   0  0  0

+    2.5909   -1.4833    0.0000 H   0  0  0

+    3.1270    1.0930    0.0000 H   0  0  0

+    4.3840   -1.8659    0.0000 H   0  0  0

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+    6.0814   -0.8781    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120-61-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -1.3870    0.1721   -0.0006 C   0  0  0

+   -2.8664    0.1721   -0.0006 C   0  0  0

+   -0.6889    1.3812    0.0004 C   0  0  0

+   -0.6892   -1.0367    0.0043 C   0  0  0

+   -3.5399   -0.9943   -0.0016 O   0  0  0

+   -3.4736    1.2238    0.0002 O   0  0  0

+    0.6889    1.3812    0.0004 C   0  0  0

+    0.6891   -1.0367    0.0043 C   0  0  0

+   -4.9919   -0.9943   -0.0016 C   0  0  0

+    1.3870    0.1721   -0.0006 C   0  0  0

+    2.8664    0.1721   -0.0006 C   0  0  0

+    3.5399   -0.9943   -0.0016 O   0  0  0

+    3.4736    1.2238    0.0002 O   0  0  0

+    4.9919   -0.9943   -0.0016 C   0  0  0

+   -1.2123    2.2878    0.0000 H   0  0  0

+   -1.2126   -1.9433    0.0000 H   0  0  0

+    1.2123    2.2878    0.0000 H   0  0  0

+    1.2125   -1.9433    0.0000 H   0  0  0

+   -4.9919    0.0525    0.0000 H   0  0  0

+   -6.0387   -0.9943    0.0000 H   0  0  0

+   -4.9919   -2.0411    0.0000 H   0  0  0

+    4.9919   -2.0411    0.0000 H   0  0  0

+    6.0387   -0.9943    0.0000 H   0  0  0

+    4.9919    0.0525    0.0000 H   0  0  0

+  1  2  1  0

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+  9 20  1  0

+  9 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+952-23-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -2.4952    1.1214   -0.4350 C   0  0  0

+   -3.1262    0.0016    0.2711 C   0  0  0

+   -1.1754    1.0033   -0.8758 C   0  0  0

+   -3.2334    2.3036   -0.6517 C   0  0  0

+   -2.4552   -1.1247    0.4959 N   0  0  0

+   -4.4579    0.1458    0.7059 C   0  0  0

+   -0.5048   -0.1953   -0.6204 C   0  0  0

+   -4.5114    2.3900   -0.2067 C   0  0  0

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+   -5.1279    1.3218    0.4603 C   0  0  0

+    0.8289   -0.3873   -1.0357 C   0  0  0

+   -0.4991   -2.4728    0.3371 C   0  0  0

+   -6.4449    1.4581    0.8924 N   0  0  0

+    1.4529   -1.5627   -0.7732 C   0  0  0

+    0.8019   -2.6005   -0.0922 C   0  0  0

+    1.4866   -3.7881    0.1539 N   0  0  0

+   10.8047    1.4351    0.3475 Cl  0  0  0

+   -0.6352    1.8370    0.0000 H   0  0  0

+   -2.7226    3.1556    0.0000 H   0  0  0

+   -5.0026   -0.6849    0.0000 H   0  0  0

+   -4.9789    3.2666    0.0000 H   0  0  0

+    1.4003    0.4253    0.0000 H   0  0  0

+   -1.0357   -3.3088    0.0000 H   0  0  0

+   -6.8504    2.3650    0.0000 H   0  0  0

+   -7.0275    0.6535    0.0000 H   0  0  0

+    2.4457   -1.5986    0.0000 H   0  0  0

+    0.9894   -4.6481    0.0000 H   0  0  0

+    2.4800   -3.7887    0.0000 H   0  0  0

+   11.7981    1.4351    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3807-77-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    0.9650    0.1339    0.0142 C   0  0  0

+   -0.3632    0.5480    0.0303 C   0  0  0

+    1.8942    1.1670    0.0770 C   0  0  0

+    1.3379   -1.2198   -0.0652 C   0  0  0

+   -1.3306   -0.4077   -0.0286 C   0  0  0

+   -0.3650    2.0550    0.1150 C   0  0  0

+    1.1241    2.4632    0.1459 C   0  0  0

+    3.2156    0.8387    0.0653 C   0  0  0

+    0.3140   -2.1794   -0.1298 C   0  0  0

+    2.7090   -1.5228   -0.0751 C   0  0  0

+   -0.9842   -1.7592   -0.1020 C   0  0  0

+   -2.7571   -0.0132   -0.0143 N   0  3  0

+    3.6097   -0.4991   -0.0077 C   0  0  0

+   -3.5441   -0.5999    0.7067 O   0  0  0

+   -3.1440    0.8983   -0.7236 O   0  5  0

+   -0.5510    3.0843    0.0000 H   0  0  0

+   -1.4067    1.9610    0.0000 H   0  0  0

+    2.0675    2.9149    0.0000 H   0  0  0

+    0.7585    3.4432    0.0000 H   0  0  0

+    3.9392    1.5940    0.0000 H   0  0  0

+    0.5422   -3.2002    0.0000 H   0  0  0

+    3.0339   -2.5170    0.0000 H   0  0  0

+   -1.7464   -2.4755    0.0000 H   0  0  0

+    4.6310   -0.7249    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  8 13  2  0

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+  6  7  1  0

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+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+612-59-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -3.2243    0.3631   -0.0005 Cl  0  0  0

+   -1.5329   -0.0277   -0.0013 C   0  0  0

+   -0.5997    0.9709    0.0004 C   0  0  0

+   -1.1242   -1.3611    0.0021 C   0  0  0

+    0.7604    0.6087    0.0002 C   0  0  0

+    0.1436   -1.6935    0.0021 N   0  0  0

+    1.1058   -0.7654   -0.0018 C   0  0  0

+    1.7752    1.5795    0.0014 C   0  0  0

+    2.4640   -1.1285   -0.0021 C   0  0  0

+    3.0795    1.1893    0.0006 C   0  0  0

+    3.4215   -0.1617   -0.0004 C   0  0  0

+   -0.8881    1.9759    0.0000 H   0  0  0

+   -1.8482   -2.1154    0.0000 H   0  0  0

+    1.5304    2.5960    0.0000 H   0  0  0

+    2.7373   -2.1377    0.0000 H   0  0  0

+    3.8345    1.9127    0.0000 H   0  0  0

+    4.4302   -0.4369    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

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+  5  3  1  0

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+  7  5  2  0

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+ 10  8  2  0

+ 11  9  2  0

+  6  7  1  0

+ 10 11  1  0

+  3 12  1  0

+  4 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13675-34-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 36                          1 V2000

+   -3.6840   -0.2556    0.0000 O   0  0  0

+   -4.9083    0.3085    0.0000 C   0  0  0

+   -2.4984    0.5827    0.0000 C   0  0  0

+   -6.1082   -0.5399    0.0000 C   0  0  0

+   -5.0198    1.5187    0.0000 O   0  0  0

+   -1.2492   -0.3007    0.0000 C   0  0  0

+   -5.9699   -2.0406    0.0000 C   0  0  0

+   -7.3169    0.0170    0.0000 C   0  0  0

+    0.0000    0.5826    0.0000 C   0  0  0

+    1.2492   -0.3008    0.0000 C   0  0  0

+    2.4985    0.5826    0.0000 C   0  0  0

+    3.6840   -0.2558    0.0000 O   0  0  0

+    4.9083    0.3082    0.0000 C   0  0  0

+    6.1081   -0.5403    0.0000 C   0  0  0

+    5.0199    1.5184    0.0000 O   0  0  0

+    5.9698   -2.0409    0.0000 C   0  0  0

+    7.3169    0.0166    0.0000 C   0  0  0

+   -1.7688    1.4000    0.0000 H   0  0  0

+   -3.2280    1.4000    0.0000 H   0  0  0

+   -1.9788   -1.1180    0.0000 H   0  0  0

+   -0.5196   -1.1180    0.0000 H   0  0  0

+   -7.0609   -2.1411    0.0000 H   0  0  0

+   -5.8694   -3.1316    0.0000 H   0  0  0

+   -4.8789   -1.9401    0.0000 H   0  0  0

+   -7.4174    1.1080    0.0000 H   0  0  0

+   -8.2115   -0.6155    0.0000 H   0  0  0

+    0.7296    1.3999    0.0000 H   0  0  0

+   -0.7296    1.3999    0.0000 H   0  0  0

+    0.5196   -1.1181    0.0000 H   0  0  0

+    1.9788   -1.1181    0.0000 H   0  0  0

+    3.2281    1.3999    0.0000 H   0  0  0

+    1.7689    1.3999    0.0000 H   0  0  0

+    4.8788   -1.9404    0.0000 H   0  0  0

+    5.8693   -3.1319    0.0000 H   0  0  0

+    7.0608   -2.1414    0.0000 H   0  0  0

+    8.2114   -0.6159    0.0000 H   0  0  0

+    7.4174    1.1076    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 33  1  0

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+ 17 36  1  0

+ 17 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71628-96-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 75                          1 V2000

+   -0.9770   -0.0185   -0.4594 C   0  0  0

+   -2.3046   -0.3945   -0.7088 C   0  0  0

+   -0.6530    1.3398   -0.2801 C   0  0  0

+    0.0777   -1.0449   -0.3914 C   0  0  0

+   -3.2909    0.5841   -0.7678 C   0  0  0

+   -2.5800   -1.7023   -0.9029 O   0  0  0

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+   -1.6594    2.3055   -0.3519 C   0  0  0

+    1.4768   -0.6448   -0.1330 C   0  0  0

+   -0.2021   -2.2178   -0.5469 O   0  0  0

+   -4.7308    0.1980   -1.0161 C   0  0  0

+   -2.9741    1.9146   -0.5965 C   0  0  0

+   -3.9575   -1.9587   -0.7962 C   0  0  0

+    1.7981    0.7129    0.0501 C   0  0  0

+    1.0206    2.9119    0.1385 O   0  0  0

+   -1.3585    3.6172   -0.1840 O   0  0  0

+    2.4822   -1.5990   -0.0683 C   0  0  0

+   -4.7655   -1.1101   -1.5875 O   0  0  0

+   -5.4490    0.1629    0.3420 C   0  0  0

+   -5.3927    1.2044   -1.9595 C   0  0  0

+   -4.4511   -2.0974    0.6309 C   0  0  0

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+   -4.6173   -0.7211    1.2823 C   0  0  0

+   -5.5243    1.4866    0.8754 O   0  0  0

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+    4.1228    0.0989    0.3543 C   0  0  0

+    3.4453    2.3814    0.4611 O   0  0  0

+    4.8328   -2.3246    0.2347 C   0  0  0

+   -3.2958   -0.1125    1.4851 N   0  0  0

+    5.5335    0.5644    0.6078 C   0  0  0

+    6.2388   -1.7532    0.0665 C   0  0  0

+   -3.4635    0.9305    2.5058 C   0  0  0

+   -2.4401   -1.1492    2.0776 C   0  0  0

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+ 38 67  1  0

+ 39 68  1  0

+ 39 69  1  0

+ 39 70  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4629-58-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+   -0.5355    0.5740   -0.0017 C   0  0  0

+   -1.3518   -0.4925   -0.0018 C   0  0  0

+    0.9258    0.3835   -0.0017 C   0  0  0

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+    1.7781    1.4907   -0.0016 C   0  0  0

+    1.4659   -0.9055    0.0042 C   0  0  0

+   -3.6637   -1.4110   -0.0020 C   0  0  0

+   -3.3512    0.9883    0.0040 C   0  0  0

+    3.1449    1.3046   -0.0010 C   0  0  0

+    2.8343   -1.0760    0.0047 C   0  0  0

+   -5.0292   -1.2288   -0.0016 C   0  0  0

+   -4.7173    1.1622    0.0044 C   0  0  0

+    3.6723    0.0255   -0.0006 C   0  0  0

+   -5.5611    0.0562   -0.0010 C   0  0  0

+    5.1404   -0.1659   -0.0005 N   0  3  0

+   -6.9443    0.2365   -0.0006 N   0  0  0

+    5.6079   -1.2906   -0.0001 O   0  0  0

+    5.8806    0.8014   -0.0008 O   0  5  0

+   -0.9359    1.5372    0.0000 H   0  0  0

+   -0.9514   -1.4557    0.0000 H   0  0  0

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+    3.2388   -2.0374    0.0000 H   0  0  0

+   -5.6650   -2.0557    0.0000 H   0  0  0

+   -5.1199    2.1244    0.0000 H   0  0  0

+   -7.3447    1.1996    0.0000 H   0  0  0

+   -7.5782   -0.5918    0.0000 H   0  0  0

+  2  1  2  0

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+ 11 27  1  0

+ 12 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142438-73-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+    0.6880    0.2063    0.1457 C   0  0  0

+   -0.4662   -0.7395   -0.1923 C   0  0  0

+    0.0030   -0.5522    1.1444 O   0  0  0

+    2.0822   -0.2247   -0.2302 C   0  0  0

+    0.4222    1.6885    0.0845 C   0  0  0

+   -1.8116   -0.1162   -0.5696 C   0  0  0

+   -0.1264   -2.0580   -0.8902 C   0  0  0

+    2.8513   -0.8640    0.6651 O   0  0  0

+    2.5077    0.0051   -1.3374 O   0  0  0

+    0.6311    2.4561    1.1724 N   0  0  0

+    0.0203    2.1905   -0.9438 O   0  0  0

+   -2.9430   -1.0667   -0.1732 C   0  0  0

+   -1.9704    1.1263    0.1181 O   0  0  0

+    4.1454   -1.3888    0.2671 C   0  0  0

+   -2.9976   -1.1870    1.3511 C   0  0  0

+   -4.2746   -0.5178   -0.6894 C   0  0  0

+   -2.7247    0.2406    0.0000 H   0  0  0

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+   -2.1620   -1.6592    0.0000 H   0  0  0

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+    3.7770   -2.2973    0.0000 H   0  0  0

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+   -5.1809   -0.1442    0.0000 H   0  0  0

+   -4.6482   -1.4241    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+500-38-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 45                          1 V2000

+    0.7371   -1.7357    0.3469 C   0  0  0

+   -0.7544   -1.8062    0.0129 C   0  0  0

+    1.0521   -0.3841    0.9909 C   0  0  0

+    1.0953   -2.8604    1.3204 C   0  0  0

+   -1.1126   -0.6815   -0.9606 C   0  0  0

+   -1.0694   -3.1578   -0.6312 C   0  0  0

+    2.4740    0.0032    0.6759 C   0  0  0

+   -2.5164   -0.2073   -0.6856 C   0  0  0

+    2.8047    0.4402   -0.5933 C   0  0  0

+    3.4437   -0.0740    1.6583 C   0  0  0

+   -2.7588    0.6577    0.3651 C   0  0  0

+   -3.5581   -0.6339   -1.4883 C   0  0  0

+    4.1116    0.7971   -0.8845 C   0  0  0

+    4.7494    0.2806    1.3744 C   0  0  0

+   -4.0489    1.0949    0.6190 C   0  0  0

+   -4.8476   -0.2014   -1.2404 C   0  0  0

+    5.0886    0.7145    0.1029 C   0  0  0

+    4.4386    1.2268   -2.1326 O   0  0  0

+   -5.0982    0.6615   -0.1856 C   0  0  0

+   -4.2891    1.9455    1.6526 O   0  0  0

+    6.3726    1.0636   -0.1781 O   0  0  0

+   -6.3661    1.0878    0.0596 O   0  0  0

+    1.6217   -1.7006    0.0000 H   0  0  0

+   -1.6390   -1.8413    0.0000 H   0  0  0

+    0.9629    0.4967    0.0000 H   0  0  0

+    0.1686   -0.3275    0.0000 H   0  0  0

+    0.2518   -3.1291    0.0000 H   0  0  0

+    1.3640   -3.7039    0.0000 H   0  0  0

+    1.9388   -2.5917    0.0000 H   0  0  0

+   -0.2315   -0.5958    0.0000 H   0  0  0

+   -1.0115    0.1980    0.0000 H   0  0  0

+   -1.9316   -2.9569    0.0000 H   0  0  0

+   -1.2703   -4.0200    0.0000 H   0  0  0

+   -0.2072   -3.3587    0.0000 H   0  0  0

+    2.3087    1.1734    0.0000 H   0  0  0

+    3.5258   -0.9555    0.0000 H   0  0  0

+   -2.1163    1.2667    0.0000 H   0  0  0

+   -3.5293   -1.5187    0.0000 H   0  0  0

+    5.2392   -0.4569    0.0000 H   0  0  0

+   -5.4863   -0.8144    0.0000 H   0  0  0

+    4.9747    1.9313    0.0000 H   0  0  0

+   -4.5297    2.7975    0.0000 H   0  0  0

+    7.2269    1.2959    0.0000 H   0  0  0

+   -7.2052    1.3699    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  7  9  2  0

+  7 10  1  0

+  8 11  2  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  2  0

+ 11 15  1  0

+ 12 16  2  0

+ 13 17  2  0

+ 13 18  1  0

+ 15 19  2  0

+ 15 20  1  0

+ 17 21  1  0

+ 19 22  1  0

+ 14 17  1  0

+ 16 19  1  0

+  1 23  1  0

+  2 24  1  0

+  3 25  1  0

+  3 26  1  0

+  4 27  1  0

+  4 28  1  0

+  4 29  1  0

+  5 30  1  0

+  5 31  1  0

+  6 32  1  0

+  6 33  1  0

+  6 34  1  0

+  9 35  1  0

+ 10 36  1  0

+ 11 37  1  0

+ 12 38  1  0

+ 14 39  1  0

+ 16 40  1  0

+ 18 41  1  0

+ 20 42  1  0

+ 21 43  1  0

+ 22 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97-24-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    1.0725    1.0682   -0.2141 C   0  0  0

+   -0.2851    2.0348    0.3580 S   0  0  0

+    1.1937    0.7670   -1.5695 C   0  0  0

+    2.0271    0.6096    0.6830 C   0  0  0

+   -1.5577    0.8162    0.3395 C   0  0  0

+    2.2628    0.0074   -2.0140 C   0  0  0

+    0.2636    1.2178   -2.4537 O   0  0  0

+    3.0918   -0.1484    0.2311 C   0  0  0

+   -2.8816    1.1850    0.5710 C   0  0  0

+   -1.2450   -0.5127    0.0888 C   0  0  0

+    3.2078   -0.4510   -1.1143 C   0  0  0

+    4.2853   -0.7216    1.3538 Cl  0  0  0

+   -3.8780    0.2234    0.5549 C   0  0  0

+   -3.1943    2.4865    0.8125 O   0  0  0

+   -2.2458   -1.4668    0.0745 C   0  0  0

+   -3.5592   -1.0998    0.3097 C   0  0  0

+   -1.8538   -3.1286   -0.2392 Cl  0  0  0

+    2.5417    1.4814    0.0000 H   0  0  0

+    1.7469   -0.8637    0.0000 H   0  0  0

+   -0.6474    1.6593    0.0000 H   0  0  0

+   -0.2747   -0.8013    0.0000 H   0  0  0

+    3.8924   -1.1968    0.0000 H   0  0  0

+   -4.8500    0.5064    0.0000 H   0  0  0

+   -3.4308    3.4708    0.0000 H   0  0  0

+   -4.2878   -1.8026    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+  9 13  1  0

+  9 14  1  0

+ 10 15  2  0

+ 13 16  2  0

+ 15 17  1  0

+  8 11  1  0

+ 15 16  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5634-39-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.7932    1.4257    0.5698 C   0  0  0

+    1.6181    0.2805    0.8216 O   0  0  0

+    0.8167    1.7127   -0.8386 O   0  0  0

+   -0.6425    1.1258    1.0053 C   0  0  0

+    2.1706   -0.1361   -0.4435 C   0  0  0

+    2.0602    1.1418   -1.3120 C   0  0  0

+   -1.5228    2.3480    0.7366 C   0  0  0

+   -1.3962   -0.5647   -0.1120 I   0  0  0

+    3.6448   -0.5024   -0.2603 C   0  0  0

+    3.7567   -1.5699    0.6831 O   0  0  0

+    1.7975    1.7050    0.0000 H   0  0  0

+    0.0119    0.3144    0.0000 H   0  0  0

+    1.7221   -1.0770    0.0000 H   0  0  0

+    3.0987    1.0523    0.0000 H   0  0  0

+    2.3264    2.1496    0.0000 H   0  0  0

+   -0.6770    2.9572    0.0000 H   0  0  0

+   -2.1320    3.1938    0.0000 H   0  0  0

+   -2.3686    1.7388    0.0000 H   0  0  0

+    4.6871   -0.5144    0.0000 H   0  0  0

+    3.7774    0.5315    0.0000 H   0  0  0

+    3.8654   -2.6066    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

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+  1 11  1  0

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+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93-68-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+   -1.3210    0.1827    0.3757 C   0  0  0

+   -2.3296    0.9444   -0.1991 C   0  0  0

+   -0.0841    0.7660    0.6720 N   0  0  0

+   -1.5443   -1.1581    0.6613 C   0  0  0

+   -3.5495    0.3655   -0.4904 C   0  0  0

+   -2.0939    2.4012   -0.5044 C   0  0  0

+    1.0514    0.2147    0.1997 C   0  0  0

+   -2.7680   -1.7294    0.3729 C   0  0  0

+   -3.7667   -0.9709   -0.2102 C   0  0  0

+    2.3890    0.7628    0.6256 C   0  0  0

+    0.9967   -0.7226   -0.5682 O   0  0  0

+    3.4890   -0.0240   -0.0392 C   0  0  0

+    4.9309    0.3269    0.2231 C   0  0  0

+    3.2150   -0.9357   -0.7822 O   0  0  0

+   -0.0784    1.7796    0.0000 H   0  0  0

+   -0.7371   -1.7711    0.0000 H   0  0  0

+   -4.3598    0.9744    0.0000 H   0  0  0

+   -1.0933    2.2393    0.0000 H   0  0  0

+   -1.9320    3.4018    0.0000 H   0  0  0

+   -3.0945    2.5631    0.0000 H   0  0  0

+   -2.8756   -2.7373    0.0000 H   0  0  0

+   -4.7080   -1.3469    0.0000 H   0  0  0

+    3.1217    1.4632    0.0000 H   0  0  0

+    1.8370    1.6129    0.0000 H   0  0  0

+    5.1706   -0.6579    0.0000 H   0  0  0

+    5.9158    0.5666    0.0000 H   0  0  0

+    4.6912    1.3117    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

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+  8  9  1  0

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+  6 20  1  0

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+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109-99-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -1.1100    0.7725    0.0737 C   0  0  0

+   -1.1099   -0.7726    0.0737 C   0  0  0

+    0.3604    1.1479   -0.2153 C   0  0  0

+    0.3604   -1.1479   -0.2153 C   0  0  0

+    1.1253    0.0000    0.2126 O   0  0  0

+   -1.2988    1.8948    0.0000 H   0  0  0

+   -2.2441    0.6777    0.0000 H   0  0  0

+   -2.2440   -0.6779    0.0000 H   0  0  0

+   -1.2986   -1.8949    0.0000 H   0  0  0

+    1.3724    1.6686    0.0000 H   0  0  0

+   -0.0433    2.2120    0.0000 H   0  0  0

+   -0.0432   -2.2120    0.0000 H   0  0  0

+    1.3724   -1.6686    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88133-11-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+    0.4921    0.2579   -0.4116 C   0  0  0

+    0.3925   -1.0616   -0.0087 C   0  0  0

+    1.7503    0.8824   -0.3534 C   0  0  0

+   -0.7183    1.0065   -0.9072 C   0  0  0

+   -0.9176   -1.7528   -0.0566 C   0  0  0

+    1.4803   -1.7171    0.4253 N   0  0  0

+    2.8232    0.1590    0.0992 N   0  0  0

+    2.1878    2.0965   -0.6536 N   0  0  0

+   -1.3056    1.8392    0.2341 C   0  0  0

+   -1.3379   -2.3752   -1.2312 C   0  0  0

+   -1.7322   -1.7881    1.0747 C   0  0  0

+    2.6575   -1.1377    0.4813 C   0  0  0

+    3.9238    1.0236    0.0475 N   0  0  0

+    3.4908    2.1735   -0.4108 C   0  0  0

+   -2.4533    2.5491   -0.2359 O   0  0  0

+   -2.5587   -3.0177   -1.2697 C   0  0  0

+   -2.9506   -2.4336    1.0241 C   0  0  0

+    3.7416   -1.8527    0.9335 N   0  0  0

+   -2.9535    3.3037    0.8697 C   0  0  0

+   -3.3647   -3.0449   -0.1460 C   0  0  0

+   -4.1898    4.0915    0.4318 C   0  0  0

+   -1.6726    0.7882    0.0000 H   0  0  0

+   -0.8786    0.0408    0.0000 H   0  0  0

+   -0.3513    2.0575    0.0000 H   0  0  0

+   -1.1453    2.8049    0.0000 H   0  0  0

+   -0.6846   -3.1043    0.0000 H   0  0  0

+   -1.9888   -0.8434    0.0000 H   0  0  0

+    4.0239    2.9946    0.0000 H   0  0  0

+   -2.3079   -3.9640    0.0000 H   0  0  0

+   -3.6044   -1.7050    0.0000 H   0  0  0

+    3.6834   -2.8299    0.0000 H   0  0  0

+    4.6170   -1.4145    0.0000 H   0  0  0

+   -1.9943    3.4993    0.0000 H   0  0  0

+   -2.7752    4.2663    0.0000 H   0  0  0

+   -4.2217   -3.5182    0.0000 H   0  0  0

+   -3.6637    4.9171    0.0000 H   0  0  0

+   -5.0154    4.6176    0.0000 H   0  0  0

+   -4.7159    3.2659    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

+  3  8  2  0

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+ 16 20  2  0

+ 19 21  1  0

+  7 12  1  0

+ 13 14  2  0

+ 17 20  1  0

+  4 22  1  0

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+  9 24  1  0

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+ 11 27  1  0

+ 14 28  1  0

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+ 19 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103942-97-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 42                          1 V2000

+   -1.1362    0.5906    0.0034 C   0  0  0

+   -2.1637    1.6356   -0.0611 C   0  0  0

+    0.2709    1.0013    0.0236 C   0  0  0

+   -1.4803   -0.6882    0.0475 N   0  0  0

+   -3.4503    1.3049   -0.0808 N   0  0  0

+   -1.7567    2.9874   -0.1009 C   0  0  0

+    0.5670    2.3537   -0.0190 C   0  0  0

+    1.3478   -0.0037    0.0874 C   0  0  0

+   -2.7683   -1.0200    0.0328 C   0  0  0

+   -3.7980    0.0234   -0.0417 C   0  0  0

+   -0.4394    3.3121   -0.0798 C   0  0  0

+    2.6367    0.3899    0.1052 N   0  0  0

+    1.0731   -1.1877    0.1239 O   0  0  0

+   -3.1736   -2.3704    0.0785 C   0  0  0

+   -5.1554   -0.3645   -0.0614 C   0  0  0

+    3.7067   -0.6087    0.1686 C   0  0  0

+   -4.4968   -2.6741    0.0620 C   0  0  0

+   -5.4762   -1.6827   -0.0207 C   0  0  0

+    5.0638    0.0979    0.1767 C   0  0  0

+    6.1368   -0.9035    0.2403 N   0  0  0

+    6.0901   -1.6530   -1.0223 C   0  0  0

+    7.4055   -0.1630    0.2449 C   0  0  0

+   -2.4758    3.7439    0.0000 H   0  0  0

+    1.5650    2.6593    0.0000 H   0  0  0

+   -0.1714    4.3209    0.0000 H   0  0  0

+    2.8719    1.4068    0.0000 H   0  0  0

+   -2.4603   -3.1324    0.0000 H   0  0  0

+   -5.9079    0.3588    0.0000 H   0  0  0

+    2.9129   -1.2864    0.0000 H   0  0  0

+    4.2903   -1.4741    0.0000 H   0  0  0

+   -4.7882   -3.6763    0.0000 H   0  0  0

+   -6.4821   -1.9614    0.0000 H   0  0  0

+    5.8576    0.7756    0.0000 H   0  0  0

+    4.4802    0.9633    0.0000 H   0  0  0

+    5.0484   -1.5881    0.0000 H   0  0  0

+    6.0252   -2.6947    0.0000 H   0  0  0

+    7.1318   -1.7179    0.0000 H   0  0  0

+    7.9316   -1.0644    0.0000 H   0  0  0

+    8.3069    0.3631    0.0000 H   0  0  0

+    6.8794    0.7384    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  5 10  2  0

+  6 11  2  0

+  8 12  1  0

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+ 10 15  1  0

+ 12 16  1  0

+ 14 17  2  0

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+ 20 22  1  0

+  7 11  1  0

+  9 10  1  0

+ 17 18  1  0

+  6 23  1  0

+  7 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60-23-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    1.1414    0.5039    0.0000 C   0  0  0

+    0.1121   -0.6281    0.0000 C   0  0  0

+    2.4955   -0.0656    0.0000 N   0  0  0

+   -1.5601    0.0752    0.0000 S   0  0  0

+    1.7030    1.5046    0.0000 H   0  0  0

+    0.2106    1.1750    0.0000 H   0  0  0

+   -0.4495   -1.6288    0.0000 H   0  0  0

+    1.0429   -1.2992    0.0000 H   0  0  0

+    2.6391   -1.2041    0.0000 H   0  0  0

+    3.4096    0.6280    0.0000 H   0  0  0

+   -2.6178    0.5201    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119169-78-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 66 69                          1 V2000

+    0.9220   -1.6108   -0.6457 C   0  0  1

+   -0.3824   -1.2802    0.0579 C   0  0  1

+    1.8647   -0.3910   -0.4707 C   0  0  1

+    1.7477   -2.7358   -0.0117 C   0  0  0

+   -1.0145   -0.0798   -0.6710 C   0  0  1

+   -1.3344   -2.4745   -0.0711 C   0  0  0

+    3.2279   -0.9405   -0.8799 C   0  0  2

+    1.3031    0.7185   -1.3408 C   0  0  0

+    1.8938    0.0428    0.9962 C   0  0  0

+    3.1826   -2.4494   -0.5325 C   0  0  0

+   -2.2609    0.3496    0.1112 C   0  0  2

+   -0.0581    1.1073   -0.7468 C   0  0  0

+   -2.7309   -2.0820    0.3023 C   0  0  0

+    4.3046   -0.2699   -0.0663 C   0  0  0

+   -3.1488   -0.8301    0.3780 C   0  0  0

+   -2.9954    1.4433   -0.6497 C   0  0  0

+   -1.8118    0.9297    1.4538 C   0  0  0

+    4.8656    0.8747   -0.5041 N   0  0  0

+    4.6663   -0.7601    0.9824 O   0  0  0

+   -4.5556   -0.5576    0.7395 C   0  0  0

+   -4.3610    0.9955   -1.1481 C   0  0  0

+    5.9694    1.4822    0.2436 C   0  0  0

+   -5.1726    0.3877   -0.0303 C   0  0  0

+    5.4919    1.8486    1.6502 C   0  0  0

+    7.1277    0.4874    0.3412 C   0  0  0

+    6.4413    2.7451   -0.4799 C   0  0  0

+   -6.5140    0.7794    0.2098 C   0  0  0

+   -7.0931    1.7163   -0.5697 O   0  0  0

+   -7.1427    0.2708    1.1185 O   0  0  0

+    0.3575   -2.4486    0.0000 H   0  0  0

+    0.2427   -0.4866    0.0000 H   0  0  0

+    0.8553   -3.2092    0.0000 H   0  0  0

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+   -1.7343   -3.4022    0.0000 H   0  0  0

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+    0.3460    2.0331    0.0000 H   0  0  0

+   -0.9220    1.6309    0.0000 H   0  0  0

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+    4.1346    1.5719    0.0000 H   0  0  0

+   -5.1192   -1.3959    0.0000 H   0  0  0

+   -4.2621    2.0008    0.0000 H   0  0  0

+   -5.2411    1.4913    0.0000 H   0  0  0

+    6.1069    2.6500    0.0000 H   0  0  0

+    4.6905    2.4636    0.0000 H   0  0  0

+    4.8769    1.0472    0.0000 H   0  0  0

+    6.4695   -0.2789    0.0000 H   0  0  0

+    7.8940   -0.1708    0.0000 H   0  0  0

+    7.7859    1.2537    0.0000 H   0  0  0

+    7.3876    2.3915    0.0000 H   0  0  0

+    6.7949    3.6914    0.0000 H   0  0  0

+    5.4950    3.0987    0.0000 H   0  0  0

+   -7.6242    2.5756    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 20 23  2  0

+ 22 24  1  0

+ 22 25  1  0

+ 22 26  1  0

+ 23 27  1  0

+ 27 28  1  0

+ 27 29  2  0

+  7 10  1  0

+  8 12  1  0

+ 13 15  2  0

+ 21 23  1  0

+  1 30  1  0

+  2 31  1  0

+  4 32  1  0

+  4 33  1  0

+  5 34  1  0

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+ 10 43  1  0

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+ 25 61  1  0

+ 25 62  1  0

+ 26 63  1  0

+ 26 64  1  0

+ 26 65  1  0

+ 28 66  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92-88-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.7418   -0.0002   -0.0018 C   0  0  0

+   -0.7418    0.0000   -0.0016 C   0  0  0

+    1.4401    1.1340   -0.4116 C   0  0  0

+    1.4401   -1.1330    0.4135 C   0  0  0

+   -1.4402   -1.1342   -0.4113 C   0  0  0

+   -1.4399    1.1328    0.4139 C   0  0  0

+    2.8194    1.1310   -0.4103 C   0  0  0

+    2.8190   -1.1300    0.4127 C   0  0  0

+   -2.8195   -1.1310   -0.4101 C   0  0  0

+   -2.8189    1.1300    0.4129 C   0  0  0

+    3.5119   -0.0003   -0.0012 C   0  0  0

+   -3.5119    0.0004   -0.0013 C   0  0  0

+    4.8708   -0.0005   -0.0014 O   0  0  0

+   -4.8708    0.0008   -0.0016 O   0  0  0

+    0.9538    2.0066    0.0000 H   0  0  0

+    0.9541   -2.0058    0.0000 H   0  0  0

+   -0.9540   -2.0069    0.0000 H   0  0  0

+   -0.9538    2.0055    0.0000 H   0  0  0

+    3.3087    2.0020    0.0000 H   0  0  0

+    3.3079   -2.0012    0.0000 H   0  0  0

+   -3.3089   -2.0019    0.0000 H   0  0  0

+   -3.3077    2.0012    0.0000 H   0  0  0

+    5.8698   -0.0006    0.0000 H   0  0  0

+   -5.8698    0.0011    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  9 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+  8 11  1  0

+ 10 12  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5742-19-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 36                          1 V2000

+   -5.1331   -0.2241    0.0524 C   0  0  0

+   -6.0627    0.7408   -0.3101 C   0  0  0

+   -3.8889    0.1594    0.5305 C   0  0  0

+   -5.4438   -1.5432   -0.0556 O   0  0  0

+   -5.7464    2.0816   -0.1940 C   0  0  0

+   -7.6212    0.2644   -0.9084 Cl  0  0  0

+   -3.5769    1.5003    0.6450 C   0  0  0

+   -4.2990   -2.2748    0.3873 C   0  0  0

+   -4.5046    2.4612    0.2832 C   0  0  0

+   -4.5794   -3.7524    0.2920 C   0  0  0

+   -4.1093    4.1454    0.4278 Cl  0  0  0

+   -3.6400   -4.6388    0.6577 O   0  0  0

+   -5.6498   -4.1393   -0.1135 O   0  0  0

+   11.7590    0.0474   -0.1155 N   0  0  0

+   10.7752    1.0686   -0.4993 C   0  0  0

+   12.9558    0.7653    0.3428 C   0  0  0

+    9.4965    0.3861   -0.9893 C   0  0  0

+   14.0273   -0.2439    0.7603 C   0  0  0

+    8.9582   -0.4245    0.0571 O   0  0  0

+   14.3653   -1.0691   -0.3563 O   0  0  0

+   -3.1435   -0.5353    0.0000 H   0  0  0

+   -6.4899    2.7783    0.0000 H   0  0  0

+   -2.5948    1.7717    0.0000 H   0  0  0

+   -3.3300   -2.5901    0.0000 H   0  0  0

+   -3.8635   -1.3536    0.0000 H   0  0  0

+   -2.8989   -5.3381    0.0000 H   0  0  0

+   11.6250   -0.9627    0.0000 H   0  0  0

+   11.5710    1.7050    0.0000 H   0  0  0

+   10.2147    1.9196    0.0000 H   0  0  0

+   13.7194    1.4400    0.0000 H   0  0  0

+   12.3539    1.5875    0.0000 H   0  0  0

+    9.3629    1.3963    0.0000 H   0  0  0

+    8.5038    0.6158    0.0000 H   0  0  0

+   15.0462   -0.2364    0.0000 H   0  0  0

+   14.3996    0.7046    0.0000 H   0  0  0

+    8.3945   -1.2733    0.0000 H   0  0  0

+   14.7515   -2.0120    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 10 13  2  0

+ 14 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+ 18 20  1  0

+  7  9  1  0

+  3 21  1  0

+  5 22  1  0

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+ 12 26  1  0

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+ 15 29  1  0

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+ 17 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-38-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -2.7659   -0.0001    0.0017 C   0  0  0

+   -2.0750   -1.1972    0.0013 C   0  0  0

+   -2.0748    1.1974    0.0014 C   0  0  0

+   -4.2729   -0.0001   -0.0037 C   0  0  0

+   -0.6926   -1.1977    0.0005 C   0  0  0

+   -0.6928    1.1979    0.0006 C   0  0  0

+   -0.0009   -0.0001    0.0002 C   0  0  0

+    1.8901    0.0000   -0.0003 Br  0  0  0

+   -2.5938   -2.0952    0.0000 H   0  0  0

+   -2.5936    2.0954    0.0000 H   0  0  0

+   -4.2729    1.0370    0.0000 H   0  0  0

+   -5.3100   -0.0001    0.0000 H   0  0  0

+   -4.2729   -1.0372    0.0000 H   0  0  0

+   -0.1743   -2.0960    0.0000 H   0  0  0

+   -0.1745    2.0962    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  2  5  1  0

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+  7  8  1  0

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+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4985-70-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -2.7290   -1.8800    0.0004 Cl  0  0  0

+   -2.1746   -0.2349    0.0014 C   0  0  0

+   -0.7912    0.0493    0.0007 C   0  0  0

+   -3.0688    0.7885   -0.0030 C   0  0  0

+   -0.3601    1.4511    0.0011 C   0  0  0

+    0.1537   -0.9750    0.0003 C   0  0  0

+   -2.6577    2.1211   -0.0028 C   0  0  0

+    0.9974    1.7673    0.0009 C   0  0  0

+   -1.3436    2.4632    0.0020 C   0  0  0

+    1.5109   -0.6588    0.0001 C   0  0  0

+    1.9421    0.7431    0.0004 C   0  0  0

+    2.4950   -1.6709   -0.0007 C   0  0  0

+    3.3249    1.0273    0.0001 C   0  0  0

+    3.8084   -1.3280   -0.0013 C   0  0  0

+    4.2186    0.0057   -0.0005 C   0  0  0

+   -4.0919    0.5710    0.0000 H   0  0  0

+   -0.1538   -1.9747    0.0000 H   0  0  0

+   -3.3806    2.8770    0.0000 H   0  0  0

+    1.3049    2.7670    0.0000 H   0  0  0

+   -1.0621    3.4705    0.0000 H   0  0  0

+    2.2140   -2.6784    0.0000 H   0  0  0

+    3.6586    2.0186    0.0000 H   0  0  0

+    4.5319   -2.0833    0.0000 H   0  0  0

+    5.2415    0.2239    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  2  0

+  8  5  1  0

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+ 10  6  2  0

+ 11  8  2  0

+ 12 10  1  0

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+  7  9  1  0

+ 10 11  1  0

+ 14 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+482-27-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.0371   -2.6327    0.4172 O   0  0  0

+   -0.1479   -3.2473   -0.8681 C   0  0  0

+    0.2282   -1.3148    0.2016 C   0  0  0

+   -0.8149   -0.4109    0.0812 C   0  0  0

+    1.5471   -0.8783    0.1084 C   0  0  0

+   -0.5424    0.9558   -0.1418 C   0  0  0

+   -2.0982   -0.8304    0.1759 O   0  0  0

+    1.8216    0.4831   -0.1138 C   0  0  0

+    2.7339   -1.5156    0.1891 O   0  0  0

+    0.7809    1.4021   -0.2426 C   0  0  0

+   -1.6603    1.8919   -0.2661 C   0  0  0

+   -3.1256    0.0254    0.0624 C   0  0  0

+    3.2865    0.5871   -0.1565 C   0  0  0

+    3.7542   -0.6529    0.0331 C   0  0  0

+    1.0478    2.7156   -0.4571 O   0  0  0

+   -2.9235    1.4020   -0.1607 C   0  0  0

+   -4.2635   -0.3992    0.1546 O   0  0  0

+    1.2830    3.3038    0.8238 C   0  0  0

+   -1.1462   -3.0673    0.0000 H   0  0  0

+   -0.3279   -4.2456    0.0000 H   0  0  0

+    0.8504   -3.4273    0.0000 H   0  0  0

+   -1.4951    2.8927    0.0000 H   0  0  0

+    3.8336    1.4413    0.0000 H   0  0  0

+    4.7360   -0.9079    0.0000 H   0  0  0

+   -3.7165    2.0345    0.0000 H   0  0  0

+    2.2249    2.9272    0.0000 H   0  0  0

+    1.6596    4.2457    0.0000 H   0  0  0

+    0.3411    3.6804    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

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+  7  4  1  0

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+ 12  7  1  0

+ 13  8  1  0

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+ 17 12  2  0

+ 18 15  1  0

+  8 10  1  0

+ 13 14  2  0

+ 12 16  1  0

+  2 19  1  0

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+ 11 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86-73-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    0.7419   -0.4129   -0.0014 C   0  0  0

+   -0.7420   -0.4131   -0.0008 C   0  0  0

+    1.2055    0.8996   -0.0006 C   0  0  0

+    1.6608   -1.4641    0.0027 C   0  0  0

+   -1.2057    0.8998    0.0003 C   0  0  0

+   -1.6605   -1.4640   -0.0013 C   0  0  0

+   -0.0001    1.8074    0.0006 C   0  0  0

+    2.5600    1.1582   -0.0005 C   0  0  0

+    3.0137   -1.1961    0.0010 C   0  0  0

+   -2.5598    1.1582    0.0011 C   0  0  0

+   -3.0138   -1.1960   -0.0006 C   0  0  0

+    3.4649    0.1117   -0.0012 C   0  0  0

+   -3.4650    0.1114    0.0006 C   0  0  0

+    1.3260   -2.4465    0.0000 H   0  0  0

+   -1.3256   -2.4464    0.0000 H   0  0  0

+    0.6988    2.5747    0.0000 H   0  0  0

+   -0.6989    2.5748    0.0000 H   0  0  0

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+  1  2  1  0

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+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+ 10 13  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  2  0

+  4 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17924-92-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 46                          1 V2000

+    1.5122    1.0214    0.0699 C   0  0  0

+    1.5240   -0.3858   -0.0489 C   0  0  0

+    2.7116    1.7218    0.0744 C   0  0  0

+    0.2215    1.7239    0.1812 C   0  0  0

+    2.7469   -1.0606   -0.1653 C   0  0  0

+    0.2519   -1.1162   -0.0476 C   0  0  0

+    3.9152    1.0397   -0.0409 C   0  0  0

+    0.1580    3.0411    0.3018 C   0  0  0

+    3.9314   -0.3440   -0.1607 C   0  0  0

+    2.7699   -2.4118   -0.2819 O   0  0  0

+    0.2125   -2.4556   -0.1657 O   0  0  0

+   -0.7890   -0.4978    0.0622 O   0  0  0

+    5.0840    1.7296   -0.0368 O   0  0  0

+   -1.1910    3.7106    0.4092 C   0  0  0

+   -1.0740   -3.1349   -0.1495 C   0  0  2

+   -2.2359    2.8542   -0.3101 C   0  0  0

+   -2.0852   -2.2793    0.6176 C   0  0  0

+   -0.9256   -4.4917    0.5417 C   0  0  0

+   -2.8453    1.8532    0.6727 C   0  0  0

+   -2.8572   -1.3943   -0.3624 C   0  0  0

+   -3.7497    0.9014   -0.0661 C   0  0  0

+   -3.8654   -0.5352    0.4021 C   0  0  0

+   -4.3827    1.2896   -1.0185 O   0  0  0

+    2.7050    2.7426    0.0000 H   0  0  0

+   -0.6432    1.1814    0.0000 H   0  0  0

+    1.0123    3.5998    0.0000 H   0  0  0

+    4.8235   -0.8401    0.0000 H   0  0  0

+    2.7873   -3.4324    0.0000 H   0  0  0

+    5.9631    2.2485    0.0000 H   0  0  0

+   -0.6131    4.5520    0.0000 H   0  0  0

+   -1.9427    4.4012    0.0000 H   0  0  0

+   -1.9753   -3.6142    0.0000 H   0  0  0

+   -2.5135    3.8365    0.0000 H   0  0  0

+   -3.2473    2.9923    0.0000 H   0  0  0

+   -3.0757   -2.5260    0.0000 H   0  0  0

+   -2.3170   -3.2734    0.0000 H   0  0  0

+   -1.9403   -4.6027    0.0000 H   0  0  0

+   -0.8146   -5.5064    0.0000 H   0  0  0

+    0.0891   -4.3807    0.0000 H   0  0  0

+   -2.4873    0.8972    0.0000 H   0  0  0

+   -1.8290    1.7571    0.0000 H   0  0  0

+   -1.8664   -1.1487    0.0000 H   0  0  0

+   -2.6231   -0.4007    0.0000 H   0  0  0

+   -4.8439   -0.2445    0.0000 H   0  0  0

+   -4.3523   -1.4324    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+ 11 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+ 16 19  1  0

+ 17 20  1  0

+ 19 21  1  0

+ 20 22  1  0

+ 21 23  2  0

+  7  9  1  0

+ 21 22  1  0

+  3 24  1  0

+  4 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 18 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 20 42  1  0

+ 20 43  1  0

+ 22 44  1  0

+ 22 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-64-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.7651    0.7740    0.0019 C   0  0  0

+   -1.1695   -0.5482    0.0007 C   0  0  0

+    0.5804    1.0863    0.0015 C   0  0  0

+   -1.7935    1.8756   -0.0029 C   0  0  0

+   -0.2290   -1.5623   -0.0011 C   0  0  0

+   -2.6384   -0.8851    0.0011 C   0  0  0

+    1.5275    0.0704    0.0001 C   0  0  0

+    1.1177   -1.2571   -0.0015 C   0  0  0

+    2.8889    0.3827    0.0002 N   0  0  0

+    0.8844    2.0826    0.0000 H   0  0  0

+   -1.0321    2.5864    0.0000 H   0  0  0

+   -2.5043    2.6370    0.0000 H   0  0  0

+   -2.5549    1.1648    0.0000 H   0  0  0

+   -0.5369   -2.5574    0.0000 H   0  0  0

+   -2.8713    0.1302    0.0000 H   0  0  0

+   -3.6537   -1.1180    0.0000 H   0  0  0

+   -2.4055   -1.9004    0.0000 H   0  0  0

+    1.8255   -2.0213    0.0000 H   0  0  0

+    3.5983   -0.3801    0.0000 H   0  0  0

+    3.1948    1.3784    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6382-01-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 20                          1 V2000

+   -4.2319   -0.8716   -0.6228 C   0  0  1

+   -5.1488    0.0965    0.1274 C   0  0  0

+   -3.0794   -1.2626    0.2659 C   0  0  0

+   -4.9901   -2.0724   -0.9984 N   0  0  0

+   -6.3189    0.4936   -0.7749 C   0  0  0

+   -1.9492   -0.5386    0.2569 O   0  0  0

+   -3.1728   -2.2279    0.9866 O   0  0  0

+   -7.2220    1.4471   -0.0359 C   0  0  0

+   -6.9537    1.7796    1.1105 O   0  0  0

+   -8.2236    1.8888   -0.5824 O   0  0  0

+    6.6960   -0.0562    0.0868 O   0  0  0

+   15.3411    0.4263   -0.0832 K   0  3  0

+   -3.7319   -0.0913    0.0000 H   0  0  0

+   -4.2939    0.4543    0.0000 H   0  0  0

+   -5.1809    1.0227    0.0000 H   0  0  0

+   -5.9161   -2.0357    0.0000 H   0  0  0

+   -4.5589   -2.8927    0.0000 H   0  0  0

+   -7.1738    0.1357    0.0000 H   0  0  0

+   -6.2868   -0.4326    0.0000 H   0  0  0

+   -1.1688   -0.0387    0.0000 H   0  0  0

+    5.7693   -0.0562    0.0000 H   0  0  0

+    7.6227   -0.0562    0.0000 H   0  0  0

+   -9.0715    2.2627    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  8  9  2  0

+  8 10  1  0

+  1 13  1  0

+  2 14  1  0

+  2 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  6 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21655-84-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -2.0892   -0.9453   -0.2087 C   0  0  0

+   -3.1581    0.0597   -0.3142 C   0  0  0

+   -1.0145   -0.3202    0.4480 C   0  0  0

+   -1.9552   -2.2777   -0.5961 C   0  0  0

+   -2.6640    1.2291    0.2849 C   0  0  0

+   -4.4430    0.0437   -0.8536 C   0  0  0

+   -1.3797    0.9812    0.7347 N   0  0  0

+    0.1401   -1.0579    0.6795 C   0  0  0

+   -0.7712   -2.9309   -0.3255 C   0  0  0

+   -3.4693    2.3634    0.3325 C   0  0  0

+   -5.2244    1.1768   -0.7969 C   0  0  0

+    0.2211   -2.3140    0.2911 N   0  0  0

+    1.3091   -0.4158    1.3812 C   0  0  0

+   -4.7377    2.3325   -0.2047 C   0  0  0

+    9.9702    0.7783   -0.3466 Cl  0  0  0

+   -2.7820   -2.8235    0.0000 H   0  0  0

+   -4.8981   -0.8362    0.0000 H   0  0  0

+   -0.7088    1.7101    0.0000 H   0  0  0

+   -0.7454   -3.9212    0.0000 H   0  0  0

+   -3.0255    3.2491    0.0000 H   0  0  0

+   -6.2098    1.0754    0.0000 H   0  0  0

+    1.7860   -1.2841    0.0000 H   0  0  0

+    2.1774    0.0611    0.0000 H   0  0  0

+    0.8322    0.4525    0.0000 H   0  0  0

+   -5.2957    3.1511    0.0000 H   0  0  0

+   10.9609    0.7783    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+  8 13  1  0

+ 10 14  2  0

+  5  7  1  0

+  9 12  2  0

+ 11 14  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67587-52-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.8702   -0.2568   -0.2291 N   0  0  0

+   -0.3578   -1.0490   -0.4144 C   0  0  0

+    0.7750    1.1996   -0.4283 C   0  0  0

+    1.9849   -0.8163    0.1002 N   0  0  0

+   -1.4941   -0.3526    0.3423 C   0  0  0

+   -0.4572    1.7057    0.3296 C   0  0  0

+    2.9863   -0.1387    0.2474 O   0  0  0

+   -1.6142    0.9955   -0.1099 O   0  0  0

+   -2.7205   -1.0461    0.1035 O   0  0  0

+   -1.0111   -1.8259    0.0000 H   0  0  0

+    0.3133   -1.8106    0.0000 H   0  0  0

+    1.7863    1.1120    0.0000 H   0  0  0

+    1.0144    2.1861    0.0000 H   0  0  0

+   -0.6313    0.1822    0.0000 H   0  0  0

+    0.1159    2.5435    0.0000 H   0  0  0

+   -1.1570    2.4410    0.0000 H   0  0  0

+   -3.6041   -1.5458    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  6  8  1  0

+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+610-14-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.0295    0.6424   -0.2280 C   0  0  0

+   -1.1289   -0.0897    0.0473 C   0  0  0

+   -0.0384    2.0357   -0.3222 C   0  0  0

+    1.3166   -0.0502   -0.4121 C   0  0  0

+   -2.3293    0.5663    0.2240 C   0  0  0

+   -1.0678   -1.5651    0.1485 N   0  3  0

+   -1.2456    2.6772   -0.1430 C   0  0  0

+    1.4235   -0.9184   -1.2526 O   0  0  0

+    2.6804    0.3760    0.5738 Cl  0  0  0

+   -2.3885    1.9455    0.1293 C   0  0  0

+   -2.0941   -2.2107    0.2646 O   0  0  0

+    0.0089   -2.1337    0.1156 O   0  5  0

+    0.8286    2.5860    0.0000 H   0  0  0

+   -3.2011    0.0237    0.0000 H   0  0  0

+   -1.2872    3.7032    0.0000 H   0  0  0

+   -3.2997    2.4190    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  7 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17341-40-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    1.1455   -1.1380    0.0989 N   0  3  0

+   -0.1010   -0.8104    0.5515 N   0  0  0

+    1.7611    0.0362   -0.5337 C   0  0  0

+    1.9763   -1.5780    1.2277 C   0  0  0

+    1.0396   -2.2246   -0.8840 C   0  0  0

+   -1.0158   -0.3055   -0.2997 C   0  0  0

+    1.5227    1.2697    0.3397 C   0  0  0

+   -2.3405    0.0965    0.1978 C   0  0  0

+   -0.7461   -0.1821   -1.4791 O   0  0  0

+    2.5048    2.3735   -0.0578 C   0  0  0

+    0.1840    1.7336    0.1535 O   0  0  0

+   -2.6747   -0.0563    1.6593 C   0  0  0

+   -3.2432    0.5947   -0.6422 C   0  0  0

+   -0.4281   -1.6279    0.0000 H   0  0  0

+    2.3859   -0.5842    0.0000 H   0  0  0

+    2.5381    0.4505    0.0000 H   0  0  0

+    1.5642   -2.3561    0.0000 H   0  0  0

+    2.7544   -1.9901    0.0000 H   0  0  0

+    2.3884   -0.7999    0.0000 H   0  0  0

+    0.1632   -2.1392    0.0000 H   0  0  0

+    0.9542   -3.1010    0.0000 H   0  0  0

+    1.9160   -2.3100    0.0000 H   0  0  0

+    2.3718    1.0364    0.0000 H   0  0  0

+    3.1626    1.7882    0.0000 H   0  0  0

+    3.0901    3.0313    0.0000 H   0  0  0

+    1.8470    2.9588    0.0000 H   0  0  0

+   -3.0408    0.7445    0.0000 H   0  0  0

+   -3.4755   -0.4224    0.0000 H   0  0  0

+   -2.3086   -0.8571    0.0000 H   0  0  0

+   -3.2602    1.4751    0.0000 H   0  0  0

+   -3.9971    0.1398    0.0000 H   0  0  0

+   -0.6480    2.0219    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  6  8  1  0

+  6  9  2  0

+  7 10  1  0

+  7 11  1  0

+  8 12  1  0

+  8 13  2  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  4 18  1  0

+  4 19  1  0

+  5 20  1  0

+  5 21  1  0

+  5 22  1  0

+  7 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+ 11 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105-58-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.0000   -0.2167   -0.0012 C   0  0  0

+   -1.1651    0.4559    0.0002 O   0  0  0

+    1.1651    0.4559    0.0002 O   0  0  0

+    0.0000   -1.4310    0.0013 O   0  0  0

+   -2.4225   -0.2701   -0.0013 C   0  0  0

+    2.4225   -0.2701   -0.0014 C   0  0  0

+   -3.5854    0.7242    0.0009 C   0  0  0

+    3.5854    0.7242    0.0007 C   0  0  0

+   -3.2192   -1.0125    0.0000 H   0  0  0

+   -1.7749   -1.1456    0.0000 H   0  0  0

+    1.7749   -1.1456    0.0000 H   0  0  0

+    3.2192   -1.0125    0.0000 H   0  0  0

+   -2.8777    1.5519    0.0000 H   0  0  0

+   -4.4131    1.4319    0.0000 H   0  0  0

+   -4.2931   -0.1035    0.0000 H   0  0  0

+    4.2931   -0.1035    0.0000 H   0  0  0

+    4.4131    1.4319    0.0000 H   0  0  0

+    2.8777    1.5519    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100757-60-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    0.6385   -0.6344    0.0587 C   0  0  0

+   -0.7452   -0.8587    0.1698 C   0  0  0

+    1.1475    0.6702    0.1864 C   0  0  0

+    1.5397   -1.7620   -0.1830 C   0  0  0

+   -1.6094    0.2343    0.4087 C   0  0  0

+   -1.2640   -2.1669    0.0436 C   0  0  0

+    2.5906    0.8685    0.0656 C   0  0  0

+    0.2675    1.7424    0.4249 C   0  0  0

+    2.9024   -1.5408   -0.2928 C   0  0  0

+    0.9713   -3.1051   -0.3038 C   0  0  0

+   -2.9856   -0.0011    0.5175 C   0  0  0

+   -1.0688    1.5338    0.5314 C   0  0  0

+   -0.3628   -3.2900   -0.2022 C   0  0  0

+   -2.6421   -2.3592    0.1585 C   0  0  0

+    3.4332   -0.2459   -0.1745 C   0  0  0

+    3.1513    2.1462    0.1837 C   0  0  0

+   -3.4790   -1.2826    0.3924 C   0  0  0

+   -3.9280    1.1470    0.7720 C   0  0  0

+    4.8223   -0.0383   -0.2888 C   0  0  0

+    4.4997    2.3088    0.0674 C   0  0  0

+   -4.4757    1.8351   -0.8020 Cl  0  0  0

+    5.3320    1.2173   -0.1685 C   0  0  0

+    0.6405    2.7205    0.0000 H   0  0  0

+    3.5536   -2.3604    0.0000 H   0  0  0

+    1.6082   -3.9359    0.0000 H   0  0  0

+   -1.7153    2.3571    0.0000 H   0  0  0

+   -0.7496   -4.2627    0.0000 H   0  0  0

+   -3.0359   -3.3291    0.0000 H   0  0  0

+    2.5273    2.9867    0.0000 H   0  0  0

+   -4.5146   -1.4355    0.0000 H   0  0  0

+   -4.9625    0.9867    0.0000 H   0  0  0

+   -4.3016    0.1691    0.0000 H   0  0  0

+    5.4697   -0.8609    0.0000 H   0  0  0

+    4.9070    3.2731    0.0000 H   0  0  0

+    6.3696    1.3560    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16069-36-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 62 64                          1 V2000

+    3.7837   -0.6328   -0.5951 C   0  0  0

+    3.5893    0.4267    0.4724 C   0  0  0

+    5.0046   -0.4028   -1.4162 C   0  0  0

+    3.2906   -1.8970   -0.3868 O   0  0  0

+    4.8372    0.5170    1.3567 C   0  0  0

+    3.3517    1.6986   -0.1370 O   0  0  0

+    6.2523   -0.3111   -0.5296 C   0  0  0

+    2.0642   -1.8250    0.3432 C   0  0  0

+    6.0590    0.8182    0.4864 C   0  0  0

+    2.3801    2.3659    0.6713 C   0  0  0

+    1.0671   -2.8329   -0.2320 C   0  0  0

+    0.9979    1.7657    0.4065 C   0  0  0

+   -0.0092   -3.0162    0.6903 O   0  0  0

+    0.3177    2.5516   -0.5744 O   0  0  0

+   -1.2159   -3.0045   -0.0751 C   0  0  0

+   -0.9390    2.9248   -0.0054 C   0  0  0

+   -2.2262   -2.0599    0.5790 C   0  0  0

+   -2.0539    2.0913   -0.6403 C   0  0  0

+   -2.8802   -1.2887   -0.4307 O   0  0  0

+   -2.8090    1.4446    0.3861 O   0  0  0

+   -3.9836   -0.6192    0.2576 C   0  0  0

+   -3.9396    0.8285   -0.3009 C   0  0  0

+   -5.2531   -1.2934   -0.3557 C   0  0  0

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+   -6.4403    0.9055   -0.2690 C   0  0  0

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+   -3.1701   -2.2693    0.0000 H   0  0  0

+   -2.4811   -2.9925    0.0000 H   0  0  0

+   -2.1892    3.0486    0.0000 H   0  0  0

+   -2.9584    2.4328    0.0000 H   0  0  0

+   -4.0112   -1.5856    0.0000 H   0  0  0

+   -3.9199    1.7951    0.0000 H   0  0  0

+   -5.8905   -2.0204    0.0000 H   0  0  0

+   -4.6530   -2.0515    0.0000 H   0  0  0

+   -4.5417    2.2978    0.0000 H   0  0  0

+   -5.7790    2.3309    0.0000 H   0  0  0

+   -7.4320   -0.3663    0.0000 H   0  0  0

+   -6.8331   -1.4598    0.0000 H   0  0  0

+   -6.7391    1.8250    0.0000 H   0  0  0

+   -7.3974    0.7686    0.0000 H   0  0  0

+  1  2  1  0

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+  7  9  1  0

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+  3 29  1  0

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+ 24 58  1  0

+ 25 59  1  0

+ 25 60  1  0

+ 26 61  1  0

+ 26 62  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+140-08-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+   -0.0125   -0.2919   -0.0773 P   0  0  0

+   -1.1641   -1.0960    0.7096 O   0  0  0

+   -0.1480    1.0474    0.8059 O   0  0  0

+    1.2012   -0.9058    0.7842 O   0  0  0

+   -2.3109   -1.1146   -0.1427 C   0  0  0

+    0.0574    2.1493   -0.0805 C   0  0  0

+    2.2553   -1.1963   -0.1359 C   0  0  0

+   -3.4485   -1.8682    0.5493 C   0  0  0

+   -0.0587    3.4601    0.6999 C   0  0  0

+    3.4460   -1.7860    0.6225 C   0  0  0

+   -4.8955   -1.8917   -0.5261 Cl  0  0  0

+    0.2005    4.8504   -0.4185 Cl  0  0  0

+    4.7761   -2.1524   -0.5383 Cl  0  0  0

+   -1.9938   -0.1506    0.0000 H   0  0  0

+   -3.1177   -0.4990    0.0000 H   0  0  0

+    0.8851    1.5621    0.0000 H   0  0  0

+    0.9376    2.6545    0.0000 H   0  0  0

+    3.0626   -0.5813    0.0000 H   0  0  0

+    2.0626   -0.1999    0.0000 H   0  0  0

+   -3.7656   -2.8322    0.0000 H   0  0  0

+   -2.6417   -2.4838    0.0000 H   0  0  0

+   -0.8864    4.0473    0.0000 H   0  0  0

+   -0.9389    2.9549    0.0000 H   0  0  0

+    2.6387   -2.4010    0.0000 H   0  0  0

+    3.6388   -2.7824    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

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+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6066-82-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.0000   -1.9270    0.0020 O   0  0  0

+    0.0000   -0.5110    0.0025 N   0  0  0

+    1.1258    0.2135    0.0001 C   0  0  0

+   -1.1258    0.2135   -0.0002 C   0  0  0

+    2.2510   -0.2375   -0.0032 O   0  0  0

+    0.7711    1.6845    0.0015 C   0  0  0

+   -2.2510   -0.2375   -0.0030 O   0  0  0

+   -0.7711    1.6845    0.0013 C   0  0  0

+    0.0000   -2.9600    0.0000 H   0  0  0

+    1.7913    1.8468    0.0000 H   0  0  0

+    0.6897    2.7143    0.0000 H   0  0  0

+   -0.6897    2.7143    0.0000 H   0  0  0

+   -1.7913    1.8468    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

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+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  6  8  1  0

+  1  9  1  0

+  6 10  1  0

+  6 11  1  0

+  8 12  1  0

+  8 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+10605-21-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -1.8862    0.7912   -0.0024 C   0  0  0

+   -1.4930   -0.5573   -0.0015 C   0  0  0

+   -0.7172    1.5327   -0.0022 N   0  0  0

+   -3.2337    1.1194    0.0018 C   0  0  0

+   -0.1345   -0.5773   -0.0008 N   0  0  0

+   -2.4681   -1.5581   -0.0015 C   0  0  0

+    0.3230    0.6488   -0.0012 C   0  0  0

+   -4.1839    0.1195    0.0068 C   0  0  0

+   -3.8010   -1.2138   -0.0023 C   0  0  0

+    1.6627    0.9975   -0.0007 N   0  0  0

+    2.6089    0.0377    0.0003 C   0  0  0

+    3.9118    0.3768    0.0008 O   0  0  0

+    2.2860   -1.1336    0.0008 O   0  0  0

+    4.9311   -0.6573    0.0019 C   0  0  0

+   -0.6453    2.5647    0.0000 H   0  0  0

+   -3.5255    2.1119    0.0000 H   0  0  0

+   -2.1894   -2.5544    0.0000 H   0  0  0

+   -5.1887    0.3655    0.0000 H   0  0  0

+   -4.5226   -1.9551    0.0000 H   0  0  0

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+    4.1943   -1.3835    0.0000 H   0  0  0

+    5.6573   -1.3941    0.0000 H   0  0  0

+    5.6679    0.0689    0.0000 H   0  0  0

+  1  2  2  0

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+  3 15  1  0

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+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68743-68-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    3.7370    0.1417    0.2150 C   0  0  0

+    2.3029    0.1176    0.5442 C   0  0  0

+    4.6707    0.6531    1.1288 C   0  0  0

+    4.1937   -0.3498   -1.0115 C   0  0  0

+    1.3114   -0.4347   -0.4472 C   0  0  0

+    1.9190    0.5420    1.6132 O   0  0  0

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+    5.4769   -0.3276   -1.3048 N   0  0  0

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+   -2.4569   -0.8174   -0.3085 N   0  0  0

+   -3.2033    0.2852   -0.5176 C   0  0  0

+   -2.9319   -1.7959    0.3849 N   0  0  0

+   -4.4440    0.3652   -0.0032 O   0  0  0

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+   -5.2482    1.5530   -0.2284 C   0  0  0

+   -6.6052    1.3879    0.4586 C   0  0  0

+    4.4566    1.4903    0.0000 H   0  0  0

+    3.8553   -1.1449    0.0000 H   0  0  0

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+    1.9555   -1.0109    0.0000 H   0  0  0

+    6.3954    1.4242    0.0000 H   0  0  0

+    0.2348    0.4531    0.0000 H   0  0  0

+   -0.7435    0.2324    0.0000 H   0  0  0

+    7.2187   -0.0371    0.0000 H   0  0  0

+   -1.4402   -1.7014    0.0000 H   0  0  0

+   -0.4620   -1.4807    0.0000 H   0  0  0

+   -4.4653    1.9188    0.0000 H   0  0  0

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+   -7.4630    1.2835    0.0000 H   0  0  0

+   -6.5008    0.5301    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+505-29-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.6516    1.3912   -0.3959 C   0  0  0

+   -0.6516    1.3912    0.3959 C   0  0  0

+    1.6927    0.0000    0.1142 S   0  0  0

+   -1.6927    0.0000   -0.1142 S   0  0  0

+    0.6516   -1.3912   -0.3959 C   0  0  0

+   -0.6516   -1.3912    0.3959 C   0  0  0

+    1.8371    1.9325    0.0000 H   0  0  0

+    0.3746    2.6646    0.0000 H   0  0  0

+   -0.3746    2.6646    0.0000 H   0  0  0

+   -1.8371    1.9325    0.0000 H   0  0  0

+    0.3746   -2.6646    0.0000 H   0  0  0

+    1.8371   -1.9325    0.0000 H   0  0  0

+   -1.8371   -1.9325    0.0000 H   0  0  0

+   -0.3746   -2.6646    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

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+  2  9  1  0

+  2 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+135-68-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    1.3477   -0.0002   -0.0013 C   0  0  0

+   -0.1358    0.0000   -0.0011 C   0  0  0

+    2.0458    1.1352   -0.4104 C   0  0  0

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+    3.4242    1.1330   -0.4098 C   0  0  0

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+   -2.2149   -1.1285   -0.4098 C   0  0  0

+   -2.2148    1.1266    0.4133 C   0  0  0

+    4.1183   -0.0004   -0.0017 C   0  0  0

+   -2.9047    0.0003   -0.0009 C   0  0  0

+    5.5141   -0.0007   -0.0023 N   0  0  0

+   -4.6407    0.0006   -0.0013 Cl  0  0  0

+    1.5587    2.0081    0.0000 H   0  0  0

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+    3.9135    2.0047    0.0000 H   0  0  0

+    3.9131   -2.0034    0.0000 H   0  0  0

+   -2.7055   -1.9995    0.0000 H   0  0  0

+   -2.7048    1.9979    0.0000 H   0  0  0

+    6.0137   -0.8665    0.0000 H   0  0  0

+    6.0141    0.8649    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  9 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+  8 11  2  0

+ 10 12  2  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+484-23-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.7090   -0.6529    0.0021 C   0  0  0

+   -0.7091   -0.6529    0.0018 C   0  0  0

+    1.3661    0.5994    0.0007 C   0  0  0

+    1.3994   -1.8693   -0.0022 C   0  0  0

+   -1.3662    0.5993    0.0003 C   0  0  0

+   -1.3993   -1.8694    0.0027 C   0  0  0

+    0.6404    1.7006   -0.0006 N   0  0  0

+    2.7540    0.6684    0.0013 N   0  0  0

+    0.6963   -3.0382   -0.0065 C   0  0  0

+   -0.6404    1.7006   -0.0008 N   0  0  0

+   -2.7540    0.6684   -0.0004 N   0  0  0

+   -0.6962   -3.0383    0.0036 C   0  0  0

+    3.3773    1.8839    0.0001 N   0  0  0

+   -3.3773    1.8839   -0.0018 N   0  0  0

+    2.4415   -1.8825    0.0000 H   0  0  0

+   -2.4414   -1.8827    0.0000 H   0  0  0

+    3.3193   -0.2071    0.0000 H   0  0  0

+    1.2093   -3.9453    0.0000 H   0  0  0

+   -3.3193   -0.2071    0.0000 H   0  0  0

+   -1.2091   -3.9455    0.0000 H   0  0  0

+    4.4181    1.9357    0.0000 H   0  0  0

+    2.8120    2.7594    0.0000 H   0  0  0

+   -2.8120    2.7594    0.0000 H   0  0  0

+   -4.4181    1.9357    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  1  0

+ 11 14  1  0

+  7 10  2  0

+  9 12  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+114460-39-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.1477   -0.7905    0.0192 C   0  0  0

+   -1.3248   -0.0328    0.0535 C   0  0  0

+    1.1967   -0.2128   -0.0182 C   0  0  0

+   -0.2459   -2.2033   -0.0095 C   0  0  0

+   -2.5426   -0.6677   -0.2448 C   0  0  0

+   -1.6755    1.2521    0.3984 N   0  0  0

+    2.3125   -1.0581    0.1938 C   0  0  0

+    1.4215    1.1351   -0.3001 C   0  0  0

+   -1.4817   -2.8149   -0.2848 C   0  0  0

+    0.8953   -2.9968    0.2428 C   0  0  0

+   -2.5986   -2.0591   -0.4257 C   0  0  0

+   -3.4926    0.2993   -0.3249 N   0  0  0

+   -2.9771    1.4353    0.0332 C   0  0  0

+   -0.8677    2.2634    1.0854 C   0  0  0

+    2.1218   -2.4491    0.3571 C   0  0  0

+    3.6038   -0.5113    0.2235 C   0  0  0

+    2.7027    1.6435   -0.2990 C   0  0  0

+   -3.7062    2.7526    0.0701 C   0  0  0

+    3.7916    0.8145   -0.0241 C   0  0  0

+    2.9088    2.9590   -0.5690 O   0  0  0

+    0.6200    1.7821    0.0000 H   0  0  0

+   -1.5514   -3.8426    0.0000 H   0  0  0

+    0.7988   -4.0223    0.0000 H   0  0  0

+   -3.5179   -2.5236    0.0000 H   0  0  0

+   -0.0629    1.6206    0.0000 H   0  0  0

+   -0.2249    3.0682    0.0000 H   0  0  0

+   -1.6725    2.9062    0.0000 H   0  0  0

+    2.9458   -3.0671    0.0000 H   0  0  0

+    4.4204   -1.1391    0.0000 H   0  0  0

+   -2.8050    3.2514    0.0000 H   0  0  0

+   -4.2050    3.6538    0.0000 H   0  0  0

+   -4.6074    2.2538    0.0000 H   0  0  0

+    4.7444    1.2058    0.0000 H   0  0  0

+    3.0682    3.9766    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  2  0

+ 13 18  1  0

+ 16 19  2  0

+ 17 20  1  0

+  9 11  2  0

+ 10 15  2  0

+ 12 13  2  0

+ 17 19  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    1.0228   -0.0745    0.0701 N   0  0  0

+   -0.2226   -0.7397   -0.3354 C   0  0  0

+    2.1264   -0.8759   -0.4756 C   0  0  0

+    1.0563    1.2190   -0.6255 C   0  0  0

+   -1.4195    0.0469    0.2027 C   0  0  0

+    3.0189   -1.3607    0.6687 C   0  0  0

+    1.4735    2.3155    0.3565 C   0  0  0

+   -2.7166   -0.6459   -0.2196 C   0  0  0

+   -3.8658    0.1094    0.2970 N   0  0  0

+   -0.9210   -1.4929    0.0000 H   0  0  0

+    0.4046   -1.5531    0.0000 H   0  0  0

+    1.2072   -1.3343    0.0000 H   0  0  0

+    2.1084   -1.9029    0.0000 H   0  0  0

+    0.3222    1.9374    0.0000 H   0  0  0

+    0.1044    0.8331    0.0000 H   0  0  0

+   -0.7211    0.8001    0.0000 H   0  0  0

+   -2.0467    0.8603    0.0000 H   0  0  0

+    2.5286   -2.2633    0.0000 H   0  0  0

+    3.9215   -1.8510    0.0000 H   0  0  0

+    3.5092   -0.4581    0.0000 H   0  0  0

+    2.4335    1.9502    0.0000 H   0  0  0

+    1.8388    3.2755    0.0000 H   0  0  0

+    0.5135    2.6808    0.0000 H   0  0  0

+   -3.4150   -1.3991    0.0000 H   0  0  0

+   -2.0894   -1.4593    0.0000 H   0  0  0

+   -3.8064    1.1348    0.0000 H   0  0  0

+   -4.7835   -0.3519    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+39720-27-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -1.1362    0.0198   -0.4135 C   0  0  0

+   -0.4957   -1.1780   -0.1298 C   0  0  0

+   -0.4650    1.2209   -0.2382 C   0  0  0

+   -2.4172    0.0158   -0.8678 O   0  0  0

+    0.8080   -1.1716    0.3263 C   0  0  0

+    0.8391    1.2220    0.2183 C   0  0  0

+   -3.4384   -0.0098    0.0035 C   0  0  0

+    1.4750    0.0273    0.5003 C   0  0  0

+   -4.8538   -0.1380   -0.4980 C   0  0  0

+   -3.2227    0.0699    1.1897 O   0  0  0

+    2.8972    0.0314    0.9985 C   0  0  0

+    4.0260   -0.0468   -0.4052 Cl  0  0  0

+   -1.0059   -2.0341    0.0000 H   0  0  0

+   -0.9697    2.0802    0.0000 H   0  0  0

+    1.3152   -2.0294    0.0000 H   0  0  0

+    1.3518    2.0765    0.0000 H   0  0  0

+   -4.9437    0.8545    0.0000 H   0  0  0

+   -5.8463   -0.2279    0.0000 H   0  0  0

+   -4.7639   -1.1305    0.0000 H   0  0  0

+    3.4339    0.8711    0.0000 H   0  0  0

+    2.4173    0.9048    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  7 10  2  0

+  8 11  1  0

+ 11 12  1  0

+  6  8  2  0

+  2 13  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6149-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    1.0243   -1.8989    0.0074 O   0  0  0

+   -0.1753   -1.2608    0.0050 C   0  0  0

+    1.9827   -0.9342    0.0035 C   0  0  0

+   -0.7916   -0.9442   -1.1970 C   0  0  0

+   -0.7889   -0.9297    1.2050 C   0  0  0

+    2.4754   -0.4417    1.2029 C   0  0  0

+    2.4713   -0.4471   -1.2003 C   0  0  0

+   -2.0116   -0.2958   -1.1966 C   0  0  0

+   -2.0085   -0.2815    1.1997 C   0  0  0

+    3.4491    0.5378    1.1997 C   0  0  0

+    3.4447    0.5321   -1.2051 C   0  0  0

+   -2.6182    0.0376    0.0002 C   0  0  0

+    3.9348    1.0296   -0.0045 C   0  0  0

+   -3.9250    0.7327   -0.0024 N   0  3  0

+    4.9212    2.0219   -0.0086 N   0  0  0

+   -4.4604    1.0269    1.0513 O   0  0  0

+   -4.4650    1.0105   -1.0583 O   0  5  0

+   -1.0340   -1.4080    0.0000 H   0  0  0

+   -0.5418   -0.4683    0.0000 H   0  0  0

+    2.8460   -0.8112    0.0000 H   0  0  0

+    2.8416   -0.8169    0.0000 H   0  0  0

+   -2.2605   -0.7562    0.0000 H   0  0  0

+   -1.7644    0.1814    0.0000 H   0  0  0

+    3.8209    0.1694    0.0000 H   0  0  0

+    3.8167    0.1640    0.0000 H   0  0  0

+    5.4271    1.8880    0.0000 H   0  0  0

+    4.7842    2.5270    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  2  0

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+  7  3  1  0

+  8  4  1  0

+  9  5  2  0

+ 10  6  1  0

+ 11  7  2  0

+ 12  8  2  0

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+  9 12  1  0

+ 11 13  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+123-92-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    2.5904   -0.1032   -0.3234 C   0  0  0

+    1.3315    0.7060   -0.0052 C   0  0  0

+    3.8255    0.7798   -0.1346 C   0  0  0

+    2.6749   -1.3063    0.6182 C   0  0  0

+    0.0964   -0.1771   -0.1939 C   0  0  0

+   -1.0983    0.5909    0.1081 O   0  0  0

+   -2.3077    0.0169    0.0101 C   0  0  0

+   -3.5477    0.8139    0.3236 C   0  0  0

+   -2.4022   -1.1388   -0.3294 O   0  0  0

+    1.6566   -0.6564    0.0000 H   0  0  0

+    2.0287    1.5378    0.0000 H   0  0  0

+    0.5941    1.5024    0.0000 H   0  0  0

+    4.4567   -0.1031    0.0000 H   0  0  0

+    4.7084    1.4110    0.0000 H   0  0  0

+    3.1943    1.6627    0.0000 H   0  0  0

+    1.5922   -1.3823    0.0000 H   0  0  0

+    2.7509   -2.3890    0.0000 H   0  0  0

+    3.7576   -1.2303    0.0000 H   0  0  0

+   -0.6008   -1.0089    0.0000 H   0  0  0

+    0.8338   -0.9735    0.0000 H   0  0  0

+   -2.9609    1.7269    0.0000 H   0  0  0

+   -4.4607    1.4007    0.0000 H   0  0  0

+   -4.1345   -0.0991    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  7  9  2  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  4 18  1  0

+  5 19  1  0

+  5 20  1  0

+  8 21  1  0

+  8 22  1  0

+  8 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+36712-34-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.6508    0.4797   -0.0078 C   0  0  0

+   -1.3767   -0.7097    0.0164 C   0  0  0

+    0.8327    0.4468   -0.0089 C   0  0  0

+   -1.3231    1.6995   -0.0366 C   0  0  0

+   -2.7562   -0.6733    0.0174 C   0  0  0

+   -0.6692   -2.0097    0.0404 N   0  3  0

+    1.5291    0.3561   -1.2122 C   0  0  0

+    1.5346    0.5124    1.1932 C   0  0  0

+   -2.7033    1.7241   -0.0411 C   0  0  0

+   -3.4186    0.5410   -0.0055 C   0  0  0

+   -1.2986   -3.0475   -0.0619 O   0  0  0

+    0.5422   -2.0416    0.1624 O   0  5  0

+    2.9091    0.3264   -1.2074 C   0  0  0

+    2.9142    0.4819    1.1863 C   0  0  0

+   -4.8985    0.5737   -0.0043 N   0  3  0

+    3.6005    0.3865   -0.0111 C   0  0  0

+   -5.4840    1.6416   -0.0244 O   0  0  0

+   -5.5307   -0.4671    0.0168 O   0  5  0

+    5.0804    0.3537   -0.0123 N   0  3  0

+    5.6915    0.4065    1.0400 O   0  0  0

+    5.6869    0.2740   -1.0655 O   0  5  0

+   -0.7888    2.5859    0.0000 H   0  0  0

+   -3.2962   -1.5562    0.0000 H   0  0  0

+    1.4510   -0.6759    0.0000 H   0  0  0

+    1.4978    1.5467    0.0000 H   0  0  0

+   -3.2037    2.6301    0.0000 H   0  0  0

+    2.9428   -0.7080    0.0000 H   0  0  0

+    2.9970    1.5135    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  1  0

+ 13 16  2  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  1  0

+ 19 20  2  0

+ 19 21  1  0

+  9 10  2  0

+ 14 16  1  0

+  4 22  1  0

+  5 23  1  0

+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54827-17-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+   -3.5124   -0.0001    0.0012 C   0  0  0

+   -2.8187   -1.1327   -0.4098 C   0  0  0

+   -2.8181    1.1319    0.4113 C   0  0  0

+   -4.9086    0.0022   -0.0037 N   0  0  0

+   -1.4403   -1.1352   -0.4112 C   0  0  0

+   -3.5744   -2.3587   -0.8535 C   0  0  0

+   -1.4392    1.1338    0.4114 C   0  0  0

+   -3.5727    2.3582    0.8558 C   0  0  0

+   -0.7416   -0.0007   -0.0002 C   0  0  0

+    0.7416   -0.0009   -0.0014 C   0  0  0

+    1.4396    1.1347   -0.4105 C   0  0  0

+    1.4398   -1.1343    0.4119 C   0  0  0

+    2.8181    1.1325   -0.4103 C   0  0  0

+    2.8187   -1.1321    0.4104 C   0  0  0

+    3.5124   -0.0007   -0.0023 C   0  0  0

+    3.5730    2.3596   -0.8523 C   0  0  0

+    3.5741   -2.3572    0.8572 C   0  0  0

+    4.9086   -0.0007   -0.0030 N   0  0  0

+   -5.4241    0.8984    0.0000 H   0  0  0

+   -5.4270   -0.8923    0.0000 H   0  0  0

+   -0.9369   -2.0383    0.0000 H   0  0  0

+   -4.4545   -1.8162    0.0000 H   0  0  0

+   -4.1169   -3.2388    0.0000 H   0  0  0

+   -2.6943   -2.9012    0.0000 H   0  0  0

+   -0.9353    2.0366    0.0000 H   0  0  0

+   -2.6922    2.9000    0.0000 H   0  0  0

+   -4.1145    3.2387    0.0000 H   0  0  0

+   -4.4532    1.8164    0.0000 H   0  0  0

+    0.9358    2.0375    0.0000 H   0  0  0

+    0.9364   -2.0373    0.0000 H   0  0  0

+    4.4536    1.8179    0.0000 H   0  0  0

+    4.1147    3.2402    0.0000 H   0  0  0

+    2.6924    2.9013    0.0000 H   0  0  0

+    2.6941   -2.8998    0.0000 H   0  0  0

+    4.1167   -3.2372    0.0000 H   0  0  0

+    4.4541   -1.8146    0.0000 H   0  0  0

+    5.4255   -0.8961    0.0000 H   0  0  0

+    5.4255    0.8947    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+ 10 11  1  0

+ 10 12  2  0

+ 11 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+ 15 18  1  0

+  7  9  2  0

+ 14 15  2  0

+  4 19  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+  6 23  1  0

+  6 24  1  0

+  7 25  1  0

+  8 26  1  0

+  8 27  1  0

+  8 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-23-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.6860   -0.4911   -0.0015 C   0  0  0

+   -0.3081    0.4763   -0.0002 C   0  0  0

+    2.0205   -0.1112   -0.0017 C   0  0  0

+    0.3534   -1.8088    0.0030 O   0  0  0

+    0.0326    1.8152    0.0010 C   0  0  0

+   -1.7326    0.0745   -0.0004 N   0  3  0

+    2.3559    1.2287   -0.0006 C   0  0  0

+    1.5787   -2.5440    0.0002 C   0  0  0

+    1.3629    2.1912    0.0008 C   0  0  0

+   -2.6051    0.9243    0.0008 O   0  0  0

+   -2.0324   -1.1061   -0.0018 O   0  5  0

+    2.7653   -0.8325    0.0000 H   0  0  0

+   -0.7101    2.5386    0.0000 H   0  0  0

+    3.3529    1.5131    0.0000 H   0  0  0

+    1.0453   -3.4331    0.0000 H   0  0  0

+    2.4678   -3.0774    0.0000 H   0  0  0

+    2.1121   -1.6549    0.0000 H   0  0  0

+    1.6166    3.1965    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  7  9  1  0

+  3 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+218-19-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.4315    0.5798    0.0021 C   0  0  0

+   -0.4009   -0.5550    0.0009 C   0  0  0

+    1.8824    0.3824    0.0015 C   0  0  0

+   -0.1272    1.8699   -0.0020 C   0  0  0

+   -1.8527   -0.3593    0.0010 C   0  0  0

+    0.1600   -1.8445   -0.0010 C   0  0  0

+    2.3905   -0.9374   -0.0001 C   0  0  0

+    2.7663    1.4651    0.0019 C   0  0  0

+   -1.4672    2.0570   -0.0074 C   0  0  0

+   -2.3559    0.9621    0.0026 C   0  0  0

+   -2.6902   -1.3933   -0.0007 N   0  0  0

+    1.4996   -2.0320   -0.0018 C   0  0  0

+    3.7800   -1.1348   -0.0008 C   0  0  0

+    4.1121    1.2386    0.0008 C   0  0  0

+   -3.7481    1.1569    0.0026 C   0  0  0

+   -3.9920   -1.2183   -0.0010 C   0  0  0

+    4.6158   -0.0581    0.0001 C   0  0  0

+   -4.5557    0.0530    0.0012 C   0  0  0

+    0.5102    2.7076    0.0000 H   0  0  0

+   -0.4768   -2.6826    0.0000 H   0  0  0

+    2.3958    2.4503    0.0000 H   0  0  0

+   -1.8529    3.0364    0.0000 H   0  0  0

+    1.8844   -3.0117    0.0000 H   0  0  0

+    4.1751   -2.1104    0.0000 H   0  0  0

+    4.7768    2.0547    0.0000 H   0  0  0

+   -4.1581    2.1264    0.0000 H   0  0  0

+   -4.6236   -2.0603    0.0000 H   0  0  0

+    5.6574   -0.2100    0.0000 H   0  0  0

+   -5.6023    0.1655    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-14-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+   -0.0804   -0.1868    0.0000 C   0  0  0

+   -1.2807    0.7620    0.0000 C   0  0  0

+    1.2142    0.6286    0.0000 C   0  0  0

+   -2.5559   -0.0411    0.0000 C   0  0  0

+    2.4144   -0.3202    0.0000 C   0  0  0

+   -3.7433    0.5849    0.0000 O   0  0  0

+   -2.5094   -1.2484    0.0000 O   0  0  0

+    3.7091    0.4951    0.0000 C   0  0  0

+    4.9093   -0.4537    0.0000 C   0  0  0

+   -0.8892   -1.0008    0.0000 H   0  0  0

+    0.6370   -1.0824    0.0000 H   0  0  0

+   -0.4719    1.5760    0.0000 H   0  0  0

+   -1.9980    1.6576    0.0000 H   0  0  0

+    2.0230    1.4426    0.0000 H   0  0  0

+    0.4969    1.5242    0.0000 H   0  0  0

+    1.6056   -1.1341    0.0000 H   0  0  0

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+   -4.7583    1.1200    0.0000 H   0  0  0

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+    2.9918    1.3907    0.0000 H   0  0  0

+    4.1977   -1.3538    0.0000 H   0  0  0

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+  1  2  1  0

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+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115664-50-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.3939   -0.9488   -0.0021 C   0  0  0

+   -1.4732   -0.0360   -0.0016 C   0  0  0

+    0.9397   -0.4918   -0.0014 C   0  0  0

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+   -2.7976   -0.5279   -0.0019 C   0  0  0

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+    0.1388    1.8651    0.0002 C   0  0  0

+   -2.3247    2.2306    0.0005 C   0  0  0

+   -3.0292   -1.9233   -0.0022 C   0  0  0

+   -3.8673    0.3822   -0.0013 C   0  0  0

+    2.5234    1.4360    0.0008 C   0  0  0

+    1.7085   -2.7728   -0.0020 C   0  0  0

+    3.3834   -0.9445   -0.0011 N   0  3  0

+    0.3950    3.2364    0.0013 C   0  0  0

+   -3.6188    1.7434    0.0003 C   0  0  0

+   -5.1461   -0.0740   -0.0014 O   0  0  0

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+    3.9607   -0.7499   -1.0559 O   0  0  0

+    3.9609   -0.7516    1.0538 O   0  5  0

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+   -2.1921   -3.8245    0.0000 H   0  0  0

+    0.2267   -4.2681    0.0000 H   0  0  0

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+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 24 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6449-35-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 78 83                          1 V2000

+    9.5761   -1.8079    1.0689 S   0  0  0

+   10.4082   -1.2278    2.0641 O   0  0  0

+   10.0100   -2.7009    0.0523 O   0  0  0

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+ 51 77  1  0

+ 51 78  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88-88-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.2410    1.1979    0.0030 C   0  0  0

+   -0.9329    0.0001    0.0019 C   0  0  0

+    1.1413    1.1973    0.0026 C   0  0  0

+   -0.9807    2.4800   -0.0015 N   0  3  0

+   -0.2407   -1.1981    0.0004 C   0  0  0

+   -2.6689    0.0000    0.0031 Cl  0  0  0

+    1.8322    0.0002    0.0010 C   0  0  0

+   -0.3714    3.5347   -0.0006 O   0  0  0

+   -2.1987    2.4804   -0.0062 O   0  5  0

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+   -0.3709   -3.5348   -0.0026 O   0  0  0

+   -2.1983   -2.4807   -0.0012 O   0  5  0

+    3.9214   -1.0546   -0.0013 O   0  0  0

+    3.9213    1.0551    0.0006 O   0  5  0

+    1.6599    2.0949    0.0000 H   0  0  0

+    1.6599   -2.0950    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+ 12 15  2  0

+ 12 16  1  0

+  7 10  1  0

+  3 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68140-48-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 46                          1 V2000

+    0.3229    0.3092    0.4255 C   0  0  0

+    0.4926   -1.0075    0.0318 C   0  0  0

+    1.6692    0.9258    0.7412 C   0  0  0

+   -0.9444    0.8552    0.4840 C   0  0  0

+    1.9647   -1.3618    0.0571 C   0  0  0

+   -0.6079   -1.7793   -0.3090 C   0  0  0

+    2.6286   -0.2694    0.9218 C   0  0  0

+    2.1311    1.7761   -0.4439 C   0  0  0

+   -2.0572    0.0803    0.1461 C   0  0  0

+    2.1684   -2.7386    0.6926 C   0  0  0

+    2.5398   -1.3420   -1.3605 C   0  0  0

+   -1.8772   -1.2457   -0.2595 C   0  0  0

+    3.9976    0.0825    0.3361 C   0  0  0

+    1.0459    1.7802   -1.5224 C   0  0  0

+    2.3883    3.2092    0.0263 C   0  0  0

+   -3.4090    0.6588    0.2078 C   0  0  0

+   -3.0680   -2.0911   -0.6315 C   0  0  0

+   -4.0874    0.8483    1.5401 C   0  0  0

+   -3.9769    0.9831   -0.8133 O   0  0  0

+    0.9696    1.6747    0.0000 H   0  0  0

+   -1.0475    1.8748    0.0000 H   0  0  0

+   -0.4986   -2.7983    0.0000 H   0  0  0

+    3.2391   -1.0926    0.0000 H   0  0  0

+    3.0981    1.4366    0.0000 H   0  0  0

+    1.1546   -2.8886    0.0000 H   0  0  0

+    2.3184   -3.7524    0.0000 H   0  0  0

+    3.1822   -2.5886    0.0000 H   0  0  0

+    2.5751   -2.3662    0.0000 H   0  0  0

+    3.5640   -1.3067    0.0000 H   0  0  0

+    2.5045   -0.3178    0.0000 H   0  0  0

+    4.2527   -0.9101    0.0000 H   0  0  0

+    4.9902    0.3376    0.0000 H   0  0  0

+    3.7425    1.0751    0.0000 H   0  0  0

+    1.0498    2.8050    0.0000 H   0  0  0

+    0.0211    1.7841    0.0000 H   0  0  0

+    1.0420    0.7554    0.0000 H   0  0  0

+    3.3970    3.0282    0.0000 H   0  0  0

+    2.5693    4.2179    0.0000 H   0  0  0

+    1.3796    3.3902    0.0000 H   0  0  0

+   -3.6613   -1.2554    0.0000 H   0  0  0

+   -3.9037   -2.6844    0.0000 H   0  0  0

+   -2.4747   -2.9268    0.0000 H   0  0  0

+   -3.8117    1.8354    0.0000 H   0  0  0

+   -5.0745    1.1240    0.0000 H   0  0  0

+   -4.3631   -0.1388    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

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+  7 13  1  0

+  8 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 12 17  1  0

+ 16 18  1  0

+ 16 19  2  0

+  5  7  1  0

+  9 12  2  0

+  3 20  1  0

+  4 21  1  0

+  6 22  1  0

+  7 23  1  0

+  8 24  1  0

+ 10 25  1  0

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+ 17 40  1  0

+ 17 41  1  0

+ 17 42  1  0

+ 18 43  1  0

+ 18 44  1  0

+ 18 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+77-92-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.0000    0.4352    0.0080 C   0  0  0

+   -1.2492    1.0847    0.6068 C   0  0  0

+    1.2492    1.0847    0.6068 C   0  0  0

+    0.0000   -1.0385    0.3229 C   0  0  0

+    0.0000    0.6196   -1.4090 O   0  0  0

+   -2.4797    0.4450    0.0170 C   0  0  0

+    2.4797    0.4450    0.0170 C   0  0  0

+    0.0000   -1.4520    1.5999 O   0  0  0

+    0.0000   -1.8479   -0.5742 O   0  0  0

+   -3.6988    0.8579    0.3977 O   0  0  0

+   -2.3688   -0.4395   -0.7985 O   0  0  0

+    3.6988    0.8579    0.3977 O   0  0  0

+    2.3688   -0.4396   -0.7985 O   0  0  0

+   -0.6396    1.8332    0.0000 H   0  0  0

+   -1.8587    1.8333    0.0000 H   0  0  0

+    1.8587    1.8333    0.0000 H   0  0  0

+    0.6396    1.8332    0.0000 H   0  0  0

+    0.0000    1.5849    0.0000 H   0  0  0

+    0.0000   -2.4173    0.0000 H   0  0  0

+   -4.6131    1.1676    0.0000 H   0  0  0

+    4.6131    1.1676    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  4  9  2  0

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+  7 12  1  0

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+  2 14  1  0

+  2 15  1  0

+  3 16  1  0

+  3 17  1  0

+  5 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51640-90-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.2697   -1.0950    0.0360 C   0  0  0

+   -0.7283   -0.1154   -0.0863 C   0  0  0

+    1.6841   -0.6800   -0.0397 C   0  0  0

+   -0.0835   -2.4276    0.2305 C   0  0  0

+   -2.0623   -0.4867   -0.0089 C   0  0  0

+   -0.3858    1.1830   -0.2868 O   0  0  0

+    1.9638    0.7040    0.0201 C   0  0  0

+    2.7254   -1.5885   -0.1648 C   0  0  0

+   -1.4152   -2.7782    0.3059 C   0  0  0

+   -2.4000   -1.8111    0.1838 C   0  0  0

+   -3.1239    0.5373   -0.1325 N   0  3  0

+    0.8195    1.6257    0.1500 C   0  0  0

+    3.2786    1.1496   -0.0439 C   0  0  0

+    4.0259   -1.1280   -0.2282 C   0  0  0

+   -4.2955    0.2112   -0.0646 O   0  0  0

+   -2.8260    1.7060   -0.3022 O   0  5  0

+    0.9512    2.7354    0.6290 O   0  0  0

+    4.3006    0.2300   -0.1674 C   0  0  0

+    0.6477   -3.1600    0.0000 H   0  0  0

+    2.5314   -2.6051    0.0000 H   0  0  0

+   -1.6807   -3.7785    0.0000 H   0  0  0

+   -3.3968   -2.0895    0.0000 H   0  0  0

+    3.4872    2.1633    0.0000 H   0  0  0

+    4.8074   -1.8066    0.0000 H   0  0  0

+    5.2833    0.5548    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

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+  8 14  2  0

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+  7 12  1  0

+  9 10  1  0

+ 14 18  1  0

+  4 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 18 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-11-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  5  4                          1 V2000

+    0.0000   -1.1919    0.0000 C   0  0  0

+   -1.7653    0.0564    0.0000 I   0  0  0

+    1.7653    0.0564    0.0000 I   0  0  0

+   -1.0799   -2.4016    0.0000 H   0  0  0

+    1.0799   -2.4016    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+568-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+    0.5856    0.2456   -0.0433 C   0  0  0

+   -0.0196   -1.0800   -0.1835 C   0  0  0

+    2.0514    0.3492    0.0033 C   0  0  0

+   -0.2101    1.3760    0.0376 C   0  0  0

+   -1.4024   -1.2145   -0.2314 C   0  0  0

+    0.8467   -2.2544   -0.2725 C   0  0  0

+    2.8287   -0.8244   -0.0879 C   0  0  0

+    2.6794    1.5887    0.1354 C   0  0  0

+   -1.6015    1.2474   -0.0153 C   0  0  0

+    0.4200    2.7374    0.1814 C   0  0  0

+   -2.2106   -0.0783   -0.1451 C   0  0  0

+   -2.0263   -2.5786   -0.3763 C   0  0  0

+    2.1863   -2.1275   -0.2269 C   0  0  0

+    4.2264   -0.7236   -0.0433 C   0  0  0

+    4.0538    1.6551    0.1757 C   0  0  0

+   -2.4419    2.3757    0.0641 C   0  0  0

+   -3.6163   -0.1769   -0.1898 C   0  0  0

+   -2.2576   -3.1365    0.9188 O   0  0  0

+    4.8184    0.4988    0.0868 C   0  0  0

+   -3.7898    2.2126    0.0093 C   0  0  0

+   -4.3703    0.9500   -0.1025 C   0  0  0

+    0.4194   -3.2101    0.0000 H   0  0  0

+    2.1100    2.4672    0.0000 H   0  0  0

+    1.3700    2.2977    0.0000 H   0  0  0

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+   -0.5300    3.1771    0.0000 H   0  0  0

+   -2.6432   -1.7328    0.0000 H   0  0  0

+   -3.0658   -2.7025    0.0000 H   0  0  0

+    2.7805   -2.9894    0.0000 H   0  0  0

+    4.8140   -1.5900    0.0000 H   0  0  0

+    4.5271    2.5889    0.0000 H   0  0  0

+   -2.0293    3.3378    0.0000 H   0  0  0

+   -4.0769   -1.1170    0.0000 H   0  0  0

+   -2.6585   -4.1036    0.0000 H   0  0  0

+    5.8629    0.5685    0.0000 H   0  0  0

+   -4.4067    3.0584    0.0000 H   0  0  0

+   -5.4139    0.8670    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+  7 13  1  0

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+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2541-69-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.4312    0.2141    0.0034 C   0  0  0

+   -0.0436   -1.1706    0.0005 C   0  0  0

+    1.8801    0.4618    0.0023 C   0  0  0

+   -0.4702    1.2658    0.0014 C   0  0  0

+   -1.4076   -1.4410    0.0010 C   0  0  0

+    0.9316   -2.2595   -0.0033 C   0  0  0

+    2.7671   -0.6353   -0.0015 C   0  0  0

+    2.3860    1.7627    0.0044 C   0  0  0

+   -1.8426    0.9999   -0.0035 C   0  0  0

+   -2.3212   -0.3846    0.0042 C   0  0  0

+   -1.8974   -2.8662   -0.0015 C   0  0  0

+    2.2532   -2.0010   -0.0042 C   0  0  0

+    4.1488   -0.3971   -0.0026 C   0  0  0

+    3.7478    1.9640    0.0028 C   0  0  0

+   -2.7881    2.0448   -0.0061 C   0  0  0

+   -3.7111   -0.6213    0.0052 C   0  0  0

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+   -4.1143    1.7487   -0.0112 C   0  0  0

+   -4.5701    0.4313    0.0088 C   0  0  0

+   -0.1253    2.2554    0.0000 H   0  0  0

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+   -2.8885   -2.5256    0.0000 H   0  0  0

+   -2.2380   -3.8573    0.0000 H   0  0  0

+   -0.9063   -3.2068    0.0000 H   0  0  0

+    2.9299   -2.8012    0.0000 H   0  0  0

+    4.8194   -1.2024    0.0000 H   0  0  0

+    4.1291    2.9401    0.0000 H   0  0  0

+   -2.4706    3.0435    0.0000 H   0  0  0

+   -4.0791   -1.6025    0.0000 H   0  0  0

+    5.6543    1.0536    0.0000 H   0  0  0

+   -4.8121    2.5305    0.0000 H   0  0  0

+   -5.6019    0.2481    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

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+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4450-68-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -2.8957   -0.1644   -0.0930 C   0  0  0

+   -2.0137   -1.6893   -0.1303 S   0  0  0

+   -2.9646    0.6222   -1.2279 C   0  0  0

+   -3.5234    0.2426    1.0691 C   0  0  0

+   -0.5560   -1.3648   -0.4241 O   0  0  0

+   -2.0385   -2.1823    1.2023 O   0  0  0

+   -2.4925   -2.3845   -1.2734 O   0  0  0

+   -3.6564    1.8184   -1.1986 C   0  0  0

+   -4.2155    1.4391    1.0984 C   0  0  0

+   -0.0591   -0.6396    0.7025 C   0  0  0

+   -4.2795    2.2283   -0.0345 C   0  0  0

+    1.3878   -0.2860    0.4737 C   0  0  0

+   -5.0338    3.5325   -0.0026 C   0  0  0

+    1.7809    1.0394    0.4553 C   0  0  0

+    2.3228   -1.2867    0.2879 C   0  0  0

+    3.1080    1.3638    0.2455 C   0  0  0

+    3.6503   -0.9623    0.0781 C   0  0  0

+    4.0423    0.3629    0.0540 C   0  0  0

+    5.4635    0.7102   -0.1707 N   0  3  0

+    6.2866   -0.1715   -0.3395 O   0  0  0

+    5.8099    1.8778   -0.1869 O   0  5  0

+   -1.9863    0.9311    0.0000 H   0  0  0

+   -4.2670   -0.4642    0.0000 H   0  0  0

+   -2.9104    2.5227    0.0000 H   0  0  0

+   -5.1948    1.1333    0.0000 H   0  0  0

+   -0.0176    0.3855    0.0000 H   0  0  0

+   -1.0327   -0.3163    0.0000 H   0  0  0

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+    1.0733    1.7822    0.0000 H   0  0  0

+    2.0296   -2.2698    0.0000 H   0  0  0

+    3.4014    2.3469    0.0000 H   0  0  0

+    4.3581   -1.7049    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5000-65-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.4564    0.1946   -0.0050 C   0  0  0

+   -1.5529   -0.8393   -0.0056 C   0  0  0

+   -0.7357    1.3745   -0.0006 O   0  0  0

+    0.9534   -0.2280   -0.0035 C   0  0  0

+   -3.3013    0.0598    0.0013 Br  0  0  0

+    1.9727    0.7283   -0.0029 C   0  0  0

+    1.2790   -1.5883    0.0032 C   0  0  0

+    3.2961    0.3221   -0.0010 C   0  0  0

+    2.6013   -1.9794    0.0050 C   0  0  0

+    4.2906    1.2484    0.0000 O   0  0  0

+    3.6083   -1.0309    0.0002 C   0  0  0

+    5.5252    0.5288    0.0018 C   0  0  0

+   -2.1327   -1.7085    0.0000 H   0  0  0

+   -0.7548   -1.5136    0.0000 H   0  0  0

+    1.7367    1.7461    0.0000 H   0  0  0

+    0.5210   -2.3074    0.0000 H   0  0  0

+    2.8435   -2.9958    0.0000 H   0  0  0

+    4.6082   -1.3339    0.0000 H   0  0  0

+    4.9991   -0.3739    0.0000 H   0  0  0

+    6.4279    0.0027    0.0000 H   0  0  0

+    6.0513    1.4315    0.0000 H   0  0  0

+  2  1  1  0

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+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+77121-90-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 71 75                          1 V2000

+    0.2847   -0.9327    0.1556 C   0  0  0

+   -0.2301   -2.0718    0.7216 C   0  0  0

+    1.7555   -0.7589   -0.1239 C   0  0  2

+   -0.5661    0.1248   -0.1923 C   0  0  0

+   -1.6081   -2.1816    0.9496 C   0  0  0

+    0.6348   -3.2372    1.1284 C   0  0  0

+    2.5789   -1.7627    0.6798 C   0  0  0

+    2.1494    0.5673    0.2342 O   0  0  0

+   -1.9387    0.0310    0.0271 C   0  0  0

+   -0.0490    1.2494   -0.7467 O   0  0  0

+   -2.4677   -1.1387    0.6088 C   0  0  0

+   -2.1098   -3.3121    1.5058 O   0  0  0

+    1.9975   -3.1618    0.4437 C   0  0  2

+    3.0916    0.9983   -0.7499 C   0  0  1

+   -2.8332    1.1429   -0.3401 C   0  0  0

+   -3.9166   -1.2530    0.8481 C   0  0  0

+    1.8368   -3.4020   -1.0353 C   0  0  0

+    2.8708   -4.1470    0.9994 O   0  0  0

+    2.9633    2.5099   -0.9513 C   0  0  0

+    4.4122    0.6791   -0.3157 O   0  0  0

+   -4.2837    1.0280   -0.1042 C   0  0  0

+   -2.3754    2.1540   -0.8375 O   0  0  0

+   -4.8132   -0.1371    0.4809 C   0  0  0

+   -4.3740   -2.2635    1.3462 O   0  0  0

+    2.9716   -3.9950   -1.8301 C   0  0  0

+    0.7986   -3.1193   -1.5836 O   0  0  0

+    3.2198    3.2154    0.3851 C   0  0  1

+    4.5760    1.2136    0.9965 C   0  0  2

+   -5.1400    2.0776   -0.4511 C   0  0  0

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+ 40 70  1  0

+ 40 71  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+138580-48-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 51                          1 V2000

+   -0.4369    0.3375   -0.0044 C   0  0  0

+   -1.7003   -0.2706   -0.0030 C   0  0  0

+   -0.3527    1.7382   -0.0024 C   0  0  0

+    0.7960   -0.4691   -0.0018 C   0  0  0

+   -2.8334    0.5725    0.0005 C   0  0  0

+   -2.1265   -1.5719   -0.0047 N   0  0  0

+   -1.4513    2.4812    0.0012 N   0  0  0

+    0.9852    2.3818   -0.0039 C   0  0  0

+    2.1167    0.2098   -0.0028 C   0  0  0

+    0.7325   -1.6819    0.0016 O   0  0  0

+   -4.0075   -0.3151    0.0011 C   0  0  0

+   -2.6577    1.9512    0.0026 C   0  0  0

+   -3.5105   -1.6280   -0.0023 C   0  0  0

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+    1.0752    3.5948   -0.0023 O   0  0  0

+    3.2712   -0.5404   -0.0004 N   0  0  0

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+   -4.0469   -3.6729    0.0000 H   0  0  0

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+   -6.4271   -3.2594    0.0000 H   0  0  0

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+    6.2809   -0.0502    0.0000 H   0  0  0

+    5.0005    0.3526    0.0000 H   0  0  0

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+ 27 45  1  0

+ 27 46  1  0

+ 27 47  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6268-09-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.0256   -2.4295    0.0050 O   0  0  0

+   -0.2064   -1.2363    0.0050 C   0  0  0

+    0.9053   -0.2687    0.0023 C   0  0  0

+   -1.6039   -0.7542    0.0015 C   0  0  0

+    0.6383    1.1133    0.0018 C   0  0  0

+    2.2301   -0.7160   -0.0003 C   0  0  0

+   -1.8726    0.6260    0.0010 C   0  0  0

+   -2.6594   -1.6615   -0.0018 C   0  0  0

+   -0.7582    1.5965    0.0049 C   0  0  0

+    1.6933    2.0195   -0.0012 C   0  0  0

+    2.4999   -2.0447    0.0006 O   0  0  0

+    3.2709    0.2087   -0.0032 C   0  0  0

+   -3.1914    1.0718   -0.0028 C   0  0  0

+   -3.9645   -1.2014   -0.0055 C   0  0  0

+   -0.9897    2.7894    0.0045 O   0  0  0

+    3.0015    1.5618   -0.0037 C   0  0  0

+    4.6995   -0.2710   -0.0055 C   0  0  0

+   -4.2288    0.1561   -0.0060 C   0  0  0

+   -2.4668   -2.6876    0.0000 H   0  0  0

+    1.4997    3.0454    0.0000 H   0  0  0

+    2.7076   -3.0678    0.0000 H   0  0  0

+   -3.3974    2.0953    0.0000 H   0  0  0

+   -4.7548   -1.8835    0.0000 H   0  0  0

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+    4.3672   -1.2607    0.0000 H   0  0  0

+    5.6892   -0.6033    0.0000 H   0  0  0

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+   -5.2172    0.4921    0.0000 H   0  0  0

+  2  1  2  0

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+ 16 24  1  0

+ 17 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96563-10-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.7419   -0.6389    0.0200 C   0  0  0

+   -0.7420   -0.6388    0.0204 C   0  0  0

+    1.2056    0.6594   -0.1740 C   0  0  0

+    1.6603   -1.6785    0.1803 C   0  0  0

+   -1.2056    0.6595   -0.1733 C   0  0  0

+   -1.6604   -1.6792    0.1756 C   0  0  0

+    0.0000    1.5573   -0.3077 C   0  0  0

+    2.5595    0.9157   -0.2127 C   0  0  0

+    3.0131   -1.4154    0.1392 C   0  0  0

+   -2.5596    0.9159   -0.2119 C   0  0  0

+   -3.0132   -1.4158    0.1363 C   0  0  0

+    0.0004    2.5839    0.8267 C   0  0  0

+    3.4662   -0.1208   -0.0581 C   0  0  0

+   -3.4662   -0.1207   -0.0575 C   0  0  0

+    4.7928    0.1315   -0.0966 F   0  0  0

+   -4.7929    0.1318   -0.0951 F   0  0  0

+    1.3278   -2.6571    0.0000 H   0  0  0

+   -1.3278   -2.6578    0.0000 H   0  0  0

+   -0.9236    2.0213    0.0000 H   0  0  0

+    2.8969    1.8927    0.0000 H   0  0  0

+    3.6893   -2.1971    0.0000 H   0  0  0

+   -2.8970    1.8929    0.0000 H   0  0  0

+   -3.6895   -2.1974    0.0000 H   0  0  0

+    1.0340    2.5835    0.0000 H   0  0  0

+    0.0008    3.6175    0.0000 H   0  0  0

+   -1.0332    2.5843    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2508-20-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.0879   -0.3906   -0.0007 C   0  0  0

+   -1.5682   -0.4184   -0.0005 C   0  0  0

+    0.3512    0.9380    0.0001 C   0  0  0

+    0.8493   -1.4346    0.0036 C   0  0  0

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+   -2.4673   -1.4895   -0.0015 C   0  0  0

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+    2.1824   -1.1610    0.0028 C   0  0  0

+   -3.4180    1.1168    0.0006 C   0  0  0

+   -3.8248   -1.2478   -0.0015 C   0  0  0

+    2.6274    0.1788   -0.0008 C   0  0  0

+   -4.3019    0.0510   -0.0004 C   0  0  0

+    3.9330    0.4530   -0.0009 N   0  0  0

+    4.7458   -0.4542   -0.0017 O   0  0  0

+    0.5219   -2.4280    0.0000 H   0  0  0

+   -2.1105   -2.4727    0.0000 H   0  0  0

+   -0.1862    2.6083    0.0000 H   0  0  0

+   -1.5945    2.5782    0.0000 H   0  0  0

+    2.0007    2.2227    0.0000 H   0  0  0

+    2.8770   -1.9430    0.0000 H   0  0  0

+   -3.7819    2.0974    0.0000 H   0  0  0

+   -4.4966   -2.0495    0.0000 H   0  0  0

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+  1  2  1  0

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+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-37-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+   -0.4464   -0.0135   -0.1235 N   0  0  0

+    0.6235    0.5230   -0.9751 C   0  0  0

+   -1.6417    0.7995   -0.3848 C   0  0  0

+   -0.7399   -1.3660   -0.6160 C   0  0  0

+    1.7554    1.0580   -0.0956 C   0  0  0

+   -2.1338    1.4186    0.9250 C   0  0  0

+   -0.5181   -2.3780    0.5098 C   0  0  0

+    2.3835   -0.0295    0.5861 O   0  0  0

+    0.6932    1.4594    0.0000 H   0  0  0

+   -0.1567    1.0455    0.0000 H   0  0  0

+   -2.5518    0.5684    0.0000 H   0  0  0

+   -1.8046   -0.1252    0.0000 H   0  0  0

+   -1.5180   -0.8404    0.0000 H   0  0  0

+   -1.5169   -1.8932    0.0000 H   0  0  0

+    2.5811    1.5052    0.0000 H   0  0  0

+    1.3310    1.8956    0.0000 H   0  0  0

+   -1.3987    2.0029    0.0000 H   0  0  0

+   -2.7181    2.1537    0.0000 H   0  0  0

+   -2.8689    0.8343    0.0000 H   0  0  0

+   -1.4353   -2.5790    0.0000 H   0  0  0

+   -0.3171   -3.2952    0.0000 H   0  0  0

+    0.3991   -2.1770    0.0000 H   0  0  0

+    2.8531   -0.8426    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4825-86-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 48                          1 V2000

+   -2.9964   -0.0186   -0.2083 C   0  0  0

+   -3.1664    0.3843    1.1173 C   0  0  0

+   -1.7357   -0.4149   -0.6696 C   0  0  0

+   -4.1584   -0.0323   -1.1228 C   0  0  0

+   -2.0835    0.3820    1.9783 C   0  0  0

+   -4.5132    0.8311    1.6225 C   0  0  0

+   -0.6471   -0.4092    0.2132 C   0  0  0

+   -1.5696   -0.8008   -1.9566 O   0  0  0

+   -5.3101    0.5195   -0.6555 O   0  0  0

+   -4.0878   -0.5133   -2.2364 O   0  0  0

+   -0.8360   -0.0090    1.5377 C   0  0  0

+   -5.6313    0.2680    0.7454 C   0  0  2

+    0.6897   -0.8236   -0.2538 C   0  0  0

+   -6.9515    0.9565    1.0975 C   0  0  0

+    1.7573   -0.6943    0.5586 N   0  0  0

+    0.8282   -1.2818   -1.3715 O   0  0  0

+    3.0847   -1.1059    0.0949 C   0  0  1

+    4.1516   -0.2445    0.7735 C   0  0  0

+    3.3118   -2.5542    0.4436 C   0  0  0

+    4.0515    1.1711    0.2666 C   0  0  0

+    4.0992   -3.3158   -0.3321 O   0  0  0

+    2.7852   -3.0300    1.4215 O   0  0  0

+    3.3767    2.1239    1.0062 C   0  0  0

+    4.6396    1.5181   -0.9356 C   0  0  0

+    3.2848    3.4227    0.5411 C   0  0  0

+    4.5478    2.8164   -1.4006 C   0  0  0

+    3.8678    3.7682   -0.6635 C   0  0  0

+   -1.9501    1.2474    0.0000 H   0  0  0

+   -4.0321    1.5628    0.0000 H   0  0  0

+   -5.0958    1.4849    0.0000 H   0  0  0

+   -1.2234   -1.6051    0.0000 H   0  0  0

+   -0.2607    0.6512    0.0000 H   0  0  0

+   -5.6375   -0.6076    0.0000 H   0  0  0

+   -6.5466    1.7329    0.0000 H   0  0  0

+   -7.7279    1.3614    0.0000 H   0  0  0

+   -7.3564    0.1801    0.0000 H   0  0  0

+    1.8361    0.1778    0.0000 H   0  0  0

+    2.9199   -0.2459    0.0000 H   0  0  0

+    4.5531   -1.0227    0.0000 H   0  0  0

+    4.9947   -0.0080    0.0000 H   0  0  0

+    4.7286   -3.9246    0.0000 H   0  0  0

+    2.5522    1.8290    0.0000 H   0  0  0

+    5.4149    1.1110    0.0000 H   0  0  0

+    2.5091    3.8291    0.0000 H   0  0  0

+    5.3717    3.1129    0.0000 H   0  0  0

+    4.0484    4.6250    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  6 12  1  0

+  7 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 13 16  2  0

+ 17 15  1  0

+ 17 18  1  0

+ 17 19  1  0

+ 18 20  1  0

+ 19 21  1  0

+ 19 22  2  0

+ 20 23  2  0

+ 20 24  1  0

+ 23 25  1  0

+ 24 26  2  0

+ 25 27  2  0

+  7 11  1  0

+  9 12  1  0

+ 26 27  1  0

+  5 28  1  0

+  6 29  1  0

+  6 30  1  0

+  8 31  1  0

+ 11 32  1  0

+ 12 33  1  0

+ 14 34  1  0

+ 14 35  1  0

+ 14 36  1  0

+ 15 37  1  0

+ 17 38  1  0

+ 18 39  1  0

+ 18 40  1  0

+ 21 41  1  0

+ 23 42  1  0

+ 24 43  1  0

+ 25 44  1  0

+ 26 45  1  0

+ 27 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1436-34-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -1.3532    0.0624   -0.5687 C   0  0  0

+   -2.6234   -0.6178   -0.0541 C   0  0  0

+   -2.2355    0.6932    0.3617 O   0  0  0

+   -0.1387   -0.4940    0.1770 C   0  0  0

+    1.1315    0.1862   -0.3376 C   0  0  0

+    2.3460   -0.3703    0.4081 C   0  0  0

+    3.6161    0.3099   -0.1065 C   0  0  0

+   -0.8391    0.9496    0.0000 H   0  0  0

+   -3.6484   -0.5892    0.0000 H   0  0  0

+   -2.3878   -1.6157    0.0000 H   0  0  0

+   -0.7561   -1.3127    0.0000 H   0  0  0

+    0.5283   -1.2728    0.0000 H   0  0  0

+    1.7489    1.0049    0.0000 H   0  0  0

+    0.4646    0.9651    0.0000 H   0  0  0

+    1.7286   -1.1890    0.0000 H   0  0  0

+    3.0130   -1.1491    0.0000 H   0  0  0

+    4.1002   -0.5940    0.0000 H   0  0  0

+    4.5200    0.7940    0.0000 H   0  0  0

+    3.1320    1.2138    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  2  3  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  7 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105579-74-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 44                          1 V2000

+   -1.2520    0.6394   -0.0032 C   0  0  0

+   -1.2398   -0.7396   -0.0338 C   0  0  0

+   -0.0760    1.3982    0.1872 C   0  0  0

+   -2.5249    1.4256   -0.1892 C   0  0  1

+    0.0643   -1.4027    0.1642 C   0  0  0

+   -2.4267   -1.4664   -0.2656 C   0  0  0

+    1.2214    0.7440   -0.0532 C   0  0  0

+   -0.2147    2.7032    0.6445 C   0  0  0

+   -3.8698    0.7105   -0.1278 C   0  0  2

+   -2.6310    2.7571    0.4977 C   0  0  0

+    1.2357   -0.6432   -0.0411 C   0  0  0

+    0.2091   -2.7052    0.6247 C   0  0  0

+   -3.7933   -0.8318   -0.1657 C   0  0  1

+   -2.3692   -2.6312   -0.6067 O   0  0  0

+    2.4106    1.4586   -0.2993 C   0  0  0

+   -1.4664    3.3248    0.8667 C   0  0  0

+    0.8899    3.4299    0.9402 O   0  0  0

+   -4.0894   -0.0489   -1.3203 O   0  0  0

+    2.5222   -1.4053   -0.2179 C   0  0  1

+    1.4552   -3.3678    0.7184 C   0  0  0

+   -0.8780   -3.3857    1.0603 O   0  0  0

+    3.7739    0.8510   -0.0679 C   0  0  1

+    2.3586    2.5834   -0.7555 O   0  0  0

+    3.8570   -0.6938   -0.0221 C   0  0  2

+    2.6103   -2.7973    0.3321 C   0  0  0

+    4.1954    0.0724   -1.1835 O   0  0  0

+   -1.6356    1.9690    0.0000 H   0  0  0

+   -4.6790    1.3673    0.0000 H   0  0  0

+   -3.5360    3.2739    0.0000 H   0  0  0

+   -4.5567   -1.5413    0.0000 H   0  0  0

+   -1.4626    4.3670    0.0000 H   0  0  0

+    1.7606    4.0027    0.0000 H   0  0  0

+    1.6335   -1.9497    0.0000 H   0  0  0

+    1.4396   -4.4099    0.0000 H   0  0  0

+   -1.7614   -3.9387    0.0000 H   0  0  0

+    4.4819    1.6157    0.0000 H   0  0  0

+    4.6206   -1.4030    0.0000 H   0  0  0

+    3.5124   -3.3191    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  2  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 15 22  1  0

+ 15 23  2  0

+ 19 24  1  0

+ 19 25  1  0

+ 22 26  1  0

+  7 11  2  0

+  9 13  1  0

+ 10 16  2  0

+ 13 18  1  0

+ 20 25  2  0

+ 22 24  1  0

+ 24 26  1  0

+  4 27  1  0

+  9 28  1  0

+ 10 29  1  0

+ 13 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 24 37  1  0

+ 25 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-99-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.6144   -0.4029   -0.0032 C   0  0  0

+   -0.7164   -0.7642   -0.0032 C   0  0  0

+    0.9717    0.9353   -0.0009 C   0  0  0

+    1.6633   -1.4473    0.0004 N   0  3  0

+   -1.7047    0.2224   -0.0007 C   0  0  0

+   -0.0042    1.9187    0.0016 C   0  0  0

+    2.6492    1.3821   -0.0004 Cl  0  0  0

+    1.3505   -2.6244    0.0033 O   0  0  0

+    2.8391   -1.1295    0.0003 O   0  5  0

+   -1.3380    1.5702    0.0017 C   0  0  0

+   -3.1316   -0.1577   -0.0001 C   0  0  0

+   -4.0828    0.7963    0.0023 O   0  0  0

+   -3.4477   -1.3306   -0.0018 O   0  0  0

+   -0.9832   -1.7682    0.0000 H   0  0  0

+    0.2697    2.9207    0.0000 H   0  0  0

+   -2.0688    2.3084    0.0000 H   0  0  0

+   -4.8163    1.5319    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+  6 10  2  0

+  2 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 12 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74-31-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -1.2233   -0.6455   -0.0650 C   0  0  0

+   -2.4594   -1.2991   -0.1318 N   0  0  0

+   -0.6378   -0.3915    1.1689 C   0  0  0

+   -0.5797   -0.2562   -1.2324 C   0  0  0

+   -3.6439   -0.5615   -0.0662 C   0  0  0

+    0.5814    0.2525    1.2348 C   0  0  0

+    0.6399    0.3880   -1.1664 C   0  0  0

+   -4.8663   -1.2145    0.0292 C   0  0  0

+   -3.6017    0.8272   -0.0905 C   0  0  0

+    1.2227    0.6466    0.0673 C   0  0  0

+   -6.0354   -0.4821    0.0939 C   0  0  0

+   -4.7745    1.5531   -0.0255 C   0  0  0

+    2.4591    1.2998    0.1341 N   0  0  0

+   -5.9902    0.8995    0.0637 C   0  0  0

+    3.6433    0.5622    0.0647 C   0  0  0

+    4.8659    1.2154   -0.0328 C   0  0  0

+    3.6019   -0.8259    0.0986 C   0  0  0

+    6.0344    0.4832   -0.1013 C   0  0  0

+    4.7747   -1.5521    0.0296 C   0  0  0

+    5.9891   -0.8989   -0.0730 C   0  0  0

+   -2.4959   -2.3334    0.0000 H   0  0  0

+   -0.1898   -1.3245    0.0000 H   0  0  0

+   -1.0894    0.6445    0.0000 H   0  0  0

+    1.0943   -0.6464    0.0000 H   0  0  0

+    0.1881    1.3191    0.0000 H   0  0  0

+   -4.9020   -2.2488    0.0000 H   0  0  0

+   -2.6901    1.3171    0.0000 H   0  0  0

+   -6.9489   -0.9685    0.0000 H   0  0  0

+   -4.7430    2.5876    0.0000 H   0  0  0

+    2.4958    2.3341    0.0000 H   0  0  0

+   -6.8697    1.4449    0.0000 H   0  0  0

+    4.9016    2.2497    0.0000 H   0  0  0

+    2.6903   -1.3160    0.0000 H   0  0  0

+    6.9480    0.9695    0.0000 H   0  0  0

+    4.7432   -2.5866    0.0000 H   0  0  0

+    6.8687   -1.4443    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

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+  7 10  2  0

+ 12 14  1  0

+ 19 20  2  0

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+  3 22  1  0

+  4 23  1  0

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+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142044-37-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    1.5880   -1.0602   -0.3023 C   0  0  1

+    0.1023   -0.8259   -0.1665 C   0  0  0

+    2.4954    0.1830   -0.3235 C   0  0  2

+    2.2786   -0.5913    0.8577 O   0  0  0

+   -0.3858    0.4760   -0.0652 C   0  0  0

+   -0.7719   -1.8938   -0.1420 C   0  0  0

+    1.8313    1.5341   -0.2036 C   0  0  0

+    0.5224    1.6363   -0.0884 C   0  0  0

+   -1.6982    0.6784    0.0547 N   0  3  0

+   -2.1300   -1.6319   -0.0152 C   0  0  0

+   -2.5551   -0.3192    0.0813 C   0  0  0

+   -2.2000    2.0507    0.1601 C   0  0  0

+    1.8142   -2.0714    0.0000 H   0  0  0

+    3.5272    0.2781    0.0000 H   0  0  0

+   -0.4194   -2.8682    0.0000 H   0  0  0

+    2.4129    2.3917    0.0000 H   0  0  0

+    0.1052    2.5848    0.0000 H   0  0  0

+   -2.8164   -2.4081    0.0000 H   0  0  0

+   -3.5710   -0.1151    0.0000 H   0  0  0

+   -1.2268    2.4066    0.0000 H   0  0  0

+   -2.5559    3.0239    0.0000 H   0  0  0

+   -3.1732    1.6948    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

+  9 11  2  0

+  9 12  1  0

+  3  4  1  0

+  7  8  2  0

+ 10 11  1  0

+  1 13  1  0

+  3 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+462-95-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.0000   -1.0721    0.0002 C   0  0  0

+   -1.0236   -0.2469    0.5601 O   0  0  0

+    1.0236   -0.2472   -0.5600 O   0  0  0

+   -1.9761   -0.0087   -0.4781 C   0  0  0

+    1.9761   -0.0085    0.4781 C   0  0  0

+   -3.1050    0.8738    0.0581 C   0  0  0

+    3.1050    0.8738   -0.0585 C   0  0  0

+   -0.6720   -1.7937    0.0000 H   0  0  0

+    0.6719   -1.7938    0.0000 H   0  0  0

+   -2.8302   -0.5014    0.0000 H   0  0  0

+   -1.8394   -0.9852    0.0000 H   0  0  0

+    1.8397   -0.9851    0.0000 H   0  0  0

+    2.8303   -0.5011    0.0000 H   0  0  0

+   -2.4977    1.6506    0.0000 H   0  0  0

+   -3.8818    1.4811    0.0000 H   0  0  0

+   -3.7123    0.0970    0.0000 H   0  0  0

+    3.7122    0.0969    0.0000 H   0  0  0

+    3.8819    1.4810    0.0000 H   0  0  0

+    2.4978    1.6507    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  1  8  1  0

+  1  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  7 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+615-05-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.9061    0.0875    0.0018 C   0  0  0

+   -0.1450   -1.0792    0.0006 C   0  0  0

+   -0.2797    1.3225    0.0019 C   0  0  0

+   -2.2651    0.0136   -0.0028 O   0  0  0

+    1.2396   -1.0013   -0.0004 C   0  0  0

+   -0.7766   -2.3281    0.0010 N   0  0  0

+    1.1006    1.3995    0.0008 C   0  0  0

+   -2.7519    1.3571   -0.0002 C   0  0  0

+    1.8631    0.2389   -0.0003 C   0  0  0

+    3.2599    0.3195   -0.0014 N   0  0  0

+   -0.8491    2.1943    0.0000 H   0  0  0

+    1.8108   -1.8720    0.0000 H   0  0  0

+   -1.8163   -2.3857    0.0000 H   0  0  0

+   -0.2068   -3.1997    0.0000 H   0  0  0

+    1.5693    2.3293    0.0000 H   0  0  0

+   -1.7729    1.7118    0.0000 H   0  0  0

+   -3.1066    2.3361    0.0000 H   0  0  0

+   -3.7309    1.0024    0.0000 H   0  0  0

+    3.8316   -0.5508    0.0000 H   0  0  0

+    3.7277    1.2498    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  9 10  1  0

+  7  9  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+868-77-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+   -0.8145   -0.4480   -0.0024 C   0  0  0

+   -1.9575    0.4755   -0.0038 C   0  0  0

+    0.4317    0.0217   -0.2109 O   0  0  0

+   -0.9921   -1.6345    0.1916 O   0  0  0

+   -1.7366    1.9477   -0.2382 C   0  0  0

+   -3.1879    0.0118    0.2021 C   0  0  0

+    1.5612   -0.8908   -0.2096 C   0  0  0

+    2.8499   -0.1075   -0.4675 C   0  0  0

+    3.0264    0.8705    0.5593 O   0  0  0

+   -0.7042    1.7928    0.0000 H   0  0  0

+   -1.5817    2.9801    0.0000 H   0  0  0

+   -2.7690    2.1026    0.0000 H   0  0  0

+   -3.9952    0.6737    0.0000 H   0  0  0

+   -3.3575   -1.0183    0.0000 H   0  0  0

+    0.8163   -1.6222    0.0000 H   0  0  0

+    2.2022   -1.7147    0.0000 H   0  0  0

+    3.1630   -1.1034    0.0000 H   0  0  0

+    3.8918   -0.0418    0.0000 H   0  0  0

+    3.2118    1.8978    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  7  8  1  0

+  8  9  1  0

+  5 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+491-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+    0.0817   -1.7365    0.2678 O   0  0  0

+    0.5162   -0.6000    0.1886 C   0  0  0

+    1.9583   -0.3257    0.0782 C   0  0  0

+   -0.3749    0.5760    0.1918 C   0  0  0

+    2.3951    1.0004    0.2520 C   0  0  0

+    2.8794   -1.3449   -0.1931 C   0  0  0

+    0.1805    1.8055    0.3565 C   0  0  0

+   -1.8398    0.4204    0.0192 C   0  0  0

+    1.4998    1.9722    0.5244 O   0  0  0

+    3.7469    1.2891    0.1431 C   0  0  0

+    2.4568   -2.6245   -0.3532 O   0  0  0

+    4.2231   -1.0362   -0.2961 C   0  0  0

+   -2.4855    1.0329   -1.0534 C   0  0  0

+   -2.5728   -0.3435    0.9261 C   0  0  0

+    4.6529    0.2762   -0.1295 C   0  0  0

+   -3.8480    0.8859   -1.2115 C   0  0  0

+   -3.9347   -0.4866    0.7626 C   0  0  0

+    5.9743    0.5683   -0.2356 O   0  0  0

+   -4.5758    0.1290   -0.3038 C   0  0  0

+   -5.9181   -0.0136   -0.4621 O   0  0  0

+   -6.3758   -0.8351    0.6139 C   0  0  0

+   -0.4225    2.6220    0.0000 H   0  0  0

+    4.0617    2.2540    0.0000 H   0  0  0

+    2.1385   -3.5883    0.0000 H   0  0  0

+    4.9075   -1.7857    0.0000 H   0  0  0

+   -2.1607    1.9945    0.0000 H   0  0  0

+   -2.1264   -1.2550    0.0000 H   0  0  0

+   -4.2952    1.7971    0.0000 H   0  0  0

+   -4.2638   -1.4467    0.0000 H   0  0  0

+    6.9653    0.7874    0.0000 H   0  0  0

+   -7.2624   -0.3411    0.0000 H   0  0  0

+   -6.8698   -1.7217    0.0000 H   0  0  0

+   -5.4892   -1.3291    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  9  5  1  0

+ 10  5  1  0

+ 11  6  1  0

+ 12  6  2  0

+ 13  8  2  0

+ 14  8  1  0

+ 15 10  2  0

+ 16 13  1  0

+ 17 14  2  0

+ 18 15  1  0

+ 19 16  2  0

+ 20 19  1  0

+ 21 20  1  0

+  7  9  1  0

+ 12 15  1  0

+ 17 19  1  0

+  7 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 21 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82389-38-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+    2.5144   -0.7898    0.6693 C   0  0  2

+    1.7376   -1.2062   -0.5814 C   0  0  1

+    3.4878    0.3046    0.3148 C   0  0  0

+    2.8331   -1.9692   -0.0719 O   0  0  0

+    0.4404   -1.8559   -0.1739 C   0  0  0

+    3.0992    1.6289    0.3971 C   0  0  0

+    4.7709   -0.0153   -0.0872 C   0  0  0

+   -0.7663   -1.0381    0.0039 C   0  0  0

+    0.3929   -3.0543    0.0073 O   0  0  0

+    3.9920    2.6326    0.0720 C   0  0  0

+    5.6640    0.9887   -0.4124 C   0  0  0

+   -1.9730   -1.6397    0.3825 C   0  0  0

+   -0.7125    0.3467   -0.1992 C   0  0  0

+    5.2737    2.3124   -0.3356 C   0  0  0

+   -3.0940   -0.8777    0.5478 C   0  0  0

+   -1.8473    1.1067   -0.0303 C   0  0  0

+   -3.0431    0.4982    0.3412 C   0  0  0

+   -4.1909    1.2690    0.5118 N   0  0  0

+   -5.3121    0.9691   -0.1734 C   0  0  0

+   -6.5905    1.7149    0.1099 C   0  0  0

+   -5.2921    0.0989   -1.0179 O   0  0  0

+    1.8880    0.0041    0.0000 H   0  0  0

+    1.2722   -0.3084    0.0000 H   0  0  0

+    2.1125    1.8504    0.0000 H   0  0  0

+    5.0695   -0.9815    0.0000 H   0  0  0

+    3.6936    3.5988    0.0000 H   0  0  0

+    6.6509    0.7679    0.0000 H   0  0  0

+   -2.0410   -2.6487    0.0000 H   0  0  0

+    0.1887    0.8055    0.0000 H   0  0  0

+    5.9736    3.0423    0.0000 H   0  0  0

+   -3.9963   -1.3342    0.0000 H   0  0  0

+   -1.7870    2.1162    0.0000 H   0  0  0

+   -4.0248    2.2665    0.0000 H   0  0  0

+   -6.0809    2.5884    0.0000 H   0  0  0

+   -7.4640    2.2245    0.0000 H   0  0  0

+   -7.1001    0.8414    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 12 15  2  0

+ 13 16  1  0

+ 15 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+ 19 21  2  0

+  2  4  1  0

+ 11 14  2  0

+ 16 17  2  0

+  1 22  1  0

+  2 23  1  0

+  6 24  1  0

+  7 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134-03-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -1.9606   -0.5966    0.7460 C   0  0  2

+   -2.9213    0.1920   -0.1185 C   0  0  0

+   -0.9226    0.3579    1.1132 O   0  0  0

+   -1.3442   -1.7285   -0.0784 C   0  0  2

+   -2.4124    1.4506   -0.1867 C   0  0  0

+   -4.0474   -0.2602   -0.6999 O   0  0  0

+   -1.2321    1.5319    0.5459 C   0  0  0

+   -0.3733   -2.5254    0.7953 C   0  0  0

+   -0.6395   -1.1770   -1.1925 O   0  0  0

+   -2.9765    2.4837   -0.8737 O   0  0  0

+   -0.4948    2.6481    0.6691 O   0  0  0

+    0.2024   -3.5826    0.0253 O   0  0  0

+   11.5304    0.5484   -0.2230 Na  0  3  0

+   -2.6706   -1.1839    0.0000 H   0  0  0

+   -2.0542   -2.3158    0.0000 H   0  0  0

+    0.5432   -2.4304    0.0000 H   0  0  0

+   -0.1081   -1.6430    0.0000 H   0  0  0

+    0.0861   -0.6091    0.0000 H   0  0  0

+   -3.4181    3.2924    0.0000 H   0  0  0

+    0.6430   -4.3918    0.0000 H   0  0  0

+   -4.9024   -0.6035    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+  7 11  2  0

+  8 12  1  0

+  5  7  1  0

+  1 14  1  0

+  4 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+  6 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.1507   -0.1275    0.0039 C   0  0  0

+    0.6581   -1.2654    0.0037 C   0  0  0

+    0.4370    1.1392    0.0017 C   0  0  0

+   -1.6218   -0.2629    0.0004 C   0  0  0

+    2.0313   -1.1317    0.0012 C   0  0  0

+    1.8111    1.2584   -0.0008 C   0  0  0

+   -2.3994    0.8371    0.0007 O   0  0  0

+   -2.1302   -1.3661   -0.0026 O   0  0  0

+    2.6070    0.1263   -0.0010 C   0  0  0

+   -3.8453    0.7040   -0.0028 C   0  0  0

+    4.1076    0.2644   -0.0037 C   0  0  0

+    0.2274   -2.2097    0.0000 H   0  0  0

+   -0.1588    1.9890    0.0000 H   0  0  0

+    2.6338   -1.9768    0.0000 H   0  0  0

+    2.2492    2.1993    0.0000 H   0  0  0

+   -3.9404    1.7375    0.0000 H   0  0  0

+   -4.8788    0.6089    0.0000 H   0  0  0

+   -3.7502   -0.3295    0.0000 H   0  0  0

+    4.2027   -0.7691    0.0000 H   0  0  0

+    5.1411    0.3595    0.0000 H   0  0  0

+    4.0125    1.2979    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+  9 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-70-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.6752   -1.2074   -0.0033 C   0  0  0

+   -0.7078   -1.1886   -0.0022 C   0  0  0

+    1.3833   -0.0187   -0.0024 C   0  0  0

+    1.5227   -2.7225    0.0015 Cl  0  0  0

+   -1.3833    0.0189   -0.0002 C   0  0  0

+    0.7080    1.1885   -0.0004 C   0  0  0

+   -0.6754    1.2073    0.0007 C   0  0  0

+   -3.1191    0.0426    0.0006 Cl  0  0  0

+    1.5964    2.6799    0.0006 Cl  0  0  0

+   -1.2388   -2.0802    0.0000 H   0  0  0

+    2.4209   -0.0328    0.0000 H   0  0  0

+   -1.1820    2.1130    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  5  8  1  0

+  6  9  1  0

+  6  7  1  0

+  2 10  1  0

+  3 11  1  0

+  7 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146177-65-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+    2.1835   -0.5571    0.0437 C   0  0  0

+    0.7237   -0.5139    0.0402 C   0  0  0

+    2.8920    0.6439   -0.0502 C   0  0  0

+    3.0902   -1.5583    0.1166 N   0  0  0

+    0.0805    0.7458   -0.0584 C   0  0  0

+   -0.0035   -1.6281    0.1277 N   0  0  0

+    4.2328    0.3011   -0.0233 N   0  0  0

+    2.2120    1.8605   -0.1461 C   0  0  0

+    4.3015   -1.0568    0.0805 C   0  0  0

+   -1.2543    0.8044   -0.0630 N   0  0  0

+    0.8562    1.9177   -0.1495 C   0  0  0

+   -1.3152   -1.5554    0.1224 C   0  0  0

+    5.3673    1.2252   -0.0954 C   0  0  0

+    5.4678   -1.7918    0.1345 N   0  0  0

+   -1.9595   -0.3112    0.0242 C   0  0  0

+    0.1702    3.2554   -0.2541 C   0  0  0

+   -3.4410   -0.2478    0.0196 C   0  0  0

+   -4.1798   -1.2013   -0.6786 C   0  0  0

+   -4.1003    0.7625    0.7184 C   0  0  0

+   -5.5586   -1.1372   -0.6794 C   0  0  0

+   -5.4790    0.8165    0.7106 C   0  0  0

+   -6.2071   -0.1294    0.0110 C   0  0  0

+    2.7539    2.7411    0.0000 H   0  0  0

+   -1.8768   -2.4235    0.0000 H   0  0  0

+    6.0203    0.4236    0.0000 H   0  0  0

+    6.1689    1.8782    0.0000 H   0  0  0

+    4.7143    2.0268    0.0000 H   0  0  0

+    5.4278   -2.8250    0.0000 H   0  0  0

+    6.3826   -1.3099    0.0000 H   0  0  0

+    1.0902    3.7272    0.0000 H   0  0  0

+   -0.3016    4.1754    0.0000 H   0  0  0

+   -0.7498    2.7836    0.0000 H   0  0  0

+   -3.7464   -2.1400    0.0000 H   0  0  0

+   -3.5903    1.6619    0.0000 H   0  0  0

+   -6.0748   -2.0331    0.0000 H   0  0  0

+   -5.9173    1.7529    0.0000 H   0  0  0

+   -7.2401   -0.0859    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 10 15  2  0

+ 11 16  1  0

+ 15 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+ 18 20  1  0

+ 19 21  2  0

+ 20 22  2  0

+  7  9  1  0

+  8 11  2  0

+ 12 15  1  0

+ 21 22  1  0

+  8 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-13-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.0000    0.0102   -0.0014 C   0  0  0

+   -1.1672    0.6841    0.0004 N   0  0  0

+    1.1672    0.6841    0.0004 N   0  0  0

+    0.0000   -1.2057    0.0004 O   0  0  0

+   -1.1672    1.6949    0.0000 H   0  0  0

+   -2.0426    0.1787    0.0000 H   0  0  0

+    2.0426    0.1787    0.0000 H   0  0  0

+    1.1672    1.6949    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+29916-56-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.1287    0.0065    0.0749 C   0  0  0

+   -1.3485    0.0030   -0.0034 N   0  3  0

+    1.0256    1.2267    0.0568 C   0  0  0

+    1.0263   -1.2124    0.1951 C   0  0  0

+   -2.0562   -1.2232    0.0251 O   0  5  0

+   -2.0549    1.2259   -0.1070 O   0  5  0

+    2.4781    0.7156    0.1529 C   0  0  0

+    2.3914   -0.7435   -0.3666 C   0  0  0

+    1.4919    2.2253    0.0000 H   0  0  0

+    0.0777    1.7889    0.0000 H   0  0  0

+    0.0773   -1.7728    0.0000 H   0  0  0

+    1.4879   -2.2132    0.0000 H   0  0  0

+    3.5674    0.5483    0.0000 H   0  0  0

+    2.7458    1.7847    0.0000 H   0  0  0

+    2.6112   -1.8234    0.0000 H   0  0  0

+    3.4907   -0.6656    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  7  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-69-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+   -0.7762   -0.2577    0.0000 C   0  0  0

+   -2.0994    0.5104    0.0000 C   0  0  0

+    0.3891    0.7339    0.0000 C   0  0  0

+   -3.2646   -0.4812    0.0000 C   0  0  0

+    1.9484   -0.1712    0.0000 Cl  0  0  0

+   -1.4608   -1.1787    0.0000 H   0  0  0

+    0.0615   -1.0420    0.0000 H   0  0  0

+   -1.4148    1.4314    0.0000 H   0  0  0

+   -2.9371    1.2947    0.0000 H   0  0  0

+    1.0737    1.6549    0.0000 H   0  0  0

+   -0.4486    1.5182    0.0000 H   0  0  0

+   -4.0083    0.3927    0.0000 H   0  0  0

+   -4.1385   -1.2249    0.0000 H   0  0  0

+   -2.5209   -1.3551    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109143-20-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -0.6045   -0.0486    0.0340 C   0  0  0

+   -1.6331   -0.2976    0.9542 C   0  0  0

+    0.7331   -0.0855    0.4471 C   0  0  0

+   -1.2753    0.2159   -1.2441 C   0  0  0

+   -1.3098   -0.5812    2.2802 C   0  0  0

+   -2.8012   -0.1960    0.2871 O   0  0  0

+    1.7598    0.1630   -0.4692 N   0  0  0

+    1.0321   -0.3689    1.7677 C   0  0  0

+   -2.5896    0.1106   -1.0051 C   0  0  0

+    0.0135   -0.6146    2.6771 C   0  0  0

+   -2.2974   -0.8248    3.1840 O   0  0  0

+    2.4969    1.3317    0.0294 C   0  0  0

+    2.6793   -0.9801   -0.3931 C   0  0  0

+   -3.6535    0.2999   -2.0172 N   0  3  0

+   -1.6577   -1.0787    4.4364 C   0  0  0

+    1.8396    2.6105   -0.4936 C   0  0  0

+    2.2131   -2.0746   -1.3551 C   0  0  0

+   -4.8236    0.1825   -1.7001 O   0  0  0

+   -3.3587    0.5730   -3.1670 O   0  5  0

+    2.7444    4.0449    0.1184 Cl  0  0  0

+    3.3417   -3.4776   -1.2617 Cl  0  0  0

+   -1.1509    1.0516    0.0000 H   0  0  0

+    1.8484   -0.5869    0.0000 H   0  0  0

+    0.1027   -1.4548    0.0000 H   0  0  0

+    3.1206    0.7617    0.0000 H   0  0  0

+    3.1682    1.8448    0.0000 H   0  0  0

+    3.3923   -1.4334    0.0000 H   0  0  0

+    3.2426   -0.3504    0.0000 H   0  0  0

+   -1.9694   -1.8640    0.0000 H   0  0  0

+   -0.8724   -1.3904    0.0000 H   0  0  0

+   -1.3460   -0.2934    0.0000 H   0  0  0

+    1.2159    3.1805    0.0000 H   0  0  0

+    1.1683    2.0975    0.0000 H   0  0  0

+    1.5001   -1.6213    0.0000 H   0  0  0

+    1.6498   -2.7043    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  5 10  2  0

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+  9 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 13 17  1  0

+ 14 18  2  0

+ 14 19  1  0

+ 16 20  1  0

+ 17 21  1  0

+  6  9  1  0

+  8 10  1  0

+  4 22  1  0

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+ 10 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-95-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.1018    0.0001    0.0033 C   0  0  0

+    0.5895   -1.1972    0.0029 C   0  0  0

+    0.5892    1.1971    0.0010 C   0  0  0

+   -1.5820    0.0000    0.0001 N   0  3  0

+    1.9717   -1.1972    0.0002 C   0  0  0

+    1.9718    1.1971   -0.0018 C   0  0  0

+   -2.1910    1.0548    0.0004 O   0  0  0

+   -2.1909   -1.0548   -0.0030 O   0  5  0

+    2.6629    0.0002   -0.0022 C   0  0  0

+    0.0712   -2.0950    0.0000 H   0  0  0

+    0.0709    2.0949    0.0000 H   0  0  0

+    2.4901   -2.0949    0.0000 H   0  0  0

+    2.4901    2.0949    0.0000 H   0  0  0

+    3.6995    0.0003    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6  9  2  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+125239-64-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -1.2386    0.5710   -0.0048 C   0  0  0

+   -1.0388   -0.8835   -0.0027 C   0  0  0

+   -0.1911    1.3899   -0.0048 N   0  0  0

+   -2.5549    1.0778   -0.0009 C   0  0  0

+    0.1912   -1.3898   -0.0004 N   0  0  0

+   -2.1689   -1.7256   -0.0028 C   0  0  0

+    1.0387    0.8837   -0.0029 C   0  0  0

+   -3.6082    0.2167    0.0047 C   0  0  0

+    1.2386   -0.5710    0.0001 C   0  0  0

+   -3.4174   -1.1785   -0.0048 C   0  0  0

+    2.1690    1.7257   -0.0033 C   0  0  0

+   -4.8724    0.7140    0.0089 O   0  0  0

+    2.5549   -1.0779    0.0021 C   0  0  0

+   -4.5302   -2.0190   -0.0054 N   0  0  0

+    3.4174    1.1785   -0.0016 C   0  0  0

+   -4.7560    2.1382    0.0061 C   0  0  0

+    3.6082   -0.2168    0.0020 C   0  0  0

+    4.5302    2.0188   -0.0025 N   0  0  0

+    4.8723   -0.7140    0.0044 O   0  0  0

+    4.7559   -2.1383    0.0065 C   0  0  0

+   -2.7204    2.1105    0.0000 H   0  0  0

+   -2.0502   -2.7647    0.0000 H   0  0  0

+    2.0505    2.7648    0.0000 H   0  0  0

+    2.7204   -2.1106    0.0000 H   0  0  0

+   -5.4934   -1.6114    0.0000 H   0  0  0

+   -4.4016   -3.0569    0.0000 H   0  0  0

+   -3.7136    2.0530    0.0000 H   0  0  0

+   -4.6708    3.1806    0.0000 H   0  0  0

+   -5.7984    2.2234    0.0000 H   0  0  0

+    5.4933    1.6111    0.0000 H   0  0  0

+    4.4017    3.0567    0.0000 H   0  0  0

+    3.7135   -2.0531    0.0000 H   0  0  0

+    4.6707   -3.1807    0.0000 H   0  0  0

+    5.7983   -2.2235    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

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+ 10 14  1  0

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+ 12 16  1  0

+ 13 17  2  0

+ 15 18  1  0

+ 17 19  1  0

+ 19 20  1  0

+  7  9  1  0

+  8 10  1  0

+ 15 17  1  0

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+ 16 27  1  0

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+ 16 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+156215-58-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.8720    0.5332    0.0041 C   0  0  0

+   -0.7390   -0.8773    0.0028 C   0  0  0

+    0.2381    1.3275    0.0032 C   0  0  0

+   -2.2357    0.7918    0.0006 N   0  0  0

+    0.4587   -1.4447    0.0011 N   0  0  0

+   -1.9904   -1.3880    0.0036 N   0  0  0

+    1.5006    0.7045    0.0010 C   0  0  0

+   -2.8712   -0.4165   -0.0027 C   0  0  0

+   -2.8724    2.1113    0.0004 C   0  0  0

+    1.5747   -0.7120    0.0006 C   0  0  0

+    2.6833    1.4615   -0.0012 C   0  0  0

+   -4.2350   -0.5895   -0.0067 N   0  0  0

+    2.8397   -1.3285   -0.0009 C   0  0  0

+    3.8887    0.8280   -0.0045 C   0  0  0

+    3.9648   -0.5633   -0.0011 C   0  0  0

+    0.1543    2.3551    0.0000 H   0  0  0

+   -1.9438    2.5594    0.0000 H   0  0  0

+   -3.3205    3.0399    0.0000 H   0  0  0

+   -3.8010    1.6632    0.0000 H   0  0  0

+    2.6392    2.4916    0.0000 H   0  0  0

+   -4.8588    0.2314    0.0000 H   0  0  0

+   -4.6341   -1.5402    0.0000 H   0  0  0

+    2.9138   -2.3569    0.0000 H   0  0  0

+    4.7563    1.3851    0.0000 H   0  0  0

+    4.8889   -1.0205    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  6  8  2  0

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+ 14 15  2  0

+  3 16  1  0

+  9 17  1  0

+  9 18  1  0

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+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83-67-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.0334    0.9740   -0.0019 C   0  0  0

+   -0.8244   -0.1680   -0.0013 C   0  0  0

+    1.3449    0.8328   -0.0010 N   0  0  0

+   -0.8565    2.0257    0.0020 N   0  0  0

+   -0.2026   -1.4353    0.0001 C   0  0  0

+   -2.1339    0.2691   -0.0020 N   0  0  0

+    1.8979   -0.3947    0.0004 C   0  0  0

+    2.2018    2.0210   -0.0021 C   0  0  0

+   -2.0994    1.6159    0.0050 C   0  0  0

+    1.1447   -1.5080    0.0009 N   0  0  0

+   -0.8745   -2.4511    0.0011 O   0  0  0

+   -3.3334   -0.5720   -0.0024 C   0  0  0

+    3.1095   -0.4989    0.0007 O   0  0  0

+    3.0220    1.4295    0.0000 H   0  0  0

+    2.7933    2.8412    0.0000 H   0  0  0

+    1.3816    2.6125    0.0000 H   0  0  0

+   -2.9111    2.2189    0.0000 H   0  0  0

+    1.5946   -2.4136    0.0000 H   0  0  0

+   -3.9139    0.2559    0.0000 H   0  0  0

+   -4.1613   -1.1525    0.0000 H   0  0  0

+   -2.7529   -1.3999    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  1  0

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+  6  9  1  0

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+  8 14  1  0

+  8 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59703-84-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 66                          1 V2000

+   -3.9634    2.3565   -0.8252 C   0  0  1

+   -4.6887    2.3760    0.4531 N   0  0  0

+   -2.6267    2.3297   -0.0947 C   0  0  1

+   -4.3226    0.6897   -1.5049 S   0  0  0

+   -5.4751    1.1956    0.7830 C   0  0  2

+   -3.5127    2.5600    1.1003 C   0  0  0

+   -2.1138    0.9577   -0.0651 N   0  0  0

+   -5.7508    0.2684   -0.4198 C   0  0  0

+   -6.7828    1.6197    1.4004 C   0  0  0

+   -3.2585    2.8227    2.2568 O   0  0  0

+   -0.7846    0.7354   -0.0495 C   0  0  0

+   -7.0794    0.6167   -1.0938 C   0  0  0

+   -5.7147   -1.2037   -0.0044 C   0  0  0

+   -7.1949    2.7600    1.2374 O   0  0  0

+   -7.4323    0.8236    2.0648 O   0  0  0

+   -0.2570   -0.6759   -0.0190 C   0  0  1

+   -0.0130    1.6711   -0.0599 O   0  0  0

+   -0.7357   -1.4176   -1.2404 C   0  0  0

+    1.2077   -0.6495   -0.0068 N   0  0  0

+   -1.5113   -2.5529   -1.0996 C   0  0  0

+   -0.4040   -0.9591   -2.5018 C   0  0  0

+    1.8945   -1.6371    0.6010 C   0  0  0

+   -1.9505   -3.2334   -2.2201 C   0  0  0

+   -0.8431   -1.6393   -3.6220 C   0  0  0

+    3.2420   -1.6129    0.6123 N   0  0  0

+    1.2986   -2.5497    1.1389 O   0  0  0

+   -1.6140   -2.7783   -3.4811 C   0  0  0

+    3.9302   -2.6018    1.2209 C   0  0  0

+    3.9598   -0.5177   -0.0403 C   0  0  0

+    5.4262   -2.5331    1.2385 C   0  0  0

+    3.3479   -3.5285    1.7441 O   0  0  0

+    5.2120   -0.1536    0.7528 C   0  0  0

+    6.0244   -1.3465    1.0015 N   0  0  0

+    6.0881   -3.5254    1.4620 O   0  0  0

+    7.4863   -1.2527    0.9870 C   0  0  0

+    7.9995   -1.5045   -0.4322 C   0  0  0

+   15.6183    7.0482   -1.2353 Na  0  3  0

+   -3.9405    3.3343    0.0000 H   0  0  0

+   -1.9718    3.0561    0.0000 H   0  0  0

+   -4.5895    0.7805    0.0000 H   0  0  0

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+   -7.3274   -0.3294    0.0000 H   0  0  0

+   -6.6925   -1.2277    0.0000 H   0  0  0

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+   -4.7369   -1.1797    0.0000 H   0  0  0

+   -1.2294   -0.5708    0.0000 H   0  0  0

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+   -2.3260   -2.0118    0.0000 H   0  0  0

+    0.1481   -0.1518    0.0000 H   0  0  0

+   -2.5067   -4.0379    0.0000 H   0  0  0

+   -0.0272   -2.1787    0.0000 H   0  0  0

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+    7.0926   -0.3574    0.0000 H   0  0  0

+    7.5687   -2.3826    0.0000 H   0  0  0

+    8.8776   -1.9353    0.0000 H   0  0  0

+    8.4303   -0.6264    0.0000 H   0  0  0

+   -8.0506    0.0658    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  3  6  1  0

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+ 24 27  1  0

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+ 35 59  1  0

+ 35 60  1  0

+ 36 61  1  0

+ 36 62  1  0

+ 36 63  1  0

+ 15 64  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-89-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.0163    0.0001    0.0020 C   0  0  0

+   -0.3064   -1.1912    0.0014 C   0  0  0

+   -0.3068    1.1910    0.0011 C   0  0  0

+   -2.5233   -0.0001   -0.0024 C   0  0  0

+    1.0749   -1.1518   -0.0002 C   0  0  0

+    1.0749    1.1518   -0.0005 C   0  0  0

+    1.7170    0.0001   -0.0011 N   0  0  0

+   -0.8056   -2.0998    0.0000 H   0  0  0

+   -0.8061    2.0995    0.0000 H   0  0  0

+   -2.5234    1.0366    0.0000 H   0  0  0

+   -3.5600   -0.0002    0.0000 H   0  0  0

+   -2.5232   -1.0368    0.0000 H   0  0  0

+    1.6127   -2.0381    0.0000 H   0  0  0

+    1.6126    2.0382    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  6  7  2  0

+  2  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93780-96-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 45                          1 V2000

+   -1.7702    0.0143   -0.2560 C   0  0  0

+   -1.8932   -1.4680   -0.4548 C   0  0  2

+   -0.4872    0.5869   -0.1200 C   0  0  0

+   -2.8666    0.8154   -0.2100 C   0  0  0

+   -3.2297   -2.0815   -0.0844 C   0  0  1

+   -2.0871   -2.1813    0.7681 O   0  0  0

+   -0.3777    2.0354    0.0637 C   0  0  0

+    0.6104   -0.1641   -0.1567 N   0  0  0

+   -4.2386    0.2021   -0.3442 C   0  0  2

+   -2.7562    2.1971   -0.0377 C   0  0  0

+   -4.2811   -1.1146    0.4342 C   0  0  2

+    0.8914    2.6082    0.1987 C   0  0  0

+   -1.5517    2.8098    0.0989 C   0  0  0

+    1.8174    0.3653   -0.0315 C   0  0  0

+   -4.5176   -0.0437   -1.7239 O   0  0  0

+   -4.0527   -0.8619    1.8220 O   0  0  0

+    1.9995    1.7608    0.1498 C   0  0  0

+    3.0056   -0.5016   -0.0801 C   0  0  0

+    3.3460    2.3114    0.2855 C   0  0  0

+    4.2875    0.0704    0.0536 C   0  0  0

+    2.8782   -1.8810   -0.2573 C   0  0  0

+    4.4293    1.5117    0.2395 C   0  0  0

+    5.4172   -0.7572    0.0054 C   0  0  0

+    4.0064   -2.6682   -0.3006 C   0  0  0

+    5.2683   -2.1026   -0.1689 C   0  0  0

+   -0.8670   -1.6485    0.0000 H   0  0  0

+   -3.6501   -3.0348    0.0000 H   0  0  0

+   -4.8020    1.0786    0.0000 H   0  0  0

+   -3.6220    2.7768    0.0000 H   0  0  0

+   -5.2418   -1.5179    0.0000 H   0  0  0

+    1.0104    3.6433    0.0000 H   0  0  0

+   -1.4931    3.8501    0.0000 H   0  0  0

+   -5.2994   -0.7325    0.0000 H   0  0  0

+   -3.3540   -0.0889    0.0000 H   0  0  0

+    3.4747    3.3453    0.0000 H   0  0  0

+    1.9332   -2.3198    0.0000 H   0  0  0

+    5.3813    1.9350    0.0000 H   0  0  0

+    6.3710   -0.3379    0.0000 H   0  0  0

+    3.9087   -3.7055    0.0000 H   0  0  0

+    6.1103   -2.7163    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+ 24 39  1  0

+ 25 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+830-96-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    1.2518   -0.1230    0.2021 C   0  0  0

+    0.1171    0.7918    0.3489 C   0  0  0

+    2.3501    0.6757   -0.1647 C   0  0  0

+    1.4103   -1.5030    0.3435 C   0  0  0

+    0.5702    2.0258    0.0769 C   0  0  0

+   -1.2918    0.4184    0.7318 C   0  0  0

+    1.9023    1.9760   -0.2321 N   0  0  0

+    3.5874    0.0765   -0.3783 C   0  0  0

+    2.6347   -2.0705    0.1303 C   0  0  0

+   -2.0978    0.1069   -0.5308 C   0  0  0

+    3.7225   -1.2861   -0.2289 C   0  0  0

+   -3.5067   -0.2665   -0.1480 C   0  0  0

+   -4.3995   -0.5820   -1.0993 O   0  0  0

+   -3.8326   -0.2820    1.0154 O   0  0  0

+    0.5847   -2.0994    0.0000 H   0  0  0

+    0.0029    2.8717    0.0000 H   0  0  0

+   -1.0616    1.4106    0.0000 H   0  0  0

+   -2.0609    1.0861    0.0000 H   0  0  0

+    2.5091    2.7940    0.0000 H   0  0  0

+    4.4226    0.6594    0.0000 H   0  0  0

+    2.7317   -3.0844    0.0000 H   0  0  0

+   -2.3280   -0.8853    0.0000 H   0  0  0

+   -1.3287   -0.5608    0.0000 H   0  0  0

+    4.6510   -1.7048    0.0000 H   0  0  0

+   -5.3598   -0.9214    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+  4  9  2  0

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+  4 15  1  0

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+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+578-06-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -1.0610    0.4285   -0.0029 C   0  0  0

+   -0.8497   -1.0224   -0.0009 C   0  0  0

+    0.0373    1.2864   -0.0029 C   0  0  0

+   -2.3860    0.9300    0.0011 C   0  0  0

+    0.3794   -1.5291    0.0005 N   0  0  0

+   -1.9787   -1.8671   -0.0010 C   0  0  0

+    1.3135    0.7140   -0.0010 C   0  0  0

+   -3.4398    0.0437    0.0067 C   0  0  0

+   -2.6195    2.3004   -0.0002 N   0  0  0

+    1.4526   -0.7449    0.0002 C   0  0  0

+   -3.2279   -1.3316   -0.0029 C   0  0  0

+    2.4743    1.5125   -0.0003 C   0  0  0

+    2.7520   -1.2952    0.0013 C   0  0  0

+    3.6957    0.9172    0.0020 C   0  0  0

+    3.8310   -0.4707    0.0004 C   0  0  0

+   -0.0886    2.3240    0.0000 H   0  0  0

+   -1.8549   -2.9050    0.0000 H   0  0  0

+   -4.4183    0.4112    0.0000 H   0  0  0

+   -1.8149    2.9676    0.0000 H   0  0  0

+   -3.5996    2.6635    0.0000 H   0  0  0

+   -4.0540   -1.9719    0.0000 H   0  0  0

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+    2.8833   -2.3322    0.0000 H   0  0  0

+    4.5541    1.5136    0.0000 H   0  0  0

+    4.7894   -0.8879    0.0000 H   0  0  0

+  1  2  1  0

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+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42200-33-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 50                          1 V2000

+   -2.3713    0.2853    0.1303 C   0  0  0

+   -3.3491    1.2490    0.2181 C   0  0  0

+   -1.0303    0.6647    0.0967 C   0  0  0

+   -2.6862   -1.1859    0.0592 C   0  0  0

+   -4.8166    0.9125    0.2687 C   0  0  0

+   -2.9916    2.5909    0.2658 C   0  0  0

+   -0.6789    2.0028    0.1462 C   0  0  0

+   -0.0618   -0.2851    0.0144 O   0  0  0

+   -4.1137   -1.4533    0.5320 C   0  0  1

+   -5.0582   -0.5124   -0.2252 C   0  0  2

+   -1.6648    2.9672    0.2305 C   0  0  0

+    1.1908    0.4026   -0.0011 C   0  0  0

+   -4.4635   -2.8094    0.2477 O   0  0  0

+   -4.7809   -0.5846   -1.6252 O   0  0  0

+    2.3299   -0.6147   -0.0932 C   0  0  0

+    3.6710    0.1215   -0.1098 C   0  0  0

+    2.2803   -1.4887    1.0363 O   0  0  0

+    4.7647   -0.8552   -0.1982 N   0  0  0

+    6.0168   -0.0870   -0.2099 C   0  0  0

+    6.0273    0.8527   -1.4173 C   0  0  0

+    6.1232    0.7344    1.0765 C   0  0  0

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+   -2.6307   -2.2297    0.0000 H   0  0  0

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+   -4.7246   -3.8215    0.0000 H   0  0  0

+   -3.7694   -0.8480    0.0000 H   0  0  0

+    1.3642   -1.0146    0.0000 H   0  0  0

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+    2.2211   -2.5322    0.0000 H   0  0  0

+    4.6715   -1.8963    0.0000 H   0  0  0

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+    6.2575    1.7710    0.0000 H   0  0  0

+    5.0866    0.8687    0.0000 H   0  0  0

+    6.5461   -1.8603    0.0000 H   0  0  0

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+    7.8615   -0.2355    0.0000 H   0  0  0

+  1  2  2  0

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+ 21 46  1  0

+ 22 47  1  0

+ 22 48  1  0

+ 22 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+484-78-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -1.2082    0.4405    0.1759 C   0  0  0

+   -2.1288   -0.6208    0.1456 C   0  0  0

+    0.1585    0.2184    0.6594 C   0  0  0

+   -1.6029    1.7110   -0.2644 C   0  0  0

+   -3.4243   -0.3947   -0.3165 C   0  0  0

+   -1.7504   -1.8871    0.5739 N   0  0  0

+    1.2953    0.1001   -0.3228 C   0  0  0

+    0.3738    0.1300    1.8500 O   0  0  0

+   -2.8847    1.9127   -0.7224 C   0  0  0

+   -3.7964    0.8680   -0.7414 C   0  0  0

+   -4.3223   -1.4157   -0.3500 O   0  0  0

+    2.6226    0.0530    0.4368 C   0  0  0

+    3.7231   -0.3720   -0.5009 C   0  0  0

+    2.9259    1.3855    0.9757 N   0  0  0

+    4.0170   -1.6738   -0.6445 O   0  0  0

+    4.3410    0.4591   -1.1234 O   0  0  0

+   -0.9531    2.4627    0.0000 H   0  0  0

+   -2.4327   -2.6095    0.0000 H   0  0  0

+   -0.7836   -2.1167    0.0000 H   0  0  0

+    0.7305   -0.7174    0.0000 H   0  0  0

+    1.7412   -0.7879    0.0000 H   0  0  0

+   -3.2241    2.8466    0.0000 H   0  0  0

+   -4.7671    1.0805    0.0000 H   0  0  0

+   -4.9785   -2.1618    0.0000 H   0  0  0

+    2.4232   -0.9205    0.0000 H   0  0  0

+    3.8752    1.6790    0.0000 H   0  0  0

+    2.1971    2.0609    0.0000 H   0  0  0

+    4.2358   -2.6431    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+590-88-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.2665   -0.5942    0.1418 C   0  0  0

+   -1.0744   -0.0511   -0.3559 C   0  0  0

+    1.3933    0.3370   -0.3102 C   0  0  0

+   -2.2012   -0.9822    0.0960 C   0  0  0

+   -1.2957    1.2908    0.1993 N   0  0  0

+    2.6808   -0.1845    0.1678 N   0  0  0

+   -0.3006   -1.5193    0.0000 H   0  0  0

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+   -3.0376   -1.6734    0.0000 H   0  0  0

+   -1.5100   -1.8186    0.0000 H   0  0  0

+   -0.4568    1.9790    0.0000 H   0  0  0

+   -2.3111    1.6732    0.0000 H   0  0  0

+    2.8309   -1.2591    0.0000 H   0  0  0

+    3.5364    0.4828    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  1  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+117929-13-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.7407    0.0002    0.0041 C   0  0  0

+   -0.7407    0.0003   -0.0032 C   0  0  0

+    1.4242    1.1997    0.1712 C   0  0  0

+    1.4234   -1.1990   -0.1722 C   0  0  0

+   -1.4241    1.1998   -0.1704 C   0  0  0

+   -1.4235   -1.1989    0.1731 C   0  0  0

+    2.8045    1.1933    0.1602 C   0  0  0

+    0.6557    2.4737    0.3898 C   0  0  0

+    2.8040   -1.1929   -0.1631 C   0  0  0

+    0.6534   -2.4717   -0.3923 C   0  0  0

+   -2.8044    1.1934   -0.1601 C   0  0  0

+   -0.6556    2.4739   -0.3882 C   0  0  0

+   -2.8041   -1.1929    0.1632 C   0  0  0

+   -0.6536   -2.4715    0.3940 C   0  0  0

+    3.4872   -0.0002   -0.0011 C   0  0  0

+   -3.4872   -0.0002    0.0008 C   0  0  0

+    4.9674   -0.0008   -0.0003 N   0  3  0

+   -4.9674   -0.0008   -0.0009 N   0  3  0

+    5.5761   -1.0463   -0.1417 O   0  0  0

+    5.5767    1.0443    0.1416 O   0  5  0

+   -5.5762   -1.0463    0.1400 O   0  0  0

+   -5.5767    1.0443   -0.1432 O   0  5  0

+    3.3260    2.0876    0.0000 H   0  0  0

+    1.6239    2.8401    0.0000 H   0  0  0

+    0.4695    3.4921    0.0000 H   0  0  0

+    3.3251   -2.0874    0.0000 H   0  0  0

+    0.4666   -3.4899    0.0000 H   0  0  0

+    1.6213   -2.8391    0.0000 H   0  0  0

+   -3.3259    2.0877    0.0000 H   0  0  0

+   -0.4692    3.4922    0.0000 H   0  0  0

+   -1.6238    2.8404    0.0000 H   0  0  0

+   -3.3252   -2.0874    0.0000 H   0  0  0

+   -1.6215   -2.8388    0.0000 H   0  0  0

+   -0.4670   -3.4898    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 11 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  2  0

+ 17 20  1  0

+ 18 21  2  0

+ 18 22  1  0

+  8 12  1  0

+  9 15  2  0

+ 10 14  1  0

+ 13 16  2  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1953-02-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.7510   -0.6276    0.0658 C   0  0  0

+   -0.4513   -0.0495    0.2570 N   0  0  0

+    1.9872   -0.0135    0.6707 C   0  0  0

+    0.8375   -1.6449   -0.5889 O   0  0  0

+   -1.6530   -0.6465   -0.3310 C   0  0  0

+    3.0055   -1.1135    0.9771 C   0  0  0

+    2.7090    1.1698   -0.4994 S   0  0  0

+   -2.8558    0.1869    0.0294 C   0  0  0

+   -4.0747   -0.1717   -0.4033 O   0  0  0

+   -2.7228    1.1778    0.7078 O   0  0  0

+   -0.4578    0.9568    0.0000 H   0  0  0

+    1.3071    0.7283    0.0000 H   0  0  0

+   -2.3564   -1.3663    0.0000 H   0  0  0

+   -1.0609   -1.4603    0.0000 H   0  0  0

+    2.2670   -1.7972    0.0000 H   0  0  0

+    3.6892   -1.8520    0.0000 H   0  0  0

+    3.7440   -0.4298    0.0000 H   0  0  0

+    3.2331    2.0289    0.0000 H   0  0  0

+   -5.0402   -0.4557    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  5  8  1  0

+  8  9  1  0

+  8 10  2  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3442-62-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.1178    0.3765   -0.0060 C   0  0  0

+    0.1375   -1.0689   -0.0030 C   0  0  0

+    0.8965    1.2349   -0.0053 N   0  0  0

+   -1.4551    0.8284   -0.0038 C   0  0  0

+    1.3844   -1.5280    0.0005 N   0  0  0

+   -0.9640   -1.9517   -0.0034 C   0  0  0

+    2.1432    0.7759   -0.0017 C   0  0  0

+   -2.4679   -0.0751    0.0010 C   0  0  0

+    2.3984   -0.6697    0.0013 C   0  0  0

+   -2.2251   -1.4498   -0.0066 C   0  0  0

+    3.2449    1.6586   -0.0004 C   0  0  0

+   -3.8664    0.4098    0.0033 N   0  3  0

+    3.7358   -1.1218    0.0045 C   0  0  0

+    4.5058    1.1565    0.0037 C   0  0  0

+   -4.7873   -0.3873    0.0076 O   0  0  0

+   -4.0962    1.6059    0.0008 O   0  5  0

+    4.7486   -0.2183    0.0047 C   0  0  0

+   -1.6586    1.8258    0.0000 H   0  0  0

+   -0.8135   -2.9585    0.0000 H   0  0  0

+   -3.0145   -2.0926    0.0000 H   0  0  0

+    3.0945    2.6654    0.0000 H   0  0  0

+    3.9393   -2.1192    0.0000 H   0  0  0

+    5.2952    1.7992    0.0000 H   0  0  0

+    5.7104   -0.5518    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 11 14  2  0

+ 12 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+  7  9  1  0

+  8 10  1  0

+ 14 17  1  0

+  4 18  1  0

+  6 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 17 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2012-00-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -2.2056    0.9527   -0.1103 C   0  0  0

+   -1.5203   -0.7267   -0.1307 P   0  0  0

+   -2.4757    1.6036   -1.2997 C   0  0  0

+   -2.4631    1.5794    1.0944 C   0  0  0

+   -0.6050   -0.9488    1.1751 O   0  0  0

+   -2.7229   -1.7972   -0.1316 O   0  0  0

+   -0.6969   -0.9088   -1.3470 O   0  0  0

+   -2.9979    2.8832   -1.2841 C   0  0  0

+   -2.9855    2.8594    1.1100 C   0  0  0

+    0.6638   -0.6074    0.8281 C   0  0  0

+   -2.1219   -3.0936   -0.1415 C   0  0  0

+   -3.2501    3.5123   -0.0791 C   0  0  0

+    1.0828    0.7109    0.9357 C   0  0  0

+    1.5439   -1.5773    0.3712 C   0  0  0

+   -3.2107   -4.1614   -0.0194 C   0  0  0

+    2.3731    1.0553    0.5829 C   0  0  0

+    2.8335   -1.2278    0.0196 C   0  0  0

+    3.2470    0.0874    0.1227 C   0  0  0

+    4.6290    0.4591   -0.2547 N   0  3  0

+    5.3996   -0.3926   -0.6601 O   0  0  0

+    4.9957    1.6167   -0.1598 O   0  5  0

+   -3.3945    1.2255    0.0000 H   0  0  0

+   -3.3825    1.2029    0.0000 H   0  0  0

+   -3.9189    2.5107    0.0000 H   0  0  0

+   -3.9058    2.4851    0.0000 H   0  0  0

+   -1.5113   -3.8774    0.0000 H   0  0  0

+   -1.2738   -2.5760    0.0000 H   0  0  0

+   -3.6215    4.4338    0.0000 H   0  0  0

+    0.3969    1.4297    0.0000 H   0  0  0

+    1.2649   -2.5309    0.0000 H   0  0  0

+   -3.9064   -3.4521    0.0000 H   0  0  0

+   -3.9200   -4.8571    0.0000 H   0  0  0

+   -2.5150   -4.8707    0.0000 H   0  0  0

+    2.6551    2.0080    0.0000 H   0  0  0

+    3.5219   -1.9442    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  8 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 11 15  1  0

+ 13 16  2  0

+ 14 17  1  0

+ 16 18  1  0

+ 18 19  1  0

+ 19 20  2  0

+ 19 21  1  0

+  9 12  2  0

+ 17 18  2  0

+  3 22  1  0

+  4 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102822-04-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.0800   -0.0547   -0.0009 C   0  0  0

+   -1.0849    0.8466   -0.0220 C   0  0  0

+    1.2979    0.4439   -0.0050 C   0  0  0

+   -0.1183   -1.5139    0.0310 C   0  0  0

+   -2.4480    0.2886   -0.0175 C   0  0  0

+   -0.9077    2.1505   -0.0446 C   0  0  0

+    2.4628   -0.4574    0.0163 C   0  0  0

+    1.4962    1.9033   -0.0304 C   0  0  0

+   -1.4815   -2.0718    0.0414 C   0  0  0

+    0.9224   -2.3192    0.0498 C   0  0  0

+   -2.6463   -1.1708    0.0076 C   0  0  0

+   -3.4888    1.0938   -0.0353 C   0  0  0

+    0.4555    2.7085   -0.0493 C   0  0  0

+   -2.0726    3.0518   -0.0656 C   0  0  0

+    2.2856   -1.7612    0.0391 C   0  0  0

+    3.7168    0.0560    0.0121 N   0  3  0

+   -1.6439   -3.2666    0.0670 O   0  0  0

+   -3.7624   -1.6277    0.0115 O   0  0  0

+   -3.2905    2.5532   -0.0604 C   0  0  0

+    4.5316   -0.3338   -0.8050 O   0  0  0

+    4.0291    0.9071    0.8254 O   0  5  0

+    2.4775    2.3051    0.0000 H   0  0  0

+    0.7797   -3.3699    0.0000 H   0  0  0

+   -4.4701    0.6920    0.0000 H   0  0  0

+    0.5982    3.7592    0.0000 H   0  0  0

+   -1.9299    4.1025    0.0000 H   0  0  0

+    3.1241   -2.4102    0.0000 H   0  0  0

+   -4.1291    3.2022    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

+  7 16  1  0

+  9 17  2  0

+ 11 18  2  0

+ 12 19  1  0

+ 16 20  2  0

+ 16 21  1  0

+  8 13  2  0

+  9 11  1  0

+ 10 15  1  0

+ 14 19  2  0

+  8 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 19 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10147-37-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.0365   -0.4766   -0.1046 S   0  0  0

+   -1.3283    0.5276    0.5432 C   0  0  0

+    0.2873   -1.6101    0.7148 O   0  0  0

+   -0.0047   -0.5639   -1.5223 O   0  0  0

+    1.6576    0.6823    0.2258 Cl  0  0  0

+   -1.3912    1.8538   -0.2172 C   0  0  0

+   -2.6470   -0.2269    0.3624 C   0  0  0

+   -0.3873    1.0319    0.0000 H   0  0  0

+   -0.3248    1.9044    0.0000 H   0  0  0

+   -1.4418    2.9202    0.0000 H   0  0  0

+   -2.4576    1.8032    0.0000 H   0  0  0

+   -3.1772    0.6998    0.0000 H   0  0  0

+   -3.5737   -0.7571    0.0000 H   0  0  0

+   -2.1168   -1.1536    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  2  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  6  9  1  0

+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-69-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.6935   -0.3229    0.0000 C   0  0  0

+   -0.6935    0.3229    0.0000 C   0  0  0

+    1.7647    0.7696    0.0000 C   0  0  0

+   -1.7647   -0.7696    0.0000 C   0  0  0

+    3.0991    0.1483    0.0000 C   0  0  0

+   -3.0991   -0.1483    0.0000 C   0  0  0

+    4.1290   -0.3311    0.0000 N   0  0  0

+   -4.1290    0.3311    0.0000 N   0  0  0

+    0.1174   -1.2646    0.0000 H   0  0  0

+    1.5641   -1.0018    0.0000 H   0  0  0

+   -0.1174    1.2646    0.0000 H   0  0  0

+   -1.5641    1.0018    0.0000 H   0  0  0

+    2.3408    1.7113    0.0000 H   0  0  0

+    0.8941    1.4485    0.0000 H   0  0  0

+   -2.3408   -1.7113    0.0000 H   0  0  0

+   -0.8941   -1.4485    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  3  0

+  6  8  3  0

+  1  9  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+62450-07-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.2722   -0.3043   -0.0022 C   0  0  0

+   -1.2011   -0.3310   -0.0016 C   0  0  0

+    0.6440    1.0539    0.0003 C   0  0  0

+    1.2598   -1.2805    0.0005 C   0  0  0

+   -1.6225    1.0072    0.0012 C   0  0  0

+   -2.1423   -1.3576   -0.0029 C   0  0  0

+   -0.5004    1.8199    0.0023 N   0  0  0

+    2.0008    1.3623    0.0008 C   0  0  0

+    2.5340   -0.9410   -0.0010 N   0  0  0

+    0.8729   -2.7370    0.0056 C   0  0  0

+   -2.9839    1.2930    0.0017 C   0  0  0

+   -3.4869   -1.0546   -0.0013 C   0  0  0

+    2.9237    0.3276   -0.0013 C   0  0  0

+   -3.9048    0.2672   -0.0007 C   0  0  0

+    4.2826    0.6245   -0.0014 N   0  0  0

+   -1.8310   -2.3515    0.0000 H   0  0  0

+   -0.5197    2.8612    0.0000 H   0  0  0

+    2.3180    2.3543    0.0000 H   0  0  0

+   -0.1337   -2.4696    0.0000 H   0  0  0

+    0.6055   -3.7436    0.0000 H   0  0  0

+    1.8795   -3.0044    0.0000 H   0  0  0

+   -3.3077    2.2829    0.0000 H   0  0  0

+   -4.1915   -1.8215    0.0000 H   0  0  0

+   -4.9228    0.4870    0.0000 H   0  0  0

+    4.9839   -0.1455    0.0000 H   0  0  0

+    4.5988    1.6168    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+ 11 14  2  0

+ 13 15  1  0

+  5  7  1  0

+  9 13  1  0

+ 12 14  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33037-07-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+   -0.6940    0.3722   -0.0555 C   0  0  0

+   -1.9540    1.0018    0.5420 C   0  0  0

+    0.5417    0.9420    0.6440 C   0  0  0

+   -0.7463   -1.4148    0.1782 Cl  0  0  0

+   -3.4101    0.3303   -0.2823 Cl  0  0  0

+    2.1607    0.1331   -0.1238 Br  0  0  0

+   -0.6752    1.5747    0.0000 H   0  0  0

+   -1.1899    1.9305    0.0000 H   0  0  0

+   -2.6887    1.9539    0.0000 H   0  0  0

+    1.3058    1.8707    0.0000 H   0  0  0

+   -0.1930    1.8941    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+161697-03-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.2018    0.3671    0.0030 C   0  0  0

+   -0.0838   -1.0224    0.0006 C   0  0  0

+    1.5386    0.7960    0.0022 C   0  0  0

+   -0.8051    1.2485    0.0004 N   0  0  0

+   -1.3560   -1.4335    0.0010 N   0  0  0

+    0.9757   -1.9480   -0.0024 C   0  0  0

+    2.5519   -0.1371   -0.0009 C   0  0  0

+    1.8628    2.2677    0.0051 C   0  0  0

+   -2.0466    0.8185   -0.0043 C   0  0  0

+   -2.3271   -0.5489    0.0034 C   0  0  0

+    2.2608   -1.5080   -0.0032 C   0  0  0

+    3.8805    0.2865   -0.0017 N   0  0  0

+   -3.1797    1.8121   -0.0068 C   0  0  0

+   -3.7601   -1.0155    0.0038 C   0  0  0

+    0.7738   -2.9752    0.0000 H   0  0  0

+    2.8852    2.0425    0.0000 H   0  0  0

+    2.0880    3.2901    0.0000 H   0  0  0

+    0.8404    2.4929    0.0000 H   0  0  0

+    3.0444   -2.2023    0.0000 H   0  0  0

+    4.6546   -0.4183    0.0000 H   0  0  0

+    4.1038    1.3093    0.0000 H   0  0  0

+   -2.4895    2.5992    0.0000 H   0  0  0

+   -3.9668    2.5023    0.0000 H   0  0  0

+   -3.8699    1.0250    0.0000 H   0  0  0

+   -4.0842   -0.0200    0.0000 H   0  0  0

+   -4.7556   -1.3396    0.0000 H   0  0  0

+   -3.4360   -2.0110    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

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+  7 11  1  0

+  9 10  1  0

+  6 15  1  0

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+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15299-08-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 46                          1 V2000

+    0.2526    0.0241    0.0022 C   0  0  0

+   -0.9540   -0.6557    0.0005 C   0  0  0

+    0.0442    1.4634    0.0040 C   0  0  0

+    1.5162   -0.5789   -0.0031 C   0  0  0

+   -2.0194    0.3611   -0.0014 C   0  0  0

+   -0.8845   -2.0655    0.0015 C   0  0  0

+   -1.4217    1.6453    0.0015 C   0  0  0

+    1.1418    2.2696    0.0066 C   0  0  0

+    2.6760    0.3225   -0.0026 C   0  0  0

+    1.5848   -1.9619   -0.0079 C   0  0  0

+   -3.4107    0.2591   -0.0052 C   0  0  0

+    0.3876   -2.7032    0.0015 C   0  0  0

+   -2.0497   -2.8474    0.0031 C   0  0  0

+   -2.2295    2.7782    0.0016 C   0  0  0

+    2.4498    1.7210    0.0055 C   0  0  0

+    3.9786   -0.1718   -0.0111 C   0  0  0

+   -4.1902    1.3957   -0.0055 C   0  0  0

+    0.4406   -4.1125    0.0020 C   0  0  0

+   -1.9547   -4.2051    0.0040 C   0  0  0

+   -3.6030    2.6510   -0.0023 C   0  0  0

+    3.5592    2.5837    0.0085 C   0  0  0

+    5.0422    0.7031   -0.0093 C   0  0  0

+   -0.7104   -4.8347    0.0033 C   0  0  0

+   -4.4697    3.8838   -0.0020 C   0  0  0

+    4.8237    2.0751    0.0046 C   0  0  0

+    1.0182    3.3105    0.0000 H   0  0  0

+    2.5129   -2.4491    0.0000 H   0  0  0

+   -3.8650   -0.6855    0.0000 H   0  0  0

+   -2.9913   -2.3868    0.0000 H   0  0  0

+   -1.7930    3.7312    0.0000 H   0  0  0

+    4.1485   -1.2061    0.0000 H   0  0  0

+   -5.2349    1.3101    0.0000 H   0  0  0

+    1.3672   -4.6025    0.0000 H   0  0  0

+   -2.8279   -4.7849    0.0000 H   0  0  0

+    3.4137    3.6217    0.0000 H   0  0  0

+    6.0224    0.3316    0.0000 H   0  0  0

+   -0.6622   -5.8818    0.0000 H   0  0  0

+   -3.6122    4.4866    0.0000 H   0  0  0

+   -5.0725    4.7413    0.0000 H   0  0  0

+   -5.3272    3.2810    0.0000 H   0  0  0

+    5.6432    2.7286    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 18 23  2  0

+ 20 24  1  0

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+  5  7  2  0

+  9 15  2  0

+ 10 12  1  0

+ 17 20  1  0

+ 19 23  1  0

+ 22 25  1  0

+  8 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 13 29  1  0

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+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+ 25 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5466-77-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 47                          1 V2000

+    1.7237    1.0903   -0.3523 C   0  0  0

+    0.7398    0.1863   -0.1530 C   0  0  0

+    3.1273    0.7058   -0.1478 C   0  0  0

+   -0.6143    0.5573   -0.3503 C   0  0  0

+    4.1487    1.6405   -0.3536 C   0  0  0

+    3.4471   -0.5952    0.2592 C   0  0  0

+   -1.5971   -0.3456   -0.1512 O   0  0  0

+   -0.8901    1.6896   -0.6990 O   0  0  0

+    5.4619    1.2753   -0.1602 C   0  0  0

+    4.7631   -0.9500    0.4498 C   0  0  0

+   -2.8313    0.3199   -0.4266 C   0  0  0

+    5.7743   -0.0191    0.2388 C   0  0  0

+   -3.9931   -0.6538   -0.2186 C   0  0  0

+    7.0707   -0.3743    0.4277 O   0  0  0

+   -5.3146    0.0587   -0.5135 C   0  0  0

+   -3.8346   -1.8462   -1.1640 C   0  0  0

+    7.0689   -1.7459    0.8287 C   0  0  0

+   -6.1810    0.0688    0.7475 C   0  0  0

+   -3.8156   -3.1424   -0.3513 C   0  0  0

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+   -3.5813    1.0145    0.0000 H   0  0  0

+   -4.8343   -1.2346    0.0000 H   0  0  0

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+   -5.6661    1.0186    0.0000 H   0  0  0

+   -2.9231   -2.3090    0.0000 H   0  0  0

+   -3.0006   -1.2551    0.0000 H   0  0  0

+    6.0467   -1.7446    0.0000 H   0  0  0

+    7.0676   -2.7681    0.0000 H   0  0  0

+    8.0911   -1.7472    0.0000 H   0  0  0

+   -6.9837   -0.5642    0.0000 H   0  0  0

+   -5.8517   -0.8989    0.0000 H   0  0  0

+   -4.8377   -3.1574    0.0000 H   0  0  0

+   -3.8006   -4.1645    0.0000 H   0  0  0

+   -2.7935   -3.1274    0.0000 H   0  0  0

+   -6.6525    1.5067    0.0000 H   0  0  0

+   -7.7845    1.8414    0.0000 H   0  0  0

+   -8.3097    1.9060    0.0000 H   0  0  0

+   -9.3438    0.8957    0.0000 H   0  0  0

+   -8.3335   -0.1384    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

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+  7  4  1  0

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+  9  5  1  0

+ 10  6  2  0

+ 11  7  1  0

+ 12  9  2  0

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+ 10 12  1  0

+  1 22  1  0

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+ 19 42  1  0

+ 20 43  1  0

+ 20 44  1  0

+ 21 45  1  0

+ 21 46  1  0

+ 21 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4098-71-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+   -0.7743    0.5593   -0.0831 C   0  0  0

+   -0.0234   -0.3948   -1.0023 C   0  0  0

+   -0.1394    1.9329   -0.0410 C   0  0  0

+   -2.2049    0.7173   -0.6512 C   0  0  0

+   -0.9127   -0.0383    1.3187 C   0  0  0

+    1.4636   -0.4059   -0.7505 C   0  0  0

+    1.3644    1.9784    0.1111 C   0  0  0

+   -2.8645   -0.5904   -0.6836 N   0  0  0

+    2.0879    0.9639   -0.7584 C   0  0  0

+    1.8658   -1.2296    0.3713 N   0  0  0

+    1.8403    3.3853   -0.3252 C   0  0  0

+    1.7763    1.8071    1.5781 C   0  0  0

+   -3.9187   -0.7749   -0.0377 C   0  0  0

+    2.6482   -2.1882    0.1941 C   0  0  0

+   -4.9374   -0.9531    0.5865 O   0  0  0

+    3.4044   -3.1146    0.0228 O   0  0  0

+   -0.8652   -0.7932    0.0000 H   0  0  0

+    0.1774   -1.3042    0.0000 H   0  0  0

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+   -1.1228   -0.9456    0.0000 H   0  0  0

+   -0.0054   -0.2484    0.0000 H   0  0  0

+    2.3948   -0.3935    0.0000 H   0  0  0

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+    2.7407    1.6281    0.0000 H   0  0  0

+    2.7225    3.0869    0.0000 H   0  0  0

+    2.1387    4.2675    0.0000 H   0  0  0

+    0.9581    3.6837    0.0000 H   0  0  0

+    1.4187    0.9472    0.0000 H   0  0  0

+    2.6362    1.4495    0.0000 H   0  0  0

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+  7  9  1  0

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+ 11 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+ 12 32  1  0

+ 12 33  1  0

+ 12 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99-09-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.4378    0.1483    0.0033 C   0  0  0

+    0.5301   -0.8370    0.0029 C   0  0  0

+   -0.0698    1.4811    0.0010 C   0  0  0

+   -1.8705   -0.2229    0.0001 N   0  3  0

+    1.8744   -0.4878    0.0001 C   0  0  0

+    1.2679    1.8324   -0.0018 C   0  0  0

+   -2.7247    0.6454    0.0004 O   0  0  0

+   -2.1955   -1.3968   -0.0030 O   0  5  0

+    2.2407    0.8524   -0.0022 C   0  0  0

+    2.8558   -1.4816    0.0001 N   0  0  0

+    0.2534   -1.8366    0.0000 H   0  0  0

+   -0.7985    2.2191    0.0000 H   0  0  0

+    1.5407    2.8330    0.0000 H   0  0  0

+    3.2437    1.1165    0.0000 H   0  0  0

+    2.5811   -2.4817    0.0000 H   0  0  0

+    3.8593   -1.2195    0.0000 H   0  0  0

+  1  2  1  0

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+  6  9  2  0

+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5470-37-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.8159   -3.2469   -0.3794 C   0  0  0

+   -0.9660   -1.9107    0.3505 C   0  0  0

+    0.3147   -1.1217    0.2242 C   0  0  0

+   -2.0607   -1.1407   -0.2572 N   0  0  0

+    0.3320    0.2125   -0.0044 C   0  0  0

+    1.5964   -1.5903    0.3127 N   0  0  0

+   -2.0917    0.1807    0.3807 C   0  0  0

+    1.7160    0.6192   -0.0702 C   0  0  0

+   -0.9261    1.0331   -0.1421 C   0  0  0

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+   -3.3965    0.8630    0.0597 C   0  0  0

+    2.3369    1.8538   -0.2825 C   0  0  0

+    3.8699   -0.5155    0.1362 C   0  0  0

+   -4.2165    0.3046   -0.6301 O   0  0  0

+   -3.6478    2.0909    0.5402 O   0  0  0

+    3.7100    1.8681   -0.2791 C   0  0  0

+    4.4574    0.7199   -0.0763 C   0  0  0

+   -1.8370   -3.3616    0.0000 H   0  0  0

+   -0.7012   -4.2680    0.0000 H   0  0  0

+    0.2052   -3.1322    0.0000 H   0  0  0

+   -1.8500   -2.4344    0.0000 H   0  0  0

+   -2.9670   -1.6248    0.0000 H   0  0  0

+    1.8566   -2.5843    0.0000 H   0  0  0

+   -1.1701   -0.2736    0.0000 H   0  0  0

+   -0.2654    1.8200    0.0000 H   0  0  0

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+    1.7932    2.7257    0.0000 H   0  0  0

+    4.4329   -1.3751    0.0000 H   0  0  0

+   -3.8538    3.0976    0.0000 H   0  0  0

+    4.1951    2.7739    0.0000 H   0  0  0

+    5.4826    0.7882    0.0000 H   0  0  0

+  2  1  1  0

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+  7  9  1  0

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+ 16 17  2  0

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+  4 22  1  0

+  6 23  1  0

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+  9 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+41533-75-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+    0.4043   -0.1059   -0.0017 C   0  0  0

+   -0.8314    0.5820   -0.0009 C   0  0  0

+    1.6106    0.5616    0.0000 C   0  0  0

+   -0.0938   -1.8067    0.0023 S   0  0  0

+   -1.9735   -0.3133   -0.0025 C   0  0  0

+   -0.7755    1.9942    0.0011 C   0  0  0

+    1.6234    1.9314    0.0024 C   0  0  0

+    2.8823   -0.1960   -0.0013 N   0  3  0

+   -1.7894   -1.5985    0.0046 N   0  0  0

+   -3.5845    0.3336   -0.0019 Cl  0  0  0

+    0.4243    2.6341    0.0023 C   0  0  0

+    3.9454    0.3985    0.0001 O   0  0  0

+    2.8656   -1.4139   -0.0039 O   0  5  0

+   -1.6660    2.5527    0.0000 H   0  0  0

+    2.5379    2.4498    0.0000 H   0  0  0

+    0.4454    3.6851    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  8 13  1  0

+  5  9  2  0

+  7 11  1  0

+  6 14  1  0

+  7 15  1  0

+ 11 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110419-21-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.0466    0.8035    0.0127 C   0  0  0

+    0.5983   -0.3172   -0.0057 C   0  0  0

+    0.8727    1.9405    0.0150 C   0  0  0

+   -1.4957    0.9634    0.0238 C   0  0  0

+    2.0352   -0.0008   -0.0172 C   0  0  0

+   -0.2235   -1.5425   -0.0102 C   0  0  0

+    2.2044    1.3163   -0.0049 C   0  0  0

+    0.3423    3.1379    0.0324 C   0  0  0

+   -2.2271   -0.1251    0.0149 C   0  0  0

+   -1.9968    2.3481    0.0438 C   0  0  0

+    3.2201   -0.8786   -0.0392 C   0  0  0

+   -1.5401   -1.4355    0.0047 C   0  0  0

+    0.3652   -2.7629   -0.0297 N   0  3  0

+    3.5614    1.8842   -0.0121 C   0  0  0

+   -1.1165    3.3330    0.0490 C   0  0  0

+   -3.5801   -0.0515    0.0249 N   0  3  0

+    4.4302   -0.3669   -0.0462 C   0  0  0

+   -0.0211   -3.6129   -0.8119 O   0  0  0

+    1.2806   -3.0098    0.7349 O   0  5  0

+    4.6131    1.0946   -0.0309 C   0  0  0

+   -4.2205   -0.7202    0.8163 O   0  0  0

+   -4.1558    0.6833   -0.7575 O   0  5  0

+    0.9519    3.9510    0.0000 H   0  0  0

+   -2.9945    2.5411    0.0000 H   0  0  0

+    3.0997   -1.8877    0.0000 H   0  0  0

+   -2.1008   -2.2830    0.0000 H   0  0  0

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+   -1.4690    4.2861    0.0000 H   0  0  0

+    5.2407   -0.9800    0.0000 H   0  0  0

+    5.5487    1.4914    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+133831-60-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.8081   -0.7199    0.0477 C   0  0  0

+   -3.0590   -0.1484   -0.1942 C   0  0  0

+   -0.6730    0.0664    1.1421 S   0  0  0

+   -1.4626   -1.9204   -0.5771 C   0  0  0

+   -3.9428   -0.7686   -1.0518 C   0  0  0

+   -3.4356    1.1202    0.4689 N   0  3  0

+    1.0370   -0.7187    1.4702 S   0  0  0

+   -2.3573   -2.5335   -1.4278 C   0  0  0

+   -3.5922   -1.9557   -1.6726 C   0  0  0

+   -4.5271    1.6175    0.2570 O   0  0  0

+   -2.5270    1.7556    1.3497 O   0  5  0

+    2.3717   -0.3079    0.4798 C   0  0  0

+    2.2147    0.5757   -0.5384 C   0  0  0

+    3.9259   -1.0215    0.7780 Cl  0  0  0

+    3.5681    0.9922   -1.5427 Cl  0  0  0

+    0.6605    1.2893   -0.8366 Cl  0  0  0

+   -0.5144   -2.2610    0.0000 H   0  0  0

+   -4.8940   -0.4365    0.0000 H   0  0  0

+   -2.2752   -3.5377    0.0000 H   0  0  0

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+  1  2  2  0

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+  8  9  1  0

+  4 17  1  0

+  5 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13593-03-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -2.8154    0.7585    0.3433 C   0  0  0

+   -2.9083   -0.4883   -0.3231 C   0  0  0

+   -1.6115    1.2891    0.5908 N   0  0  0

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+   -1.7918   -1.1240   -0.6990 N   0  0  0

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+    1.7839    0.0634    0.0711 P   0  0  0

+    3.2503    0.5673    0.5045 O   0  0  0

+    1.4402   -1.3102    0.8373 O   0  0  0

+    1.7451   -0.2254   -1.7695 S   0  0  0

+    3.4500    1.8391   -0.1157 C   0  0  0

+    2.5268   -2.2046    0.5891 C   0  0  0

+    4.8329    2.3770    0.2576 C   0  0  0

+    2.2618   -3.5368    1.2933 C   0  0  0

+   -3.9561    2.4090    0.0000 H   0  0  0

+   -4.2397   -2.0300    0.0000 H   0  0  0

+   -6.0196    1.4148    0.0000 H   0  0  0

+    0.1933   -1.1579    0.0000 H   0  0  0

+   -6.1756   -0.8280    0.0000 H   0  0  0

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+  1  2  2  0

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+ 19 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-42-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 80 79                          1 V2000

+    0.3888    0.9025    0.3078 P   0  0  0

+   -0.8478    1.4099   -0.5897 O   0  0  0

+   -0.0155   -0.4654    1.0544 O   0  0  0

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+ 29 79  1  0

+ 29 80  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6884-87-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+   -0.8367   -0.0388   -0.0747 C   0  0  0

+   -0.0446   -0.7417    0.8149 C   0  0  0

+   -0.2841    0.9558   -0.8602 C   0  0  0

+   -2.5521   -0.4167   -0.2126 S   0  0  0

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+    1.0616    1.2506   -0.7586 C   0  0  0

+   -3.3337    0.3750    1.0140 N   0  0  0

+   -2.9891    0.2049   -1.4134 O   0  0  0

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+    3.2230    0.8429    0.2389 N   0  0  0

+    4.1411   -0.1120   -0.0095 C   0  0  0

+    5.6098    0.2185    0.0600 C   0  0  0

+    3.7853   -1.2373   -0.2890 O   0  0  0

+   -0.2970   -1.7026    0.0000 H   0  0  0

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+ 14 25  1  0

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+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+116374-65-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    0.9753    0.5531   -0.2745 C   0  0  0

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+    4.7828    1.0916    0.9712 Cl  0  0  0

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+   -1.1412    0.7059    0.0000 H   0  0  0

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+   -3.8369   -1.2431    0.0000 H   0  0  0

+   -6.6861    0.6140    0.0000 H   0  0  0

+   -7.5914   -0.4987    0.0000 H   0  0  0

+   -6.4787   -1.4040    0.0000 H   0  0  0

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+   -6.1705    2.0322    0.0000 H   0  0  0

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+ 25 43  1  0

+ 25 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+113698-18-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -0.7117    0.4812    0.0008 C   0  0  0

+   -1.4807   -0.7104   -0.0100 C   0  0  0

+    0.6808    0.3599    0.0011 C   0  0  0

+   -1.5881    1.5316    0.0141 N   0  0  0

+   -2.8703   -0.2811   -0.0051 C   0  0  0

+   -0.8255   -1.9431   -0.0216 C   0  0  0

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+   -4.1080   -1.1408   -0.0091 C   0  0  0

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+    1.0592    2.6654    0.0211 O   0  0  0

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+   -5.3019   -0.2745    0.4109 C   0  0  0

+    3.5711    0.1708    0.0033 C   0  0  0

+    3.2448   -2.1458   -0.0186 O   0  0  0

+   -5.3091    1.0152   -0.3998 C   0  0  0

+    4.9192    0.0514    0.0043 O   0  0  0

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+ 20 35  1  0

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+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+123-73-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+   -0.1480   -0.2722    0.0000 C   0  0  0

+   -1.2794    0.4356    0.0000 C   0  0  0

+    1.1437    0.4138    0.0000 C   0  0  0

+   -2.6104   -0.2713    0.0000 C   0  0  0

+    2.1724   -0.2296    0.0000 O   0  0  0

+   -0.1851   -1.3205    0.0000 H   0  0  0

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+   -3.1024    0.6551    0.0000 H   0  0  0

+   -3.5368   -0.7633    0.0000 H   0  0  0

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+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3930-19-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 59 62                          1 V2000

+   -2.2126   -0.8380   -0.2176 C   0  0  0

+   -3.2935    0.1595   -0.3992 C   0  0  0

+   -0.8645   -0.4784   -0.3843 C   0  0  0

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+ 37 59  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4430-25-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    0.0720    1.2367   -1.8788 Br  0  0  0

+    1.3159    0.4608   -0.6844 C   0  0  0

+    0.8890   -0.0133    0.5461 C   0  0  0

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+    3.5687   -0.2060   -0.1819 C   0  0  0

+   -0.4057   -0.2149    2.6048 O   0  0  0

+   -1.2061    1.2196    0.8630 C   0  0  0

+   -1.2462   -1.2166    0.5992 C   0  0  0

+    0.8895   -1.0192    2.8391 S   0  0  0

+    3.1487   -0.6765    1.0544 C   0  0  0

+    5.3866   -0.3411   -0.6847 Br  0  0  0

+   -2.3548    1.1853    0.0947 C   0  0  0

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+   -3.0276    2.3573   -0.1977 C   0  0  0

+   -1.3981    3.5993    1.0563 C   0  0  0

+   -2.9432   -2.8933    0.8145 C   0  0  0

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+   -0.7453    5.2469    1.7161 Br  0  0  0

+   -4.2937   -3.7348    1.8362 Br  0  0  0

+   -2.6627   -3.3409   -0.4686 C   0  0  0

+   -1.2927   -3.3199   -2.9691 Br  0  0  0

+   -3.2082    4.7223   -0.0053 O   0  0  0

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+ 15 34  1  0

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+ 17 36  1  0

+ 18 37  1  0

+ 32 38  1  0

+ 33 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+609-19-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.0004   -0.4712   -0.0019 C   0  0  0

+   -1.1992    0.2210   -0.0009 C   0  0  0

+    1.1996    0.2200   -0.0012 C   0  0  0

+   -0.0012   -2.2072    0.0033 Cl  0  0  0

+   -1.2000    1.6038    0.0002 C   0  0  0

+   -2.7024   -0.6475   -0.0018 Cl  0  0  0

+    1.2018    1.6024    0.0004 C   0  0  0

+    2.7019   -0.6500   -0.0018 Cl  0  0  0

+    0.0011    2.2973    0.0008 C   0  0  0

+    0.0018    3.6565    0.0024 O   0  0  0

+   -2.1003    2.1232    0.0000 H   0  0  0

+    2.1026    2.1209    0.0000 H   0  0  0

+    0.0023    4.6959    0.0000 H   0  0  0

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+  9 10  1  0

+  7  9  1  0

+  5 11  1  0

+  7 12  1  0

+ 10 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75586-69-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -2.1285    0.9251   -0.3240 C   0  0  0

+   -2.8051   -0.2110    0.3098 C   0  0  0

+   -0.8229    0.7741   -0.7993 C   0  0  0

+   -2.8093    2.1531   -0.4363 C   0  0  0

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+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+69177-41-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+197202                          1 V2000

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+102197  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4792-83-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+    1.7863    0.2366    0.1396 C   0  0  0

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+   -8.9965    1.2619    0.0000 H   0  0  0

+   -7.9067    0.2723    0.0000 H   0  0  0

+  1  2  1  0

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+ 20 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+116505-02-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+    1.4063   -0.3691   -0.1435 C   0  0  0

+    2.7193   -0.0232   -0.4790 N   0  0  0

+    0.7798    0.2451    0.9337 C   0  0  0

+    0.7265   -1.3230   -0.8913 C   0  0  0

+    3.0621    1.1456   -0.4713 O   0  0  0

+    3.6048   -0.9825   -0.8106 C   0  0  0

+   -0.5160   -0.0963    1.2648 C   0  0  0

+   -0.5689   -1.6644   -0.5604 C   0  0  0

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+    4.2002   -1.0126   -2.1947 C   0  0  0

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+   -1.1938   -1.0541    0.5208 C   0  0  0

+    4.1364    3.0917    0.5966 C   0  0  0

+    3.9600    0.9350    1.5377 O   0  0  0

+   -2.8477   -1.4903    0.9437 S   0  0  0

+   -3.7205   -0.1734    0.1634 C   0  0  0

+   -5.0876   -0.0269    0.3668 C   0  0  0

+   -3.0426    0.7245   -0.6521 C   0  0  0

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+    4.2467   -0.0930    0.0000 H   0  0  0

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+   -5.5670   -0.8130    0.0000 H   0  0  0

+   -2.1223    0.6974    0.0000 H   0  0  0

+   -6.6883    1.0380    0.0000 H   0  0  0

+   -3.2544    2.5442    0.0000 H   0  0  0

+   -5.4569    2.7402    0.0000 H   0  0  0

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+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96910-73-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+    1.3045    0.9557   -0.1949 C   0  0  2

+    0.8383   -0.4688   -0.5878 C   0  0  2

+    2.5399    0.6979    0.6997 C   0  0  0

+    0.2214    1.6072    0.6638 C   0  0  2

+   -0.1407   -1.0689    0.3529 C   0  0  0

+    2.1186   -1.3115   -0.6711 C   0  0  0

+    0.2529   -0.4171   -1.8904 O   0  0  0

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+    0.6377    3.0380    1.0108 C   0  0  0

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+   -3.0476    0.6075   -1.1203 C   0  0  0

+   -3.4698   -0.9220    1.5330 O   0  0  0

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+    4.6607   -1.0457    0.0000 H   0  0  0

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+ 13 35  1  0

+ 13 36  1  0

+ 15 37  1  0

+ 16 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-94-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -1.3860    0.0009   -0.0017 C   0  0  0

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+ 17 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-32-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -0.3106   -0.2137   -0.0014 C   0  0  0

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+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90-13-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+    1.2229    0.7808    0.0025 C   0  0  0

+    0.2016   -0.2019    0.0018 C   0  0  0

+    0.8704    2.1410    0.0012 C   0  0  0

+    2.5688    0.3759   -0.0014 C   0  0  0

+   -1.1447    0.2034    0.0003 C   0  0  0

+    0.5545   -1.5621    0.0022 C   0  0  0

+   -0.4436    2.4967   -0.0007 C   0  0  0

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+   -1.4482    1.5317   -0.0005 C   0  0  0

+   -2.4131   -0.9818   -0.0011 Cl  0  0  0

+    1.8684   -1.9170    0.0032 C   0  0  0

+    1.6166    2.8792    0.0000 H   0  0  0

+    3.3354    1.0928    0.0000 H   0  0  0

+   -0.1914   -2.3006    0.0000 H   0  0  0

+   -0.7038    3.5136    0.0000 H   0  0  0

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+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+212-54-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    0.4161    0.0928   -0.0009 C   0  0  0

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+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26530-20-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+    2.2713    0.0132   -0.3893 N   0  0  0

+    3.0082   -1.0021    0.1078 C   0  0  0

+    3.2018    1.3969   -0.0169 S   0  0  0

+    0.9847   -0.0551   -1.0867 C   0  0  0

+    4.2038   -0.6849    0.7260 C   0  0  0

+    2.6322   -2.1608    0.0152 O   0  0  0

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+   -3.9782   -0.0121   -0.5060 C   0  0  0

+   -5.1160    0.0809    0.5127 C   0  0  0

+   -6.4596    0.0095   -0.2157 C   0  0  0

+   -7.5974    0.1024    0.8030 C   0  0  0

+    0.4780   -0.8629    0.0000 H   0  0  0

+    1.4683   -0.8770    0.0000 H   0  0  0

+    4.8823   -1.3550    0.0000 H   0  0  0

+    5.4134    1.0052    0.0000 H   0  0  0

+    0.3536    0.8456    0.0000 H   0  0  0

+   -0.6367    0.8597    0.0000 H   0  0  0

+   -2.0034   -0.8414    0.0000 H   0  0  0

+   -1.0131   -0.8555    0.0000 H   0  0  0

+   -2.1278    0.8671    0.0000 H   0  0  0

+   -3.1181    0.8812    0.0000 H   0  0  0

+   -4.4850   -0.8199    0.0000 H   0  0  0

+   -3.4946   -0.8340    0.0000 H   0  0  0

+   -4.6092    0.8887    0.0000 H   0  0  0

+   -5.5996    0.9028    0.0000 H   0  0  0

+   -6.9663   -0.7983    0.0000 H   0  0  0

+   -5.9760   -0.8124    0.0000 H   0  0  0

+   -7.5198    1.0528    0.0000 H   0  0  0

+   -8.5478    0.1800    0.0000 H   0  0  0

+   -7.6750   -0.8480    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  8  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+  5  7  2  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 14 32  1  0

+ 14 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+321-14-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.7902    0.1269    0.0021 C   0  0  0

+   -0.9170   -1.2690    0.0201 C   0  0  0

+    0.4825    0.7048   -0.0098 C   0  0  0

+   -1.9919    0.9803   -0.0105 C   0  0  0

+    0.2204   -2.0628    0.0261 C   0  0  0

+   -2.1470   -1.8412    0.0322 O   0  0  0

+    1.6023   -0.0994   -0.0036 C   0  0  0

+   -1.8697    2.3178    0.0991 O   0  0  0

+   -3.0928    0.4777   -0.1198 O   0  0  0

+    1.4717   -1.4797    0.0143 C   0  0  0

+    3.1825    0.6192   -0.0183 Cl  0  0  0

+    0.5845    1.7396    0.0000 H   0  0  0

+    0.1304   -3.0987    0.0000 H   0  0  0

+   -3.0898   -2.2798    0.0000 H   0  0  0

+   -1.7751    3.3533    0.0000 H   0  0  0

+    2.3213   -2.0792    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  2  0

+  7 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-70-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.7206    0.7999    0.0018 C   0  0  0

+   -1.1458   -0.5218    0.0004 C   0  0  0

+    0.6295    1.0910    0.0018 C   0  0  0

+   -1.7323    1.9168   -0.0028 C   0  0  0

+   -0.2135   -1.5512   -0.0011 C   0  0  0

+   -2.5143   -0.8169    0.0009 N   0  0  0

+    1.5615    0.0619    0.0003 C   0  0  0

+    1.1362   -1.2602   -0.0012 C   0  0  0

+    2.9301    0.3570   -0.0002 N   0  0  0

+    0.9485    2.0826    0.0000 H   0  0  0

+   -0.9603    2.6161    0.0000 H   0  0  0

+   -2.4316    2.6888    0.0000 H   0  0  0

+   -2.5043    1.2175    0.0000 H   0  0  0

+   -0.5325   -2.5428    0.0000 H   0  0  0

+   -3.2136   -0.0449    0.0000 H   0  0  0

+   -2.8333   -1.8085    0.0000 H   0  0  0

+    1.8354   -2.0322    0.0000 H   0  0  0

+    3.6293   -0.4150    0.0000 H   0  0  0

+    3.2491    1.3486    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

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+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3397-62-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -1.1639    1.1498    0.0020 C   0  0  0

+   -1.8296    0.0001    0.0011 N   0  0  0

+    0.1671    1.1465    0.0017 N   0  0  0

+   -1.8516    2.3462   -0.0025 N   0  0  0

+   -1.1638   -1.1499   -0.0002 C   0  0  0

+    0.8270    0.0000    0.0005 C   0  0  0

+    0.1668   -1.1466   -0.0004 N   0  0  0

+   -1.8516   -2.3462   -0.0007 N   0  0  0

+    2.5630    0.0000   -0.0004 Cl  0  0  0

+   -1.3510    3.2095    0.0000 H   0  0  0

+   -2.8496    2.3481    0.0000 H   0  0  0

+   -2.8496   -2.3480    0.0000 H   0  0  0

+   -1.3511   -3.2095    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  5  8  1  0

+  6  9  1  0

+  6  7  1  0

+  4 10  1  0

+  4 11  1  0

+  8 12  1  0

+  8 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6358-53-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+    2.7862   -0.5453    0.0859 C   0  0  0

+    1.7241    0.3226   -0.4214 C   0  0  0

+    4.1239   -0.0819    0.0515 C   0  0  0

+    2.5064   -1.8140    0.6064 C   0  0  0

+    0.4273   -0.0850   -0.4065 N   0  0  0

+    2.0718    1.5797   -0.9221 C   0  0  0

+    4.4025    1.1956   -0.4661 C   0  0  0

+    5.1493   -0.9108    0.5374 C   0  0  0

+    3.5257   -2.5924    1.0694 C   0  0  0

+   -0.4875    0.6915    0.0671 N   0  0  0

+    3.4039    1.9902   -0.9343 C   0  0  0

+    1.1072    2.4058   -1.3997 O   0  0  0

+    4.8428   -2.1421    1.0321 C   0  0  0

+   -1.7894    0.2823    0.0820 C   0  0  0

+   -2.7872    1.1238    0.5962 C   0  0  0

+   -2.1363   -0.9748   -0.4202 C   0  0  0

+   -4.1058    0.7013    0.6072 C   0  0  0

+   -2.4605    2.3496    1.0823 O   0  0  0

+   -3.4580   -1.3823   -0.4021 C   0  0  0

+   -4.4396   -0.5457    0.1134 C   0  0  0

+   -3.6764    2.9554    1.5260 C   0  0  0

+   -3.7973   -2.6050   -0.8908 O   0  0  0

+   -5.2120   -2.7337   -0.7358 C   0  0  0

+    1.5871   -2.1504    0.0000 H   0  0  0

+    5.3248    1.5239    0.0000 H   0  0  0

+    6.0775   -0.5996    0.0000 H   0  0  0

+    3.3684   -3.5586    0.0000 H   0  0  0

+    3.5855    2.9522    0.0000 H   0  0  0

+    0.3637    3.0426    0.0000 H   0  0  0

+    5.5640   -2.8041    0.0000 H   0  0  0

+   -1.4338   -1.6566    0.0000 H   0  0  0

+   -4.8146    1.3765    0.0000 H   0  0  0

+   -5.3743   -0.8366    0.0000 H   0  0  0

+   -3.2398    3.8316    0.0000 H   0  0  0

+   -4.5526    3.3920    0.0000 H   0  0  0

+   -4.1130    2.0792    0.0000 H   0  0  0

+   -5.3007   -1.7588    0.0000 H   0  0  0

+   -6.1869   -2.8224    0.0000 H   0  0  0

+   -5.1233   -3.7086    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

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+ 14 15  1  0

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+ 15 17  2  0

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+ 16 19  1  0

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+ 19 22  1  0

+ 22 23  1  0

+  7 11  1  0

+  9 13  1  0

+ 19 20  2  0

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+ 21 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+ 23 37  1  0

+ 23 38  1  0

+ 23 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+607-59-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+    3.0013   -0.3240   -0.0009 C   0  0  0

+    1.9060    0.6445   -0.0005 C   0  0  0

+    4.3351    0.1524   -0.0007 C   0  0  0

+    2.7591   -1.7025    0.0042 C   0  0  0

+    0.6090    0.2279   -0.0003 N   0  0  0

+    2.2165    2.0002    0.0001 C   0  0  0

+    4.5742    1.5369    0.0004 C   0  0  0

+    5.3940   -0.7720   -0.0011 C   0  0  0

+    3.8098   -2.5713    0.0036 C   0  0  0

+   -0.3468    1.0943    0.0001 N   0  0  0

+    3.5387    2.4210    0.0003 C   0  0  0

+    5.1227   -2.1063   -0.0016 C   0  0  0

+   -1.6452    0.6772    0.0004 C   0  0  0

+   -2.6834    1.6154    0.0008 C   0  0  0

+   -1.9430   -0.6904   -0.0056 C   0  0  0

+   -3.9926    1.1904    0.0010 C   0  0  0

+   -3.2545   -1.1071   -0.0053 C   0  0  0

+   -4.2845   -0.1705    0.0009 C   0  0  0

+   -5.6103   -0.5963    0.0012 N   0  0  0

+   -5.9197   -2.0283    0.0011 C   0  0  0

+   -6.6957    0.3876    0.0016 C   0  0  0

+    1.7794   -2.0634    0.0000 H   0  0  0

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+    5.9108   -2.7912    0.0000 H   0  0  0

+   -2.4653    2.6365    0.0000 H   0  0  0

+   -1.1711   -1.3935    0.0000 H   0  0  0

+   -4.7678    1.8899    0.0000 H   0  0  0

+   -3.4774   -2.1272    0.0000 H   0  0  0

+   -6.9403   -1.8078    0.0000 H   0  0  0

+   -6.1402   -3.0489    0.0000 H   0  0  0

+   -4.8991   -2.2488    0.0000 H   0  0  0

+   -5.9945    1.1612    0.0000 H   0  0  0

+   -7.4693    1.0888    0.0000 H   0  0  0

+   -7.3969   -0.3860    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 20 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-69-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 56                          1 V2000

+   -3.6156    0.8311   -1.3677 C   0  0  0

+   -2.8277    0.0683   -0.3341 C   0  0  0

+   -3.0530    0.5342   -2.7592 C   0  0  0

+   -5.0832    0.4025   -1.3089 C   0  0  0

+   -3.5105    2.3310   -1.0845 C   0  0  0

+   -3.1540    0.1822    1.0097 C   0  0  0

+   -1.7851   -0.7479   -0.7250 C   0  0  0

+   -2.4294   -0.5189    1.9621 C   0  0  0

+   -4.1847    0.9822    1.3932 O   0  0  0

+   -1.0589   -1.4511    0.2282 C   0  0  0

+   -1.3825   -1.3316    1.5738 C   0  0  0

+    0.2716   -2.4936   -0.2694 S   0  0  0

+   -0.5951   -2.0928    2.6089 C   0  0  0

+    1.5890   -1.3235   -0.2819 C   0  0  0

+    2.8651   -1.7173   -0.6656 C   0  0  0

+    1.3513   -0.0053    0.0862 C   0  0  0

+    3.8965   -0.7996   -0.6750 C   0  0  0

+    3.1232   -3.1456   -1.0707 C   0  0  0

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+    4.6759    1.4185   -0.3113 O   0  0  0

+    0.6507    2.5110    0.8395 C   0  0  0

+    2.9947    2.6972    1.6842 C   0  0  0

+    2.4741    3.2670   -0.6921 C   0  0  0

+   -3.5203   -0.3514    0.0000 H   0  0  0

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+   -1.2910   -2.8127    0.0000 H   0  0  0

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+    0.1008   -1.3729    0.0000 H   0  0  0

+    0.4052    0.3224    0.0000 H   0  0  0

+    4.8429   -1.1265    0.0000 H   0  0  0

+    2.1379   -3.3237    0.0000 H   0  0  0

+    3.3013   -4.1309    0.0000 H   0  0  0

+    4.1085   -2.9675    0.0000 H   0  0  0

+    5.4245    2.0835    0.0000 H   0  0  0

+    0.7652    3.5057    0.0000 H   0  0  0

+   -0.3440    2.6255    0.0000 H   0  0  0

+    0.5362    1.5163    0.0000 H   0  0  0

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+    3.9210    3.0774    0.0000 H   0  0  0

+    2.6145    3.6235    0.0000 H   0  0  0

+    3.4117    2.9155    0.0000 H   0  0  0

+    2.8256    4.2046    0.0000 H   0  0  0

+    1.5365    3.6185    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

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+ 10 11  2  0

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+ 24 52  1  0

+ 25 53  1  0

+ 25 54  1  0

+ 25 55  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+512-56-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -0.0037    0.1710    0.0348 P   0  0  0

+   -1.3196    0.2306   -0.8909 O   0  0  0

+    0.0151   -1.2160    0.8521 O   0  0  0

+    1.3093    0.2656   -0.8921 O   0  0  0

+   -0.0184    1.3043    0.9866 O   0  0  0

+   -2.4226    0.5023   -0.0239 C   0  0  0

+    0.0414   -2.2660   -0.1168 C   0  0  0

+    2.4090    0.5442   -0.0232 C   0  0  0

+   -2.2188    1.3296    0.0000 H   0  0  0

+   -3.2499    0.7061    0.0000 H   0  0  0

+   -2.6264   -0.3250    0.0000 H   0  0  0

+   -0.8103   -2.2873    0.0000 H   0  0  0

+    0.0627   -3.1177    0.0000 H   0  0  0

+    0.8931   -2.2447    0.0000 H   0  0  0

+    2.6182   -0.2817    0.0000 H   0  0  0

+    3.2349    0.7534    0.0000 H   0  0  0

+    2.1998    1.3701    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+525-03-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.7419   -0.6373   -0.0011 C   0  0  0

+   -0.7420   -0.6369   -0.0003 C   0  0  0

+    1.2057    0.6591   -0.2086 C   0  0  0

+    1.6605   -1.6742    0.1694 C   0  0  0

+   -1.2055    0.6592   -0.2072 C   0  0  0

+   -1.6611   -1.6747    0.1656 C   0  0  0

+    0.0001    1.5555   -0.3511 C   0  0  0

+    2.5597    0.9144   -0.2498 C   0  0  0

+    3.0139   -1.4096    0.1258 C   0  0  0

+   -2.5599    0.9149   -0.2479 C   0  0  0

+   -3.0140   -1.4098    0.1237 C   0  0  0

+    0.0008    2.5523    0.7279 N   0  0  0

+    3.4650   -0.1193   -0.0847 C   0  0  0

+   -3.4651   -0.1184   -0.0830 C   0  0  0

+    1.3291   -2.6532    0.0000 H   0  0  0

+   -1.3298   -2.6537    0.0000 H   0  0  0

+   -0.9232    2.0200    0.0000 H   0  0  0

+    2.8971    1.8913    0.0000 H   0  0  0

+    3.6906   -2.1909    0.0000 H   0  0  0

+   -2.8972    1.8919    0.0000 H   0  0  0

+   -3.6909   -2.1909    0.0000 H   0  0  0

+    0.8963    3.0685    0.0000 H   0  0  0

+   -0.8939    3.0697    0.0000 H   0  0  0

+    4.4797    0.0774    0.0000 H   0  0  0

+   -4.4797    0.0785    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+ 10 14  2  0

+  5  7  1  0

+  9 13  2  0

+ 11 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+598-55-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.4485   -0.0024   -0.0013 C   0  0  0

+   -0.7168    0.6719    0.0009 O   0  0  0

+    1.6164    0.6704    0.0000 N   0  0  0

+    0.4473   -1.2175    0.0005 O   0  0  0

+   -1.9750   -0.0528   -0.0006 C   0  0  0

+    2.4909    0.1644    0.0000 H   0  0  0

+    1.6174    1.6807    0.0000 H   0  0  0

+   -2.4793    0.8227    0.0000 H   0  0  0

+   -2.8505   -0.5571    0.0000 H   0  0  0

+   -1.4707   -0.9283    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  5  8  1  0

+  5  9  1  0

+  5 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17902-23-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.3348    0.3841   -0.0288 N   0  0  0

+   -1.7892    0.5584   -0.0472 C   0  0  0

+    0.4662    1.4651   -0.0327 C   0  0  0

+    0.1975   -0.8789   -0.0020 C   0  0  0

+   -2.3716   -0.1167   -1.3041 C   0  0  0

+   -2.3649   -0.0968    1.0954 O   0  0  0

+    1.8056    1.3344   -0.0161 N   0  0  0

+   -0.0272    2.5763   -0.0520 O   0  0  0

+    1.5385   -1.0385    0.0155 C   0  0  0

+   -3.3607   -1.1688   -0.7459 C   0  0  0

+   -3.6417   -0.6265    0.6787 C   0  0  0

+    2.3694    0.1098    0.0053 C   0  0  0

+    2.0805   -2.2757    0.0427 F   0  0  0

+    3.5814   -0.0085    0.0204 O   0  0  0

+   -2.1504    1.5028    0.0000 H   0  0  0

+   -0.4105   -1.6868    0.0000 H   0  0  0

+   -2.0661   -1.0806    0.0000 H   0  0  0

+   -1.3811   -0.3200    0.0000 H   0  0  0

+    2.3917    2.1583    0.0000 H   0  0  0

+   -4.2004   -1.7320    0.0000 H   0  0  0

+   -2.7066   -1.9398    0.0000 H   0  0  0

+   -4.0554    0.2961    0.0000 H   0  0  0

+   -4.5522   -1.0661    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 12 14  2  0

+  9 12  1  0

+ 10 11  1  0

+  2 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  7 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+132-98-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+    0.6276   -2.4289    0.0551 N   0  0  0

+   -0.2114   -2.4277   -1.1518 C   0  0  1

+    1.4072   -1.2273    0.3173 C   0  0  2

+   -0.4790   -2.6475    0.8058 C   0  0  0

+   -1.4763   -2.4403   -0.3027 C   0  0  1

+    0.0373   -0.7501   -1.8541 S   0  0  0

+    1.5460   -0.2904   -0.9015 C   0  0  0

+    2.7771   -1.6151    0.8112 C   0  0  0

+   -0.6193   -2.9199    1.9793 O   0  0  0

+   -2.0228   -1.0835   -0.2205 N   0  0  0

+    1.5059    1.1791   -0.4772 C   0  0  0

+    2.8175   -0.5988   -1.6945 C   0  0  0

+    3.2047   -2.7428    0.6061 O   0  0  0

+    3.4616   -0.8022    1.4175 O   0  0  0

+   -3.3508   -0.8992   -0.0831 C   0  0  0

+   -3.9130    0.4965    0.0014 C   0  0  0

+   -4.0934   -1.8564   -0.0273 O   0  0  0

+   -5.3334    0.4300    0.1432 O   0  0  0

+   -5.7815    1.7111    0.2139 C   0  0  0

+   -7.1380    1.9661    0.3557 C   0  0  0

+   -4.8829    2.7659    0.1502 C   0  0  0

+   -7.5908    3.2690    0.4272 C   0  0  0

+   -5.3409    4.0674    0.2222 C   0  0  0

+   -6.6935    4.3189    0.3577 C   0  0  0

+   13.1573    2.7598    0.1854 K   0  3  0

+   -0.2070   -3.4609    0.0000 H   0  0  0

+    0.4407   -0.8621    0.0000 H   0  0  0

+   -2.1390   -3.2329    0.0000 H   0  0  0

+   -1.3870   -0.2691    0.0000 H   0  0  0

+    2.5387    1.2073    0.0000 H   0  0  0

+    1.4777    2.2119    0.0000 H   0  0  0

+    0.4731    1.1509    0.0000 H   0  0  0

+    2.5740   -1.6029    0.0000 H   0  0  0

+    3.8216   -0.8423    0.0000 H   0  0  0

+    3.0610    0.4053    0.0000 H   0  0  0

+   -2.9175    0.7730    0.0000 H   0  0  0

+   -4.0764    1.5167    0.0000 H   0  0  0

+   -7.8123    1.1833    0.0000 H   0  0  0

+   -3.8671    2.5773    0.0000 H   0  0  0

+   -8.6061    3.4604    0.0000 H   0  0  0

+   -4.6689    4.8522    0.0000 H   0  0  0

+   -7.0379    5.2930    0.0000 H   0  0  0

+    4.1271   -0.0119    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  7 11  1  0

+  7 12  1  0

+  8 13  2  0

+  8 14  1  0

+ 10 15  1  0

+ 15 16  1  0

+ 15 17  2  0

+ 16 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+ 19 21  2  0

+ 20 22  2  0

+ 21 23  1  0

+ 22 24  1  0

+  4  5  1  0

+  6  7  1  0

+ 23 24  2  0

+  2 26  1  0

+  3 27  1  0

+  5 28  1  0

+ 10 29  1  0

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+ 12 35  1  0

+ 16 36  1  0

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+ 20 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+ 14 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3018-12-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+   -0.0584    0.0000   -0.5604 C   0  0  0

+   -1.4672    0.0000   -0.1335 C   0  0  0

+    0.7632    1.4721    0.0788 Cl  0  0  0

+    0.7631   -1.4722    0.0788 Cl  0  0  0

+   -2.5544    0.0001    0.1959 N   0  0  0

+    1.1021    0.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  3  0

+  1  6  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+32692-19-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -1.2014    0.6381    0.0027 C   0  0  0

+   -1.6466   -0.6744    0.0017 C   0  0  0

+    0.1514    0.9191    0.0019 C   0  0  0

+   -2.4046    1.5540   -0.0015 C   0  0  0

+   -0.7079   -1.7086   -0.0002 C   0  0  0

+   -3.0406   -0.7453    0.0027 N   0  0  0

+    1.0744   -0.1099    0.0000 C   0  0  0

+   -3.6131    0.6036   -0.0051 C   0  0  0

+    0.6406   -1.4232   -0.0010 C   0  0  0

+    2.5231    0.1928   -0.0003 N   0  3  0

+    3.3350   -0.7151   -0.0020 O   0  0  0

+    2.9035    1.3499    0.0010 O   0  5  0

+    0.4758    1.9066    0.0000 H   0  0  0

+   -1.7074    2.3249    0.0000 H   0  0  0

+   -3.1139    2.3139    0.0000 H   0  0  0

+   -1.0276   -2.6977    0.0000 H   0  0  0

+   -3.5921   -1.6264    0.0000 H   0  0  0

+   -4.1811    1.4742    0.0000 H   0  0  0

+   -4.5304    0.1147    0.0000 H   0  0  0

+    1.3339   -2.1977    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

+  4  8  1  0

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+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-37-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -0.8782   -0.1838    0.0614 C   0  0  0

+   -2.0390    0.6699    0.0235 C   0  0  0

+    0.4836    0.3723    0.1061 C   0  0  0

+   -1.1007   -1.5454    0.0599 C   0  0  0

+   -3.2430    0.0663   -0.0155 C   0  0  0

+    1.5480   -0.4538    0.1408 N   0  0  0

+    0.6486    1.5775    0.1116 O   0  0  0

+   -2.8274   -1.6655    0.0086 S   0  0  0

+   -4.5846    0.6904   -0.0593 N   0  3  0

+    2.8434    0.0697    0.0533 C   0  0  0

+   -5.5811   -0.0093   -0.0915 O   0  0  0

+   -4.6921    1.9036   -0.0631 O   0  5  0

+    3.9360   -0.7858   -0.0432 C   0  0  0

+    3.0402    1.4434    0.0567 C   0  0  0

+    5.2136   -0.2646   -0.1300 C   0  0  0

+    3.7491   -2.1238   -0.0517 F   0  0  0

+    4.3200    1.9573   -0.0304 C   0  0  0

+    5.4048    1.1053   -0.1209 C   0  0  0

+   -1.9514    1.7011    0.0000 H   0  0  0

+   -0.4036   -2.3102    0.0000 H   0  0  0

+    1.4057   -1.4788    0.0000 H   0  0  0

+    2.2262    2.0825    0.0000 H   0  0  0

+    6.0305   -0.9000    0.0000 H   0  0  0

+    4.4664    2.9818    0.0000 H   0  0  0

+    6.3646    1.4922    0.0000 H   0  0  0

+  1  2  1  0

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+  5  8  1  0

+ 17 18  2  0

+  2 19  1  0

+  4 20  1  0

+  6 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 17 24  1  0

+ 18 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+8003-03-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 68                          1 V2000

+    5.3156    0.1805    0.1636 N   0  0  0

+    4.1327   -0.5642    0.6023 C   0  0  1

+    5.5422    1.5220    0.3407 C   0  0  0

+    6.3958   -0.3335   -0.4900 C   0  0  0

+    3.0660   -0.5483   -0.5221 C   0  0  1

+    4.4653   -1.9632    0.7313 O   0  0  0

+    6.7953    1.7829   -0.2383 C   0  0  0

+    4.8684    2.5217    0.9005 N   0  0  0

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+    2.2715   -1.8454   -0.2337 C   0  0  1

+    2.2098    0.5828   -0.3504 O   0  0  0

+    3.2366   -2.6995    0.6111 C   0  0  1

+    7.2829    3.1005   -0.1990 C   0  0  0

+    5.3649    3.7406    0.9143 C   0  0  0

+    1.1117   -1.5314    0.5398 O   0  0  0

+    3.5043   -4.0250   -0.1047 C   0  0  0

+    6.5376    4.0344    0.3825 N   0  0  0

+    8.5110    3.4178   -0.7524 N   0  0  0

+   -0.1643   -1.9946   -0.3258 P   0  0  0

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+   -0.1795   -1.2008   -1.7264 O   0  0  0

+   -0.0833   -3.4496   -0.5842 O   0  0  0

+   -2.6042   -2.1006   -0.3255 C   0  0  0

+   -3.9236   -1.8182    0.3958 C   0  0  1

+   -4.0603   -0.4031    0.6079 O   0  0  0

+   -5.1007   -2.2641   -0.4931 C   0  0  2

+   -5.4647   -0.0920    0.4835 C   0  0  2

+   -5.9260   -0.9718   -0.7063 C   0  0  2

+   -5.8919   -3.2239    0.2103 O   0  0  0

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+   -7.3174   -1.2671   -0.5691 O   0  0  0

+   -6.3395    2.1326    0.9352 C   0  0  0

+   -5.0382    1.8113   -0.9945 C   0  0  0

+   -6.4995    3.4220    0.6423 N   0  0  0

+   -6.8516    1.6788    1.9451 O   0  0  0

+   -5.1914    3.1202   -1.3058 C   0  0  0

+   -5.9536    3.9413   -0.4495 C   0  0  0

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+  2  1  1  0

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+  5 10  1  0

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+ 19 22  1  0

+ 19 23  2  0

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+  7  9  1  0

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+ 30 59  1  0

+ 32 60  1  0

+ 34 61  1  0

+ 37 62  1  0

+ 39 63  1  0

+ 39 64  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104445-28-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    0.6540   -0.1252    0.2270 C   0  0  0

+   -0.6810    0.4032    0.6849 C   0  0  0

+    1.8368    0.5155    0.3460 N   0  0  0

+    0.8593   -1.2799   -0.3451 N   0  0  0

+   -1.5953    0.5052   -0.4747 N   0  0  0

+   -1.2935   -0.5487    1.5813 O   0  0  0

+    2.7955   -0.3015   -0.1899 C   0  0  0

+    2.0535    1.8379    0.9381 C   0  0  0

+    2.1664   -1.4140   -0.6144 C   0  0  0

+   -2.9317    0.1130    0.0285 C   0  0  0

+   -2.7042   -0.2346    1.5160 C   0  0  0

+    4.2456   -0.0182   -0.2816 N   0  3  0

+   -3.9139    1.2788   -0.1024 C   0  0  0

+   -3.4508   -1.1081   -0.7334 C   0  0  0

+    4.8602    0.3382    0.7077 O   0  0  0

+    4.8240   -0.1416   -1.3463 O   0  5  0

+   -3.8695    1.7917   -1.4354 O   0  0  0

+   -4.6897   -1.5343   -0.1627 O   0  0  0

+   -0.4436    1.3567    0.0000 H   0  0  0

+   -1.6809    1.4841    0.0000 H   0  0  0

+    3.0232    1.6790    0.0000 H   0  0  0

+    2.2124    2.8076    0.0000 H   0  0  0

+    1.0838    1.9968    0.0000 H   0  0  0

+    2.6175   -2.2870    0.0000 H   0  0  0

+   -3.6390   -0.5375    0.0000 H   0  0  0

+   -2.6579   -1.2161    0.0000 H   0  0  0

+   -4.8377    1.6137    0.0000 H   0  0  0

+   -4.4762    0.4730    0.0000 H   0  0  0

+   -3.3655   -2.0870    0.0000 H   0  0  0

+   -2.4803   -1.2623    0.0000 H   0  0  0

+   -3.7848    2.7707    0.0000 H   0  0  0

+   -5.6189   -1.8539    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

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+  7  9  2  0

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+ 13 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+637-69-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -2.9065    0.2311   -0.0007 C   0  0  0

+   -3.5645   -0.9200   -0.0022 C   0  0  0

+   -1.4288    0.2375   -0.0010 C   0  0  0

+   -0.7344    1.4480    0.0007 C   0  0  0

+   -0.7238   -0.9674    0.0030 C   0  0  0

+    0.6444    1.4498    0.0009 C   0  0  0

+    0.6545   -0.9574    0.0032 C   0  0  0

+    1.3419    0.2494   -0.0005 C   0  0  0

+    2.7006    0.2552   -0.0008 O   0  0  0

+    3.1195   -1.1110   -0.0023 C   0  0  0

+   -3.4311    1.1308    0.0000 H   0  0  0

+   -4.6059   -0.9245    0.0000 H   0  0  0

+   -3.0399   -1.8197    0.0000 H   0  0  0

+   -1.2570    2.3488    0.0000 H   0  0  0

+   -1.2386   -1.8727    0.0000 H   0  0  0

+    1.1633    2.3528    0.0000 H   0  0  0

+    1.1811   -1.8559    0.0000 H   0  0  0

+    2.1238   -1.4163    0.0000 H   0  0  0

+    3.4248   -2.1067    0.0000 H   0  0  0

+    4.1152   -0.8057    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

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+ 10  9  1  0

+  7  8  1  0

+  1 11  1  0

+  2 12  1  0

+  2 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106063-42-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 43                          1 V2000

+    0.8391    0.0024   -0.5730 C   0  0  0

+    1.5123   -1.2061   -0.3018 C   0  0  0

+    1.5163    1.2071   -0.2971 C   0  0  0

+   -0.4356    0.0056   -1.0953 N   0  0  0

+    2.8275   -1.1674    0.2310 C   0  0  0

+    0.8993   -2.4455   -0.5512 C   0  0  0

+    2.8316    1.1618    0.2356 C   0  0  0

+    0.9077    2.4498   -0.5415 C   0  0  0

+   -1.5440    0.0029   -0.2383 C   0  0  0

+    3.4289   -0.0042    0.4765 N   0  0  0

+    3.4893   -2.3834    0.4975 C   0  0  0

+    1.5720   -3.5969   -0.2797 C   0  0  0

+    3.4977    2.3744    0.5070 C   0  0  0

+    1.5845    3.5976   -0.2654 C   0  0  0

+   -2.8337    0.0062   -0.7657 C   0  0  0

+   -1.3587   -0.0089    1.1367 C   0  0  0

+    2.8647   -3.5635    0.2430 C   0  0  0

+    2.8771    3.5576    0.2571 C   0  0  0

+   -3.9270    0.0029    0.0844 C   0  0  0

+   -3.0184    0.0130   -2.1129 O   0  0  0

+   -2.4518   -0.0121    1.9818 C   0  0  0

+   -3.7365   -0.0036    1.4581 C   0  0  0

+   -4.4299    0.0148   -2.3362 C   0  0  0

+   -4.8100   -0.0067    2.2925 O   0  0  0

+   -0.4356    0.9882    0.0000 H   0  0  0

+   -0.0827   -2.4796    0.0000 H   0  0  0

+   -0.0741    2.4878    0.0000 H   0  0  0

+    4.4718   -2.3777    0.0000 H   0  0  0

+    1.0940   -4.4553    0.0000 H   0  0  0

+    4.4802    2.3649    0.0000 H   0  0  0

+    1.1104    4.4582    0.0000 H   0  0  0

+   -0.3766   -0.0387    0.0000 H   0  0  0

+    3.3824   -4.3986    0.0000 H   0  0  0

+    3.3985    4.3904    0.0000 H   0  0  0

+   -4.9094    0.0182    0.0000 H   0  0  0

+   -2.4536   -0.9947    0.0000 H   0  0  0

+   -4.4286    0.9974    0.0000 H   0  0  0

+   -5.4125    0.0161    0.0000 H   0  0  0

+   -4.4312   -0.9678    0.0000 H   0  0  0

+   -5.7926   -0.0095    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+ 20 23  1  0

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+  7 10  2  0

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+ 19 35  1  0

+ 21 36  1  0

+ 23 37  1  0

+ 23 38  1  0

+ 23 39  1  0

+ 24 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93-08-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.9060    0.5604   -0.0027 C   0  0  0

+   -1.2840   -0.8069   -0.0012 C   0  0  0

+    0.4537    0.9015   -0.0023 C   0  0  0

+   -1.9041    1.5522    0.0013 C   0  0  0

+   -0.2919   -1.8050    0.0012 C   0  0  0

+   -2.6480   -1.1423   -0.0016 C   0  0  0

+    1.4096   -0.1056   -0.0004 C   0  0  0

+   -3.2153    1.1880    0.0065 C   0  0  0

+    1.0199   -1.4593    0.0021 C   0  0  0

+   -3.5861   -0.1554   -0.0035 C   0  0  0

+    2.8383    0.2433    0.0000 C   0  0  0

+    3.8799   -0.8458    0.0021 C   0  0  0

+    3.1781    1.4074   -0.0012 O   0  0  0

+    0.7474    1.9121    0.0000 H   0  0  0

+   -1.6380    2.5704    0.0000 H   0  0  0

+   -0.5679   -2.8206    0.0000 H   0  0  0

+   -2.9437   -2.1523    0.0000 H   0  0  0

+   -3.9601    1.9316    0.0000 H   0  0  0

+    1.7556   -2.2118    0.0000 H   0  0  0

+   -4.6070   -0.4111    0.0000 H   0  0  0

+    3.1193   -1.5732    0.0000 H   0  0  0

+    4.6073   -1.6064    0.0000 H   0  0  0

+    4.6405   -0.1184    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

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+  7  9  2  0

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+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119-36-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.1605    0.1886   -0.0105 C   0  0  0

+    1.0762   -0.8725    0.0232 C   0  0  0

+    0.6297    1.5050   -0.0371 C   0  0  0

+   -1.2882   -0.0825   -0.0239 C   0  0  0

+    2.4373   -0.6054    0.0297 C   0  0  0

+    0.6331   -2.1542    0.0497 O   0  0  0

+    1.9851    1.7512   -0.0302 C   0  0  0

+   -2.1653    0.9371    0.0601 O   0  0  0

+   -1.6917   -1.2254   -0.1107 O   0  0  0

+    2.8868    0.6996    0.0031 C   0  0  0

+   -3.5925    0.6700    0.0469 C   0  0  0

+   -0.0428    2.2969    0.0000 H   0  0  0

+    3.1196   -1.3889    0.0000 H   0  0  0

+    0.2936   -3.1361    0.0000 H   0  0  0

+    2.3327    2.7303    0.0000 H   0  0  0

+    3.9073    0.8943    0.0000 H   0  0  0

+   -3.7836    1.6912    0.0000 H   0  0  0

+   -4.6137    0.4789    0.0000 H   0  0  0

+   -3.4014   -0.3512    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15131-84-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+    0.0452    1.8175   -0.2614 C   0  0  0

+   -0.5223    0.4256   -0.1201 C   0  0  0

+    1.5735    1.9733   -0.2891 C   0  0  0

+    0.8059    2.1384    0.9050 O   0  0  0

+    0.3167   -0.6646   -0.0207 C   0  0  0

+   -1.9140    0.2449   -0.0899 C   0  0  0

+    2.4095    0.7205   -0.1751 C   0  0  0

+    1.7935   -0.5192   -0.0482 C   0  0  0

+   -0.2278   -1.9585    0.1117 C   0  0  0

+   -2.4457   -1.0623    0.0434 C   0  0  0

+   -2.7918    1.3391   -0.1900 C   0  0  0

+    3.7864    0.8153   -0.1971 C   0  0  0

+    2.5843   -1.6672    0.0568 C   0  0  0

+   -1.5688   -2.1570    0.1434 C   0  0  0

+   -3.8389   -1.2394    0.0733 C   0  0  0

+   -4.1360    1.1288   -0.1574 C   0  0  0

+    4.5620   -0.3252   -0.0935 C   0  0  0

+    3.9588   -1.5637    0.0343 C   0  0  0

+   -4.6582   -0.1567   -0.0261 C   0  0  0

+   -0.6951    2.5489    0.0000 H   0  0  0

+    2.1586    2.8339    0.0000 H   0  0  0

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+   -2.4157    2.3094    0.0000 H   0  0  0

+    4.2413    1.7512    0.0000 H   0  0  0

+    2.1352   -2.6059    0.0000 H   0  0  0

+   -1.9492   -3.1256    0.0000 H   0  0  0

+   -4.2425   -2.1986    0.0000 H   0  0  0

+   -4.7823    1.9444    0.0000 H   0  0  0

+    5.5999   -0.2503    0.0000 H   0  0  0

+    4.5433   -2.4247    0.0000 H   0  0  0

+   -5.6899   -0.2926    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

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+ 15 19  2  0

+  3  4  1  0

+  7  8  2  0

+ 10 14  1  0

+ 16 19  1  0

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+  1 20  1  0

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+  9 22  1  0

+ 11 23  1  0

+ 12 24  1  0

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+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+610-39-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.1181    0.7885    0.0496 C   0  0  0

+    0.2883   -0.5307   -0.0296 C   0  0  0

+    0.8229    1.7990    0.1102 C   0  0  0

+   -1.5608    1.1188    0.0632 N   0  3  0

+    1.6355   -0.8388   -0.0482 C   0  0  0

+   -0.7194   -1.6129   -0.0951 N   0  3  0

+    2.1705    1.4907    0.0917 C   0  0  0

+   -2.0088    1.9240   -0.7334 O   0  0  0

+   -2.3001    0.5856    0.8711 O   0  5  0

+    2.5768    0.1720    0.0129 C   0  0  0

+   -0.3671   -2.7773   -0.0366 O   0  0  0

+   -1.9008   -1.3389   -0.2074 O   0  5  0

+    4.0457   -0.1640   -0.0078 C   0  0  0

+    0.5188    2.7889    0.0000 H   0  0  0

+    1.9396   -1.8287    0.0000 H   0  0  0

+    2.8752    2.2496    0.0000 H   0  0  0

+    3.8148   -1.1735    0.0000 H   0  0  0

+    5.0552   -0.3949    0.0000 H   0  0  0

+    4.2766    0.8455    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  7 10  2  0

+  3 14  1  0

+  5 15  1  0

+  7 16  1  0

+ 13 17  1  0

+ 13 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112575-91-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -1.4186    0.5131   -0.0033 C   0  0  0

+   -0.7803   -0.8018   -0.0030 C   0  0  0

+   -0.4724    1.5281   -0.0024 C   0  0  0

+   -2.7911    0.7255    0.0009 C   0  0  0

+    0.6731   -0.5353   -0.0019 C   0  0  0

+   -1.5758   -1.9215   -0.0033 C   0  0  0

+    0.8580    0.8788   -0.0015 C   0  0  0

+   -0.9513    2.8393   -0.0020 C   0  0  0

+   -3.6577   -0.4699    0.0062 C   0  0  0

+   -3.2483    2.0391    0.0007 C   0  0  0

+    1.7658   -1.3819   -0.0013 C   0  0  0

+   -2.9842   -1.8092   -0.0040 C   0  0  0

+    2.1307    1.4068   -0.0009 C   0  0  0

+   -2.3167    3.0713   -0.0028 C   0  0  0

+   -4.8673   -0.3721    0.0104 O   0  0  0

+    3.0679   -0.8510    0.0004 C   0  0  0

+   -3.6631   -2.8183   -0.0041 O   0  0  0

+    3.2521    0.5549   -0.0001 C   0  0  0

+    4.1919   -1.6929    0.0020 C   0  0  0

+    4.5542    1.0770    0.0013 C   0  0  0

+    5.4433   -1.1499    0.0039 C   0  0  0

+    5.6238    0.2294    0.0027 C   0  0  0

+   -1.1337   -2.8685    0.0000 H   0  0  0

+   -0.2825    3.6424    0.0000 H   0  0  0

+   -4.2727    2.2464    0.0000 H   0  0  0

+    1.6241   -2.4174    0.0000 H   0  0  0

+    2.2643    2.4433    0.0000 H   0  0  0

+   -2.6595    4.0586    0.0000 H   0  0  0

+    4.0702   -2.7309    0.0000 H   0  0  0

+    4.7046    2.1112    0.0000 H   0  0  0

+    6.2780   -1.7789    0.0000 H   0  0  0

+    6.5923    0.6222    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  2  0

+ 11 16  2  0

+ 12 17  2  0

+ 13 18  2  0

+ 16 19  1  0

+ 18 20  1  0

+ 19 21  2  0

+ 20 22  2  0

+  5  7  2  0

+  9 12  1  0

+ 10 14  2  0

+ 16 18  1  0

+ 21 22  1  0

+  6 23  1  0

+  8 24  1  0

+ 10 25  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+ 22 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111712-47-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+    0.0996    0.9988    0.2746 P   0  0  0

+    0.0245   -0.4292    1.0144 O   0  0  0

+    1.3750    1.0281   -0.7074 O   0  0  0

+   -1.2433    1.2303   -0.5828 O   0  0  0

+    0.2305    2.0718    1.2855 O   0  0  0

+   -0.1244   -1.4166   -0.0078 C   0  0  0

+    2.5367    1.0454    0.1247 C   0  0  0

+   -2.2986    1.4534    0.3546 C   0  0  0

+   -0.2024   -2.8045    0.6313 C   0  0  0

+    3.7909    1.0737   -0.7511 C   0  0  0

+   -3.6104    1.6816   -0.3990 C   0  0  0

+   -0.3618   -3.8617   -0.4631 C   0  0  0

+    1.4463   -3.1532    1.6440 Br  0  0  0

+    5.0346    1.0921    0.1399 C   0  0  0

+    3.8278   -0.5250   -1.8948 Br  0  0  0

+   -4.7402    1.9205    0.6047 C   0  0  0

+   -3.4297    3.2517   -1.5683 Br  0  0  0

+   -0.4398   -5.2496    0.1760 C   0  0  0

+   -2.0105   -3.5130   -1.4758 Br  0  0  0

+    6.2889    1.1204   -0.7359 C   0  0  0

+    4.9978    2.6908    1.2836 Br  0  0  0

+   -6.0520    2.1487   -0.1490 C   0  0  0

+   -4.9209    0.3504    1.7740 Br  0  0  0

+   -0.9241   -0.8185    0.0000 H   0  0  0

+   -1.0295   -1.8386    0.0000 H   0  0  0

+    2.0526    0.1720    0.0000 H   0  0  0

+    3.0532    0.1907    0.0000 H   0  0  0

+   -1.6402    2.2042    0.0000 H   0  0  0

+   -2.6310    2.3951    0.0000 H   0  0  0

+   -1.1957   -2.7019    0.0000 H   0  0  0

+    3.7722    2.0722    0.0000 H   0  0  0

+   -3.7993    0.7010    0.0000 H   0  0  0

+    0.6315   -3.9643    0.0000 H   0  0  0

+    5.0532    0.0936    0.0000 H   0  0  0

+   -4.5513    2.9011    0.0000 H   0  0  0

+   -1.4369   -5.1936    0.0000 H   0  0  0

+   -0.4958   -6.2467    0.0000 H   0  0  0

+    0.5573   -5.3056    0.0000 H   0  0  0

+    6.3114    0.1220    0.0000 H   0  0  0

+    7.2873    1.1429    0.0000 H   0  0  0

+    6.2664    2.1188    0.0000 H   0  0  0

+   -5.8808    3.1326    0.0000 H   0  0  0

+   -7.0359    2.3198    0.0000 H   0  0  0

+   -6.2232    1.1648    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+ 14 20  1  0

+ 14 21  1  0

+ 16 22  1  0

+ 16 23  1  0

+  6 24  1  0

+  6 25  1  0

+  7 26  1  0

+  7 27  1  0

+  8 28  1  0

+  8 29  1  0

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+ 16 35  1  0

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+ 20 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+ 22 42  1  0

+ 22 43  1  0

+ 22 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106449-56-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -0.3698   -0.0339   -0.1931 N   0  0  0

+   -1.5859   -0.1608    0.4124 C   0  0  0

+    0.9359   -0.2860    0.4217 C   0  0  2

+   -0.5958    0.3686   -1.4891 C   0  0  0

+   -2.5436    0.2939   -0.5471 C   0  0  0

+   -1.9418   -0.5845    1.6036 N   0  0  0

+    1.7421    0.9096    0.3467 O   0  0  0

+    1.6887   -1.3242   -0.3951 C   0  0  0

+   -1.8691    0.5471   -1.6909 N   0  0  0

+   -3.8861    0.4325   -0.2083 C   0  0  0

+   -3.3718   -0.7472    1.8977 C   0  0  0

+    3.1054    0.4434    0.4589 C   0  0  1

+    3.1357   -0.8564   -0.3750 C   0  0  1

+    1.2375   -2.3033   -0.9392 O   0  0  0

+   -4.1870    0.1851    1.1187 N   0  0  0

+   -4.8412    0.7881   -1.1237 N   0  0  0

+    4.0493    1.4725   -0.1663 C   0  0  0

+    3.9420   -1.8306    0.2906 O   0  0  0

+    3.9453    2.7078    0.5444 O   0  0  0

+    0.4264   -1.0860    0.0000 H   0  0  0

+   -0.0609    1.1518    0.0000 H   0  0  0

+   -4.1964   -1.2158    0.0000 H   0  0  0

+   -3.0779   -1.6490    0.0000 H   0  0  0

+    3.9932    0.1098    0.0000 H   0  0  0

+    4.0242   -0.5246    0.0000 H   0  0  0

+   -5.1322    0.2629    0.0000 H   0  0  0

+   -4.9990    1.7233    0.0000 H   0  0  0

+   -5.5722    0.1838    0.0000 H   0  0  0

+    4.5694    0.6794    0.0000 H   0  0  0

+    4.9459    1.7818    0.0000 H   0  0  0

+    4.5467   -2.5612    0.0000 H   0  0  0

+    3.8657    3.6529    0.0000 H   0  0  0

+  1  2  1  0

+  3  1  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

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+  5  9  1  0

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+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1672-88-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    3.5693    0.2517    0.0037 N   0  0  0

+    3.9604   -1.1686    0.0047 C   0  0  0

+    4.7099    0.9649   -0.0018 C   0  0  0

+    2.3674    0.7201    0.0026 N   0  0  0

+    5.4755   -1.1209   -0.0010 C   0  0  0

+    5.7988    0.1875   -0.0045 N   0  0  0

+    4.7471    2.1787   -0.0040 O   0  0  0

+    1.3307   -0.1106    0.0027 C   0  0  0

+    6.2378   -2.0635   -0.0015 O   0  0  0

+    0.0429    0.3913    0.0015 C   0  0  0

+   -1.0604   -0.4929    0.0016 C   0  0  0

+   -2.3469    0.0085    0.0004 C   0  0  0

+   -3.4875   -0.7182    0.0004 O   0  0  0

+   -2.7126    1.3816    0.0052 C   0  0  0

+   -4.5398    0.1061   -0.0010 C   0  0  0

+   -4.0917    1.4182    0.0018 C   0  0  0

+   -5.9591   -0.3154   -0.0021 N   0  3  0

+   -6.8432    0.5225   -0.0034 O   0  0  0

+   -6.2888   -1.6925   -0.0019 O   0  5  0

+    2.9543   -1.3617    0.0000 H   0  0  0

+    4.0734   -2.1869    0.0000 H   0  0  0

+    6.7597    0.5429    0.0000 H   0  0  0

+    1.4858   -1.1233    0.0000 H   0  0  0

+   -0.1122    1.4040    0.0000 H   0  0  0

+   -0.9053   -1.5056    0.0000 H   0  0  0

+   -2.0776    2.1856    0.0000 H   0  0  0

+   -4.6766    2.2593    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  8 10  1  0

+ 10 11  2  0

+ 11 12  1  0

+ 12 13  1  0

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+  5  6  1  0

+ 15 16  2  0

+  2 20  1  0

+  2 21  1  0

+  6 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105650-23-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -1.4344    0.2948    0.0505 C   0  0  0

+   -1.7909   -1.0539   -0.1355 C   0  0  0

+   -0.0966    0.6485    0.0936 C   0  0  0

+   -2.6218    1.0011    0.1485 N   0  0  0

+   -3.1461   -1.1068   -0.1367 N   0  0  0

+   -0.8460   -1.9834   -0.2687 N   0  0  0

+    0.8575   -0.3620   -0.0513 C   0  0  0

+   -3.6375    0.0982    0.0244 C   0  0  0

+   -2.7611    2.4456    0.3487 C   0  0  0

+    0.4322   -1.6791   -0.2318 C   0  0  0

+    2.3047   -0.0390   -0.0133 C   0  0  0

+   -4.9790    0.4061    0.0676 N   0  0  0

+    3.1941   -0.8888    0.6423 C   0  0  0

+    2.7810    1.1120   -0.6379 C   0  0  0

+    4.5395   -0.5836    0.6741 C   0  0  0

+    4.1288    1.4073   -0.5997 C   0  0  0

+    5.0060    0.5633    0.0568 C   0  0  0

+    0.1865    1.6412    0.0000 H   0  0  0

+   -1.7336    2.5447    0.0000 H   0  0  0

+   -2.8602    3.4731    0.0000 H   0  0  0

+   -3.7886    2.3465    0.0000 H   0  0  0

+    1.1329   -2.4372    0.0000 H   0  0  0

+   -5.2821    1.3929    0.0000 H   0  0  0

+   -5.6820   -0.3498    0.0000 H   0  0  0

+    2.9190   -1.8837    0.0000 H   0  0  0

+    2.1183    1.9035    0.0000 H   0  0  0

+    5.2075   -1.3706    0.0000 H   0  0  0

+    4.4093    2.4007    0.0000 H   0  0  0

+    6.0158    0.7777    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+ 11 13  1  0

+ 11 14  2  0

+ 13 15  2  0

+ 14 16  1  0

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+  5  8  2  0

+  7 10  1  0

+ 16 17  2  0

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+  9 19  1  0

+  9 20  1  0

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+ 10 22  1  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+479-13-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.4557    0.7350    0.0022 C   0  0  0

+   -0.1453   -0.5210    0.0007 C   0  0  0

+    1.9062    0.4830    0.0016 C   0  0  0

+   -0.3460    1.8965   -0.0012 C   0  0  0

+   -1.6129   -0.5727    0.0007 C   0  0  0

+    0.8107   -1.4622   -0.0006 O   0  0  0

+    2.0457   -0.9141   -0.0002 C   0  0  0

+    3.0321    1.3014    0.0024 C   0  0  0

+   -1.6870    1.8186   -0.0065 O   0  0  0

+    0.1883    2.9907    0.0003 O   0  0  0

+   -2.3353    0.6333    0.0024 C   0  0  0

+   -2.2896   -1.7956   -0.0013 C   0  0  0

+    3.3187   -1.4685   -0.0011 C   0  0  0

+    4.2890    0.7365    0.0014 C   0  0  0

+   -3.7223    0.5936    0.0024 C   0  0  0

+   -3.6551   -1.8171   -0.0017 C   0  0  0

+    4.4322   -0.6469   -0.0004 C   0  0  0

+   -4.3775   -0.6266    0.0008 C   0  0  0

+    5.6755   -1.1961   -0.0009 O   0  0  0

+   -5.7349   -0.6623    0.0012 O   0  0  0

+    2.9250    2.3366    0.0000 H   0  0  0

+   -1.7540   -2.6879    0.0000 H   0  0  0

+    3.4355   -2.5026    0.0000 H   0  0  0

+    5.1325    1.3461    0.0000 H   0  0  0

+   -4.2692    1.4790    0.0000 H   0  0  0

+   -4.1584   -2.7280    0.0000 H   0  0  0

+    6.6274   -1.6166    0.0000 H   0  0  0

+   -6.7752   -0.6897    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  7 13  2  0

+  8 14  1  0

+ 11 15  1  0

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+ 15 18  2  0

+ 17 19  1  0

+ 18 20  1  0

+  6  7  1  0

+  9 11  1  0

+ 14 17  2  0

+ 16 18  1  0

+  8 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 19 27  1  0

+ 20 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14925-39-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+   -0.7319    0.7447   -0.0016 C   0  0  0

+   -1.9902   -0.0025    0.0013 C   0  0  0

+   -0.7482    2.0797    0.0003 C   0  0  0

+    0.9172   -0.1807    0.0001 Br  0  0  0

+   -1.9753   -1.2156   -0.0004 O   0  0  0

+   -2.9054    0.5110    0.0000 H   0  0  0

+    0.1542    2.6155    0.0000 H   0  0  0

+   -1.6634    2.5933    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+27113-22-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 46                          1 V2000

+    2.6529    0.5582   -0.4639 C   0  0  0

+    3.3692   -0.6225   -0.3928 C   0  0  0

+    3.2205    1.7416   -0.0307 C   0  0  0

+    1.2526    0.5557   -1.0208 C   0  0  0

+    4.6586   -0.6209    0.1135 C   0  0  0

+    4.5072    1.7502    0.4758 C   0  0  0

+    0.2534    0.3157    0.1128 C   0  0  0

+    5.2303    0.5709    0.5498 C   0  0  0

+    5.3643   -1.7813    0.1845 O   0  0  0

+   -1.1469    0.3131   -0.4441 C   0  0  0

+    6.4958    0.5776    1.0476 O   0  0  0

+    4.5182   -2.8114   -0.3303 C   0  0  0

+   -2.3224    0.0956    0.4736 C   0  0  0

+   -1.3272    0.4854   -1.6256 O   0  0  0

+   -3.6183    0.1393   -0.3385 C   0  0  0

+   -4.8117   -0.0816    0.5931 C   0  0  0

+   -6.1076   -0.0378   -0.2190 C   0  0  0

+   -7.3010   -0.2587    0.7127 C   0  0  0

+   -8.5969   -0.2149   -0.0994 C   0  0  0

+   -9.7903   -0.4358    0.8323 C   0  0  0

+    2.8927   -1.4702    0.0000 H   0  0  0

+    2.6997    2.5629    0.0000 H   0  0  0

+    1.6702    1.4340    0.0000 H   0  0  0

+    0.6401    1.3110    0.0000 H   0  0  0

+    4.9794    2.6003    0.0000 H   0  0  0

+   -0.1641   -0.5626    0.0000 H   0  0  0

+    0.8659   -0.4396    0.0000 H   0  0  0

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+    3.7667   -2.1942    0.0000 H   0  0  0

+    3.9010   -3.5629    0.0000 H   0  0  0

+    5.2697   -3.4286    0.0000 H   0  0  0

+   -2.7759   -0.7647    0.0000 H   0  0  0

+   -1.7461   -0.6877    0.0000 H   0  0  0

+   -3.1649    0.9996    0.0000 H   0  0  0

+   -4.1947    0.9226    0.0000 H   0  0  0

+   -5.2652   -0.9419    0.0000 H   0  0  0

+   -4.2354   -0.8649    0.0000 H   0  0  0

+   -5.6541    0.8225    0.0000 H   0  0  0

+   -6.6839    0.7455    0.0000 H   0  0  0

+   -7.7545   -1.1190    0.0000 H   0  0  0

+   -6.7247   -1.0420    0.0000 H   0  0  0

+   -8.1434    0.6454    0.0000 H   0  0  0

+   -9.1732    0.5684    0.0000 H   0  0  0

+   -9.9673    0.5204    0.0000 H   0  0  0

+  -10.7465   -0.6128    0.0000 H   0  0  0

+   -9.6133   -1.3920    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+  6  8  2  0

+  2 21  1  0

+  3 22  1  0

+  4 23  1  0

+  4 24  1  0

+  6 25  1  0

+  7 26  1  0

+  7 27  1  0

+ 11 28  1  0

+ 12 29  1  0

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+ 13 32  1  0

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+ 15 34  1  0

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+ 18 41  1  0

+ 19 42  1  0

+ 19 43  1  0

+ 20 44  1  0

+ 20 45  1  0

+ 20 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+118-56-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+    1.0335    0.2749   -0.2322 C   0  0  0

+    0.0001   -0.4920    0.1673 O   0  0  0

+    0.8249    1.3128   -0.8286 O   0  0  0

+    2.4168   -0.1422    0.0596 C   0  0  0

+   -1.3628   -0.0782   -0.1149 C   0  0  0

+    3.4971    0.5911   -0.4510 C   0  0  0

+    2.6594   -1.2679    0.8518 C   0  0  0

+   -2.2490   -1.3153   -0.2731 C   0  0  0

+   -1.8849    0.7789    1.0400 C   0  0  0

+    3.2745    1.6889   -1.2161 O   0  0  0

+    4.7945    0.1892   -0.1699 C   0  0  0

+    3.9547   -1.6523    1.1206 C   0  0  0

+   -3.6851   -0.8792   -0.5705 C   0  0  0

+   -3.3210    1.2150    0.7426 C   0  0  0

+    5.0195   -0.9280    0.6092 C   0  0  0

+   -3.7127   -0.0631   -1.8643 C   0  0  0

+   -4.5713   -2.1163   -0.7288 C   0  0  0

+   -4.2072   -0.0221    0.5844 C   0  0  0

+   -3.8432    2.0720    1.8975 C   0  0  0

+   -0.7671    0.6906    0.0000 H   0  0  0

+    1.9460   -1.9289    0.0000 H   0  0  0

+   -2.6311   -2.2096    0.0000 H   0  0  0

+   -1.4015   -1.7924    0.0000 H   0  0  0

+   -0.9467    1.0350    0.0000 H   0  0  0

+   -1.8711    1.7514    0.0000 H   0  0  0

+    3.0812    2.6421    0.0000 H   0  0  0

+    5.5162    0.8411    0.0000 H   0  0  0

+    4.1043   -2.6133    0.0000 H   0  0  0

+   -2.7253    1.9838    0.0000 H   0  0  0

+    5.9200   -1.2954    0.0000 H   0  0  0

+   -2.7407   -0.0302    0.0000 H   0  0  0

+   -3.7456    0.9089    0.0000 H   0  0  0

+   -4.6847   -0.0960    0.0000 H   0  0  0

+   -5.3619   -1.5499    0.0000 H   0  0  0

+   -5.1377   -2.9069    0.0000 H   0  0  0

+   -3.7807   -2.6827    0.0000 H   0  0  0

+   -4.9151    0.6448    0.0000 H   0  0  0

+   -4.9627   -0.6345    0.0000 H   0  0  0

+   -3.0127    2.5781    0.0000 H   0  0  0

+   -4.3493    2.9025    0.0000 H   0  0  0

+   -4.6737    1.5659    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  1  0

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+  7  4  1  0

+  8  5  1  0

+  9  5  1  0

+ 10  6  1  0

+ 11  6  1  0

+ 12  7  2  0

+ 13  8  1  0

+ 14  9  1  0

+ 15 11  2  0

+ 16 13  1  0

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+ 18 13  1  0

+ 19 14  1  0

+ 12 15  1  0

+ 14 18  1  0

+  5 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

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+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+111-20-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    5.6191   -0.0143   -0.0011 C   0  0  0

+    4.3279    0.7627   -0.0001 C   0  0  0

+    6.7935    0.6356   -0.0005 O   0  0  0

+    5.5972   -1.2224    0.0026 O   0  0  0

+    3.1471   -0.2103   -0.0010 C   0  0  0

+    1.8362    0.5786    0.0000 C   0  0  0

+    0.6555   -0.3944   -0.0009 C   0  0  0

+   -0.6555    0.3944    0.0001 C   0  0  0

+   -1.8362   -0.5786   -0.0009 C   0  0  0

+   -3.1471    0.2103    0.0001 C   0  0  0

+   -4.3279   -0.7627   -0.0008 C   0  0  0

+   -5.6191    0.0143    0.0002 C   0  0  0

+   -6.7935   -0.6356   -0.0004 O   0  0  0

+   -5.5972    1.2224    0.0015 O   0  0  0

+    5.0269    1.6727    0.0000 H   0  0  0

+    3.5028    1.5601    0.0000 H   0  0  0

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+    2.5352    1.4886    0.0000 H   0  0  0

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+   -0.0434   -1.3044    0.0000 H   0  0  0

+    1.4807   -1.1917    0.0000 H   0  0  0

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+   -1.4807    1.1917    0.0000 H   0  0  0

+   -2.5352   -1.4886    0.0000 H   0  0  0

+   -1.0110   -1.3760    0.0000 H   0  0  0

+   -2.4481    1.1203    0.0000 H   0  0  0

+   -3.9722    1.0077    0.0000 H   0  0  0

+   -5.0269   -1.6727    0.0000 H   0  0  0

+   -3.5028   -1.5601    0.0000 H   0  0  0

+   -7.7975   -1.1912    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

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+ 10 28  1  0

+ 10 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+ 13 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89784-39-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    3.8878    0.2501   -0.4286 C   0  0  2

+    2.5884    1.0560   -0.3744 C   0  0  0

+    4.0379   -0.5182    0.8098 N   0  0  0

+    5.0558    1.1900   -0.5812 C   0  0  0

+    1.1855   -0.0730   -0.1909 S   0  0  0

+    4.6938   -1.6955    0.7971 C   0  0  0

+    6.2535    0.8604   -0.0727 O   0  0  0

+    4.9142    2.2404   -1.1614 O   0  0  0

+   -0.4538    0.5665   -0.0990 C   0  0  0

+    4.8482   -2.4858    2.0709 C   0  0  0

+    5.1598   -2.1189   -0.2395 O   0  0  0

+   -1.4946   -0.2711    0.0371 C   0  0  0

+   -0.7234    2.2793   -0.1844 Cl  0  0  0

+   -2.8425    0.2641    0.2660 C   0  0  0

+   -1.2463   -1.9866   -0.0576 Cl  0  0  0

+   -3.9113   -0.4193   -0.1491 C   0  0  0

+   -3.0462    1.7858    1.0764 Cl  0  0  0

+   -5.5055    0.1188    0.2784 Cl  0  0  0

+   -3.7072   -1.8463   -1.1165 Cl  0  0  0

+    2.9954   -0.3660    0.0000 H   0  0  0

+    3.2600    1.9075    0.0000 H   0  0  0

+    1.8178    1.8190    0.0000 H   0  0  0

+    3.0195   -0.8907    0.0000 H   0  0  0

+    7.2991    0.5727    0.0000 H   0  0  0

+    3.7839   -2.6937    0.0000 H   0  0  0

+    5.0561   -3.5501    0.0000 H   0  0  0

+    5.9125   -2.2779    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

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+  6 10  1  0

+  6 11  2  0

+  9 12  2  0

+  9 13  1  0

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+ 14 16  2  0

+ 14 17  1  0

+ 16 18  1  0

+ 16 19  1  0

+  1 20  1  0

+  2 21  1  0

+  2 22  1  0

+  3 23  1  0

+  7 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+22608-53-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -0.1146   -0.3960    0.3060 P   0  0  0

+   -0.2597   -1.7725   -0.5164 O   0  0  0

+    1.9219    0.1920    0.3458 S   0  0  0

+   -1.2679    1.1140   -0.6343 S   0  0  0

+   -0.5977   -0.5954    1.6907 O   0  0  0

+   -1.6586   -2.0435   -0.6245 C   0  0  0

+    2.2751    0.2247   -1.4331 C   0  0  0

+   -0.9248    2.5084    0.4740 C   0  0  0

+   -1.8618   -0.9943    0.0000 H   0  0  0

+   -2.7078   -2.2467    0.0000 H   0  0  0

+   -1.4554   -3.0927    0.0000 H   0  0  0

+    2.3736   -0.8394    0.0000 H   0  0  0

+    3.3392    0.3232    0.0000 H   0  0  0

+    2.1766    1.2888    0.0000 H   0  0  0

+    0.1129    2.2531    0.0000 H   0  0  0

+   -0.6695    3.5461    0.0000 H   0  0  0

+   -1.9625    2.7637    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  1  0

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+  6  9  1  0

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+  7 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+617-48-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.4702    0.2721   -0.3549 C   0  0  2

+   -0.5348   -0.6729    0.3068 C   0  0  0

+    1.8712   -0.1974   -0.0591 C   0  0  0

+    0.2919    1.5932    0.1597 O   0  0  0

+   -1.9359   -0.2034    0.0109 C   0  0  0

+    2.2669   -1.4184   -0.4520 O   0  0  0

+    2.6384    0.5252    0.5319 O   0  0  0

+   -2.9876   -0.8839    0.4931 O   0  0  0

+   -2.1125    0.7856   -0.6604 O   0  0  0

+   -0.4545    0.6003    0.0000 H   0  0  0

+   -0.9945   -1.5398    0.0000 H   0  0  0

+    0.2452   -1.2682    0.0000 H   0  0  0

+    0.1607    2.5656    0.0000 H   0  0  0

+    2.5694   -2.3518    0.0000 H   0  0  0

+   -3.8114   -1.4169    0.0000 H   0  0  0

+  1  2  1  0

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+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  4 13  1  0

+  6 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2397-76-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    2.3653   -0.0905    0.0000 C   0  0  0

+    1.1042    0.7758    0.0000 C   0  0  0

+    2.3773   -0.9737    1.2492 C   0  0  0

+    2.3773   -0.9737   -1.2492 C   0  0  0

+    3.6024    0.8098    0.0000 C   0  0  0

+   -0.0698   -0.0786    0.0000 O   0  0  0

+   -1.3017    0.4687    0.0000 C   0  0  0

+   -2.4899   -0.3960    0.0000 C   0  0  0

+   -1.4297    1.6773    0.0000 O   0  0  0

+   -2.3312   -1.8946    0.0000 C   0  0  0

+   -3.7061    0.1444    0.0000 C   0  0  0

+    1.7927    1.5685    0.0000 H   0  0  0

+    0.3944    1.5495    0.0000 H   0  0  0

+    1.3274   -0.9880    0.0000 H   0  0  0

+    2.3916   -2.0236    0.0000 H   0  0  0

+    3.4272   -0.9594    0.0000 H   0  0  0

+    1.3274   -0.9880    0.0000 H   0  0  0

+    2.3916   -2.0236    0.0000 H   0  0  0

+    3.4272   -0.9594    0.0000 H   0  0  0

+    4.2202   -0.0392    0.0000 H   0  0  0

+    4.4514    1.4276    0.0000 H   0  0  0

+    2.9846    1.6588    0.0000 H   0  0  0

+   -3.3754   -2.0052    0.0000 H   0  0  0

+   -2.2206   -2.9388    0.0000 H   0  0  0

+   -1.2870   -1.7840    0.0000 H   0  0  0

+   -3.8166    1.1886    0.0000 H   0  0  0

+   -4.5551   -0.4734    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  5 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13707-88-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 41                          1 V2000

+   -1.9031   -0.4763   -0.0732 C   0  0  0

+   -3.1855    0.0027   -0.2992 C   0  0  0

+   -0.8333    0.3501   -0.2132 O   0  0  0

+   -1.7152   -1.7986    0.3016 C   0  0  0

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+   -3.3938    1.4404   -0.7000 C   0  0  0

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+   -2.8048   -2.6352    0.4488 C   0  0  0

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+   -2.7329    3.2650    0.7817 C   0  0  0

+    2.8212   -0.3806    0.2610 C   0  0  0

+    1.6626    0.9456   -1.3940 O   0  0  0

+    4.0182    0.4604    0.1267 N   0  0  0

+    5.1713   -0.3930    0.4433 C   0  0  0

+    5.6775   -1.0617   -0.8364 C   0  0  0

+    6.2872    0.4614    1.0480 C   0  0  0

+   -0.7629   -2.1872    0.0000 H   0  0  0

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+   -4.8815   -2.8038    0.0000 H   0  0  0

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+    0.7078    1.0012    0.0000 H   0  0  0

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+ 18 39  1  0

+ 18 40  1  0

+ 18 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+602-38-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -0.7233    0.0002    0.0020 C   0  0  0

+   -0.0350   -1.2220    0.0823 C   0  0  0

+   -0.0340    1.2223   -0.0800 C   0  0  0

+   -2.1408    0.0005   -0.0021 C   0  0  0

+    1.4451   -1.2438    0.0822 N   0  3  0

+   -0.7364   -2.3861    0.1605 C   0  0  0

+    1.4461    1.2428   -0.0828 N   0  3  0

+   -0.7344    2.3866   -0.1563 C   0  0  0

+   -2.8301   -1.2215    0.0736 C   0  0  0

+   -2.8293    1.2231   -0.0823 C   0  0  0

+    2.0456   -1.8212   -0.8063 O   0  0  0

+    2.0624   -0.6842    0.9707 O   0  5  0

+   -2.1297   -2.3854    0.1623 C   0  0  0

+    2.0489    1.8220    0.8031 O   0  0  0

+    2.0613    0.6806   -0.9711 O   0  5  0

+   -2.1282    2.3872   -0.1545 C   0  0  0

+   -0.2226   -3.2960    0.0000 H   0  0  0

+   -0.2199    3.2961    0.0000 H   0  0  0

+   -3.8750   -1.2362    0.0000 H   0  0  0

+   -3.8742    1.2384    0.0000 H   0  0  0

+   -2.6442   -3.2949    0.0000 H   0  0  0

+   -2.6421    3.2971    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 21  1  0

+ 16 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33089-36-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 49                          1 V2000

+   -4.1145    1.2292    0.1004 C   0  0  0

+   -4.1489   -0.2001   -0.4444 C   0  0  0

+   -2.7664    1.7032    0.1095 O   0  0  0

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+   -0.2147   -4.1252    0.3284 C   0  0  0

+    1.9797    3.5682   -0.4274 C   0  0  0

+    1.1182   -3.8625   -0.3755 C   0  0  0

+    2.4411    2.4302    0.3033 O   0  0  0

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+    3.6749    2.0274   -0.2946 C   0  0  0

+    3.1359   -2.7757   -0.2604 C   0  0  0

+    4.1315    0.7031    0.3208 C   0  0  0

+    3.8937   -1.5792    0.3185 C   0  0  0

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+ 20 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-43-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.5978   -0.2629    0.0023 C   0  0  0

+    0.3432   -1.2993    0.0012 C   0  0  0

+   -0.1281    1.0554    0.0015 C   0  0  0

+   -2.0469   -0.5528   -0.0018 C   0  0  0

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+    1.2330    1.2803   -0.0003 C   0  0  0

+   -2.9222    0.4431   -0.0007 C   0  0  0

+    2.0860    0.2739   -0.0013 N   0  0  0

+    0.0363   -2.2872    0.0000 H   0  0  0

+   -0.7915    1.8492    0.0000 H   0  0  0

+   -2.3784   -1.5327    0.0000 H   0  0  0

+    2.3883   -1.7426    0.0000 H   0  0  0

+    1.5896    2.2514    0.0000 H   0  0  0

+   -2.5907    1.4230    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+299-88-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 63 64                          1 V2000

+   -1.8602   -1.6748   -0.2515 C   0  0  0

+   -3.4565   -2.4051   -0.0995 S   0  0  0

+   -0.8747   -2.3489   -0.8300 C   0  0  0

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+   -6.1041   -2.1224    0.7962 C   0  0  0

+   -4.5668   -0.3878    1.0942 O   0  0  0

+    1.3407   -1.5265   -1.0887 C   0  0  0

+   -2.1324    2.0691   -0.0974 O   0  0  0

+   -7.1431   -1.4160    1.4043 C   0  0  0

+   -6.3369   -3.4080    0.3038 C   0  0  0

+    2.4201   -0.9216   -1.9489 C   0  0  0

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+ 36 63  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61740-00-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+    1.5018    0.2292    0.2528 C   0  0  0

+    0.1358    0.4445    0.2312 C   0  0  0

+    2.6713    1.1811    0.4000 C   0  0  1

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+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1928-38-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.1010   -0.0583   -0.0036 C   0  0  0

+   -1.1004   -1.0215   -0.0015 C   0  0  0

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+  8 19  1  0

+ 14 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+85-33-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    0.7682    0.3389   -0.0024 C   0  0  0

+    1.3633   -1.0100   -0.0006 C   0  0  0

+    1.8991    1.2662    0.0012 C   0  0  0

+   -0.5729    0.6948   -0.0015 C   0  0  0

+    0.7004   -2.2413   -0.0023 C   0  0  0

+    2.7569   -0.8406    0.0037 C   0  0  0

+    3.0699    0.4804    0.0048 C   0  0  0

+    1.8317    2.6721    0.0003 C   0  0  0

+   -1.6822   -0.1623    0.0009 C   0  0  0

+   -0.6671   -2.4696   -0.0066 C   0  0  0

+    1.5774   -3.4668    0.0002 C   0  0  0

+    0.7514    3.2287   -0.0037 O   0  0  0

+   -1.7070   -1.5600    0.0024 C   0  0  0

+   -3.0008    0.4998    0.0013 C   0  0  0

+   -4.2598   -0.3284    0.0038 C   0  0  0

+   -3.0781    1.8252   -0.0004 C   0  0  0

+   -0.7810    1.7254    0.0000 H   0  0  0

+    3.4577   -1.6244    0.0000 H   0  0  0

+    4.0488    0.8640    0.0000 H   0  0  0

+    2.7160    3.2408    0.0000 H   0  0  0

+   -0.9542   -3.4810    0.0000 H   0  0  0

+    0.7224   -4.0787    0.0000 H   0  0  0

+    2.1893   -4.3218    0.0000 H   0  0  0

+    2.4324   -2.8549    0.0000 H   0  0  0

+   -2.6682   -1.9860    0.0000 H   0  0  0

+   -4.8376    0.5500    0.0000 H   0  0  0

+   -5.1382   -0.9062    0.0000 H   0  0  0

+   -3.6820   -1.2068    0.0000 H   0  0  0

+   -2.1997    2.4030    0.0000 H   0  0  0

+   -4.0177    2.2970    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  8 12  2  0

+  9 13  2  0

+  9 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+  6  7  1  0

+ 10 13  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-36-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    0.5677   -0.0031    0.0016 C   0  0  0

+    1.3461   -1.2935   -0.0006 C   0  0  0

+    1.1513    1.0543   -0.0004 O   0  0  0

+   -1.1680   -0.0365   -0.0002 Cl  0  0  0

+    0.3783   -1.8773    0.0000 H   0  0  0

+    1.9299   -2.2613    0.0000 H   0  0  0

+    2.3139   -0.7097    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+621-52-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -2.2710   -0.8601    0.0000 O   0  0  0

+   -3.4002    0.0156    0.0011 C   0  0  0

+   -1.1633   -0.0727    0.0012 C   0  0  0

+   -4.6872   -0.8118   -0.0001 C   0  0  0

+    0.0985   -0.6488    0.0005 C   0  0  0

+   -1.2927    1.3087   -0.0028 C   0  0  0

+    1.2231    0.1539    0.0012 C   0  0  0

+   -0.1654    2.1068   -0.0020 C   0  0  0

+    2.5698   -0.4601   -0.0001 N   0  3  0

+    1.0915    1.5300    0.0026 C   0  0  0

+    3.5615    0.2470    0.0006 O   0  0  0

+    2.6863   -1.6725   -0.0017 O   0  5  0

+   -2.6762    0.7580    0.0000 H   0  0  0

+   -4.0560    0.8189    0.0000 H   0  0  0

+   -5.2480    0.0605    0.0000 H   0  0  0

+   -5.5595   -1.3726    0.0000 H   0  0  0

+   -4.1264   -1.6841    0.0000 H   0  0  0

+    0.1977   -1.6810    0.0000 H   0  0  0

+   -2.2350    1.7416    0.0000 H   0  0  0

+   -0.2616    3.1393    0.0000 H   0  0  0

+    1.9367    2.1308    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  5  1  0

+  8  6  2  0

+  9  7  1  0

+ 10  7  2  0

+ 11  9  2  0

+ 12  9  1  0

+  8 10  1  0

+  2 13  1  0

+  2 14  1  0

+  4 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  6 19  1  0

+  8 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+693-98-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.6997   -0.0008    0.0019 C   0  0  0

+    0.0950   -1.0927    0.0008 N   0  0  0

+    0.0535    1.0648    0.0008 N   0  0  0

+   -2.2067   -0.0113   -0.0018 C   0  0  0

+    1.3904   -0.6506   -0.0010 C   0  0  0

+    1.3428    0.6953   -0.0009 C   0  0  0

+   -0.2101   -2.0571    0.0000 H   0  0  0

+   -2.2137    1.0001    0.0000 H   0  0  0

+   -3.2181   -0.0183    0.0000 H   0  0  0

+   -2.1997   -1.0227    0.0000 H   0  0  0

+    2.2233   -1.2244    0.0000 H   0  0  0

+    2.1397    1.3183    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  6  2  0

+  2  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67730-11-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.6400   -0.6398   -0.0012 N   0  0  0

+   -0.6914   -0.2797   -0.0006 C   0  0  0

+    1.3778    0.5193   -0.0005 C   0  0  0

+    1.2624   -1.8561    0.0027 C   0  0  0

+   -0.7183    1.1262    0.0006 C   0  0  0

+   -1.8233   -0.9707   -0.0008 N   0  0  0

+    0.5576    1.5585    0.0005 N   0  0  0

+    2.7884    0.4437   -0.0010 C   0  0  0

+    2.6085   -1.9407    0.0018 C   0  0  0

+   -1.9583    1.7836    0.0010 C   0  0  0

+   -2.9986   -0.3670    0.0000 C   0  0  0

+    3.3920   -0.7738   -0.0021 C   0  0  0

+    3.6169    1.7025    0.0003 C   0  0  0

+   -3.0966    1.0250    0.0004 C   0  0  0

+   -4.1603   -1.1335   -0.0007 N   0  0  0

+    0.6974   -2.7179    0.0000 H   0  0  0

+    3.0645   -2.8648    0.0000 H   0  0  0

+   -2.0100    2.8128    0.0000 H   0  0  0

+    4.4203   -0.8413    0.0000 H   0  0  0

+    4.4777    1.1360    0.0000 H   0  0  0

+    4.1834    2.5633    0.0000 H   0  0  0

+    2.7561    2.2690    0.0000 H   0  0  0

+   -4.0216    1.4791    0.0000 H   0  0  0

+   -5.0819   -0.6724    0.0000 H   0  0  0

+   -4.0989   -2.1622    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+  8 13  1  0

+ 10 14  2  0

+ 11 15  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 14  1  0

+  4 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+565-20-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    0.4128   -0.7128    0.1223 C   0  0  0

+   -1.1303   -1.5483   -0.0367 S   0  0  0

+    0.9323   -0.4564    1.3777 C   0  0  0

+    1.1046   -0.3199   -1.0091 C   0  0  0

+   -2.3945   -0.3211   -0.0537 C   0  0  0

+   -1.1283   -2.1185   -1.3383 O   0  0  0

+   -1.3067   -2.2675    1.1761 O   0  0  0

+    2.1420    0.1980    1.5057 C   0  0  0

+    2.3144    0.3347   -0.8879 C   0  0  0

+   -2.8048    0.2300   -1.2536 C   0  0  0

+   -2.9782    0.0847    1.1327 C   0  0  0

+    2.8364    0.5984    0.3719 C   0  0  0

+   -3.7955    1.1923   -1.2705 C   0  0  0

+   -3.9692    1.0462    1.1230 C   0  0  0

+    4.0621    1.2615    0.4982 N   0  0  0

+   -4.3798    1.6062   -0.0804 C   0  0  0

+    5.1517    0.7911   -0.1405 C   0  0  0

+   -5.3817    2.5793   -0.0938 N   0  0  0

+    6.4380    1.5758   -0.1140 C   0  0  0

+    5.0970   -0.2638   -0.7365 O   0  0  0

+    1.2962   -1.1601    0.0000 H   0  0  0

+    0.7204    0.3730    0.0000 H   0  0  0

+    2.5284   -0.4936    0.0000 H   0  0  0

+    1.9472    1.0367    0.0000 H   0  0  0

+   -2.2092    0.7524    0.0000 H   0  0  0

+   -3.4818   -0.5269    0.0000 H   0  0  0

+   -3.2890    1.8015    0.0000 H   0  0  0

+   -4.5666    0.5258    0.0000 H   0  0  0

+    4.0271    2.0530    0.0000 H   0  0  0

+   -5.1878    3.3475    0.0000 H   0  0  0

+   -6.1439    2.3631    0.0000 H   0  0  0

+    6.8506    0.8995    0.0000 H   0  0  0

+    7.1143    1.9884    0.0000 H   0  0  0

+    6.0254    2.2521    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  2  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  8 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 12 15  1  0

+ 13 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+ 17 20  2  0

+  9 12  1  0

+ 14 16  1  0

+  3 21  1  0

+  4 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15088-70-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    1.7131   -0.5435    0.0000 C   0  0  0

+    0.6024    0.4117    0.0000 N   0  0  0

+    3.0204    0.2062    0.0000 C   0  0  0

+   -0.6696   -0.0339    0.0000 C   0  0  0

+    4.1809   -0.4683    0.0000 O   0  0  0

+    3.0239    1.4145    0.0000 O   0  0  0

+   -1.8122    0.9487    0.0000 C   0  0  0

+   -0.8946   -1.2257    0.0000 O   0  0  0

+    5.4405    0.2541    0.0000 C   0  0  0

+   -3.5176   -0.0295    0.0000 Br  0  0  0

+    6.6005   -0.7434    0.0000 C   0  0  0

+    0.9107   -1.2869    0.0000 H   0  0  0

+    2.3610   -1.4248    0.0000 H   0  0  0

+    0.8054    1.4866    0.0000 H   0  0  0

+   -1.0098    1.6922    0.0000 H   0  0  0

+   -2.4602    1.8300    0.0000 H   0  0  0

+    6.2429    0.9976    0.0000 H   0  0  0

+    4.7925    1.1354    0.0000 H   0  0  0

+    5.8873   -1.5728    0.0000 H   0  0  0

+    7.4299   -1.4566    0.0000 H   0  0  0

+    7.3137    0.0860    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  1  0

+  6  3  2  0

+  7  4  1  0

+  8  4  2  0

+  9  5  1  0

+ 10  7  1  0

+ 11  9  1  0

+  1 12  1  0

+  1 13  1  0

+  2 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+371-47-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 11                          1 V2000

+   -3.3052   -0.6884   -0.0934 C   0  0  0

+   -4.2507   -1.1214    0.9541 C   0  0  0

+   -2.8129    0.5524   -0.0767 O   0  0  0

+   -2.9380   -1.5394   -1.0544 O   0  0  0

+   -5.4809   -0.5775    1.0172 C   0  0  0

+   -5.8371    0.5471    0.1301 C   0  0  0

+   -4.9815    0.9513   -0.8116 O   0  0  0

+   -7.0149    1.1602    0.2694 O   0  0  0

+    6.7778   -0.0555    0.0383 Na  0  3  0

+   15.4331    0.2342    0.0773 Na  0  3  0

+   -4.2449   -2.0061    0.0000 H   0  0  0

+   -6.1398   -1.1679    0.0000 H   0  0  0

+   -2.5875   -2.3517    0.0000 H   0  0  0

+   -7.7997    1.5687    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  5  6  1  0

+  6  7  2  0

+  6  8  1  0

+  2 11  1  0

+  5 12  1  0

+  4 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24496-65-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+   -0.2969   -0.2487   -0.0016 C   0  0  0

+   -1.6739    0.0335   -0.0013 C   0  0  0

+    0.6144    0.8242   -0.0001 C   0  0  0

+    0.1699   -1.6327    0.0025 C   0  0  0

+   -2.0944    1.3828    0.0005 C   0  0  0

+   -2.6103   -1.0231   -0.0024 C   0  0  0

+    2.0410    0.5162   -0.0004 C   0  0  0

+    0.1102    2.1361    0.0021 C   0  0  0

+    1.5309   -1.8910    0.0027 C   0  0  0

+   -0.8258   -2.7052    0.0070 C   0  0  0

+   -1.1807    2.3670    0.0014 N   0  0  0

+   -3.4691    1.6515    0.0008 C   0  0  0

+   -2.1448   -2.4075   -0.0033 C   0  0  0

+   -3.9708   -0.7096   -0.0020 C   0  0  0

+    2.4624   -0.8388   -0.0022 C   0  0  0

+    2.9985    1.5376    0.0006 C   0  0  0

+   -4.3769    0.6133   -0.0007 C   0  0  0

+    3.8431   -1.1217   -0.0025 C   0  0  0

+    4.3252    1.2250   -0.0002 C   0  0  0

+    4.7446   -0.1031   -0.0011 C   0  0  0

+    0.7803    2.9474    0.0000 H   0  0  0

+    1.8712   -2.8867    0.0000 H   0  0  0

+   -0.5146   -3.7104    0.0000 H   0  0  0

+   -3.8097    2.6471    0.0000 H   0  0  0

+   -2.8498   -3.1887    0.0000 H   0  0  0

+   -4.6878   -1.4797    0.0000 H   0  0  0

+    2.6944    2.5450    0.0000 H   0  0  0

+   -5.4060    0.8330    0.0000 H   0  0  0

+    4.1762   -2.1198    0.0000 H   0  0  0

+    5.0410    1.9962    0.0000 H   0  0  0

+    5.7739   -0.3217    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  1  0

+  7 16  1  0

+ 12 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 18 20  2  0

+  8 11  2  0

+  9 15  2  0

+ 10 13  2  0

+ 14 17  1  0

+ 19 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+346-18-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+   -0.4799    0.5030   -1.1047 C   0  0  0

+   -1.0617    1.1938   -0.0552 C   0  0  0

+    0.6655    0.9510   -1.7626 N   0  0  0

+   -1.0541   -0.6908   -1.5423 C   0  0  0

+   -2.2133    0.7028    0.5387 C   0  0  0

+   -0.3664    2.6902    0.5664 S   0  0  0

+    1.5381    1.9695   -1.1780 C   0  0  0

+   -2.1980   -1.1763   -0.9427 C   0  0  0

+   -2.7811   -0.4765    0.0991 C   0  0  0

+    0.6828    3.0537   -0.6654 N   0  0  0

+   -1.3966    3.6683    0.5318 O   0  0  0

+    0.4263    2.3392    1.6923 O   0  0  0

+    2.3332    1.3578   -0.0228 C   0  0  0

+   -2.9052   -2.6624   -1.4949 Cl  0  0  0

+   -4.2454   -1.0897    0.8638 S   0  0  0

+    0.7562    4.4058   -1.2245 C   0  0  0

+    3.3404   -0.0174   -0.6434 S   0  0  0

+   -5.4135   -1.1820   -0.3064 N   0  0  0

+   -3.9572   -2.4325    1.2284 O   0  0  0

+   -4.6719   -0.0687    1.7554 O   0  0  0

+    4.1493   -0.5350    0.8955 C   0  0  0

+    5.0765   -1.7183    0.6112 C   0  0  0

+    4.3293   -2.7830    0.0962 F   0  0  0

+    6.0477   -1.3364   -0.3205 F   0  0  0

+    5.7004   -2.1176    1.7981 F   0  0  0

+    1.2198    0.1706    0.0000 H   0  0  0

+   -0.3933   -1.3834    0.0000 H   0  0  0

+   -2.8745    1.3950    0.0000 H   0  0  0

+    2.2108    2.6505    0.0000 H   0  0  0

+    3.2708    1.5506    0.0000 H   0  0  0

+    2.5481    2.2906    0.0000 H   0  0  0

+    1.7120    4.3539    0.0000 H   0  0  0

+    0.8081    5.3616    0.0000 H   0  0  0

+   -0.1996    4.4577    0.0000 H   0  0  0

+   -5.9559   -0.3933    0.0000 H   0  0  0

+   -5.8253   -2.0461    0.0000 H   0  0  0

+    5.0760   -0.2951    0.0000 H   0  0  0

+    4.2999    0.4103    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  6 11  2  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 13 17  1  0

+ 15 18  1  0

+ 15 19  2  0

+ 15 20  2  0

+ 17 21  1  0

+ 21 22  1  0

+ 22 23  1  0

+ 22 24  1  0

+ 22 25  1  0

+  7 10  1  0

+  8  9  2  0

+  3 26  1  0

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+  7 29  1  0

+ 13 30  1  0

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+ 16 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1761-71-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+    1.2492   -0.0003    0.2314 C   0  0  0

+    0.0000   -0.0013    1.1148 C   0  0  0

+    2.0821    1.2486    0.5274 C   0  0  0

+    2.0821   -1.2498    0.5244 C   0  0  0

+   -1.2492   -0.0003    0.2314 C   0  0  0

+    3.3313    1.2497   -0.3560 C   0  0  0

+    3.3313   -1.2488   -0.3589 C   0  0  0

+   -2.0821   -1.2499    0.5244 C   0  0  0

+   -2.0821    1.2486    0.5274 C   0  0  0

+    4.1641    0.0001   -0.0630 C   0  0  0

+   -3.3313   -1.2488   -0.3589 C   0  0  0

+   -3.3313    1.2496   -0.3560 C   0  0  0

+    5.3635    0.0011   -0.9111 N   0  0  0

+   -4.1641    0.0001   -0.0630 C   0  0  0

+   -5.3635    0.0011   -0.9111 N   0  0  0

+    0.7623    0.9089    0.0000 H   0  0  0

+   -0.5159   -0.8943    0.0000 H   0  0  0

+    0.5159   -0.8943    0.0000 H   0  0  0

+    2.2824    2.2603    0.0000 H   0  0  0

+    1.1289    1.6424    0.0000 H   0  0  0

+    1.1291   -1.6440    0.0000 H   0  0  0

+    2.2835   -2.2613    0.0000 H   0  0  0

+   -0.7623    0.9089    0.0000 H   0  0  0

+    4.2844    1.6439    0.0000 H   0  0  0

+    3.1299    2.2612    0.0000 H   0  0  0

+    3.1309   -2.2605    0.0000 H   0  0  0

+    4.2845   -1.6426    0.0000 H   0  0  0

+   -2.2835   -2.2614    0.0000 H   0  0  0

+   -1.1291   -1.6441    0.0000 H   0  0  0

+   -1.1289    1.6425    0.0000 H   0  0  0

+   -2.2825    2.2603    0.0000 H   0  0  0

+    4.6511   -0.9091    0.0000 H   0  0  0

+   -4.2845   -1.6426    0.0000 H   0  0  0

+   -3.1310   -2.2605    0.0000 H   0  0  0

+   -3.1299    2.2611    0.0000 H   0  0  0

+   -4.2844    1.6438    0.0000 H   0  0  0

+    5.8799   -0.8917    0.0000 H   0  0  0

+    5.8784    0.8947    0.0000 H   0  0  0

+   -4.6511   -0.9091    0.0000 H   0  0  0

+   -5.8784    0.8947    0.0000 H   0  0  0

+   -5.8799   -0.8917    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  5  8  1  0

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+  8 11  1  0

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+ 10 13  1  0

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+ 14 15  1  0

+  7 10  1  0

+ 12 14  1  0

+  1 16  1  0

+  2 17  1  0

+  2 18  1  0

+  3 19  1  0

+  3 20  1  0

+  4 21  1  0

+  4 22  1  0

+  5 23  1  0

+  6 24  1  0

+  6 25  1  0

+  7 26  1  0

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+  8 29  1  0

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+ 10 32  1  0

+ 11 33  1  0

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+ 12 35  1  0

+ 12 36  1  0

+ 13 37  1  0

+ 13 38  1  0

+ 14 39  1  0

+ 15 40  1  0

+ 15 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-59-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.6055   -0.2500    0.0000 C   0  0  0

+   -0.5265    0.7793    0.0000 C   0  0  0

+    1.9532    0.4741    0.0000 C   0  0  0

+   -1.8232    0.0826    0.0000 C   0  0  0

+    3.0852   -0.5552    0.0000 C   0  0  0

+   -2.8239   -0.4551    0.0000 N   0  0  0

+   -0.2574   -1.0062    0.0000 H   0  0  0

+    1.2594   -1.1929    0.0000 H   0  0  0

+    0.3364    1.5356    0.0000 H   0  0  0

+   -1.1804    1.7222    0.0000 H   0  0  0

+    2.8161    1.2303    0.0000 H   0  0  0

+    1.2993    1.4170    0.0000 H   0  0  0

+    2.3133   -1.4042    0.0000 H   0  0  0

+    3.9342   -1.3271    0.0000 H   0  0  0

+    3.8571    0.2938    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

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+  1  7  1  0

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+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+68162-37-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.3822    1.3275    0.1667 C   0  0  0

+   -1.0140    1.5059    0.0194 C   0  0  0

+    1.1160    0.3256   -0.3614 O   0  0  0

+    1.2374    2.1502    0.8712 C   0  0  0

+   -1.8395    0.4282    0.0171 C   0  0  0

+    2.4004    0.4816   -0.0123 C   0  0  0

+    2.5190    1.5934    0.7474 C   0  0  0

+   -1.3379   -0.8467    0.3626 C   0  0  0

+   -3.2654    0.5888   -0.3474 N   0  3  0

+    3.5113   -0.4172   -0.3992 N   0  3  0

+   -2.1184   -1.9394    0.2241 O   0  0  0

+   -0.2021   -0.9597    0.7850 O   0  0  0

+   -4.0060   -0.3781   -0.3495 O   0  0  0

+   -3.6978    1.6878   -0.6452 O   0  5  0

+    4.6456   -0.1797   -0.0245 O   0  0  0

+    3.2909   -1.3943   -1.0923 O   0  5  0

+   -1.3398   -3.0597    0.6490 C   0  0  0

+   -1.3874    2.4015    0.0000 H   0  0  0

+    1.0655    3.1052    0.0000 H   0  0  0

+    3.3576    2.0817    0.0000 H   0  0  0

+   -2.1366   -3.6135    0.0000 H   0  0  0

+   -0.7860   -3.8565    0.0000 H   0  0  0

+   -0.5430   -2.5059    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

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+  8 11  1  0

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+  9 13  2  0

+  9 14  1  0

+ 10 15  2  0

+ 10 16  1  0

+ 11 17  1  0

+  6  7  2  0

+  2 18  1  0

+  4 19  1  0

+  7 20  1  0

+ 17 21  1  0

+ 17 22  1  0

+ 17 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6257-64-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 41                          1 V2000

+   -4.4942   -0.0202    0.0028 C   0  0  0

+   -3.9498   -1.3007    0.0007 C   0  0  0

+   -3.6605    1.0944    0.0038 C   0  0  0

+   -5.8772    0.1468   -0.0019 N   0  0  0

+   -2.5835   -1.4699   -0.0004 C   0  0  0

+   -2.2935    0.9336    0.0027 C   0  0  0

+   -6.4524    1.4942    0.0003 C   0  0  0

+   -6.7565   -1.0250   -0.0090 C   0  0  0

+   -1.7423   -0.3524    0.0006 C   0  0  0

+   -0.3871   -0.5160   -0.0001 N   0  0  0

+    0.3871    0.5158    0.0008 N   0  0  0

+    1.7423    0.3522    0.0002 C   0  0  0

+    2.5837    1.4700    0.0012 C   0  0  0

+    2.2933   -0.9333    0.0043 C   0  0  0

+    3.9497    1.3010    0.0005 C   0  0  0

+    3.6607   -1.0942    0.0036 C   0  0  0

+    4.4942    0.0200   -0.0012 C   0  0  0

+    5.8772   -0.1469   -0.0024 N   0  0  0

+    6.4524   -1.4943   -0.0041 C   0  0  0

+    6.7565    1.0249   -0.0018 C   0  0  0

+   -4.5783   -2.1343    0.0000 H   0  0  0

+   -4.0725    2.0536    0.0000 H   0  0  0

+   -2.1759   -2.4310    0.0000 H   0  0  0

+   -1.6688    1.7700    0.0000 H   0  0  0

+   -5.4923    1.9041    0.0000 H   0  0  0

+   -6.8623    2.4543    0.0000 H   0  0  0

+   -7.4125    1.0843    0.0000 H   0  0  0

+   -7.5915   -0.3984    0.0000 H   0  0  0

+   -7.3831   -1.8600    0.0000 H   0  0  0

+   -5.9215   -1.6516    0.0000 H   0  0  0

+    2.1760    2.4310    0.0000 H   0  0  0

+    1.6686   -1.7697    0.0000 H   0  0  0

+    4.5781    2.1346    0.0000 H   0  0  0

+    4.0727   -2.0534    0.0000 H   0  0  0

+    5.4923   -1.9042    0.0000 H   0  0  0

+    6.8623   -2.4544    0.0000 H   0  0  0

+    7.4125   -1.0844    0.0000 H   0  0  0

+    7.5915    0.3983    0.0000 H   0  0  0

+    7.3831    1.8599    0.0000 H   0  0  0

+    5.9215    1.6515    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  4  7  1  0

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+  6  9  1  0

+ 16 17  2  0

+  2 21  1  0

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+ 13 31  1  0

+ 14 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103393-72-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -2.0031   -0.0453   -0.0107 C   0  0  0

+   -0.9741   -1.0633    0.1965 C   0  0  0

+   -1.4894    1.1414   -0.0202 C   0  0  0

+   -3.4125   -0.3752   -0.1852 C   0  0  0

+    0.2701   -0.2875    0.3125 C   0  0  0

+   -1.3668   -2.3124    0.2265 C   0  0  0

+   -0.0396    0.9976    0.1855 C   0  0  0

+   -2.4317    2.2584   -0.2228 C   0  0  0

+   -3.7553   -1.8069   -0.1410 C   0  0  0

+   -4.2509    0.6169   -0.3655 C   0  0  0

+    1.6687   -0.6899    0.5265 C   0  0  0

+   -2.7827   -2.6782    0.0589 C   0  0  0

+    1.0325    2.0075    0.2629 C   0  0  0

+   -3.7170    1.9968   -0.3801 C   0  0  0

+    2.6191    0.2167    0.5941 C   0  0  0

+    2.2803    1.6434    0.4539 C   0  0  0

+    4.0499   -0.2026    0.8131 C   0  0  0

+    4.8455   -0.4802   -0.7809 Cl  0  0  0

+   -0.6193   -3.0997    0.0000 H   0  0  0

+   -2.0752    3.2838    0.0000 H   0  0  0

+   -4.7916   -2.1305    0.0000 H   0  0  0

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+    1.9276   -1.7442    0.0000 H   0  0  0

+   -3.0395   -3.7330    0.0000 H   0  0  0

+    0.7789    3.0631    0.0000 H   0  0  0

+   -4.4174    2.8263    0.0000 H   0  0  0

+    3.0672    2.3913    0.0000 H   0  0  0

+    4.8601    0.5200    0.0000 H   0  0  0

+    3.8112    0.8565    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  5  7  2  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97-00-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.6333   -0.3977   -0.0029 C   0  0  0

+   -0.7067   -0.7375   -0.0029 C   0  0  0

+    1.0090    0.9336   -0.0004 C   0  0  0

+    1.6659   -1.4583    0.0005 N   0  3  0

+   -1.6710    0.2528   -0.0003 C   0  0  0

+    0.0431    1.9245    0.0022 C   0  0  0

+    2.6916    1.3610   -0.0010 Cl  0  0  0

+    1.3349   -2.6304    0.0034 O   0  0  0

+    2.8465   -1.1588    0.0005 O   0  5  0

+   -1.2961    1.5836    0.0027 C   0  0  0

+   -3.1056   -0.1117   -0.0003 N   0  3  0

+   -3.9556    0.7607    0.0020 O   0  0  0

+   -3.4361   -1.2840   -0.0025 O   0  5  0

+   -0.9884   -1.7353    0.0000 H   0  0  0

+    0.3241    2.9225    0.0000 H   0  0  0

+   -2.0199    2.3260    0.0000 H   0  0  0

+  1  2  1  0

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+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  6 10  2  0

+  2 14  1  0

+  6 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57309-27-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+    0.6286    0.3341   -2.4825 C   0  0  0

+    0.3400    0.1358   -0.9931 C   0  0  0

+   -0.5108    1.2719   -0.4692 C   0  0  0

+   -0.4579   -1.0816   -0.7877 N   0  0  0

+    1.6306    0.0517   -0.2196 C   0  0  0

+   -0.2295    2.4518   -0.4483 O   0  0  0

+   -1.7508    0.6435    0.0082 C   0  0  0

+    0.2654   -1.8989    0.1866 O   0  0  0

+   -1.6677   -0.7417   -0.2026 C   0  0  0

+    2.6221   -0.8227   -0.6226 C   0  0  0

+    1.8250    0.8534    0.8899 C   0  0  0

+   -2.8992    1.1939    0.5914 C   0  0  0

+   -2.7391   -1.5503    0.1763 C   0  0  0

+    3.8062   -0.8999    0.0870 C   0  0  0

+    3.0087    0.7763    1.5993 C   0  0  0

+   -3.9437    0.3752    0.9565 C   0  0  0

+   -3.8619   -0.9933    0.7491 C   0  0  0

+    3.9983   -0.1026    1.1995 C   0  0  0

+    1.1737   -0.4592    0.0000 H   0  0  0

+    1.4219    0.8792    0.0000 H   0  0  0

+    0.0835    1.1274    0.0000 H   0  0  0

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+   -3.0038    2.1508    0.0000 H   0  0  0

+   -2.6497   -2.5087    0.0000 H   0  0  0

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+   -4.8214    0.7705    0.0000 H   0  0  0

+   -4.6644   -1.5248    0.0000 H   0  0  0

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+  2  1  1  0

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+  4  2  1  0

+  5  2  1  0

+  6  3  2  0

+  7  3  1  0

+  8  4  1  0

+  9  4  1  0

+ 10  5  2  0

+ 11  5  1  0

+ 12  7  2  0

+ 13  9  2  0

+ 14 10  1  0

+ 15 11  2  0

+ 16 12  1  0

+ 17 13  1  0

+ 18 14  2  0

+  7  9  1  0

+ 16 17  2  0

+ 15 18  1  0

+  1 19  1  0

+  1 20  1  0

+  1 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+836-37-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.4375   -1.2019    0.0497 C   0  0  0

+   -1.1658   -0.0647    0.0520 O   0  0  0

+    0.9652   -1.2889    0.1063 C   0  0  0

+   -1.3203   -2.2674   -0.0125 C   0  0  0

+   -2.4681   -0.3698   -0.0118 C   0  0  0

+    1.7342   -0.1358    0.0552 C   0  0  0

+   -2.6068   -1.7162   -0.0471 C   0  0  0

+   -3.5791    0.6083   -0.0303 N   0  3  0

+    3.1964   -0.2316   -0.0064 C   0  0  0

+    1.1004    1.1483    0.0626 C   0  0  0

+   -4.7319    0.2196   -0.0902 O   0  0  0

+   -3.3405    1.8019    0.0145 O   0  5  0

+    3.9442    0.8898   -0.0562 O   0  0  0

+    3.7346   -1.3222   -0.0127 O   0  0  0

+    0.5977    2.1670    0.0684 N   0  0  0

+    5.3918    0.7950   -0.1172 C   0  0  0

+    1.4212   -2.2085    0.0000 H   0  0  0

+   -1.0792   -3.2652    0.0000 H   0  0  0

+   -3.4916   -2.2366    0.0000 H   0  0  0

+    5.3247   -0.2293    0.0000 H   0  0  0

+    6.4161    0.7279    0.0000 H   0  0  0

+    5.4589    1.8193    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  6 10  1  0

+  8 11  2  0

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+ 10 15  3  0

+ 13 16  1  0

+  5  7  2  0

+  3 17  1  0

+  4 18  1  0

+  7 19  1  0

+ 16 20  1  0

+ 16 21  1  0

+ 16 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+123-32-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.3371   -0.0207    0.0019 C   0  0  0

+   -0.6028   -1.1937    0.0013 C   0  0  0

+   -0.7177    1.1463    0.0012 N   0  0  0

+   -2.8431   -0.0746   -0.0031 C   0  0  0

+    0.7176   -1.1465    0.0002 N   0  0  0

+    0.6030    1.1935    0.0001 C   0  0  0

+    1.3370    0.0209   -0.0005 C   0  0  0

+    2.8431    0.0748   -0.0013 C   0  0  0

+   -1.0783   -2.0897    0.0000 H   0  0  0

+   -2.8794    0.9391    0.0000 H   0  0  0

+   -3.8568   -0.1109    0.0000 H   0  0  0

+   -2.8068   -1.0883    0.0000 H   0  0  0

+    1.0785    2.0895    0.0000 H   0  0  0

+    2.8794   -0.9389    0.0000 H   0  0  0

+    3.8568    0.1111    0.0000 H   0  0  0

+    2.8068    1.0885    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  6  7  2  0

+  2  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  6 13  1  0

+  8 14  1  0

+  8 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64188-64-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 43                          1 V2000

+   -0.5985    1.1039   -1.3707 C   0  0  0

+   -0.0489   -0.3282   -1.4523 C   0  0  0

+    0.5193    0.6611   -0.5269 N   0  0  0

+   -1.8115    1.3482   -0.5049 C   0  0  0

+   -0.7550   -1.4034   -0.6610 C   0  0  0

+    1.7476    1.1681   -1.1531 C   0  0  0

+   -2.3982    0.2961    0.1892 C   0  0  0

+   -2.3334    2.6226   -0.4080 C   0  0  0

+   -1.8665   -1.0866    0.1116 C   0  0  0

+   -0.2888   -2.7019   -0.7100 C   0  0  0

+    2.9401    0.7471   -0.3334 C   0  0  0

+   -3.5202    0.5438    0.9848 C   0  0  0

+   -3.4439    2.8598    0.3813 C   0  0  0

+   -2.5050   -2.0966    0.8365 C   0  0  0

+   -0.9260   -3.6959    0.0101 C   0  0  0

+    3.5743   -0.4520   -0.6009 C   0  0  0

+    3.4032    1.5623    0.6821 C   0  0  0

+   -4.0349    1.8195    1.0758 C   0  0  0

+   -2.0327   -3.3906    0.7820 C   0  0  0

+    4.6679   -0.8381    0.1509 C   0  0  0

+    4.4971    1.1761    1.4341 C   0  0  0

+    5.1276   -0.0253    1.1705 C   0  0  0

+   -0.3422    1.9693    0.0000 H   0  0  0

+    0.7200   -0.8009    0.0000 H   0  0  0

+    2.2716    1.9030    0.0000 H   0  0  0

+    1.1861    1.8748    0.0000 H   0  0  0

+   -1.7545    3.3151    0.0000 H   0  0  0

+    0.6081   -2.8034    0.0000 H   0  0  0

+   -4.1033   -0.1452    0.0000 H   0  0  0

+   -3.8135    3.6833    0.0000 H   0  0  0

+   -3.4025   -2.0003    0.0000 H   0  0  0

+   -0.6032   -4.5388    0.0000 H   0  0  0

+    2.9847   -1.1354    0.0000 H   0  0  0

+    3.0874    2.4079    0.0000 H   0  0  0

+   -4.9355    1.8795    0.0000 H   0  0  0

+   -2.6446   -4.0541    0.0000 H   0  0  0

+    4.9845   -1.6834    0.0000 H   0  0  0

+    5.0878    1.8586    0.0000 H   0  0  0

+    6.0301   -0.0395    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

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+ 12 18  2  0

+ 14 19  2  0

+ 16 20  2  0

+ 17 21  1  0

+ 20 22  1  0

+  2  3  1  0

+  7  9  1  0

+ 13 18  1  0

+ 15 19  1  0

+ 21 22  2  0

+  1 23  1  0

+  2 24  1  0

+  6 25  1  0

+  6 26  1  0

+  8 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+29590-42-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 32                          1 V2000

+    3.6377   -0.0405   -0.0298 C   0  0  0

+    2.3937    0.4495    0.1416 O   0  0  0

+    4.8044    0.8303    0.1698 C   0  0  0

+    3.7945   -1.2039   -0.3445 O   0  0  0

+    1.2408   -0.4110   -0.0556 C   0  0  0

+    6.0325    0.3465    0.0006 C   0  0  0

+   -0.0400    0.3858    0.2000 C   0  0  0

+   -1.2547   -0.5209   -0.0078 C   0  0  0

+   -2.5356    0.2760    0.2478 C   0  0  0

+   -3.7503   -0.6308    0.0399 C   0  0  0

+   -5.0312    0.1661    0.2956 C   0  0  0

+   -5.1017    1.3442   -0.6780 C   0  0  0

+   -6.2459   -0.7406    0.0877 C   0  0  0

+    4.6570    1.9321    0.0000 H   0  0  0

+    0.5411   -1.2747    0.0000 H   0  0  0

+    2.0111   -1.2125    0.0000 H   0  0  0

+    6.1968   -0.7529    0.0000 H   0  0  0

+    6.9025    1.0385    0.0000 H   0  0  0

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+   -0.8103    1.1872    0.0000 H   0  0  0

+   -1.9544   -1.3846    0.0000 H   0  0  0

+   -0.4844   -1.3224    0.0000 H   0  0  0

+   -1.8359    1.1397    0.0000 H   0  0  0

+   -3.3059    1.0774    0.0000 H   0  0  0

+   -4.4500   -1.4945    0.0000 H   0  0  0

+   -2.9800   -1.4322    0.0000 H   0  0  0

+   -4.0761    0.7348    0.0000 H   0  0  0

+   -3.9921    1.4106    0.0000 H   0  0  0

+   -5.1681    2.4538    0.0000 H   0  0  0

+   -6.2113    1.2778    0.0000 H   0  0  0

+   -6.9108    0.1502    0.0000 H   0  0  0

+   -7.1367   -1.4055    0.0000 H   0  0  0

+   -5.5810   -1.6314    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

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+  5 15  1  0

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+ 12 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+118-92-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.1143    0.2636   -0.0083 C   0  0  0

+    0.5744   -0.9599   -0.0206 C   0  0  0

+    0.6068    1.4609    0.0233 C   0  0  0

+   -1.5868    0.2857   -0.0346 C   0  0  0

+    1.9638   -0.9667   -0.0013 C   0  0  0

+   -0.1291   -2.1564   -0.0515 N   0  0  0

+    1.9837    1.4333    0.0420 C   0  0  0

+   -2.2825    0.2073    1.1170 O   0  0  0

+   -2.1743    0.3747   -1.0946 O   0  0  0

+    2.6605    0.2235    0.0298 C   0  0  0

+    0.1041    2.3717    0.0000 H   0  0  0

+    2.4791   -1.8705    0.0000 H   0  0  0

+   -1.1694   -2.1482    0.0000 H   0  0  0

+    0.3839   -3.0615    0.0000 H   0  0  0

+    2.5189    2.3254    0.0000 H   0  0  0

+   -3.3163    0.0908    0.0000 H   0  0  0

+    3.7008    0.2133    0.0000 H   0  0  0

+  1  2  2  0

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+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61788-44-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.8862    0.0001    0.0021 C   0  0  0

+   -0.1913   -1.2009    0.0012 C   0  0  0

+   -0.1916    1.2007    0.0013 C   0  0  0

+   -2.2452    0.0000   -0.0019 O   0  0  0

+    1.1900   -1.1981   -0.0004 C   0  0  0

+    1.1901    1.1981   -0.0004 C   0  0  0

+    1.8802    0.0002   -0.0012 C   0  0  0

+   -0.7084   -2.0996    0.0000 H   0  0  0

+   -0.7088    2.0994    0.0000 H   0  0  0

+   -3.2820   -0.0001    0.0000 H   0  0  0

+    1.7098   -2.0952    0.0000 H   0  0  0

+    1.7098    2.0953    0.0000 H   0  0  0

+    2.9170    0.0002    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  5  7  1  0

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+  3  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+114454-59-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -0.5490    0.5917   -0.0433 C   0  0  0

+   -1.3716   -0.6273   -0.0070 C   0  0  0

+    0.8518    0.4976   -0.0006 C   0  0  0

+   -1.1663    1.8364   -0.1764 C   0  0  0

+   -0.7620   -1.8908   -0.0821 C   0  0  0

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+    1.4950   -0.8268   -0.0322 C   0  0  0

+    1.6116    1.6677    0.0504 C   0  0  0

+   -2.6545    1.9212   -0.3761 C   0  0  2

+   -0.3975    2.9781   -0.1297 C   0  0  0

+    0.7072   -1.9924   -0.0893 C   0  0  0

+   -1.5641   -3.0321   -0.1283 C   0  0  0

+   -3.3837    0.8240    0.3889 C   0  0  2

+   -3.5259   -1.6615    0.1145 C   0  0  0

+    2.8868   -0.9369   -0.0092 C   0  0  0

+    0.9821    2.8920   -0.0015 C   0  0  0

+    3.0860    1.5933    0.1591 N   0  3  0

+   -2.9553    1.8115   -1.7687 O   0  0  0

+    1.3287   -3.2412   -0.1495 C   0  0  0

+   -2.9338   -2.9066   -0.0425 C   0  0  0

+   -3.3660    1.1247    1.7857 O   0  0  0

+    3.4788   -2.1786   -0.0603 C   0  0  0

+    3.6120    1.5014    1.2538 O   0  0  0

+    3.7731    1.6238   -0.8461 O   0  5  0

+    2.7026   -3.3265   -0.1350 C   0  0  0

+   -2.8061    2.9494    0.0000 H   0  0  0

+   -0.8569    3.9103    0.0000 H   0  0  0

+   -1.1276   -3.9753    0.0000 H   0  0  0

+   -4.4043    0.6281    0.0000 H   0  0  0

+   -4.5622   -1.5827    0.0000 H   0  0  0

+    3.4757   -0.0806    0.0000 H   0  0  0

+    1.5509    3.7618    0.0000 H   0  0  0

+   -3.9317    1.4554    0.0000 H   0  0  0

+    0.7544   -4.1074    0.0000 H   0  0  0

+   -3.5284   -3.7590    0.0000 H   0  0  0

+   -3.3049    2.1622    0.0000 H   0  0  0

+    4.5152   -2.2563    0.0000 H   0  0  0

+    3.1613   -4.2591    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 25 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51325-91-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 41                          1 V2000

+    3.5714    0.0942   -0.0022 C   0  0  0

+    2.2290    0.5210   -0.0016 C   0  0  0

+    4.6327    1.0348   -0.0011 C   0  0  0

+    3.8358   -1.3011    0.0019 C   0  0  0

+    1.2289   -0.4321   -0.0028 C   0  0  0

+    5.9911    0.5816   -0.0017 C   0  0  0

+    4.3461    2.4378    0.0008 C   0  0  0

+    2.8077   -2.1696    0.0062 C   0  0  0

+   -0.1716   -0.0150   -0.0022 C   0  0  0

+    1.5366   -1.7427   -0.0051 O   0  0  0

+    7.0687    0.2220   -0.0022 N   0  0  0

+    4.1187    3.5508    0.0023 N   0  0  0

+    3.0905   -3.6499    0.0101 C   0  0  0

+   -1.1526   -0.9431   -0.0034 C   0  0  0

+   -2.5612   -0.5236   -0.0028 C   0  0  0

+   -3.5796   -1.4840   -0.0040 C   0  0  0

+   -2.8883    0.8378    0.0049 C   0  0  0

+   -4.8975   -1.0867   -0.0030 C   0  0  0

+   -4.2084    1.2262    0.0059 C   0  0  0

+   -5.2181    0.2677   -0.0007 C   0  0  0

+   -6.5527    0.6652    0.0004 N   0  0  0

+   -6.8926    2.0902    0.0028 C   0  0  0

+   -7.6169   -0.3417   -0.0009 C   0  0  0

+    1.9936    1.5413    0.0000 H   0  0  0

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+   -0.4145    1.0036    0.0000 H   0  0  0

+    2.0620   -3.8464    0.0000 H   0  0  0

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+    4.1190   -3.4534    0.0000 H   0  0  0

+   -0.9097   -1.9617    0.0000 H   0  0  0

+   -3.3392   -2.5032    0.0000 H   0  0  0

+   -2.1295    1.5594    0.0000 H   0  0  0

+   -5.6599   -1.8045    0.0000 H   0  0  0

+   -4.4539    2.2442    0.0000 H   0  0  0

+   -5.8740    2.3332    0.0000 H   0  0  0

+   -7.1356    3.1088    0.0000 H   0  0  0

+   -7.9112    1.8472    0.0000 H   0  0  0

+   -8.3366    0.4189    0.0000 H   0  0  0

+   -8.3775   -1.0614    0.0000 H   0  0  0

+   -6.8972   -1.1023    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  6 11  3  0

+  7 12  3  0

+  8 13  1  0

+  9 14  2  0

+ 14 15  1  0

+ 15 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+ 20 21  1  0

+ 21 22  1  0

+ 21 23  1  0

+  8 10  1  0

+ 19 20  1  0

+  2 24  1  0

+  4 25  1  0

+  9 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+ 23 39  1  0

+ 23 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2426-08-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -2.4658    0.2133   -0.5089 C   0  0  0

+   -3.7044   -0.5961   -0.1196 C   0  0  0

+   -3.3003    0.5744    0.5935 O   0  0  0

+   -1.2115   -0.4922    0.0106 C   0  0  0

+   -0.0546    0.2638   -0.3529 O   0  0  0

+    1.0777   -0.4426    0.1577 C   0  0  0

+    2.3566    0.3178   -0.1990 C   0  0  0

+    3.5689   -0.4386    0.3478 C   0  0  0

+    4.8478    0.3218   -0.0090 C   0  0  0

+   -1.9897    1.1734    0.0000 H   0  0  0

+   -4.7756   -0.5654    0.0000 H   0  0  0

+   -3.4133   -1.6275    0.0000 H   0  0  0

+   -1.8789   -1.3307    0.0000 H   0  0  0

+   -0.4899   -1.2846    0.0000 H   0  0  0

+    0.3738   -1.2507    0.0000 H   0  0  0

+    1.7642   -1.2655    0.0000 H   0  0  0

+    3.0606    1.1258    0.0000 H   0  0  0

+    1.6701    1.1407    0.0000 H   0  0  0

+    2.8649   -1.2466    0.0000 H   0  0  0

+    4.2554   -1.2615    0.0000 H   0  0  0

+    5.3955   -0.5994    0.0000 H   0  0  0

+    5.7690    0.8695    0.0000 H   0  0  0

+    4.3001    1.2430    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  1  0

+  2  3  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  4 13  1  0

+  4 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+603-54-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.0018   -0.6236    0.0317 N   0  0  0

+   -0.0121   -1.9698    0.0946 C   0  0  0

+    1.2162    0.0662   -0.0080 C   0  0  0

+   -1.2092    0.0851    0.0004 C   0  0  0

+    1.0329   -2.6747   -0.3823 N   0  0  0

+   -0.9642   -2.5484    0.5815 O   0  0  0

+    1.7235    0.5128   -1.2209 C   0  0  0

+    1.9165    0.3101    1.1663 C   0  0  0

+   -2.0489   -0.0196   -1.1004 C   0  0  0

+   -1.5718    0.8898    1.0728 C   0  0  0

+    2.9250    1.1933   -1.2567 C   0  0  0

+    3.1171    0.9910    1.1238 C   0  0  0

+   -3.2392    0.6809   -1.1283 C   0  0  0

+   -2.7630    1.5875    1.0388 C   0  0  0

+    3.6223    1.4299   -0.0865 C   0  0  0

+   -3.5946    1.4855   -0.0616 C   0  0  0

+    0.9746   -3.5083    0.0000 H   0  0  0

+    1.7839   -2.3084    0.0000 H   0  0  0

+    1.2390    1.1936    0.0000 H   0  0  0

+    2.2614   -0.4510    0.0000 H   0  0  0

+   -2.2181   -0.8379    0.0000 H   0  0  0

+   -0.9503    1.4484    0.0000 H   0  0  0

+    2.5833    1.9559    0.0000 H   0  0  0

+    3.5996    0.3088    0.0000 H   0  0  0

+   -3.8633    0.1253    0.0000 H   0  0  0

+   -2.5938    2.4058    0.0000 H   0  0  0

+    4.3469    1.8460    0.0000 H   0  0  0

+   -4.3212    1.8981    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  2  2  0

+  7  3  2  0

+  8  3  1  0

+  9  4  2  0

+ 10  4  1  0

+ 11  7  1  0

+ 12  8  2  0

+ 13  9  1  0

+ 14 10  2  0

+ 15 11  2  0

+ 16 13  2  0

+ 12 15  1  0

+ 14 16  1  0

+  5 17  1  0

+  5 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+555-68-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.2371    0.2630   -0.0040 C   0  0  0

+   -0.9356   -0.4987   -0.0033 C   0  0  0

+    0.1554    1.6594   -0.0015 C   0  0  0

+    1.5505   -0.4011   -0.0013 C   0  0  0

+   -2.1625    0.1310   -0.0002 C   0  0  0

+   -1.0786    2.2740    0.0016 C   0  0  0

+    2.6797    0.3372   -0.0019 C   0  0  0

+   -2.2350    1.5130    0.0018 C   0  0  0

+   -3.4050   -0.6733    0.0005 N   0  3  0

+    3.9847   -0.3227    0.0008 C   0  0  0

+   -4.4895   -0.1187    0.0033 O   0  0  0

+   -3.3431   -1.8897   -0.0016 O   0  5  0

+    5.1138    0.4156    0.0001 O   0  0  0

+    4.0521   -1.5370    0.0037 O   0  0  0

+   -0.8829   -1.5335    0.0000 H   0  0  0

+    1.0200    2.2303    0.0000 H   0  0  0

+    1.6079   -1.4356    0.0000 H   0  0  0

+   -1.1407    3.3082    0.0000 H   0  0  0

+    2.6223    1.3717    0.0000 H   0  0  0

+   -3.1596    1.9806    0.0000 H   0  0  0

+    5.9810    0.9826    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  5  8  2  0

+  5  9  1  0

+  7 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+  6  8  1  0

+  2 15  1  0

+  3 16  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112-55-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 38                          1 V2000

+   -0.8881   -0.3500   -0.0038 C   0  0  0

+   -2.1554    0.5072    0.0055 C   0  0  0

+    0.3425    0.5591    0.0061 C   0  0  0

+   -3.3860   -0.4018   -0.0044 C   0  0  0

+    1.6098   -0.2981   -0.0033 C   0  0  0

+   -4.6533    0.4554    0.0050 C   0  0  0

+    2.8404    0.6110    0.0067 C   0  0  0

+   -5.8840   -0.4537   -0.0050 C   0  0  0

+    4.1077   -0.2462   -0.0027 C   0  0  0

+   -7.1513    0.4035    0.0044 C   0  0  0

+    5.3383    0.6628    0.0072 C   0  0  0

+   -8.3819   -0.5056   -0.0055 C   0  0  0

+    6.8409   -0.3535   -0.0039 S   0  0  0

+   -1.6343   -1.2217    0.0000 H   0  0  0

+   -0.1063   -1.1900    0.0000 H   0  0  0

+   -1.4092    1.3789    0.0000 H   0  0  0

+   -2.9372    1.3472    0.0000 H   0  0  0

+    1.0887    1.4308    0.0000 H   0  0  0

+   -0.4393    1.3991    0.0000 H   0  0  0

+   -4.1322   -1.2735    0.0000 H   0  0  0

+   -2.6042   -1.2418    0.0000 H   0  0  0

+    0.8636   -1.1698    0.0000 H   0  0  0

+    2.3916   -1.1381    0.0000 H   0  0  0

+   -3.9071    1.3271    0.0000 H   0  0  0

+   -5.4351    1.2954    0.0000 H   0  0  0

+    3.5866    1.4827    0.0000 H   0  0  0

+    2.0586    1.4510    0.0000 H   0  0  0

+   -6.6302   -1.3254    0.0000 H   0  0  0

+   -5.1022   -1.2937    0.0000 H   0  0  0

+    3.3615   -1.1179    0.0000 H   0  0  0

+    4.8895   -1.0862    0.0000 H   0  0  0

+   -6.4051    1.2752    0.0000 H   0  0  0

+   -7.9331    1.2435    0.0000 H   0  0  0

+    6.0845    1.5345    0.0000 H   0  0  0

+    4.5565    1.5028    0.0000 H   0  0  0

+   -9.0637    0.4174    0.0000 H   0  0  0

+   -9.3049   -1.1874    0.0000 H   0  0  0

+   -7.7001   -1.4286    0.0000 H   0  0  0

+    7.7914   -0.9964    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+  1 14  1  0

+  1 15  1  0

+  2 16  1  0

+  2 17  1  0

+  3 18  1  0

+  3 19  1  0

+  4 20  1  0

+  4 21  1  0

+  5 22  1  0

+  5 23  1  0

+  6 24  1  0

+  6 25  1  0

+  7 26  1  0

+  7 27  1  0

+  8 28  1  0

+  8 29  1  0

+  9 30  1  0

+  9 31  1  0

+ 10 32  1  0

+ 10 33  1  0

+ 11 34  1  0

+ 11 35  1  0

+ 12 36  1  0

+ 12 37  1  0

+ 12 38  1  0

+ 13 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+693-13-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+   -2.1681    0.2959    0.1858 C   0  0  0

+   -1.1787   -0.6012   -0.4163 N   0  0  0

+   -2.7224    1.2366   -0.8860 C   0  0  0

+   -3.3107   -0.5302    0.7798 C   0  0  0

+    0.0000   -0.6013   -0.0001 C   0  0  0

+    1.1786   -0.6014    0.4162 N   0  0  0

+    2.1681    0.2958   -0.1858 C   0  0  0

+    2.7225    1.2363    0.8861 C   0  0  0

+    3.3107   -0.5303   -0.7798 C   0  0  0

+   -1.4370    0.8912    0.0000 H   0  0  0

+   -1.9101    1.7152    0.0000 H   0  0  0

+   -3.2010    2.0489    0.0000 H   0  0  0

+   -3.5347    0.7580    0.0000 H   0  0  0

+   -3.8631    0.2339    0.0000 H   0  0  0

+   -4.0748   -1.0826    0.0000 H   0  0  0

+   -2.7583   -1.2943    0.0000 H   0  0  0

+    1.4370    0.8912    0.0000 H   0  0  0

+    3.5347    0.7575    0.0000 H   0  0  0

+    3.2013    2.0485    0.0000 H   0  0  0

+    1.9103    1.7151    0.0000 H   0  0  0

+    2.7583   -1.2944    0.0000 H   0  0  0

+    4.0748   -1.0827    0.0000 H   0  0  0

+    3.8631    0.2338    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  5  6  2  0

+  6  7  1  0

+  7  8  1  0

+  7  9  1  0

+  1 10  1  0

+  3 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  4 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+127-07-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.5318    0.0103   -0.0013 C   0  0  0

+   -0.6288    0.6956    0.0010 N   0  0  0

+    1.7055    0.6728    0.0000 N   0  0  0

+    0.5199   -1.2055    0.0005 O   0  0  0

+   -1.8619   -0.0005   -0.0004 O   0  0  0

+   -0.6190    1.7064    0.0000 H   0  0  0

+    2.5760    0.1589    0.0000 H   0  0  0

+    1.7153    1.6836    0.0000 H   0  0  0

+   -2.7422   -0.4974    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+503-09-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -0.3804   -0.0726   -0.5305 C   0  0  0

+   -1.6800   -0.6763    0.0056 C   0  0  0

+   -1.3566    0.7067    0.1635 O   0  0  0

+    0.7698   -0.4128    0.4193 C   0  0  0

+    1.9582    0.1392   -0.0709 F   0  0  0

+    0.0740    0.7988    0.0000 H   0  0  0

+   -2.6627   -0.6683    0.0000 H   0  0  0

+   -1.4719   -1.6368    0.0000 H   0  0  0

+    0.2392   -1.2400    0.0000 H   0  0  0

+    1.4161   -1.1532    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  2  3  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  4  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+27946-19-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    2.5041    0.2949    0.3484 C   0  0  0

+    1.4214   -0.7155    0.6272 C   0  0  0

+    2.7951    1.2714    1.2822 C   0  0  0

+    3.2102    0.2417   -0.8391 C   0  0  0

+    0.3531   -0.6118   -0.4307 C   0  0  0

+    2.1278   -2.3742    0.6073 Cl  0  0  0

+    3.7884    2.1985    1.0265 C   0  0  0

+    4.2033    1.1684   -1.0947 C   0  0  0

+   -0.9141   -0.3134   -0.0818 N   0  0  0

+    0.6336   -0.7969   -1.5960 O   0  0  0

+    4.4904    2.1487   -0.1631 C   0  0  0

+   -1.9526   -0.2125   -1.1102 C   0  0  0

+   -3.2696    0.1289   -0.4622 C   0  0  0

+   -3.6341    1.4512   -0.2927 C   0  0  0

+   -4.1159   -0.8807   -0.0426 C   0  0  0

+   -4.8424    1.7645    0.3018 C   0  0  0

+   -5.3238   -0.5676    0.5517 C   0  0  0

+   -5.6858    0.7552    0.7265 C   0  0  0

+    1.1077    0.2091    0.0000 H   0  0  0

+    1.9651    1.7857    0.0000 H   0  0  0

+    3.5338   -0.6795    0.0000 H   0  0  0

+    3.4627    3.1190    0.0000 H   0  0  0

+    5.0345    0.6560    0.0000 H   0  0  0

+   -0.7546    0.6499    0.0000 H   0  0  0

+    5.2921    2.7061    0.0000 H   0  0  0

+   -2.6001   -0.9433    0.0000 H   0  0  0

+   -1.5954   -1.1212    0.0000 H   0  0  0

+   -2.9490    2.1469    0.0000 H   0  0  0

+   -3.8183   -1.8106    0.0000 H   0  0  0

+   -5.1407    2.6942    0.0000 H   0  0  0

+   -6.0095   -1.2627    0.0000 H   0  0  0

+   -6.6398    0.9630    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

+  7 11  2  0

+  9 12  1  0

+ 12 13  1  0

+ 13 14  2  0

+ 13 15  1  0

+ 14 16  1  0

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+  8 11  1  0

+ 17 18  1  0

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+  3 20  1  0

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+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2226-96-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -0.3538    1.2386   -0.0794 C   0  0  0

+   -1.0216    0.0119   -0.4536 N   0  0  0

+    1.1425    1.2157   -0.4013 C   0  0  0

+   -0.9780    2.3909   -0.8999 C   0  0  0

+   -0.5516    1.5797    1.3995 C   0  0  0

+   -0.3849   -1.2309   -0.0794 C   0  0  0

+   -2.3567    0.0288    0.1443 O   0  0  0

+    1.7705   -0.0087    0.2745 C   0  0  0

+    1.1198   -1.2514   -0.3375 C   0  0  0

+   -0.6558   -1.5946    1.3845 C   0  0  0

+   -1.0075   -2.3559   -0.9417 C   0  0  0

+    3.1753   -0.0268    0.0132 O   0  0  0

+    2.1323    1.5337    0.0000 H   0  0  0

+    0.9894    2.2440    0.0000 H   0  0  0

+   -0.0638    2.8861    0.0000 H   0  0  0

+   -1.4732    3.3051    0.0000 H   0  0  0

+   -1.8922    1.8957    0.0000 H   0  0  0

+    0.3478    2.1012    0.0000 H   0  0  0

+   -1.0731    2.4791    0.0000 H   0  0  0

+   -1.4510    1.0582    0.0000 H   0  0  0

+   -3.3963    0.0420    0.0000 H   0  0  0

+    0.7308   -0.0043    0.0000 H   0  0  0

+    0.9440   -2.2761    0.0000 H   0  0  0

+    2.1047   -1.5845    0.0000 H   0  0  0

+   -1.4896   -0.9736    0.0000 H   0  0  0

+   -1.2768   -2.4284    0.0000 H   0  0  0

+    0.1780   -2.2156    0.0000 H   0  0  0

+   -1.9172   -1.8525    0.0000 H   0  0  0

+   -1.5109   -3.2656    0.0000 H   0  0  0

+   -0.0978   -2.8593    0.0000 H   0  0  0

+    4.2149   -0.0402    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  6  9  1  0

+  6 10  1  0

+  6 11  1  0

+  8 12  1  0

+  8  9  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  5 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 11 30  1  0

+ 12 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54818-87-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+   -0.2058   -0.9282    0.1213 C   0  0  0

+   -1.7686   -1.7329    0.0007 S   0  0  0

+    0.2913   -0.5581    1.3652 C   0  0  0

+    0.5325   -0.6687   -1.0266 C   0  0  0

+   -2.8314   -0.3290   -0.0647 C   0  0  0

+    1.5155    0.0722    1.4592 C   0  0  0

+    1.7570   -0.0381   -0.9317 C   0  0  0

+   -4.2107   -0.4970   -0.0271 C   0  0  0

+   -2.2926    0.9491   -0.1481 C   0  0  0

+    2.2506    0.3367    0.3108 C   0  0  0

+   -5.0403    0.6053   -0.0781 C   0  0  0

+   -3.1286    2.0472   -0.1986 C   0  0  0

+    3.4933    0.9771    0.4067 N   0  0  0

+   -4.5004    1.8759   -0.1664 C   0  0  0

+    4.5886    0.4071   -0.1336 C   0  0  0

+    5.8960    1.1563   -0.1531 C   0  0  0

+    4.5220   -0.7089   -0.6041 O   0  0  0

+   -0.2564    0.3200    0.0000 H   0  0  0

+    0.9420   -1.6191    0.0000 H   0  0  0

+    1.1026    1.0211    0.0000 H   0  0  0

+    2.3089   -0.9135    0.0000 H   0  0  0

+   -4.6158   -1.4493    0.0000 H   0  0  0

+   -1.2659    1.0790    0.0000 H   0  0  0

+   -6.0675    0.4797    0.0000 H   0  0  0

+   -2.7276    3.0012    0.0000 H   0  0  0

+    3.4954    2.0120    0.0000 H   0  0  0

+   -5.1239    2.7019    0.0000 H   0  0  0

+    6.4105    0.2584    0.0000 H   0  0  0

+    6.7939    1.6708    0.0000 H   0  0  0

+    5.3815    2.0542    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+ 13 15  1  0

+ 15 16  1  0

+ 15 17  2  0

+  7 10  2  0

+ 12 14  2  0

+  3 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6358-23-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -0.1493    0.4592    0.7810 C   0  0  0

+   -0.7174   -0.7099    0.2910 C   0  0  0

+    1.2032    0.4880    1.1290 N   0  0  0

+   -0.9283    1.6017    0.9189 C   0  0  0

+   -2.0549   -0.7346   -0.0526 C   0  0  0

+    0.1097   -1.9279    0.1376 N   0  3  0

+    2.1814    0.5585    0.1304 C   0  0  0

+   -2.2635    1.5713    0.5686 C   0  0  0

+   -2.8283    0.4026    0.0908 C   0  0  0

+   -0.0081   -2.6229   -0.8558 O   0  0  0

+    0.9079   -2.2352    1.0047 O   0  5  0

+    3.5309    0.4660    0.4663 C   0  0  0

+    1.8102    0.7150   -1.1970 C   0  0  0

+   -4.2615    0.3723   -0.2784 N   0  3  0

+    4.4942    0.5365   -0.5259 C   0  0  0

+    3.9007    0.3074    1.7654 O   0  0  0

+    2.7783    0.7845   -2.1815 C   0  0  0

+   -4.9441    1.3732   -0.1526 O   0  0  0

+   -4.7582   -0.6536   -0.7079 O   0  5  0

+    4.1167    0.6984   -1.8467 C   0  0  0

+    1.2486   -0.4845    0.0000 H   0  0  0

+   -0.4832    2.4675    0.0000 H   0  0  0

+   -2.5023   -1.5992    0.0000 H   0  0  0

+   -2.7902    2.3900    0.0000 H   0  0  0

+    0.8497    0.8736    0.0000 H   0  0  0

+    5.4543    0.3756    0.0000 H   0  0  0

+    4.7954   -0.0763    0.0000 H   0  0  0

+    2.7747    1.7580    0.0000 H   0  0  0

+    4.3431    1.6452    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+  7 13  2  0

+  9 14  1  0

+ 12 15  2  0

+ 12 16  1  0

+ 13 17  1  0

+ 14 18  2  0

+ 14 19  1  0

+ 15 20  1  0

+  8  9  1  0

+ 17 20  2  0

+  3 21  1  0

+  4 22  1  0

+  5 23  1  0

+  8 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 20 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80115-73-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+   -1.4197    0.1407    0.0612 C   0  0  0

+   -2.8908   -0.0348   -0.0140 C   0  0  0

+   -0.7066   -0.3942    1.1332 C   0  0  0

+   -0.7475    0.8356   -0.9428 C   0  0  0

+   -3.6984    1.0122   -0.4533 C   0  0  0

+   -3.4698   -1.2496    0.3491 C   0  0  0

+    0.6604   -0.2303    1.2007 C   0  0  0

+    0.6200    0.9970   -0.8711 C   0  0  0

+   -5.0667    0.8432   -0.5217 C   0  0  0

+   -4.8387   -1.4074    0.2768 C   0  0  0

+    1.3279    0.4676    0.2010 C   0  0  0

+   -5.6362   -0.3627   -0.1552 C   0  0  0

+    2.7146    0.6326    0.2716 N   0  0  0

+    3.5327   -0.3601   -0.1305 C   0  0  0

+    3.2594    1.8426    0.7657 O   0  0  0

+    5.0193   -0.1260   -0.2094 C   0  0  0

+    3.0725   -1.4419   -0.4289 O   0  0  0

+    5.7119   -1.4030   -0.6895 C   0  0  0

+   -0.9658   -1.3602    0.0000 H   0  0  0

+   -1.1913    1.7320    0.0000 H   0  0  0

+   -3.3131    1.9352    0.0000 H   0  0  0

+   -2.8883   -2.0634    0.0000 H   0  0  0

+    1.1076   -1.1250    0.0000 H   0  0  0

+    0.8794    1.9630    0.0000 H   0  0  0

+   -5.6529    1.6536    0.0000 H   0  0  0

+   -5.2301   -2.3279    0.0000 H   0  0  0

+   -6.6309   -0.4679    0.0000 H   0  0  0

+    3.6700    2.7546    0.0000 H   0  0  0

+    5.9469    0.2481    0.0000 H   0  0  0

+    4.7527    0.8380    0.0000 H   0  0  0

+    4.8327   -1.8799    0.0000 H   0  0  0

+    6.1888   -2.2822    0.0000 H   0  0  0

+    6.5911   -0.9261    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  9 12  2  0

+ 11 13  1  0

+ 13 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+ 14 17  2  0

+ 16 18  1  0

+  8 11  2  0

+ 10 12  1  0

+  3 19  1  0

+  4 20  1  0

+  5 21  1  0

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+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+501-30-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.1499    0.4218    0.0035 C   0  0  0

+   -0.5591   -0.7903    0.0033 C   0  0  0

+   -0.4217    1.5440    0.0017 O   0  0  0

+   -2.6541    0.5137   -0.0005 C   0  0  0

+    0.8562   -0.8652    0.0011 C   0  0  0

+    0.9183    1.5224   -0.0004 C   0  0  0

+   -3.2117   -0.8021   -0.0041 O   0  0  0

+    1.5926    0.3516   -0.0008 C   0  0  0

+    1.4278   -1.9450    0.0012 O   0  0  0

+    2.9534    0.3369   -0.0034 O   0  0  0

+   -1.1207   -1.6381    0.0000 H   0  0  0

+   -2.4777    1.5153    0.0000 H   0  0  0

+   -3.6293    0.8021    0.0000 H   0  0  0

+    1.4343    2.3987    0.0000 H   0  0  0

+   -3.6085   -1.7385    0.0000 H   0  0  0

+    3.9703    0.3259    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  2  0

+  8 10  1  0

+  6  8  2  0

+  2 11  1  0

+  4 12  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2224-15-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -3.4742    0.6251   -0.5313 C   0  0  0

+   -4.9494    0.5633   -0.1302 C   0  0  0

+   -4.0046    1.3892    0.5534 O   0  0  0

+   -2.7444   -0.6023    0.0183 C   0  0  0

+   -1.3666   -0.5446   -0.3563 O   0  0  0

+   -0.7427   -1.7114    0.1835 C   0  0  0

+    0.7427   -1.7114   -0.1835 C   0  0  0

+    1.3666   -0.5446    0.3563 O   0  0  0

+    2.7444   -0.6022   -0.0183 C   0  0  0

+    3.4742    0.6251    0.5313 C   0  0  0

+    4.9494    0.5634    0.1302 C   0  0  0

+    4.0046    1.3893   -0.5534 O   0  0  0

+   -2.6044    1.1846    0.0000 H   0  0  0

+   -5.8288    1.1077    0.0000 H   0  0  0

+   -5.2115   -0.4372    0.0000 H   0  0  0

+   -3.7081   -0.9778    0.0000 H   0  0  0

+   -2.5321   -1.6145    0.0000 H   0  0  0

+   -1.7220   -2.0440    0.0000 H   0  0  0

+   -0.5742   -2.7318    0.0000 H   0  0  0

+    0.5742   -2.7318    0.0000 H   0  0  0

+    1.7220   -2.0440    0.0000 H   0  0  0

+    2.5322   -1.6144    0.0000 H   0  0  0

+    3.7081   -0.9777    0.0000 H   0  0  0

+    2.6044    1.1846    0.0000 H   0  0  0

+    5.2116   -0.4371    0.0000 H   0  0  0

+    5.8288    1.1078    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 10 12  1  0

+  2  3  1  0

+ 11 12  1  0

+  1 13  1  0

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+  2 15  1  0

+  4 16  1  0

+  4 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91-84-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 45                          1 V2000

+    1.0015    0.1317   -0.4133 N   0  0  0

+    1.1461   -1.2205   -0.1256 C   0  0  0

+    0.0678    0.5629   -1.4566 C   0  0  0

+    1.7784    1.1261    0.3309 C   0  0  0

+    0.4225   -1.7840    0.9208 C   0  0  0

+    1.9669   -1.9620   -0.8531 N   0  0  0

+   -1.3208    0.6598   -0.8791 C   0  0  0

+    3.2617    0.9760   -0.0132 C   0  0  0

+    0.5756   -3.1307    1.1957 C   0  0  0

+    2.1327   -3.2492   -0.6135 C   0  0  0

+   -1.7721    1.8612   -0.3652 C   0  0  0

+   -2.1435   -0.4517   -0.8693 C   0  0  0

+    4.0407    1.9731    0.7330 N   0  0  0

+    1.4506   -3.8719    0.4122 C   0  0  0

+   -3.0449    1.9528    0.1644 C   0  0  0

+   -3.4168   -0.3653   -0.3410 C   0  0  0

+    5.4475    1.7757    0.3591 C   0  0  0

+    3.6471    3.2902    0.2150 C   0  0  0

+   -3.8702    0.8380    0.1802 C   0  0  0

+   -5.1224    0.9255    0.7010 O   0  0  0

+   -5.7139   -0.3691    0.5739 C   0  0  0

+    0.7822    1.2094    0.0000 H   0  0  0

+   -0.2471    1.4735    0.0000 H   0  0  0

+    2.0523    2.0498    0.0000 H   0  0  0

+    0.9219    1.5674    0.0000 H   0  0  0

+   -0.4657   -1.4106    0.0000 H   0  0  0

+    2.9878    0.0523    0.0000 H   0  0  0

+    4.1182    0.5347    0.0000 H   0  0  0

+   -0.2742   -3.5846    0.0000 H   0  0  0

+    3.0373   -3.5808    0.0000 H   0  0  0

+   -1.1954    2.6330    0.0000 H   0  0  0

+   -1.7393   -1.3263    0.0000 H   0  0  0

+    1.4685   -4.8352    0.0000 H   0  0  0

+   -3.4473    2.8282    0.0000 H   0  0  0

+   -3.9915   -1.1386    0.0000 H   0  0  0

+    5.3136    0.8216    0.0000 H   0  0  0

+    6.4016    1.6418    0.0000 H   0  0  0

+    5.5814    2.7298    0.0000 H   0  0  0

+    4.5702    3.5661    0.0000 H   0  0  0

+    3.3712    4.2133    0.0000 H   0  0  0

+    2.7240    3.0143    0.0000 H   0  0  0

+   -6.5902    0.0313    0.0000 H   0  0  0

+   -6.1143   -1.2454    0.0000 H   0  0  0

+   -4.8376   -0.7695    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 13 17  1  0

+ 13 18  1  0

+ 15 19  2  0

+ 19 20  1  0

+ 20 21  1  0

+ 10 14  2  0

+ 16 19  1  0

+  3 22  1  0

+  3 23  1  0

+  4 24  1  0

+  4 25  1  0

+  5 26  1  0

+  8 27  1  0

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+ 12 32  1  0

+ 14 33  1  0

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+ 18 39  1  0

+ 18 40  1  0

+ 18 41  1  0

+ 21 42  1  0

+ 21 43  1  0

+ 21 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+126-27-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 75 76                          1 V2000

+    3.6428   -1.3007    1.2253 C   0  0  0

+    3.0404   -0.0606    1.7210 N   0  0  0

+    2.8505   -1.8053    0.0176 C   0  0  0

+    5.0908   -1.0336    0.8098 C   0  0  0

+    3.6161   -2.3580    2.3308 C   0  0  0

+    1.8479    0.3472    1.2433 C   0  0  0

+    3.7342    0.7361    2.7359 C   0  0  0

+    2.9682   -0.8132   -1.1106 C   0  0  0

+    1.3165    1.7097    1.6070 C   0  0  0

+    1.2024   -0.3824    0.5208 O   0  0  0

+    3.1303   -1.2591   -2.4092 C   0  0  0

+    2.9084    0.5424   -0.8478 C   0  0  0

+    0.1543    2.0228    0.7648 N   0  0  0

+    3.2384   -0.3492   -3.4439 C   0  0  0

+    3.0164    1.4526   -1.8829 C   0  0  0

+   -1.0132    1.4091    1.4116 C   0  0  0

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+ 33 74  1  0

+ 34 75  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+151-56-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  8                          1 V2000

+    0.7650   -0.4620    0.0000 C   0  0  0

+   -0.7650   -0.4620    0.0000 C   0  0  0

+    0.0000    0.7921    0.0000 N   0  0  0

+    0.9650   -1.5454    0.0000 H   0  0  0

+    1.7941   -0.0686    0.0000 H   0  0  0

+   -1.7941   -0.0686    0.0000 H   0  0  0

+   -0.9650   -1.5454    0.0000 H   0  0  0

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+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1522-92-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.0000    0.5883    0.1351 C   0  0  0

+   -1.2492    0.4868    1.0126 C   0  0  0

+    1.2492    0.4868    1.0126 C   0  0  0

+    0.0000   -0.5513   -0.8859 C   0  0  0

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+   -2.8544    0.6172   -0.1150 Br  0  0  0

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+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2921-88-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -1.9682    0.0100    0.1799 P   0  0  0

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+    0.9252   -3.5143    0.0814 Cl  0  0  0

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+    2.8200    0.0009    0.0469 C   0  0  0

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+ 13 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-10-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    1.2476   -0.0617    0.2070 C   0  0  0

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+  6 17  1  0

+  6 18  1  0

+  6 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+52898-98-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 87 88                          1 V2000

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+ 29 73  1  0

+ 29 74  1  0

+ 30 75  1  0

+ 30 76  1  0

+ 31 77  1  0

+ 31 78  1  0

+ 32 79  1  0

+ 32 80  1  0

+ 33 81  1  0

+ 33 82  1  0

+ 34 83  1  0

+ 34 84  1  0

+ 35 85  1  0

+ 35 86  1  0

+ 35 87  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+139953-77-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+   -3.3565   -0.5762   -0.0012 C   0  0  0

+   -4.8265   -0.5536   -0.0008 C   0  0  0

+   -2.9429    0.7548    0.0000 C   0  0  0

+   -2.4483   -1.5651    0.0027 N   0  0  0

+   -5.2031    0.8004    0.0005 C   0  0  0

+   -5.8044   -1.5488   -0.0011 C   0  0  0

+   -4.0571    1.5662    0.0009 N   0  0  0

+   -1.5544    1.0314    0.0003 C   0  0  0

+   -1.1860   -1.3205    0.0022 N   0  0  0

+   -6.5567    1.1298    0.0006 C   0  0  0

+   -7.1267   -1.2037   -0.0002 C   0  0  0

+   -0.6938   -0.0106   -0.0004 N   0  0  0

+   -1.1454    2.1805    0.0009 O   0  0  0

+   -7.5054    0.1316   -0.0005 C   0  0  0

+    0.6880    0.2202    0.0000 N   0  0  0

+    1.5143   -0.7829   -0.0007 C   0  0  0

+    2.9674   -0.5402   -0.0003 C   0  0  0

+    3.8569   -1.6196   -0.0011 C   0  0  0

+    3.4579    0.7696   -0.0050 C   0  0  0

+    5.2140   -1.3895   -0.0007 C   0  0  0

+    4.8046    0.9971   -0.0045 C   0  0  0

+    5.6980   -0.0781    0.0005 C   0  0  0

+    7.1530    0.1715    0.0015 C   0  0  0

+    7.6197    1.4354    0.0026 O   0  0  0

+    7.9296   -0.7628    0.0012 O   0  0  0

+   -5.5268   -2.5541    0.0000 H   0  0  0

+   -4.0361    2.6089    0.0000 H   0  0  0

+   -6.8510    2.1303    0.0000 H   0  0  0

+   -7.8563   -1.9489    0.0000 H   0  0  0

+   -8.5180    0.3813    0.0000 H   0  0  0

+    1.1487   -1.7596    0.0000 H   0  0  0

+    3.4926   -2.5968    0.0000 H   0  0  0

+    2.7941    1.5740    0.0000 H   0  0  0

+    5.8799   -2.1921    0.0000 H   0  0  0

+    5.1672    1.9749    0.0000 H   0  0  0

+    7.9810    2.4137    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

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+ 23 25  2  0

+  5  7  1  0

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+ 11 14  1  0

+ 21 22  1  0

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+ 10 28  1  0

+ 11 29  1  0

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+ 16 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 24 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21229-99-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.3992   -1.0069   -0.0022 C   0  0  0

+   -1.1863   -1.7489   -0.2028 S   0  0  0

+    0.9116   -0.7967    1.2716 C   0  0  0

+    1.1395   -0.6372   -1.1183 C   0  0  0

+   -2.2094   -0.3184   -0.0957 C   0  0  0

+    2.1541   -0.2151    1.4286 C   0  0  0

+    2.3816   -0.0558   -0.9610 C   0  0  0

+   -3.5906   -0.4539   -0.0177 C   0  0  0

+   -1.6371    0.9478   -0.0833 C   0  0  0

+    2.8913    0.1596    0.3131 C   0  0  0

+   -4.3890    0.6691    0.0666 C   0  0  0

+   -2.4421    2.0667    0.0012 C   0  0  0

+    4.1508    0.7491    0.4724 N   0  0  0

+   -3.8161    1.9282    0.0734 C   0  0  0

+    4.9027    1.1313   -0.6650 O   0  0  0

+    1.3270   -1.7432    0.0000 H   0  0  0

+    0.6895    0.2933    0.0000 H   0  0  0

+    2.6074   -1.1440    0.0000 H   0  0  0

+    1.9613    0.8885    0.0000 H   0  0  0

+   -4.0191   -1.3945    0.0000 H   0  0  0

+   -0.6086    1.0506    0.0000 H   0  0  0

+   -5.4179    0.5705    0.0000 H   0  0  0

+   -2.0175    3.0091    0.0000 H   0  0  0

+    4.6041   -0.1798    0.0000 H   0  0  0

+   -4.4184    2.7682    0.0000 H   0  0  0

+    5.8241    1.5997    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+ 13 15  1  0

+  7 10  1  0

+ 12 14  2  0

+  3 16  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-54-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.4451   -0.1562    0.0037 C   0  0  0

+    1.2540   -1.2929    0.0029 C   0  0  0

+    1.0315    1.1102    0.0010 C   0  0  0

+   -1.0267   -0.2926    0.0013 C   0  0  0

+    2.6274   -1.1588   -0.0006 C   0  0  0

+    2.4057    1.2306   -0.0025 C   0  0  0

+   -1.7927    0.7894    0.0021 C   0  0  0

+    3.2024    0.0993   -0.0033 C   0  0  0

+   -3.2932    0.6503   -0.0003 C   0  0  0

+   -3.6432   -0.7351   -0.0033 O   0  0  0

+    0.8220   -2.2412    0.0000 H   0  0  0

+    0.4326    1.9630    0.0000 H   0  0  0

+   -1.4622   -1.2393    0.0000 H   0  0  0

+    3.2326   -2.0071    0.0000 H   0  0  0

+    2.8448    2.1756    0.0000 H   0  0  0

+   -1.3572    1.7361    0.0000 H   0  0  0

+    4.2400    0.1955    0.0000 H   0  0  0

+   -3.2715    1.6921    0.0000 H   0  0  0

+   -4.3259    0.7897    0.0000 H   0  0  0

+   -3.8984   -1.7454    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  5  8  2  0

+  7  9  1  0

+  9 10  1  0

+  6  8  1  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+626-43-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -2.7012    1.1051    0.0002 Cl  0  0  0

+   -1.1992    0.2347   -0.0015 C   0  0  0

+   -0.0002    0.9253    0.0002 C   0  0  0

+   -1.2021   -1.1478    0.0011 C   0  0  0

+    1.1992    0.2346   -0.0012 C   0  0  0

+   -0.0001   -1.8434   -0.0003 C   0  0  0

+    2.7012    1.1051    0.0010 Cl  0  0  0

+    1.2022   -1.1475   -0.0047 C   0  0  0

+    0.0000   -3.2401    0.0023 N   0  0  0

+   -0.0002    1.9669    0.0000 H   0  0  0

+   -2.1049   -1.6672    0.0000 H   0  0  0

+    2.1051   -1.6668    0.0000 H   0  0  0

+   -0.9020   -3.7610    0.0000 H   0  0  0

+    0.9021   -3.7608    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

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+  7  5  1  0

+  8  5  2  0

+  9  6  1  0

+  6  8  1  0

+  3 10  1  0

+  4 11  1  0

+  8 12  1  0

+  9 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+73341-53-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.2736   -0.2321   -0.0024 C   0  0  0

+   -1.0455   -0.6345   -0.0015 N   0  0  0

+    0.2556    1.1740   -0.0014 C   0  0  0

+    1.4271   -0.8864    0.0008 N   0  0  0

+   -1.8200    0.5004    0.0001 C   0  0  0

+   -1.6291   -1.8701   -0.0019 C   0  0  0

+   -1.0334    1.5653    0.0002 N   0  0  0

+    1.4739    1.8708   -0.0016 C   0  0  0

+    2.5825   -0.2453   -0.0007 C   0  0  0

+   -3.2275    0.3800    0.0013 C   0  0  0

+   -2.9718   -1.9974   -0.0007 C   0  0  0

+    2.6359    1.1490   -0.0028 C   0  0  0

+    3.7681   -0.9743    0.0033 N   0  0  0

+   -3.7920   -0.8561    0.0009 C   0  0  0

+   -4.0955    1.6119    0.0036 C   0  0  0

+    5.0135   -0.3005    0.0018 O   0  0  0

+   -1.0359   -2.7151    0.0000 H   0  0  0

+    1.4926    2.9030    0.0000 H   0  0  0

+   -3.3990   -2.9373    0.0000 H   0  0  0

+    3.5476    1.6334    0.0000 H   0  0  0

+    3.7395   -2.0063    0.0000 H   0  0  0

+   -4.8195   -0.9565    0.0000 H   0  0  0

+   -3.2515    2.2066    0.0000 H   0  0  0

+   -4.6902    2.4559    0.0000 H   0  0  0

+   -4.9395    1.0172    0.0000 H   0  0  0

+    5.9215    0.1908    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+  9 13  1  0

+ 10 14  2  0

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+  5  7  2  0

+  9 12  1  0

+ 11 14  1  0

+  6 17  1  0

+  8 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+129-03-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+    0.0561   -0.1545   -0.0264 C   0  0  0

+    1.1753   -1.1161   -0.1570 C   0  0  0

+    0.3301    1.2779   -0.2860 C   0  0  0

+   -1.1736   -0.5705    0.3123 C   0  0  0

+    2.3325   -0.9601    0.6266 C   0  0  0

+    1.0852   -2.1693   -1.0622 C   0  0  0

+    1.3032    1.9566    0.4696 C   0  0  0

+   -0.3692    1.9500   -1.2834 C   0  0  0

+   -1.9723    0.1308    1.3924 C   0  0  0

+   -1.8208   -1.7561   -0.3746 C   0  0  0

+    2.4168    0.0702    1.6575 C   0  0  0

+    3.4082   -1.8359    0.4321 C   0  0  0

+    2.1473   -3.0369   -1.2191 C   0  0  0

+    1.9792    1.3103    1.5907 C   0  0  0

+    1.5993    3.2889    0.1563 C   0  0  0

+   -0.0798    3.2719   -1.5581 C   0  0  0

+   -3.3925    0.3578    0.8622 C   0  0  0

+   -3.2542   -1.3640   -0.7503 C   0  0  0

+    3.3077   -2.8612   -0.4823 C   0  0  0

+    0.9094    3.9325   -0.8479 C   0  0  0

+   -3.9730   -0.9233    0.4461 N   0  0  0

+   -5.3532   -0.6451    0.0271 C   0  0  0

+    0.1885   -2.5487    0.0000 H   0  0  0

+   -1.3008    1.6671    0.0000 H   0  0  0

+   -1.1245    0.6095    0.0000 H   0  0  0

+   -2.1445    1.0891    0.0000 H   0  0  0

+   -2.1497   -2.6725    0.0000 H   0  0  0

+   -0.9326   -2.1550    0.0000 H   0  0  0

+    3.3824    0.1953    0.0000 H   0  0  0

+    4.3069   -1.4613    0.0000 H   0  0  0

+    1.8901   -3.9759    0.0000 H   0  0  0

+    2.7970    1.8386    0.0000 H   0  0  0

+    2.5292    3.5773    0.0000 H   0  0  0

+   -0.8840    3.8207    0.0000 H   0  0  0

+   -3.1540    1.3018    0.0000 H   0  0  0

+   -4.3115    0.6792    0.0000 H   0  0  0

+   -4.0624   -1.9069    0.0000 H   0  0  0

+   -3.0969   -2.3248    0.0000 H   0  0  0

+    4.0140   -3.5313    0.0000 H   0  0  0

+    0.9881    4.9029    0.0000 H   0  0  0

+   -5.1608    0.3093    0.0000 H   0  0  0

+   -6.3076   -0.4527    0.0000 H   0  0  0

+   -5.5456   -1.5995    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  3  7  1  0

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+  7 14  1  0

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+  8 16  1  0

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+ 10 18  1  0

+ 12 19  2  0

+ 15 20  1  0

+ 17 21  1  0

+ 21 22  1  0

+ 11 14  2  0

+ 13 19  1  0

+ 16 20  2  0

+ 18 21  1  0

+  6 23  1  0

+  8 24  1  0

+  9 25  1  0

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+ 18 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+ 22 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119-06-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 96 96                          1 V2000

+    0.7183    4.4409   -0.0716 C   0  0  0

+   -0.6293    4.2126    0.2654 C   0  0  0

+    1.3013    5.6713    0.2202 C   0  0  0

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+   -1.3629    5.2200    0.8864 C   0  0  0

+   -1.2618    2.9113   -0.0387 C   0  0  0

+    0.5572    6.6594    0.8371 C   0  0  0

+    2.6665    2.9621   -0.1713 O   0  0  0

+    1.1221    2.8813   -1.7632 O   0  0  0

+   -0.7673    6.4351    1.1683 C   0  0  0

+   -2.5814    2.7389    0.1696 O   0  0  0

+   -0.5916    1.9979   -0.4763 O   0  0  0

+    3.4455    1.9187   -0.8139 C   0  0  0

+   -3.2027    1.4609   -0.1290 C   0  0  0

+    4.7003    1.6358    0.0146 C   0  0  0

+   -4.6963    1.5319    0.1949 C   0  0  0

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+   -9.6474   -2.3661   -0.1012 C   0  0  0

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+   11.7483   -3.6106   -0.2080 C   0  0  0

+  -11.7956   -3.6417   -0.0919 C   0  0  0

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+   13.8240   -4.9929   -0.0565 C   0  0  0

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+   -4.5095    2.5439    0.0000 H   0  0  0

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+    4.5558    0.1800    0.0000 H   0  0  0

+    5.5890   -0.4904    0.0000 H   0  0  0

+   -5.5376   -0.8267    0.0000 H   0  0  0

+   -4.3733   -0.1359    0.0000 H   0  0  0

+    7.7414    0.6099    0.0000 H   0  0  0

+    6.7082    1.2803    0.0000 H   0  0  0

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+  -17.0175   -5.7432    0.0000 H   0  0  0

+  -16.5419   -7.1186    0.0000 H   0  0  0

+  -15.1665   -6.6430    0.0000 H   0  0  0

+  1  2  2  0

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+ 38 94  1  0

+ 38 95  1  0

+ 38 96  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109-09-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -0.3380   -0.0194    0.0030 C   0  0  0

+    0.3481   -1.2213    0.0016 C   0  0  0

+    0.3128    1.1284    0.0019 N   0  0  0

+   -2.0740   -0.0220   -0.0012 Cl  0  0  0

+    1.7337   -1.2076   -0.0009 C   0  0  0

+    1.6309    1.1781   -0.0005 C   0  0  0

+    2.3821    0.0187   -0.0020 C   0  0  0

+   -0.1686   -2.1215    0.0000 H   0  0  0

+    2.2737   -2.0940    0.0000 H   0  0  0

+    2.1094    2.0992    0.0000 H   0  0  0

+    3.4190    0.0646    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

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+  6  7  2  0

+  2  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+396-32-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.3804    0.5812   -0.0027 C   0  0  0

+   -0.6330   -0.8136   -0.0009 C   0  0  0

+    0.9496    1.0350   -0.0023 C   0  0  0

+   -1.4029    1.4421    0.0007 N   0  0  0

+    0.4444   -1.7150    0.0018 C   0  0  0

+   -1.9654   -1.2654   -0.0013 C   0  0  0

+    1.9717    0.1332   -0.0001 C   0  0  0

+   -2.6458    1.0242    0.0057 C   0  0  0

+    1.7195   -1.2398    0.0026 C   0  0  0

+   -2.9630   -0.3317   -0.0035 C   0  0  0

+    3.2484    0.5750   -0.0001 F   0  0  0

+    1.1522    2.0496    0.0000 H   0  0  0

+    0.2694   -2.7347    0.0000 H   0  0  0

+   -2.1838   -2.2767    0.0000 H   0  0  0

+   -3.4111    1.7204    0.0000 H   0  0  0

+    2.5122   -1.9046    0.0000 H   0  0  0

+   -3.9531   -0.6318    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  7  9  1  0

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+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+150-76-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.0279   -0.2859    0.0021 C   0  0  0

+   -0.1753   -1.3802    0.0014 C   0  0  0

+   -0.5067    0.9992    0.0016 C   0  0  0

+   -2.3747   -0.4733   -0.0024 O   0  0  0

+    1.1926   -1.1898    0.0002 C   0  0  0

+    0.8617    1.1896    0.0004 C   0  0  0

+   -2.9724    0.8247   -0.0004 C   0  0  0

+    1.7140    0.0957   -0.0002 C   0  0  0

+    3.0608    0.2831   -0.0014 O   0  0  0

+   -0.5662   -2.3440    0.0000 H   0  0  0

+   -1.1459    1.8196    0.0000 H   0  0  0

+    1.8318   -2.0102    0.0000 H   0  0  0

+    1.2526    2.1534    0.0000 H   0  0  0

+   -2.0277    1.2597    0.0000 H   0  0  0

+   -3.4074    1.7694    0.0000 H   0  0  0

+   -3.9171    0.3897    0.0000 H   0  0  0

+    4.0909    0.4264    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58-54-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    1.4332    0.3004    0.2293 C   0  0  0

+    0.8420   -0.9606    0.0925 C   0  0  0

+    2.9001    0.4233    0.3243 C   0  0  0

+    0.6293    1.4441    0.2698 C   0  0  0

+   -0.5303   -1.0698    0.0036 C   0  0  0

+    1.8334   -2.3845    0.0343 Cl  0  0  0

+    3.5285    1.7526    0.3157 C   0  0  0

+    3.5900   -0.5751    0.4098 O   0  0  0

+   -0.7386    1.3260    0.1751 C   0  0  0

+   -1.3241    0.0708    0.0494 C   0  0  0

+   -1.2668   -2.6326   -0.1661 Cl  0  0  0

+    3.8043    2.4472   -0.9929 C   0  0  0

+    3.8538    2.3426    1.4641 C   0  0  0

+   -2.6738   -0.0403   -0.0392 O   0  0  0

+    4.8589    1.6615   -1.7750 C   0  0  0

+   -3.2032    1.2849    0.0371 C   0  0  0

+   -4.7064    1.2314   -0.0559 C   0  0  0

+   -5.4227    2.3655   -0.0062 O   0  0  0

+   -5.2668    0.1676   -0.1753 O   0  0  0

+    1.0680    2.3857    0.0000 H   0  0  0

+   -1.3339    2.1773    0.0000 H   0  0  0

+    4.3498    3.3312    0.0000 H   0  0  0

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+    4.2383    0.8285    0.0000 H   0  0  0

+    5.6919    1.0409    0.0000 H   0  0  0

+    5.4795    2.4945    0.0000 H   0  0  0

+   -2.2007    1.5572    0.0000 H   0  0  0

+   -3.3588    2.3120    0.0000 H   0  0  0

+   -5.9774    3.2438    0.0000 H   0  0  0

+  1  2  2  0

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+ 15 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+112022-06-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+   -0.8547    0.8412    0.1765 C   0  0  0

+   -1.9887    1.5722   -0.2077 C   0  0  0

+    0.3573    1.5103    0.4047 C   0  0  0

+   -0.9394   -0.6257    0.3457 C   0  0  0

+   -3.2707    0.8763   -0.4501 C   0  0  0

+   -1.9016    2.9554   -0.3593 C   0  0  0

+    0.4213    2.8955    0.2469 C   0  0  0

+    1.5610    0.7514    0.8110 C   0  0  0

+   -2.2216   -1.3213    0.1092 C   0  0  0

+    0.0434   -1.2576    0.6781 O   0  0  0

+   -3.3559   -0.5901   -0.2870 C   0  0  0

+   -4.2530    1.5094   -0.7825 O   0  0  0

+   -0.7017    3.6056   -0.1319 C   0  0  0

+    2.6152    0.6623   -0.0241 N   0  0  0

+    1.5991    0.2085    1.8976 O   0  0  0

+   -2.3112   -2.7015    0.2663 C   0  0  0

+   -4.5586   -1.2531   -0.5130 C   0  0  0

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+    6.0419   -0.7868   -0.3393 N   0  0  0

+    5.6399   -2.1965   -0.2440 C   0  0  0

+    6.9952   -0.6940   -1.4531 C   0  0  0

+   -2.7702    3.5104    0.0000 H   0  0  0

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+   -3.5592   -4.3742    0.0000 H   0  0  0

+   -5.5462   -3.0968    0.0000 H   0  0  0

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+    4.6486   -1.9138    0.0000 H   0  0  0

+    5.3572   -3.1878    0.0000 H   0  0  0

+    6.6312   -2.4792    0.0000 H   0  0  0

+    7.0951   -1.7200    0.0000 H   0  0  0

+    8.0212   -0.5941    0.0000 H   0  0  0

+    6.8953    0.3320    0.0000 H   0  0  0

+  1  2  2  0

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+ 23 39  1  0

+ 24 40  1  0

+ 24 41  1  0

+ 24 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67-71-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+   -0.0602    0.0000    0.0000 S   0  0  0

+    1.1130    0.0000    1.3835 C   0  0  0

+    1.1130    0.0000   -1.3835 C   0  0  0

+   -0.7751   -1.2281    0.0000 O   0  0  0

+   -0.7751    1.2281    0.0000 O   0  0  0

+    1.1130   -0.9728    0.0000 H   0  0  0

+    2.0858    0.0000    0.0000 H   0  0  0

+    1.1130    0.9728    0.0000 H   0  0  0

+    1.1130   -0.9728    0.0000 H   0  0  0

+    2.0858    0.0000    0.0000 H   0  0  0

+    1.1130    0.9728    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-67-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    1.8413   -0.3848   -0.2200 C   0  0  0

+    0.4993   -0.3848    0.3675 N   0  0  0

+    2.5691    0.8171    0.2188 C   0  0  0

+    2.5978   -1.6340    0.2361 C   0  0  0

+    1.7300   -0.3848   -1.7460 C   0  0  0

+   -0.4993   -0.3848   -0.3675 N   0  0  0

+    3.1308    1.7447    0.5575 N   0  0  0

+   -1.8413   -0.3848    0.2200 C   0  0  0

+   -2.5691    0.8171   -0.2188 C   0  0  0

+   -2.5978   -1.6340   -0.2361 C   0  0  0

+   -1.7300   -0.3848    1.7460 C   0  0  0

+   -3.1308    1.7447   -0.5575 N   0  0  0

+    1.7369   -2.1554    0.0000 H   0  0  0

+    3.1192   -2.4949    0.0000 H   0  0  0

+    3.4587   -1.1126    0.0000 H   0  0  0

+    1.7300    0.6217    0.0000 H   0  0  0

+    0.7235   -0.3848    0.0000 H   0  0  0

+    1.7300   -1.3913    0.0000 H   0  0  0

+   -3.4587   -1.1126    0.0000 H   0  0  0

+   -3.1192   -2.4949    0.0000 H   0  0  0

+   -1.7369   -2.1554    0.0000 H   0  0  0

+   -1.7300   -1.3913    0.0000 H   0  0  0

+   -0.7235   -0.3848    0.0000 H   0  0  0

+   -1.7300    0.6217    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2562-38-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.0477   -0.2392   -0.6249 C   0  0  0

+   -1.2477   -0.0061    0.0184 N   0  3  0

+    0.8433    1.0772   -0.6678 C   0  0  0

+    0.8740   -1.2260    0.2256 C   0  0  0

+   -2.2788   -0.2214   -0.5932 O   0  0  0

+   -1.2936    0.4029    1.1647 O   0  5  0

+    2.1253    0.8444    0.1581 C   0  0  0

+    2.3243   -0.6913    0.1260 C   0  0  0

+   -0.4453   -1.0887    0.0000 H   0  0  0

+    1.1345    2.0152    0.0000 H   0  0  0

+   -0.0526    1.4798    0.0000 H   0  0  0

+    0.0538   -1.7663    0.0000 H   0  0  0

+    1.3169   -2.1026    0.0000 H   0  0  0

+    3.1072    0.8700    0.0000 H   0  0  0

+    2.2007    1.8237    0.0000 H   0  0  0

+    2.5943   -1.6357    0.0000 H   0  0  0

+    3.2862   -0.4927    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  7  8  1  0

+  1  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-50-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -2.7848    0.0001   -0.0014 N   0  0  0

+   -1.3848    0.0001   -0.0014 C   0  0  0

+   -0.6906    1.2025    0.0015 C   0  0  0

+   -0.6904   -1.2026    0.0015 C   0  0  0

+    0.6906    1.2025    0.0015 C   0  0  0

+    0.6903   -1.2027    0.0015 C   0  0  0

+    1.3848    0.0001   -0.0014 C   0  0  0

+    2.7848    0.0001   -0.0014 N   0  0  0

+   -3.3055    0.9020    0.0000 H   0  0  0

+   -3.3055   -0.9018    0.0000 H   0  0  0

+   -1.2113    2.1044    0.0000 H   0  0  0

+   -1.2111   -2.1045    0.0000 H   0  0  0

+    1.2113    2.1044    0.0000 H   0  0  0

+    1.2110   -2.1046    0.0000 H   0  0  0

+    3.3055   -0.9018    0.0000 H   0  0  0

+    3.3055    0.9020    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  4  2  0

+  7  5  2  0

+  8  7  1  0

+  6  7  1  0

+  1  9  1  0

+  1 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+159092-71-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.5081    0.9885    0.0050 C   0  0  0

+   -0.1728   -0.2499   -0.0021 C   0  0  0

+    1.9739    0.9862   -0.0070 C   0  0  0

+   -0.2199    2.1791    0.0288 C   0  0  0

+    0.5630   -1.4578   -0.0200 C   0  0  0

+   -1.5744   -0.2584    0.0092 C   0  0  0

+    2.6507   -0.2540   -0.0251 C   0  0  0

+    2.7060    2.1750   -0.0013 C   0  0  0

+   -1.5853    2.1372    0.0451 C   0  0  0

+    1.9112   -1.4597   -0.0305 C   0  0  0

+   -0.1630   -2.7478   -0.0268 N   0  3  0

+   -2.2587    0.9218    0.0268 C   0  0  0

+    4.0527   -0.2668   -0.0367 C   0  0  0

+    4.0710    2.1290   -0.0134 C   0  0  0

+    0.1595   -3.6322    0.7462 O   0  0  0

+   -1.0828   -2.9249   -0.8053 O   0  5  0

+   -3.7388    0.9073    0.0387 N   0  3  0

+    4.7406    0.9111   -0.0303 C   0  0  0

+   -4.3581    1.9560    0.0545 O   0  0  0

+   -4.3375   -0.1534    0.0328 O   0  5  0

+    0.2769    3.0979    0.0000 H   0  0  0

+   -2.0931   -1.1650    0.0000 H   0  0  0

+    2.2121    3.0953    0.0000 H   0  0  0

+   -2.1293    3.0289    0.0000 H   0  0  0

+    2.4208   -2.3715    0.0000 H   0  0  0

+    4.5686   -1.1750    0.0000 H   0  0  0

+    4.6178    3.0190    0.0000 H   0  0  0

+    5.7850    0.8976    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 11 15  2  0

+ 11 16  1  0

+ 12 17  1  0

+ 13 18  2  0

+ 17 19  2  0

+ 17 20  1  0

+  7 10  1  0

+  9 12  2  0

+ 14 18  1  0

+  4 21  1  0

+  6 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33611-88-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.6481    1.1309    0.0016 C   0  0  0

+    0.3661   -0.1311    0.0008 C   0  0  0

+    2.0941    1.3477    0.0015 C   0  0  0

+   -0.3121    2.2280   -0.0030 C   0  0  0

+    1.6390   -0.8690    0.0002 C   0  0  0

+   -1.0677   -0.4790    0.0008 C   0  0  0

+    2.6539   -0.0124    0.0008 C   0  0  0

+    2.5122    2.5889    0.0015 C   0  0  0

+   -1.5867    1.9199   -0.0081 C   0  0  0

+    0.2544    3.5876   -0.0019 C   0  0  0

+    1.9193   -2.3170   -0.0013 C   0  0  0

+   -1.9659    0.4897    0.0017 C   0  0  0

+   -1.4585   -1.7765   -0.0007 N   0  3  0

+    4.0379   -0.5109    0.0012 C   0  0  0

+    1.5688    3.7187    0.0019 C   0  0  0

+    3.1571   -2.7576   -0.0017 C   0  0  0

+   -3.2807    0.1621    0.0020 N   0  3  0

+   -1.6338   -2.3608    1.0535 O   0  0  0

+   -1.6343   -2.3583   -1.0562 O   0  5  0

+    4.2795   -1.8037    0.0006 C   0  0  0

+   -4.1267    1.0383    0.0028 O   0  0  0

+   -3.6165   -1.0087    0.0013 O   0  5  0

+    3.5110    2.7762    0.0000 H   0  0  0

+   -2.2973    2.6464    0.0000 H   0  0  0

+   -0.3506    4.4041    0.0000 H   0  0  0

+    1.1486   -2.9794    0.0000 H   0  0  0

+    4.8119    0.1476    0.0000 H   0  0  0

+    1.9531    4.6595    0.0000 H   0  0  0

+    3.3403   -3.7572    0.0000 H   0  0  0

+    5.2373   -2.1434    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+ 11 16  2  0

+ 12 17  1  0

+ 13 18  2  0

+ 13 19  1  0

+ 14 20  2  0

+ 17 21  2  0

+ 17 22  1  0

+  5  7  2  0

+  9 12  1  0

+ 10 15  2  0

+ 16 20  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+137-40-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 10                          1 V2000

+   -2.4739    0.4334   -0.0200 C   0  0  0

+   -3.3777   -0.6859    0.4290 C   0  0  0

+   -1.4431    0.1806   -0.6285 O   0  0  0

+   -2.7736    1.5951    0.2196 O   0  0  0

+   -2.7795   -2.0274    0.0007 C   0  0  0

+    7.4435   -0.0448    0.0705 Na  0  3  0

+   -4.0406    0.0486    0.0000 H   0  0  0

+   -4.2070   -1.2255    0.0000 H   0  0  0

+   -3.6831   -2.4303    0.0000 H   0  0  0

+   -2.3766   -2.9310    0.0000 H   0  0  0

+   -1.8759   -1.6245    0.0000 H   0  0  0

+   -3.0208    2.5531    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  7  1  0

+  2  8  1  0

+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-13-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.8629   -0.0248    0.0037 C   0  0  0

+   -0.2774   -1.2780    0.0034 C   0  0  0

+   -0.0758    1.1132    0.0024 C   0  0  0

+   -2.3377    0.0994   -0.0006 N   0  3  0

+    1.0971   -1.4006    0.0017 C   0  0  0

+    1.2995    1.0043    0.0007 C   0  0  0

+   -2.8560    1.2016   -0.0003 O   0  0  0

+   -3.0331   -0.9006   -0.0045 O   0  5  0

+    1.8964   -0.2571    0.0004 C   0  0  0

+    3.3694   -0.3812   -0.0019 C   0  0  0

+    4.1262    0.7072   -0.0032 C   0  0  0

+   -0.8728   -2.1275    0.0000 H   0  0  0

+   -0.5208    2.0503    0.0000 H   0  0  0

+    1.5351   -2.3410    0.0000 H   0  0  0

+    1.8886    1.8582    0.0000 H   0  0  0

+    3.8109   -1.3200    0.0000 H   0  0  0

+    5.1600    0.6202    0.0000 H   0  0  0

+    3.6847    1.6460    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

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+  9 10  1  0

+ 10 11  2  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1116-40-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 39                          1 V2000

+   -0.1462    0.1598   -0.2899 N   0  0  0

+    0.1892   -1.1830   -0.7824 C   0  0  0

+    0.8533    1.0776   -0.8524 C   0  0  0

+   -1.4366    0.5202   -0.8923 C   0  0  0

+    1.0419   -1.9100    0.2593 C   0  0  0

+    1.9929    1.2676    0.1507 C   0  0  0

+   -2.5697    0.1344    0.0606 C   0  0  0

+    0.1424   -2.4263    1.3842 C   0  0  0

+    1.7594   -3.0887   -0.4016 C   0  0  0

+    3.1603    1.9822   -0.5331 C   0  0  0

+    1.4998    2.1091    1.3294 C   0  0  0

+   -2.5506    1.0616    1.2776 C   0  0  0

+   -3.9117    0.2689   -0.6619 C   0  0  0

+   -0.7596   -1.1144    0.0000 H   0  0  0

+   -0.1717   -2.0632    0.0000 H   0  0  0

+    1.0104    2.0158    0.0000 H   0  0  0

+    0.0171    1.5311    0.0000 H   0  0  0

+   -0.9028    1.3076    0.0000 H   0  0  0

+   -2.0135    1.2766    0.0000 H   0  0  0

+    1.7659   -1.2930    0.0000 H   0  0  0

+    2.3256    0.3764    0.0000 H   0  0  0

+   -2.4614   -0.8107    0.0000 H   0  0  0

+   -0.3312   -1.6013    0.0000 H   0  0  0

+   -0.6826   -2.8999    0.0000 H   0  0  0

+    0.6160   -3.2513    0.0000 H   0  0  0

+    0.9468   -3.5833    0.0000 H   0  0  0

+    2.2540   -3.9013    0.0000 H   0  0  0

+    2.5720   -2.5941    0.0000 H   0  0  0

+    3.6569    1.1709    0.0000 H   0  0  0

+    3.9716    2.4788    0.0000 H   0  0  0

+    2.6637    2.7935    0.0000 H   0  0  0

+    2.3206    2.5900    0.0000 H   0  0  0

+    1.0189    2.9299    0.0000 H   0  0  0

+    0.6790    1.6282    0.0000 H   0  0  0

+   -1.5995    1.0420    0.0000 H   0  0  0

+   -2.5310    2.0127    0.0000 H   0  0  0

+   -3.5017    1.0812    0.0000 H   0  0  0

+   -3.8168    1.2154    0.0000 H   0  0  0

+   -4.8582    0.3638    0.0000 H   0  0  0

+   -4.0066   -0.6776    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  1  0

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+  7 22  1  0

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+ 12 35  1  0

+ 12 36  1  0

+ 12 37  1  0

+ 13 38  1  0

+ 13 39  1  0

+ 13 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5907-38-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 41                          1 V2000

+   -3.5115    0.1439   -0.5169 N   0  0  0

+   -4.3485    1.2424   -0.2978 C   0  0  0

+   -2.6308   -0.3723    0.3640 C   0  0  0

+   -3.4425   -0.6209   -1.6889 N   0  0  0

+   -3.9094    2.5242   -0.6041 C   0  0  0

+   -5.6228    1.0537    0.2212 C   0  0  0

+   -1.9917   -1.4746   -0.2598 C   0  0  0

+   -2.4217    0.0345    1.4928 O   0  0  0

+   -2.5012   -1.6045   -1.5031 C   0  0  0

+   -4.2365   -0.4089   -2.9017 C   0  0  0

+   -4.7384    3.6068   -0.3865 C   0  0  0

+   -6.4471    2.1410    0.4364 C   0  0  0

+   -0.9994   -2.2937    0.3191 N   0  0  0

+   -2.1076   -2.6514   -2.5131 C   0  0  0

+   -6.0048    3.4160    0.1358 C   0  0  0

+    0.4177   -1.9938    0.0997 C   0  0  0

+   -1.3862   -3.4442    1.1395 C   0  0  0

+    0.8872   -0.5417    1.0803 S   0  0  0

+    0.4848   -0.6735    2.4367 O   0  0  0

+    2.1735   -0.0587    0.7177 O   0  0  0

+   -0.0411    0.5450    0.5570 O   0  0  0

+   10.9979    0.4295   -0.0368 O   0  0  0

+   19.5925    1.1884   -0.7823 Na  0  3  0

+   -2.9564    2.6797    0.0000 H   0  0  0

+   -5.9877    0.1597    0.0000 H   0  0  0

+   -3.9874    0.5240    0.0000 H   0  0  0

+   -5.1694   -0.1598    0.0000 H   0  0  0

+   -4.4856   -1.3418    0.0000 H   0  0  0

+   -4.3768    4.5021    0.0000 H   0  0  0

+   -7.4008    1.9897    0.0000 H   0  0  0

+   -3.0114   -2.9912    0.0000 H   0  0  0

+   -1.7678   -3.5552    0.0000 H   0  0  0

+   -1.2038   -2.3116    0.0000 H   0  0  0

+   -6.6218    4.1587    0.0000 H   0  0  0

+    0.4513   -2.9588    0.0000 H   0  0  0

+    1.3740   -2.1275    0.0000 H   0  0  0

+   -2.3014   -3.1365    0.0000 H   0  0  0

+   -1.6939   -4.3594    0.0000 H   0  0  0

+   -0.4710   -3.7519    0.0000 H   0  0  0

+   10.0323    0.4295    0.0000 H   0  0  0

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+   -0.6683    1.2792    0.0000 H   0  0  0

+  1  2  1  0

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+  7  9  2  0

+ 12 15  2  0

+  5 24  1  0

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+ 17 37  1  0

+ 17 38  1  0

+ 17 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+ 21 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87-84-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.2088   -0.9912   -0.7989 C   0  0  0

+   -1.5363   -0.2664    0.5081 C   0  0  0

+    0.2627   -1.4101   -0.7949 C   0  0  0

+   -2.2500   -2.4553   -0.9515 Cl  0  0  0

+   -0.6527    0.9760    0.6375 C   0  0  0

+   -3.4272    0.2719    0.5029 Br  0  0  0

+    1.1463   -0.1677   -0.6655 C   0  0  0

+    0.5974   -2.6133    0.7235 Br  0  0  0

+    0.8188    0.5570    0.6416 C   0  0  0

+   -0.9874    2.1791   -0.8809 Br  0  0  0

+    3.0372   -0.7060   -0.6602 Br  0  0  0

+    1.9541    2.1534    0.8079 Br  0  0  0

+   -0.4605   -0.1239    0.0000 H   0  0  0

+   -2.2846   -1.1337    0.0000 H   0  0  0

+    1.3910   -1.6078    0.0000 H   0  0  0

+   -1.7810    1.1737    0.0000 H   0  0  0

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+    0.0705   -0.3103    0.0000 H   0  0  0

+  1  2  1  0

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+  7 11  1  0

+  9 12  1  0

+  7  9  1  0

+  1 13  1  0

+  2 14  1  0

+  3 15  1  0

+  5 16  1  0

+  7 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+132335-20-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 43                          1 V2000

+   -0.2466    1.1289   -0.1073 C   0  0  0

+    0.4512   -0.0376   -0.0645 C   0  0  0

+    0.4827    2.4526   -0.1770 C   0  0  0

+   -1.6616    1.1435   -0.0943 C   0  0  0

+    1.9334   -0.0723   -0.0835 C   0  0  0

+   -0.2680   -1.3199    0.0028 C   0  0  0

+    2.0182    2.4343   -0.1907 C   0  0  0

+    1.2635    2.6390    1.0531 N   0  0  0

+   -2.3976   -0.0594   -0.0364 C   0  0  0

+   -2.3534    2.3657   -0.1389 C   0  0  0

+    2.6995    1.0868   -0.1429 C   0  0  0

+    2.5774   -1.3138   -0.0397 C   0  0  0

+   -1.6769   -1.3350    0.0227 C   0  0  0

+    0.4331   -2.5300    0.0470 C   0  0  0

+   -3.7938   -0.0182   -0.0247 C   0  0  0

+   -3.7166    2.3736   -0.1260 C   0  0  0

+    4.0768    1.0140   -0.1584 C   0  0  0

+    3.9541   -1.3777   -0.0562 C   0  0  0

+   -2.3551   -2.5544    0.0863 C   0  0  0

+   -0.2554   -3.7074    0.1086 C   0  0  0

+   -4.4367    1.1860   -0.0693 C   0  0  0

+    4.7059   -0.2176   -0.1149 C   0  0  0

+   -1.6447   -3.7204    0.1287 C   0  0  0

+   -0.1499    3.2834    0.0000 H   0  0  0

+    2.6779    3.2438    0.0000 H   0  0  0

+    1.2794    3.6831    0.0000 H   0  0  0

+   -1.8248    3.2663    0.0000 H   0  0  0

+    2.0145   -2.1933    0.0000 H   0  0  0

+    1.4774   -2.5321    0.0000 H   0  0  0

+   -4.3440   -0.9057    0.0000 H   0  0  0

+   -4.2264    3.2850    0.0000 H   0  0  0

+    4.6453    1.8900    0.0000 H   0  0  0

+    4.4314   -2.3065    0.0000 H   0  0  0

+   -3.3992   -2.5751    0.0000 H   0  0  0

+    0.2685   -4.6108    0.0000 H   0  0  0

+   -5.4806    1.2146    0.0000 H   0  0  0

+    5.7488   -0.2712    0.0000 H   0  0  0

+   -2.1519   -4.6332    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  6 14  1  0

+  9 15  1  0

+ 10 16  2  0

+ 11 17  1  0

+ 12 18  2  0

+ 13 19  1  0

+ 14 20  2  0

+ 15 21  2  0

+ 17 22  2  0

+ 19 23  2  0

+  7  8  1  0

+  7 11  1  0

+  9 13  1  0

+ 16 21  1  0

+ 18 22  1  0

+ 20 23  1  0

+  3 24  1  0

+  7 25  1  0

+  8 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3688-53-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.6409    1.2667   -0.0906 C   0  0  0

+   -0.7414    1.2900   -0.1267 C   0  0  0

+    1.4194    0.1630   -0.0227 O   0  0  0

+    1.4961    2.3928   -0.1243 C   0  0  0

+   -1.4731    0.0776   -0.0518 C   0  0  0

+    2.7057    0.5264   -0.0065 C   0  0  0

+    2.7891    1.9044   -0.0682 C   0  0  0

+   -2.8627    0.1041   -0.0412 C   0  0  0

+   -0.7549   -1.2198    0.0154 C   0  0  0

+    3.8580   -0.4005    0.0631 N   0  3  0

+   -3.7545   -0.4299   -1.0752 C   0  0  0

+   -3.6515    0.6220    0.9277 O   0  0  0

+   -0.7968   -1.9556    1.1438 N   0  0  0

+   -0.1295   -1.6183   -0.9466 O   0  0  0

+    4.9937    0.0394    0.0722 O   0  0  0

+    3.6398   -1.7985    0.1190 O   0  5  0

+   -5.0361   -0.1765   -0.6318 C   0  0  0

+   -4.9354    0.4663    0.5936 C   0  0  0

+   -1.2319    2.1763    0.0000 H   0  0  0

+    1.2161    3.3663    0.0000 H   0  0  0

+    3.6394    2.4549    0.0000 H   0  0  0

+   -3.5810   -1.4279    0.0000 H   0  0  0

+   -1.7014   -2.4114    0.0000 H   0  0  0

+    0.0502   -2.5111    0.0000 H   0  0  0

+   -5.8663   -0.7569    0.0000 H   0  0  0

+   -5.6391    1.1949    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  8 11  2  0

+  8 12  1  0

+  9 13  1  0

+  9 14  2  0

+ 10 15  2  0

+ 10 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+  6  7  2  0

+ 17 18  2  0

+  2 19  1  0

+  4 20  1  0

+  7 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+548-83-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.6402    0.4885    0.0099 C   0  0  0

+   -1.1315   -0.8217   -0.0274 C   0  0  0

+   -0.6896    1.6108    0.0450 C   0  0  0

+   -3.0244    0.7076    0.0190 C   0  0  0

+    0.2026   -1.0241   -0.0309 O   0  0  0

+   -2.0113   -1.8931   -0.0608 C   0  0  0

+    0.6954    1.2944    0.0389 C   0  0  0

+   -1.0756    2.7681    0.0785 O   0  0  0

+   -3.8848   -0.3736   -0.0089 C   0  0  0

+   -3.5162    1.9720    0.0555 O   0  0  0

+    1.0838   -0.0099    0.0005 C   0  0  0

+   -3.3788   -1.6685   -0.0572 C   0  0  0

+    1.6258    2.2866    0.0697 O   0  0  0

+    2.5263   -0.3217   -0.0054 C   0  0  0

+   -4.2331   -2.7230   -0.0900 O   0  0  0

+    3.1490   -0.7837    1.1564 C   0  0  0

+    3.2743   -0.1616   -1.1745 C   0  0  0

+    4.4976   -1.0736    1.1435 C   0  0  0

+    4.6217   -0.4553   -1.1728 C   0  0  0

+    5.2332   -0.9077   -0.0166 C   0  0  0

+   -1.6491   -2.8546    0.0000 H   0  0  0

+   -4.9008   -0.2202    0.0000 H   0  0  0

+   -3.8887    2.9296    0.0000 H   0  0  0

+    2.3286    3.0361    0.0000 H   0  0  0

+   -4.8799   -3.5214    0.0000 H   0  0  0

+    2.7253   -1.7198    0.0000 H   0  0  0

+    3.2762    0.8659    0.0000 H   0  0  0

+    4.5028   -2.1011    0.0000 H   0  0  0

+    5.0461    0.4804    0.0000 H   0  0  0

+    6.2386   -1.1194    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+ 11 14  1  0

+ 12 15  1  0

+ 14 16  2  0

+ 14 17  1  0

+ 16 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+  7 11  2  0

+  9 12  1  0

+ 19 20  1  0

+  6 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 13 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+148193-30-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -0.0886    0.1398    0.0025 C   0  0  0

+   -0.4616   -1.2239    0.0015 C   0  0  0

+    1.3502    0.3299    0.0002 C   0  0  0

+   -1.1355    1.0898    0.0001 C   0  0  0

+   -1.7813   -1.6233    0.0034 C   0  0  0

+    1.1026   -2.0579   -0.0023 S   0  0  0

+    2.1401   -0.7007   -0.0025 N   0  0  0

+    2.0147    1.9337    0.0015 Cl  0  0  0

+   -2.4466    0.6737   -0.0030 C   0  0  0

+   -2.7754   -0.6826    0.0063 C   0  0  0

+   -3.4701    1.6284   -0.0053 N   0  0  0

+   -0.9106    2.1206    0.0000 H   0  0  0

+   -2.0238   -2.6500    0.0000 H   0  0  0

+   -3.7871   -0.9818    0.0000 H   0  0  0

+   -3.2326    2.6563    0.0000 H   0  0  0

+   -4.4790    1.3201    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  9 11  1  0

+  6  7  1  0

+  9 10  1  0

+  4 12  1  0

+  5 13  1  0

+ 10 14  1  0

+ 11 15  1  0

+ 11 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96839-34-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.0001   -0.1241    0.1218 C   0  0  0

+   -1.1966    0.5650    0.0649 C   0  0  0

+    1.1977    0.5644    0.0643 C   0  0  0

+   -0.0004   -1.6254    0.2528 C   0  0  0

+   -1.1962    1.9428   -0.0495 C   0  0  0

+   -2.4787   -0.1722    0.1260 N   0  3  0

+    1.1981    1.9418   -0.0501 C   0  0  0

+    2.4793   -0.1736    0.1256 N   0  3  0

+   -0.0041   -2.2171   -1.0479 O   0  0  0

+    0.0010    2.6311   -0.1065 C   0  0  0

+   -3.2582   -0.1166   -0.8082 O   0  0  0

+   -2.7542   -0.8344    1.1105 O   0  5  0

+    2.7541   -0.8360    1.1101 O   0  0  0

+    3.2591   -0.1184   -0.8083 O   0  5  0

+    0.8933   -2.1465    0.0000 H   0  0  0

+    0.8967   -1.1102    0.0000 H   0  0  0

+   -2.0916    2.4610    0.0000 H   0  0  0

+    2.0938    2.4594    0.0000 H   0  0  0

+   -0.0106   -3.2516    0.0000 H   0  0  0

+    0.0013    3.6656    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+  8 14  1  0

+  7 10  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 51                          1 V2000

+    1.3694    1.3166    0.0999 C   0  0  0

+   -0.0764    0.8296    0.2157 C   0  0  0

+    2.3179    0.1177    0.1615 C   0  0  0

+   -1.0106    2.0105    0.1551 C   0  0  0

+    3.7636    0.6047    0.0457 C   0  0  0

+   -2.1622    1.9038   -0.4604 C   0  0  0

+    4.7121   -0.5942    0.1073 C   0  0  0

+   -3.1716    0.8846    0.0013 C   0  0  0

+    6.1579   -0.1072   -0.0085 C   0  0  0

+   -4.4413    1.5851    0.4113 C   0  0  0

+    7.1064   -1.3061    0.0531 C   0  0  0

+   -5.5674    1.3104   -0.1990 C   0  0  0

+    8.5305   -0.8264   -0.0610 C   0  0  0

+   -6.1103   -0.0953   -0.1820 C   0  0  0

+    9.5407   -1.7098   -0.0311 O   0  0  0

+    8.7629    0.3533   -0.1794 O   0  0  0

+   -7.6364   -0.0514   -0.0821 C   0  0  0

+   -8.1875   -1.4786   -0.0648 C   0  0  0

+   -9.7136   -1.4348    0.0351 C   0  0  0

+  -10.2648   -2.8620    0.0523 C   0  0  0

+    2.3421    1.9190    0.0000 H   0  0  0

+    0.8824    2.3519    0.0000 H   0  0  0

+   -1.0491    0.2272    0.0000 H   0  0  0

+    0.4106   -0.2057    0.0000 H   0  0  0

+    1.3452   -0.4847    0.0000 H   0  0  0

+    2.8049   -0.9176    0.0000 H   0  0  0

+   -0.5602    3.0623    0.0000 H   0  0  0

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+    3.2766    1.6400    0.0000 H   0  0  0

+   -2.6509    2.9383    0.0000 H   0  0  0

+    3.7394   -1.1966    0.0000 H   0  0  0

+    5.1991   -1.6295    0.0000 H   0  0  0

+   -3.8141   -0.0621    0.0000 H   0  0  0

+   -2.2880    0.1577    0.0000 H   0  0  0

+    7.1306    0.4952    0.0000 H   0  0  0

+    5.6709    0.9281    0.0000 H   0  0  0

+   -4.2902    2.7192    0.0000 H   0  0  0

+    6.1337   -1.9085    0.0000 H   0  0  0

+    7.5934   -2.3414    0.0000 H   0  0  0

+   -6.3225    2.1700    0.0000 H   0  0  0

+   -6.2723   -1.2279    0.0000 H   0  0  0

+   -5.0032   -0.3842    0.0000 H   0  0  0

+   10.4020   -2.4630    0.0000 H   0  0  0

+   -7.4745    1.0812    0.0000 H   0  0  0

+   -8.7435    0.2375    0.0000 H   0  0  0

+   -8.3494   -2.6112    0.0000 H   0  0  0

+   -7.0804   -1.7675    0.0000 H   0  0  0

+   -9.5517   -0.3022    0.0000 H   0  0  0

+  -10.8207   -1.1459    0.0000 H   0  0  0

+  -11.3321   -2.4498    0.0000 H   0  0  0

+  -10.6770   -3.9293    0.0000 H   0  0  0

+   -9.1975   -3.2742    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  2  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 13 16  2  0

+ 14 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+  1 21  1  0

+  1 22  1  0

+  2 23  1  0

+  2 24  1  0

+  3 25  1  0

+  3 26  1  0

+  4 27  1  0

+  5 28  1  0

+  5 29  1  0

+  6 30  1  0

+  7 31  1  0

+  7 32  1  0

+  8 33  1  0

+  8 34  1  0

+  9 35  1  0

+  9 36  1  0

+ 10 37  1  0

+ 11 38  1  0

+ 11 39  1  0

+ 12 40  1  0

+ 14 41  1  0

+ 14 42  1  0

+ 15 43  1  0

+ 17 44  1  0

+ 17 45  1  0

+ 18 46  1  0

+ 18 47  1  0

+ 19 48  1  0

+ 19 49  1  0

+ 20 50  1  0

+ 20 51  1  0

+ 20 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129176-05-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -0.6941    0.9505   -0.4950 C   0  0  1

+   -2.2141    0.7756   -0.5053 C   0  0  2

+   -1.5324    1.4820    0.5331 O   0  0  0

+   -0.0358   -0.3390   -0.0004 C   0  0  0

+   -2.6323   -0.8814    0.0693 Cl  0  0  0

+    1.9173   -0.1143    0.0129 Br  0  0  0

+    0.1314    1.7025    0.0000 H   0  0  0

+   -3.1901    1.3182    0.0000 H   0  0  0

+   -1.0837   -0.7249    0.0000 H   0  0  0

+    0.2228   -1.4253    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  4  6  1  0

+  2  3  1  0

+  1  7  1  0

+  2  8  1  0

+  4  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+116-66-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+   -0.9413   -0.0235   -0.0292 C   0  0  0

+   -0.4182   -1.3033   -0.0164 C   0  0  0

+   -0.0906    1.0688   -0.0218 C   0  0  0

+   -2.4533   -0.0893   -0.0565 C   0  0  0

+   -1.5431   -2.3160   -0.0283 C   0  0  0

+    0.9540   -1.4867    0.0038 C   0  0  0

+    1.2783    0.8837   -0.0018 C   0  0  0

+   -0.6495    2.4392   -0.0360 N   0  3  0

+   -2.7871   -1.5297   -0.4991 C   0  0  0

+   -3.0218    0.1830    1.3376 C   0  0  0

+   -3.0104    0.9183   -1.0643 C   0  0  0

+   -1.2315   -3.4440   -1.0139 C   0  0  0

+   -1.7612   -2.8839    1.3755 C   0  0  0

+    1.8012   -0.3956    0.0111 C   0  0  0

+    2.2005    2.0756    0.0062 C   0  0  0

+   -1.0320    2.9517    1.0007 O   0  0  0

+   -0.7270    3.0546   -1.0843 O   0  5  0

+    3.2676   -0.5963    0.0330 N   0  3  0

+    3.8299   -1.0848   -0.9307 O   0  0  0

+    3.9119   -0.2730    1.0148 O   0  5  0

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+ 15 36  1  0

+ 15 37  1  0

+ 15 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+502-65-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 96 95                          1 V2000

+   -7.7656    0.8277   -0.4913 C   0  0  0

+   -6.6313    0.0679   -0.4971 C   0  0  0

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+ 40 96  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+578-67-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.4839    0.8911   -0.0026 C   0  0  0

+    0.0111   -0.4366   -0.0016 C   0  0  0

+    0.4277    1.9610   -0.0019 C   0  0  0

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+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+20153-98-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 87 89                          1 V2000

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+ 43 87  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+28124-29-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.4018    0.3861   -0.0030 C   0  0  0

+   -1.1395   -1.0574   -0.0015 C   0  0  0

+   -0.3941    1.2495   -0.0029 N   0  0  0

+   -2.7486    0.8321    0.0014 C   0  0  0

+    0.1115   -1.5100   -0.0001 N   0  0  0

+   -2.2343   -1.9457   -0.0012 C   0  0  0

+    0.8555    0.8003   -0.0015 C   0  0  0

+   -3.7590   -0.0863    0.0069 C   0  0  0

+   -3.0372    2.1934    0.0006 N   0  0  0

+    1.1211   -0.6441   -0.0001 C   0  0  0

+   -3.5017   -1.4547   -0.0022 C   0  0  0

+    1.9500    1.6937   -0.0009 C   0  0  0

+    2.4576   -1.0879    0.0010 C   0  0  0

+    3.2144    1.2061    0.0010 C   0  0  0

+    3.4709   -0.1736    0.0006 C   0  0  0

+    4.7903   -0.6202    0.0021 N   0  0  0

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+    4.9949   -1.6439    0.0000 H   0  0  0

+    5.5746    0.0688    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83905-01-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+124126                          1 V2000

+    0.2188    1.4917    1.0080 C   0  0  1

+   -0.5567    0.2550    0.4697 C   0  0  2

+    0.7352    2.1375   -0.2006 O   0  0  0

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+   -0.9555   -1.9328    1.6450 C   0  0  2

+    2.7521    2.9659   -1.2437 C   0  0  1

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+ 52124  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146795-43-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -1.6085    0.0985    0.0667 C   0  0  0

+   -2.8906    0.7554    0.0190 C   0  0  0

+   -0.3531    0.8655    0.1082 C   0  0  0

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+    2.0241    0.9431    0.0618 C   0  0  0

+   -6.2783   -0.4823   -0.0944 O   0  0  0

+   -5.7066    1.5484   -0.0817 O   0  5  0

+    3.2385    0.2729   -0.0250 C   0  0  0

+    1.9987    2.3312    0.0529 C   0  0  0

+    4.4162    0.9897   -0.1142 C   0  0  0

+    3.2789   -1.6177   -0.0218 Br  0  0  0

+    3.1800    3.0418   -0.0366 C   0  0  0

+    4.3871    2.3725   -0.1171 C   0  0  0

+   -2.9694    1.7897    0.0000 H   0  0  0

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+ 14 22  1  0

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+ 17 24  1  0

+ 18 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2855-19-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 37                          1 V2000

+   -4.9741    0.3536   -0.4055 C   0  0  0

+   -6.2286   -0.4955   -0.1907 C   0  0  0

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+ 13 35  1  0

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+ 13 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115-86-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+    0.0307   -1.1407    0.1899 P   0  0  0

+   -1.2725   -2.0800    0.2966 O   0  0  0

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+   -2.3464   -1.2949    0.0188 C   0  0  0

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+   -3.1553   -0.8343    1.0478 C   0  0  0

+   -1.2559    1.8158    0.6467 C   0  0  0

+    1.1280    1.7761    0.3582 C   0  0  0

+    3.1394   -0.6812    1.0939 C   0  0  0

+    2.7706   -0.9562   -1.2632 C   0  0  0

+   -3.7314   -0.1588   -1.5742 C   0  0  0

+   -4.2461   -0.0364    0.7628 C   0  0  0

+   -1.3042    3.0624    0.0530 C   0  0  0

+    1.0744    3.0225   -0.2346 C   0  0  0

+    4.2132    0.1460    0.8266 C   0  0  0

+    3.8449   -0.1285   -1.5251 C   0  0  0

+   -4.5324    0.3035   -0.5467 C   0  0  0

+   -0.1409    3.6640   -0.3898 C   0  0  0

+    4.5639    0.4244   -0.4813 C   0  0  0

+   -2.0053   -0.2688    0.0000 H   0  0  0

+   -3.6638   -1.6197    0.0000 H   0  0  0

+   -2.0486    1.3187    0.0000 H   0  0  0

+    1.9383    1.3083    0.0000 H   0  0  0

+    3.7078   -1.4245    0.0000 H   0  0  0

+    2.1990   -0.2155    0.0000 H   0  0  0

+   -3.2208    0.6252    0.0000 H   0  0  0

+   -4.8847   -0.7203    0.0000 H   0  0  0

+   -2.1127    3.5333    0.0000 H   0  0  0

+    1.8651    3.5227    0.0000 H   0  0  0

+    4.7896   -0.5910    0.0000 H   0  0  0

+    3.2742    0.6130    0.0000 H   0  0  0

+   -5.2498    0.9042    0.0000 H   0  0  0

+   -0.1370    4.5997    0.0000 H   0  0  0

+    5.3012    1.0005    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  2  0

+  6 10  1  0

+  7 11  2  0

+  7 12  1  0

+  8 13  2  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  2  0

+ 11 17  1  0

+ 12 18  2  0

+ 13 19  1  0

+ 14 20  2  0

+ 15 21  2  0

+ 17 22  2  0

+ 19 23  2  0

+ 16 21  1  0

+ 18 22  1  0

+ 20 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58-90-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.0577   -1.0786   -0.0023 C   0  0  0

+   -1.2913   -0.7543   -0.0015 C   0  0  0

+    1.0095   -0.0741   -0.0015 C   0  0  0

+    0.5511   -2.7430    0.0030 Cl  0  0  0

+   -1.6830    0.5773    0.0000 C   0  0  0

+   -2.2283   -1.7396   -0.0028 O   0  0  0

+    0.6159    1.2532    0.0001 C   0  0  0

+    2.6977   -0.4785   -0.0018 Cl  0  0  0

+   -0.7291    1.5779    0.0009 C   0  0  0

+   -3.3702    0.9861    0.0004 Cl  0  0  0

+    1.8115    2.5119    0.0011 Cl  0  0  0

+   -2.9454   -2.4936    0.0000 H   0  0  0

+   -1.0229    2.5761    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  5 10  1  0

+  7 11  1  0

+  7  9  1  0

+  6 12  1  0

+  9 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+68299-98-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -1.5739   -0.8925    0.0221 N   0  0  0

+   -2.5039    0.0696    0.1832 C   0  0  0

+   -1.9719   -2.2410   -0.1458 O   0  0  0

+   -0.2148   -0.5579    0.0150 C   0  0  0

+   -2.8713    0.9637   -0.9730 C   0  0  0

+   -3.0452    0.2158    1.2587 O   0  0  0

+    0.5388   -0.7342   -1.1378 C   0  0  0

+    0.3810   -0.0436    1.1593 C   0  0  0

+   -3.8713    1.8953   -0.5557 O   0  0  0

+    1.8799   -0.4032   -1.1421 C   0  0  0

+    1.7221    0.2857    1.1496 C   0  0  0

+    2.4723    0.1036    0.0009 C   0  0  0

+    4.1580    0.5185   -0.0079 Cl  0  0  0

+   -2.2560   -3.2035    0.0000 H   0  0  0

+   -1.8678    0.9737    0.0000 H   0  0  0

+   -2.5084    1.8994    0.0000 H   0  0  0

+    0.5449   -1.7378    0.0000 H   0  0  0

+   -0.0793    0.8482    0.0000 H   0  0  0

+   -4.6056    2.5794    0.0000 H   0  0  0

+    2.3387   -1.2958    0.0000 H   0  0  0

+    1.7208    1.2893    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  2  2  0

+  7  4  2  0

+  8  4  1  0

+  9  5  1  0

+ 10  7  1  0

+ 11  8  2  0

+ 12 10  2  0

+ 13 12  1  0

+ 11 12  1  0

+  3 14  1  0

+  5 15  1  0

+  5 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+581-47-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.6939   -0.0113   -0.0061 C   0  0  0

+   -0.7899   -0.0146   -0.0072 C   0  0  0

+    1.4095    1.1129   -0.4264 C   0  0  0

+    1.4140   -1.1306    0.4209 C   0  0  0

+   -1.4778   -1.1587   -0.4051 C   0  0  0

+   -1.4502    1.0701    0.3758 N   0  0  0

+    2.7892    1.0736   -0.4089 C   0  0  0

+    2.7931   -1.0850    0.4063 C   0  0  0

+   -2.8621   -1.1470   -0.4005 C   0  0  0

+   -2.7669    1.1082    0.3898 C   0  0  0

+    3.4305   -0.0051   -0.0031 N   0  0  0

+   -3.5131    0.0102    0.0024 C   0  0  0

+    0.9417    1.9947    0.0000 H   0  0  0

+    0.9504   -2.0146    0.0000 H   0  0  0

+   -0.9901   -2.0296    0.0000 H   0  0  0

+    3.2951    1.9341    0.0000 H   0  0  0

+    3.3023   -1.9436    0.0000 H   0  0  0

+   -3.3697   -2.0065    0.0000 H   0  0  0

+   -3.2212    1.9970    0.0000 H   0  0  0

+   -4.5104    0.0523    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  1  0

+  7 11  2  0

+  9 12  1  0

+  8 11  1  0

+ 10 12  2  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -0.7007    0.2352    0.5927 C   0  0  0

+    0.0894   -1.0247    0.3156 C   0  0  0

+   -0.1054    1.3763   -0.2388 C   0  0  0

+   -2.1613    0.0197    0.1912 C   0  0  0

+    1.5960   -0.9679    0.4388 C   0  0  0

+   -0.4682   -2.0494    0.0037 O   0  0  0

+    1.3909    1.4931    0.0563 C   0  0  0

+   -2.9677    1.2816    0.5045 C   0  0  0

+   -2.2397   -0.2765   -1.3078 C   0  0  0

+    2.1080    0.2168   -0.3871 C   0  0  0

+    3.6141    0.3766   -0.1704 C   0  0  0

+   -1.3425    1.1376    0.0000 H   0  0  0

+    0.0143    2.4771    0.0000 H   0  0  0

+   -1.1650    1.6978    0.0000 H   0  0  0

+   -3.2553   -0.1512    0.0000 H   0  0  0

+    1.4735   -2.0684    0.0000 H   0  0  0

+    2.6663   -1.2519    0.0000 H   0  0  0

+    2.4244    1.8907    0.0000 H   0  0  0

+    1.1465    2.5731    0.0000 H   0  0  0

+   -2.0346    1.8779    0.0000 H   0  0  0

+   -3.5640    2.2147    0.0000 H   0  0  0

+   -3.9008    0.6853    0.0000 H   0  0  0

+   -3.3101    0.0068    0.0000 H   0  0  0

+   -2.5230   -1.3469    0.0000 H   0  0  0

+   -1.1693   -0.5598    0.0000 H   0  0  0

+    1.0022    0.1593    0.0000 H   0  0  0

+    3.7309   -0.7245    0.0000 H   0  0  0

+    4.7152    0.4934    0.0000 H   0  0  0

+    3.4973    1.4777    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+ 10 11  1  0

+  7 10  1  0

+  1 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1635-63-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 42                          1 V2000

+    1.6635    0.8545   -1.2648 N   0  0  0

+    2.1023    2.2483   -1.4153 C   0  0  0

+    1.4912    0.5773    0.3862 P   0  0  0

+    2.8731    1.0154    1.2411 N   0  0  0

+    0.2116    1.2403    0.9612 N   0  0  0

+    1.0244   -0.9596    0.7102 N   0  0  0

+    3.6305   -0.2202    1.4811 C   0  0  0

+   -1.2466    0.9709    0.2641 P   0  0  0

+   -0.1960   -1.5799   -0.0201 P   0  0  0

+   -2.4788    1.8398    1.0118 N   0  0  0

+   -1.2150    1.2350   -1.3978 N   0  0  0

+   -1.2958   -0.5389    0.6186 N   0  0  0

+   -0.0790   -1.4311   -1.6924 N   0  0  0

+   -0.4746   -3.1724    0.4478 N   0  0  0

+   -3.6760    0.9892    0.9776 C   0  0  0

+   -1.5842    2.6411   -1.6088 C   0  0  0

+    1.0530   -2.2678   -2.1124 C   0  0  0

+   -1.9185   -3.4060    0.3113 C   0  0  0

+    2.6569    0.3982    0.0000 H   0  0  0

+    3.1450    1.9200    0.0000 H   0  0  0

+    2.4306    3.2910    0.0000 H   0  0  0

+    1.0596    2.5766    0.0000 H   0  0  0

+    3.2550    2.0396    0.0000 H   0  0  0

+    2.6985   -0.7915    0.0000 H   0  0  0

+    4.2018   -1.1522    0.0000 H   0  0  0

+    4.5625    0.3511    0.0000 H   0  0  0

+   -2.4807    2.9329    0.0000 H   0  0  0

+   -0.1245    1.3102    0.0000 H   0  0  0

+   -0.2250   -0.3478    0.0000 H   0  0  0

+    0.2934   -3.9503    0.0000 H   0  0  0

+   -4.3091    1.8803    0.0000 H   0  0  0

+   -4.5671    0.3561    0.0000 H   0  0  0

+   -3.0429    0.0981    0.0000 H   0  0  0

+   -0.5269    2.9187    0.0000 H   0  0  0

+   -1.8618    3.6984    0.0000 H   0  0  0

+   -2.6415    2.3635    0.0000 H   0  0  0

+    0.4033   -3.1469    0.0000 H   0  0  0

+    1.9321   -2.9175    0.0000 H   0  0  0

+    1.7027   -1.3887    0.0000 H   0  0  0

+   -2.0931   -2.3269    0.0000 H   0  0  0

+   -2.9976   -3.5806    0.0000 H   0  0  0

+   -1.7439   -4.4851    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  5  1  0

+  9  6  2  0

+ 10  8  1  0

+ 11  8  1  0

+ 12  8  2  0

+ 13  9  1  0

+ 14  9  1  0

+ 15 10  1  0

+ 16 11  1  0

+ 17 13  1  0

+ 18 14  1  0

+  9 12  1  0

+  1 19  1  0

+  2 20  1  0

+  2 21  1  0

+  2 22  1  0

+  4 23  1  0

+  7 24  1  0

+  7 25  1  0

+  7 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 16 36  1  0

+ 17 37  1  0

+ 17 38  1  0

+ 17 39  1  0

+ 18 40  1  0

+ 18 41  1  0

+ 18 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+62-50-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.6476   -0.5483   -0.3806 O   0  0  0

+   -0.7001    0.0161    0.0457 S   0  0  0

+    1.6485    0.3001    0.1858 C   0  0  0

+   -1.1016    1.1787   -1.2875 C   0  0  0

+   -1.5439   -1.1268    0.0157 O   0  0  0

+   -0.3894    0.6938    1.2555 O   0  0  0

+    3.0348   -0.2145   -0.2068 C   0  0  0

+    2.1632    1.1863    0.0000 H   0  0  0

+    0.8627    0.9579    0.0000 H   0  0  0

+   -0.1330    1.5132    0.0000 H   0  0  0

+   -1.4361    2.1473    0.0000 H   0  0  0

+   -2.0702    0.8442    0.0000 H   0  0  0

+    2.6782   -1.1752    0.0000 H   0  0  0

+    3.9955   -0.5711    0.0000 H   0  0  0

+    3.3914    0.7462    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+59-89-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.5548   -0.2864    0.2093 N   0  0  0

+    0.4280   -1.3774    0.3265 C   0  0  0

+   -0.0812    1.0844    0.4669 C   0  0  0

+   -1.7817   -0.5218   -0.1119 N   0  0  0

+    1.6938   -0.9634   -0.4318 C   0  0  0

+    1.2278    1.2901   -0.3033 C   0  0  0

+   -2.5749    0.3981   -0.2022 O   0  0  0

+    2.1674    0.2843    0.0732 O   0  0  0

+   -0.4005   -1.9372    0.0000 H   0  0  0

+    0.8675   -2.2755    0.0000 H   0  0  0

+   -0.0742    2.0843    0.0000 H   0  0  0

+   -1.0667    1.2534    0.0000 H   0  0  0

+    1.7835   -1.9592    0.0000 H   0  0  0

+    2.6844   -1.0994    0.0000 H   0  0  0

+    2.0787    1.8152    0.0000 H   0  0  0

+    0.8808    2.2279    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3333-52-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    0.4957    0.5827    0.0000 C   0  0  0

+   -0.4957   -0.5827    0.0000 C   0  0  0

+    1.8707    0.0571    0.0000 C   0  0  0

+    0.2769    1.4385   -1.2492 C   0  0  0

+    0.2769    1.4384    1.2493 C   0  0  0

+   -1.8707   -0.0571    0.0000 C   0  0  0

+   -0.2769   -1.4384   -1.2493 C   0  0  0

+   -0.2769   -1.4385    1.2492 C   0  0  0

+    2.9318   -0.3485    0.0000 N   0  0  0

+   -2.9318    0.3485    0.0000 N   0  0  0

+    1.1023    1.6495    0.0000 H   0  0  0

+    0.0659    2.2639    0.0000 H   0  0  0

+   -0.5485    1.2275    0.0000 H   0  0  0

+    1.1023    1.6495    0.0000 H   0  0  0

+    0.0658    2.2638    0.0000 H   0  0  0

+   -0.5485    1.2273    0.0000 H   0  0  0

+   -1.1023   -1.6495    0.0000 H   0  0  0

+   -0.0658   -2.2638    0.0000 H   0  0  0

+    0.5485   -1.2273    0.0000 H   0  0  0

+   -1.1023   -1.6495    0.0000 H   0  0  0

+   -0.0659   -2.2639    0.0000 H   0  0  0

+    0.5485   -1.2275    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  3  0

+  6 10  3  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+  7 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+159394-73-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    1.3367   -0.3746    0.0071 C   0  0  0

+    2.1800   -1.4895    0.0064 C   0  0  0

+    1.8877    0.9096    0.0039 C   0  0  0

+   -0.1259   -0.5527    0.0049 C   0  0  0

+    3.5478   -1.3150    0.0027 C   0  0  0

+    3.2579    1.0684    0.0003 C   0  0  0

+   -0.9335    0.5214    0.0055 C   0  0  0

+    4.0862   -0.0399   -0.0003 C   0  0  0

+   -2.3947    0.3436    0.0033 C   0  0  0

+    5.5557    0.1390   -0.0038 N   0  3  0

+   -3.2357    1.4617    0.0039 C   0  0  0

+   -2.9430   -0.9440   -0.0052 C   0  0  0

+    6.0328    1.2596   -0.0065 O   0  0  0

+    6.2877   -0.8345   -0.0040 O   0  5  0

+   -4.5915    1.2962    0.0020 C   0  0  0

+   -4.2985   -1.1086   -0.0072 C   0  0  0

+   -5.1390    0.0095   -0.0007 C   0  0  0

+   -6.5605   -0.1635   -0.0028 C   0  0  0

+   -7.6882   -0.3008   -0.0045 N   0  0  0

+    1.7756   -2.4510    0.0000 H   0  0  0

+    1.2644    1.7460    0.0000 H   0  0  0

+   -0.5345   -1.5124    0.0000 H   0  0  0

+    4.1783   -2.1460    0.0000 H   0  0  0

+    3.6706    2.0263    0.0000 H   0  0  0

+   -0.5249    1.4811    0.0000 H   0  0  0

+   -2.8274    2.4215    0.0000 H   0  0  0

+   -2.3163   -1.7778    0.0000 H   0  0  0

+   -5.2186    2.1297    0.0000 H   0  0  0

+   -4.7073   -2.0682    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 10 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 15 17  2  0

+ 17 18  1  0

+ 18 19  3  0

+  6  8  2  0

+ 16 17  1  0

+  2 20  1  0

+  3 21  1  0

+  4 22  1  0

+  5 23  1  0

+  6 24  1  0

+  7 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1982-67-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    2.2841   -0.1110    0.0156 S   0  0  0

+    0.7472    0.5986   -0.6362 C   0  0  0

+    3.6327    0.8222   -0.7595 C   0  0  0

+    2.3216    0.2093    1.4739 N   0  0  0

+    2.3895   -1.5247   -0.0824 O   0  0  0

+   -0.4507   -0.1353   -0.0300 C   0  0  0

+   -1.7470    0.4633   -0.5797 C   0  0  0

+   -2.9268   -0.2596    0.0174 C   0  0  0

+   -1.8163    1.8878   -0.2279 N   0  0  0

+   -3.4309   -1.3423   -0.5954 O   0  0  0

+   -3.4190    0.1354    1.0477 O   0  0  0

+    1.3697    1.4546    0.0000 H   0  0  0

+    0.0289    1.3760    0.0000 H   0  0  0

+    4.2350   -0.0482    0.0000 H   0  0  0

+    4.5031    1.4245    0.0000 H   0  0  0

+    3.0304    1.6926    0.0000 H   0  0  0

+    2.4447    1.2605    0.0000 H   0  0  0

+   -1.0732   -0.9913    0.0000 H   0  0  0

+    0.2675   -0.9127    0.0000 H   0  0  0

+   -1.6851   -0.5933    0.0000 H   0  0  0

+   -0.9265    2.4609    0.0000 H   0  0  0

+   -2.7576    2.3718    0.0000 H   0  0  0

+   -3.8776   -2.3018    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  6  7  1  0

+  7  8  1  0

+  7  9  1  0

+  8 10  1  0

+  8 11  2  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18829-55-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.7769   -0.8377   -0.1657 C   0  0  0

+   -0.5317   -0.4819    0.4915 C   0  0  0

+    1.8567    0.1504    0.2801 C   0  0  0

+   -1.5923   -0.1730   -0.2574 C   0  0  0

+    3.1853   -0.2109   -0.3871 C   0  0  0

+   -2.8624    0.1723    0.3804 C   0  0  0

+    4.2651    0.7772    0.0586 C   0  0  0

+   -3.8265    0.4531   -0.3005 O   0  0  0

+    0.3313   -1.7519    0.0000 H   0  0  0

+    1.5917   -1.4464    0.0000 H   0  0  0

+   -0.8073   -1.4609    0.0000 H   0  0  0

+    2.3024    1.0646    0.0000 H   0  0  0

+    1.0419    0.7591    0.0000 H   0  0  0

+   -1.3167    0.8060    0.0000 H   0  0  0

+    2.7396   -1.1251    0.0000 H   0  0  0

+    4.0001   -0.8196    0.0000 H   0  0  0

+   -3.1380   -0.8067    0.0000 H   0  0  0

+    4.9517    0.0269    0.0000 H   0  0  0

+    5.0154    1.4638    0.0000 H   0  0  0

+    3.5785    1.5275    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  2  0

+  1  9  1  0

+  1 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  7 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+820-75-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.1123   -0.2863    0.0000 N   0  0  0

+   -0.9839    0.6857    0.0000 C   0  0  0

+    1.3909    0.1399    0.0000 C   0  0  0

+   -2.3024   -0.0441    0.0000 C   0  0  0

+    2.4397   -0.7902    0.0000 C   0  0  0

+    1.6352    1.3338    0.0000 O   0  0  0

+   -3.4572    0.6508    0.0000 N   0  0  0

+   -2.3243   -1.2567    0.0000 O   0  0  0

+    3.6256   -0.3949    0.0000 N   0  3  0

+   -4.6523   -0.0107    0.0000 N   0  0  0

+    4.6919   -0.0395    0.0000 N   0  5  0

+   -0.0903   -1.2766    0.0000 H   0  0  0

+   -0.2321    1.3614    0.0000 H   0  0  0

+   -1.5702    1.5091    0.0000 H   0  0  0

+    2.2370   -1.7805    0.0000 H   0  0  0

+   -3.4389    1.6615    0.0000 H   0  0  0

+   -5.5184    0.5104    0.0000 H   0  0  0

+   -4.6706   -1.0214    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+  9 11  2  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  5 15  1  0

+  7 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+41044-12-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 50                          1 V2000

+    2.7907   -0.5912    2.3047 C   0  0  0

+    3.1953   -0.1747    0.9597 N   0  0  0

+    2.3654    0.0421   -0.1085 C   0  0  0

+    4.4852    0.0788    0.5328 C   0  0  0

+    3.0728    0.4052   -1.1526 N   0  0  0

+    0.8986   -0.1096   -0.0881 C   0  0  0

+    4.3863    0.4461   -0.8210 C   0  0  0

+    5.7286    0.0366    1.1475 C   0  0  0

+    0.0614    0.9943   -0.1523 C   0  0  0

+    0.2703   -1.4395   -0.0051 C   0  0  0

+    5.5471    0.7657   -1.5329 C   0  0  0

+    6.8596    0.3555    0.4253 C   0  0  0

+   -1.3381    0.7848   -0.0943 C   0  0  0

+    0.8554   -2.4397   -0.3772 O   0  0  0

+   -0.9850   -1.5056    0.5024 O   0  0  0

+    6.7622    0.7188   -0.9104 C   0  0  0

+   -1.8432   -0.4949    0.2110 C   0  0  0

+   -2.2276    1.8417   -0.3459 C   0  0  0

+   -3.2104   -0.7080    0.2241 C   0  0  0

+   -3.5715    1.6181   -0.3229 C   0  0  0

+   -4.0741    0.3455   -0.0440 C   0  0  0

+   -5.4481    0.1318   -0.0352 N   0  0  0

+   -6.1633   -0.0880   -1.2947 C   0  0  0

+   -6.1805    0.1266    1.2336 C   0  0  0

+   -5.7744   -1.4510   -1.8708 C   0  0  0

+   -6.5563    1.5608    1.6114 C   0  0  0

+    2.0835    0.0958    0.0000 H   0  0  0

+    2.1037   -1.2984    0.0000 H   0  0  0

+    3.4979   -1.2782    0.0000 H   0  0  0

+    5.8471   -0.9422    0.0000 H   0  0  0

+    0.4332    1.9074    0.0000 H   0  0  0

+    5.4339    1.7451    0.0000 H   0  0  0

+    7.7167   -0.1318    0.0000 H   0  0  0

+    7.3773    1.4893    0.0000 H   0  0  0

+   -1.8866    2.7668    0.0000 H   0  0  0

+   -3.5621   -1.6291    0.0000 H   0  0  0

+   -4.1913    2.3849    0.0000 H   0  0  0

+   -6.4466    0.8564    0.0000 H   0  0  0

+   -7.1095   -0.3649    0.0000 H   0  0  0

+   -7.1517   -0.0433    0.0000 H   0  0  0

+   -6.0917   -0.8553    0.0000 H   0  0  0

+   -6.7225   -1.7215    0.0000 H   0  0  0

+   -5.5039   -2.3991    0.0000 H   0  0  0

+   -4.8263   -1.1805    0.0000 H   0  0  0

+   -5.6026    1.8107    0.0000 H   0  0  0

+   -6.8062    2.5145    0.0000 H   0  0  0

+   -7.5100    1.3109    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  9  6  2  0

+ 10  6  1  0

+ 11  7  1  0

+ 12  8  2  0

+ 13  9  1  0

+ 14 10  2  0

+ 15 10  1  0

+ 16 11  2  0

+ 17 13  2  0

+ 18 13  1  0

+ 19 17  1  0

+ 20 18  2  0

+ 21 19  2  0

+ 22 21  1  0

+ 23 22  1  0

+ 24 22  1  0

+ 25 23  1  0

+ 26 24  1  0

+  5  7  1  0

+ 12 16  1  0

+ 15 17  1  0

+ 20 21  1  0

+  1 27  1  0

+  1 28  1  0

+  1 29  1  0

+  8 30  1  0

+  9 31  1  0

+ 11 32  1  0

+ 12 33  1  0

+ 16 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+ 23 38  1  0

+ 23 39  1  0

+ 24 40  1  0

+ 24 41  1  0

+ 25 42  1  0

+ 25 43  1  0

+ 25 44  1  0

+ 26 45  1  0

+ 26 46  1  0

+ 26 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19600-63-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -2.5097   -0.0312   -0.5639 C   0  0  0

+   -3.7217   -0.7285    0.0573 C   0  0  0

+   -3.4032    0.6380    0.3283 O   0  0  0

+   -1.2438   -0.4386    0.1925 C   0  0  0

+   -0.0319    0.2587   -0.4287 C   0  0  0

+    1.2341   -0.1487    0.3278 C   0  0  0

+    2.4460    0.5486   -0.2934 C   0  0  0

+    3.6930    0.1473    0.4517 C   0  0  0

+    4.6677   -0.4577   -0.1806 C   0  0  0

+   -2.0517    0.8549    0.0000 H   0  0  0

+   -4.7189   -0.7498    0.0000 H   0  0  0

+   -3.4540   -1.6894    0.0000 H   0  0  0

+   -1.7712   -1.2852    0.0000 H   0  0  0

+   -0.5509   -1.1561    0.0000 H   0  0  0

+    0.4955    1.1053    0.0000 H   0  0  0

+   -0.7248    0.9762    0.0000 H   0  0  0

+    0.7067   -0.9953    0.0000 H   0  0  0

+    1.9270   -0.8662    0.0000 H   0  0  0

+    2.9734    1.3952    0.0000 H   0  0  0

+    1.7531    1.2661    0.0000 H   0  0  0

+    4.1119    1.0525    0.0000 H   0  0  0

+    4.6359   -1.4546    0.0000 H   0  0  0

+    5.5470    0.0132    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  2  0

+  2  3  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102-28-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.1133    0.5706   -0.2925 C   0  0  0

+    0.5548   -0.6413   -0.3936 C   0  0  0

+    0.5784    1.7138    0.0872 C   0  0  0

+   -1.4811    0.6423   -0.5783 N   0  0  0

+    1.9125   -0.7071   -0.1148 C   0  0  0

+    1.9305    1.6453    0.3641 C   0  0  0

+   -2.3469   -0.1669    0.0636 C   0  0  0

+    2.5987    0.4405    0.2645 C   0  0  0

+    2.5887   -1.9251   -0.2149 N   0  0  0

+   -3.8007   -0.1813   -0.3333 C   0  0  0

+   -1.9561   -0.8836    0.9607 O   0  0  0

+    0.0153   -1.5063    0.0000 H   0  0  0

+    0.1004    2.6143    0.0000 H   0  0  0

+   -1.8303    1.6001    0.0000 H   0  0  0

+    2.4699    2.5104    0.0000 H   0  0  0

+    3.6180    0.4239    0.0000 H   0  0  0

+    2.0642   -2.7993    0.0000 H   0  0  0

+    3.6080   -1.9422    0.0000 H   0  0  0

+   -3.8108    0.8381    0.0000 H   0  0  0

+   -4.8201   -0.1914    0.0000 H   0  0  0

+   -3.7906   -1.2007    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  7 10  1  0

+  7 11  2  0

+  6  8  2  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15481-70-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 21                          1 V2000

+   -6.1745   -0.6863   -0.1693 C   0  0  0

+   -7.0517    0.3092   -0.5766 C   0  0  0

+   -5.0148   -0.3481    0.5133 C   0  0  0

+   -6.4841   -2.1318   -0.4622 C   0  0  0

+   -6.7661    1.6406   -0.2998 C   0  0  0

+   -8.2200   -0.0269   -1.2643 N   0  0  0

+   -4.7352    0.9857    0.7869 C   0  0  0

+   -4.1296   -1.3467    0.9254 N   0  0  0

+   -5.6104    1.9740    0.3801 C   0  0  0

+    5.2234   -0.1740    0.4903 Cl  0  0  0

+   13.8310    0.1263   -0.4147 Cl  0  0  0

+   -7.4572   -1.9234    0.0000 H   0  0  0

+   -6.6925   -3.1049    0.0000 H   0  0  0

+   -5.5110   -2.3402    0.0000 H   0  0  0

+   -7.4938    2.3194    0.0000 H   0  0  0

+   -8.9364    0.6638    0.0000 H   0  0  0

+   -8.4599   -0.9927    0.0000 H   0  0  0

+   -3.7733    1.2406    0.0000 H   0  0  0

+   -4.4445   -2.2907    0.0000 H   0  0  0

+   -3.1546   -1.1474    0.0000 H   0  0  0

+   -5.3329    2.9297    0.0000 H   0  0  0

+    6.2185   -0.1740    0.0000 H   0  0  0

+   14.8261    0.1263    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  7  9  2  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4350-09-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -1.1439    0.3033    0.2430 C   0  0  0

+   -2.0461    1.3150   -0.1306 C   0  0  0

+    0.1539    0.9606    0.4154 C   0  0  0

+   -1.5865   -1.0156    0.3681 C   0  0  0

+   -1.3352    2.4957   -0.1779 N   0  0  0

+   -3.3780    0.9920   -0.3686 C   0  0  0

+   -0.0275    2.2640    0.1503 C   0  0  0

+    1.4476    0.2989    0.8148 C   0  0  0

+   -2.9112   -1.3164    0.1230 C   0  0  0

+   -3.8043   -0.3106   -0.2380 C   0  0  0

+    2.3032    0.0586   -0.4306 C   0  0  0

+   -3.3479   -2.5987    0.2431 O   0  0  0

+    3.6750   -0.4070   -0.0154 C   0  0  0

+    1.6704   -0.9685   -1.2687 N   0  0  0

+    4.6494    0.4892    0.2063 O   0  0  0

+    3.8978   -1.5870    0.1180 O   0  0  0

+   -0.9046   -1.7697    0.0000 H   0  0  0

+   -1.7560    3.4212    0.0000 H   0  0  0

+   -4.0682    1.7385    0.0000 H   0  0  0

+    0.7046    2.9694    0.0000 H   0  0  0

+    0.6326   -0.3088    0.0000 H   0  0  0

+    1.6331   -0.7007    0.0000 H   0  0  0

+   -4.7997   -0.5175    0.0000 H   0  0  0

+    2.6041    1.0297    0.0000 H   0  0  0

+   -3.6756   -3.5611    0.0000 H   0  0  0

+    0.6542   -0.9395    0.0000 H   0  0  0

+    2.1534   -1.8631    0.0000 H   0  0  0

+    5.3977    1.1774    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  6 10  2  0

+  8 11  1  0

+  9 12  1  0

+ 11 13  1  0

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+ 13 15  1  0

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+  5  7  1  0

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+  4 17  1  0

+  5 18  1  0

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+  7 20  1  0

+  8 21  1  0

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+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13345-23-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+   -0.0122   -0.4025   -0.0019 C   0  0  0

+   -1.4149   -0.3021   -0.0015 C   0  0  0

+    0.7722    0.7647   -0.0005 C   0  0  0

+    0.6214   -1.7218    0.0025 C   0  0  0

+   -2.0192    0.9753   -0.0003 C   0  0  0

+   -2.2097   -1.4707   -0.0020 C   0  0  0

+    2.2273    0.6250   -0.0008 C   0  0  0

+    0.1469    2.0252    0.0008 C   0  0  0

+    2.0030   -1.8204    0.0017 C   0  0  0

+   -0.2296   -2.9121    0.0070 C   0  0  0

+   -1.2065    2.1291    0.0010 C   0  0  0

+   -3.4219    1.0634    0.0000 C   0  0  0

+   -1.5746   -2.7858   -0.0023 C   0  0  0

+   -3.6009   -1.3425   -0.0017 C   0  0  0

+    2.8068   -0.6687   -0.0025 C   0  0  0

+    3.0560    1.7535    0.0010 C   0  0  0

+   -4.1866   -0.0914   -0.0009 C   0  0  0

+   -4.0265    2.2788    0.0017 O   0  0  0

+    4.2110   -0.7868   -0.0023 C   0  0  0

+    4.4106    1.6007    0.0011 C   0  0  0

+    4.9851    0.3320   -0.0006 C   0  0  0

+    0.7364    2.8991    0.0000 H   0  0  0

+    2.4568   -2.7718    0.0000 H   0  0  0

+    0.2081   -3.8710    0.0000 H   0  0  0

+   -1.6557    3.0827    0.0000 H   0  0  0

+   -2.1761   -3.6514    0.0000 H   0  0  0

+   -4.2068   -2.2050    0.0000 H   0  0  0

+    2.6334    2.7192    0.0000 H   0  0  0

+   -5.2379   -0.0140    0.0000 H   0  0  0

+   -4.4960    3.2226    0.0000 H   0  0  0

+    4.6608   -1.7401    0.0000 H   0  0  0

+    5.0307    2.4531    0.0000 H   0  0  0

+    6.0349    0.2372    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+133-18-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    2.7401   -0.1478    0.1857 C   0  0  0

+    1.3494    0.1606    0.5602 C   0  0  0

+    3.6346    0.8888   -0.1254 C   0  0  0

+    3.1797   -1.4743    0.1434 C   0  0  0

+    0.3309   -0.3005   -0.1923 O   0  0  0

+    1.1204    0.8308    1.5477 O   0  0  0

+    4.9441    0.5843   -0.4767 C   0  0  0

+    3.2128    2.2108   -0.0827 N   0  0  0

+    4.4815   -1.7557   -0.2071 C   0  0  0

+   -1.0401    0.0035    0.1769 C   0  0  0

+    5.3606   -0.7301   -0.5188 C   0  0  0

+   -1.9941   -0.6340   -0.8352 C   0  0  0

+   -3.4170   -0.3184   -0.4521 C   0  0  0

+   -4.0282    0.8205   -0.9416 C   0  0  0

+   -4.1130   -1.1712    0.3846 C   0  0  0

+   -5.3336    1.1100   -0.5900 C   0  0  0

+   -5.4180   -0.8818    0.7360 C   0  0  0

+   -6.0274    0.2605    0.2509 C   0  0  0

+    2.5096   -2.2204    0.0000 H   0  0  0

+    5.6249    1.3207    0.0000 H   0  0  0

+    3.8878    2.9525    0.0000 H   0  0  0

+    2.2330    2.4245    0.0000 H   0  0  0

+    4.8014   -2.7062    0.0000 H   0  0  0

+   -0.5835    0.8964    0.0000 H   0  0  0

+   -1.7893    0.6702    0.0000 H   0  0  0

+    6.3433   -0.9302    0.0000 H   0  0  0

+   -2.4507   -1.5268    0.0000 H   0  0  0

+   -1.2450   -1.3007    0.0000 H   0  0  0

+   -3.4227    1.6199    0.0000 H   0  0  0

+   -3.7842   -2.1186    0.0000 H   0  0  0

+   -5.6622    2.0575    0.0000 H   0  0  0

+   -6.0245   -1.6805    0.0000 H   0  0  0

+   -7.0255    0.3580    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+ 12 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2531-84-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.4061   -0.3549    0.0013 C   0  0  0

+   -1.0591   -0.3841    0.0010 C   0  0  0

+    1.0600    0.8981    0.0004 C   0  0  0

+    1.1610   -1.5293   -0.0033 C   0  0  0

+   -1.7624    0.8418   -0.0001 C   0  0  0

+   -1.7667   -1.5877    0.0014 C   0  0  0

+    2.4616    0.9376    0.0007 C   0  0  0

+    0.2988    2.0898   -0.0011 C   0  0  0

+    2.5249   -1.4572   -0.0028 C   0  0  0

+   -1.0494    2.0629   -0.0014 C   0  0  0

+   -3.1645    0.8254   -0.0004 C   0  0  0

+   -3.1323   -1.5700    0.0006 C   0  0  0

+    3.1717   -0.2269    0.0018 C   0  0  0

+   -3.8276   -0.3665    0.0004 C   0  0  0

+    4.6779   -0.1791    0.0015 C   0  0  0

+    0.6836   -2.4613    0.0000 H   0  0  0

+   -1.2526   -2.5000    0.0000 H   0  0  0

+    2.9613    1.8578    0.0000 H   0  0  0

+    0.7927    3.0131    0.0000 H   0  0  0

+    3.0898   -2.3389    0.0000 H   0  0  0

+   -1.5798    2.9658    0.0000 H   0  0  0

+   -3.7005    1.7249    0.0000 H   0  0  0

+   -3.6616   -2.4735    0.0000 H   0  0  0

+   -4.8747   -0.3750    0.0000 H   0  0  0

+    4.7111   -1.2257    0.0000 H   0  0  0

+    5.7245   -0.1459    0.0000 H   0  0  0

+    4.6447    0.8675    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

+  3  8  2  0

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+  5 10  2  0

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+ 11 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+28166-06-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.9946   -0.2319   -0.0034 C   0  0  0

+   -0.1355   -0.9825   -0.0036 C   0  0  0

+    0.9300    1.1637   -0.0009 C   0  0  0

+    2.3147   -0.9011    0.0003 N   0  3  0

+   -1.4458   -0.3019   -0.0011 C   0  0  0

+   -0.2886    1.8477    0.0016 C   0  0  0

+    2.0798    1.8730   -0.0004 F   0  0  0

+    2.3810   -2.1173    0.0032 O   0  0  0

+    3.5006   -0.1274    0.0006 O   0  5  0

+   -1.4662    1.1746    0.0016 C   0  0  0

+   -2.5580   -0.9881   -0.0016 N   0  0  0

+   -3.5474   -0.4547    0.0003 N   0  3  0

+   -4.5368    0.0786    0.0023 N   0  5  0

+   -0.0810   -1.9985    0.0000 H   0  0  0

+   -0.2926    2.8652    0.0000 H   0  0  0

+   -2.3498    1.6792    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 11 12  2  0

+ 12 13  2  0

+  6 10  2  0

+  2 14  1  0

+  6 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+126983-61-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.6824    0.4776    0.0034 C   0  0  0

+   -1.4459   -0.7115    0.0025 C   0  0  0

+    0.7123    0.3555    0.0021 C   0  0  0

+   -1.5413    1.5471    0.0002 N   0  0  0

+   -2.8553   -0.2939    0.0041 C   0  0  0

+   -0.7945   -1.9405    0.0000 C   0  0  0

+    1.2851   -0.9250    0.0000 C   0  0  0

+    1.5813    1.5489    0.0024 C   0  0  0

+   -2.8496    1.1141   -0.0030 C   0  0  0

+   -4.0718   -0.9682    0.0037 C   0  0  0

+    0.5202   -2.0100   -0.0015 N   0  0  0

+   -1.6053   -3.2108   -0.0004 C   0  0  0

+    2.7621   -1.0509   -0.0014 C   0  0  0

+    3.0401    1.3937    0.0005 C   0  0  0

+    1.0879    2.6605    0.0039 O   0  0  0

+   -4.0774    1.7729   -0.0069 C   0  0  0

+   -5.2048   -0.2950    0.0051 N   0  0  0

+    3.6030    0.1681   -0.0006 C   0  0  0

+    3.2803   -2.1490   -0.0028 O   0  0  0

+   -5.2363    1.0267   -0.0094 C   0  0  0

+    4.9515    0.0509   -0.0019 O   0  0  0

+    5.4814    1.3780   -0.0006 C   0  0  0

+   -1.2457    2.5476    0.0000 H   0  0  0

+   -4.0874   -2.0113    0.0000 H   0  0  0

+   -2.4847   -2.6495    0.0000 H   0  0  0

+   -2.1666   -4.0902    0.0000 H   0  0  0

+   -0.7259   -3.7721    0.0000 H   0  0  0

+    3.6489    2.2409    0.0000 H   0  0  0

+   -4.1189    2.8153    0.0000 H   0  0  0

+   -6.1580    1.5153    0.0000 H   0  0  0

+    6.4502    0.9912    0.0000 H   0  0  0

+    5.8682    2.3468    0.0000 H   0  0  0

+    4.5126    1.7648    0.0000 H   0  0  0

+  1  2  2  0

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+  5  9  2  0

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+ 14 28  1  0

+ 16 29  1  0

+ 20 30  1  0

+ 22 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91423-46-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 39                          1 V2000

+    2.8344   -0.2810   -0.0428 C   0  0  0

+    1.6739    0.3164    0.2819 C   0  0  0

+    4.0089    0.2673    0.3443 O   0  0  0

+    0.4461   -0.2568   -0.1228 C   0  0  0

+    5.0447   -0.5871   -0.1450 C   0  0  0

+   -0.7263    0.3468    0.2054 C   0  0  0

+    6.4070   -0.0209    0.2608 C   0  0  0

+   -1.9485   -0.2237   -0.1975 C   0  0  0

+    7.5159   -0.9356   -0.2631 C   0  0  0

+    6.5646    1.2858   -0.2959 O   0  0  0

+   -3.1226    0.3807    0.1311 C   0  0  0

+    8.7882   -0.4068    0.1159 O   0  0  0

+   -4.3457   -0.1903   -0.2720 C   0  0  0

+   -5.5164    0.4124    0.0556 C   0  0  0

+   -6.7852   -0.1799   -0.3626 C   0  0  0

+   -7.9376    0.4133   -0.0401 C   0  0  0

+   -9.2460   -0.1974   -0.4714 C   0  0  0

+  -10.0880   -0.5240    0.7637 C   0  0  0

+    2.8149   -1.2878    0.0000 H   0  0  0

+    1.6933    1.3232    0.0000 H   0  0  0

+    0.4266   -1.2636    0.0000 H   0  0  0

+    4.2867   -1.2501    0.0000 H   0  0  0

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+   -0.7068    1.3536    0.0000 H   0  0  0

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+   -1.9680   -1.2305    0.0000 H   0  0  0

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+    8.0477   -1.7908    0.0000 H   0  0  0

+    6.6852    2.2856    0.0000 H   0  0  0

+   -3.1032    1.3875    0.0000 H   0  0  0

+    9.7181   -0.0203    0.0000 H   0  0  0

+   -4.3652   -1.1971    0.0000 H   0  0  0

+   -5.4969    1.4192    0.0000 H   0  0  0

+   -6.8046   -1.1867    0.0000 H   0  0  0

+   -7.9181    1.4201    0.0000 H   0  0  0

+   -9.3779   -1.1958    0.0000 H   0  0  0

+   -8.4339   -0.7929    0.0000 H   0  0  0

+  -10.4522    0.4149    0.0000 H   0  0  0

+  -11.0269   -0.8882    0.0000 H   0  0  0

+   -9.7238   -1.4629    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 17 37  1  0

+ 18 38  1  0

+ 18 39  1  0

+ 18 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+81424-67-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    0.5113   -0.3646    0.3335 N   0  0  0

+   -0.5868   -0.1308    0.8057 O   0  0  0

+    1.3549    0.6490    0.0552 C   0  0  0

+    0.8850   -1.6373    0.0944 C   0  0  0

+   -1.6380    0.0741   -0.0066 C   0  0  0

+    1.0461    1.9055    0.4325 N   0  0  0

+    2.3942    0.4299   -0.5361 O   0  0  0

+    0.6950   -2.6904    1.1555 C   0  0  0

+    1.3743   -1.9350   -0.9747 O   0  0  0

+   -2.8531    0.3327    0.5160 N   0  0  0

+   -1.4926    0.0261   -1.2124 O   0  0  0

+    1.9631    3.0073    0.1300 C   0  0  0

+   -3.9987    0.5561   -0.3694 C   0  0  0

+    0.2093    2.0984    0.0000 H   0  0  0

+   -0.1501   -2.5379    0.0000 H   0  0  0

+    0.5425   -3.5355    0.0000 H   0  0  0

+    1.5401   -2.8429    0.0000 H   0  0  0

+   -2.6815    1.1741    0.0000 H   0  0  0

+    2.6231    2.4580    0.0000 H   0  0  0

+    2.5124    3.6673    0.0000 H   0  0  0

+    1.3031    3.5566    0.0000 H   0  0  0

+   -3.8343    1.3989    0.0000 H   0  0  0

+   -4.8415    0.7205    0.0000 H   0  0  0

+   -4.1631   -0.2867    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+ 10 13  1  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+709-49-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.2284   -2.0242   -0.0014 N   0  3  0

+   -0.3523   -3.0949    0.0031 O   0  5  0

+    1.4459   -1.9918   -0.0092 O   0  0  0

+   -0.5456   -0.7625   -0.0034 C   0  0  0

+   -1.9271   -0.7993   -0.0002 C   0  0  0

+    0.1138    0.4533   -0.0028 C   0  0  0

+   -2.6501    0.3792   -0.0022 C   0  0  0

+    2.2080    0.5095    0.0019 I   0  0  0

+   -0.6096    1.6318   -0.0047 C   0  0  0

+   -4.1298    0.3396    0.0017 N   0  3  0

+   -1.9915    1.5944   -0.0073 C   0  0  0

+   -4.7669    1.3777    0.0000 O   0  0  0

+   -4.7103   -0.7312    0.0066 O   0  5  0

+   -2.4214   -1.7107    0.0000 H   0  0  0

+   -0.1156    2.5434    0.0000 H   0  0  0

+   -2.5340    2.4780    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

+  9  6  2  0

+ 10  7  1  0

+ 11  7  2  0

+ 12 10  2  0

+ 13 10  1  0

+  9 11  1  0

+  5 14  1  0

+  9 15  1  0

+ 11 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+316-14-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.2890   -0.2781   -0.0021 C   0  0  0

+   -1.7174   -0.6251   -0.0016 C   0  0  0

+    0.0890    1.1362   -0.0005 C   0  0  0

+    0.6829   -1.2650    0.0016 C   0  0  0

+   -2.6780    0.4081    0.0005 C   0  0  0

+   -2.1322   -1.9579   -0.0027 C   0  0  0

+    1.4311    1.5001   -0.0014 C   0  0  0

+   -0.9591    2.1551    0.0016 C   0  0  0

+    2.0336   -0.9049    0.0015 C   0  0  0

+   -2.2597    1.8060    0.0016 C   0  0  0

+   -4.0400    0.0750    0.0011 C   0  0  0

+   -3.4768   -2.2528   -0.0017 C   0  0  0

+    2.4155    0.5094   -0.0038 C   0  0  0

+   -0.5796    3.6135    0.0038 C   0  0  0

+    3.0490   -1.8820    0.0061 C   0  0  0

+   -4.4219   -1.2348   -0.0005 C   0  0  0

+    3.7857    0.8415   -0.0043 C   0  0  0

+    4.3516   -1.4950    0.0066 C   0  0  0

+    4.7154   -0.1493   -0.0062 C   0  0  0

+    0.4072   -2.2760    0.0000 H   0  0  0

+   -1.4237   -2.7300    0.0000 H   0  0  0

+    1.7024    2.5123    0.0000 H   0  0  0

+   -2.9901    2.5575    0.0000 H   0  0  0

+   -4.7646    0.8321    0.0000 H   0  0  0

+   -3.7898   -3.2529    0.0000 H   0  0  0

+    0.4346    3.3496    0.0000 H   0  0  0

+   -0.3157    4.6277    0.0000 H   0  0  0

+   -1.5938    3.8774    0.0000 H   0  0  0

+    2.8012   -2.9002    0.0000 H   0  0  0

+   -5.4417   -1.4760    0.0000 H   0  0  0

+    4.0851    1.8458    0.0000 H   0  0  0

+    5.1017   -2.2268    0.0000 H   0  0  0

+    5.7321    0.1047    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  2  0

+ 13 17  1  0

+ 15 18  2  0

+ 17 19  2  0

+  8 10  1  0

+  9 13  1  0

+ 12 16  1  0

+ 18 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-09-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    1.6128    0.4206   -0.5664 C   0  0  0

+    0.1501    0.1925   -0.2848 C   0  0  0

+    2.3724    0.5507    0.7553 C   0  0  0

+    2.3772   -0.6533   -0.0145 O   0  0  0

+   -0.7069    1.2703   -0.1650 C   0  0  0

+   -0.3358   -1.0950   -0.1518 C   0  0  0

+   -2.0488    1.0611    0.0934 C   0  0  0

+   -1.6774   -1.3041    0.1065 C   0  0  0

+   -2.5335   -0.2258    0.2320 C   0  0  0

+    1.4473    1.4321    0.0000 H   0  0  0

+    3.3956    0.6113    0.0000 H   0  0  0

+    2.2554    1.5690    0.0000 H   0  0  0

+   -0.3342    2.2251    0.0000 H   0  0  0

+    0.3105   -1.8905    0.0000 H   0  0  0

+   -2.6954    1.8564    0.0000 H   0  0  0

+   -2.0505   -2.2588    0.0000 H   0  0  0

+   -3.5461   -0.3845    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  5  7  1  0

+  6  8  2  0

+  7  9  2  0

+  3  4  1  0

+  8  9  1  0

+  1 10  1  0

+  3 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74367-78-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.7741    1.1956   -0.1043 C   0  0  0

+   -1.4434   -0.0034    0.0561 C   0  0  0

+    0.5697    1.1991   -0.4276 C   0  0  0

+   -1.4980    2.4756    0.0643 N   0  3  0

+   -0.7688   -1.1987   -0.1070 C   0  0  0

+    1.2446    0.0035   -0.5907 C   0  0  0

+   -0.9083    3.5320   -0.0769 O   0  0  0

+   -2.6834    2.4726    0.3443 O   0  5  0

+    0.5754   -1.1952   -0.4304 C   0  0  0

+   -1.4855   -2.4824    0.0642 N   0  3  0

+    2.7099    0.0072   -0.9428 C   0  0  0

+   -0.8910   -3.5357   -0.0795 O   0  0  0

+   -2.6698   -2.4854    0.3488 O   0  5  0

+    3.6913    0.0074    0.5697 Cl  0  0  0

+   -2.4622   -0.0058    0.0000 H   0  0  0

+    1.0822    2.0796    0.0000 H   0  0  0

+    1.0923   -2.0731    0.0000 H   0  0  0

+    3.2184    0.8900    0.0000 H   0  0  0

+    2.1990    0.8886    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  1  0

+ 10 12  2  0

+ 10 13  1  0

+ 11 14  1  0

+  6  9  2  0

+  2 15  1  0

+  3 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1013-96-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.4840   -0.6339   -0.0089 C   0  0  0

+   -1.6580    0.1255   -0.0295 C   0  0  0

+    0.8279    0.0327    0.0128 C   0  0  0

+   -0.5631   -2.0304   -0.0032 C   0  0  0

+   -2.8835   -0.5066   -0.0493 C   0  0  0

+   -1.5855    1.6039   -0.0296 N   0  3  0

+    1.9584   -0.7034    0.0327 C   0  0  0

+   -1.7959   -2.6474   -0.0179 C   0  0  0

+   -2.9533   -1.8887   -0.0489 C   0  0  0

+   -2.2782    2.2477    0.7380 O   0  0  0

+   -0.8330    2.1767   -0.7972 O   0  5  0

+    3.2619   -0.0411    0.0543 C   0  0  0

+    4.3923   -0.7771    0.0741 O   0  0  0

+    3.3270    1.1734    0.0544 O   0  0  0

+    0.8833    1.0673    0.0000 H   0  0  0

+    0.3026   -2.5996    0.0000 H   0  0  0

+   -3.7543    0.0547    0.0000 H   0  0  0

+    1.9030   -1.7380    0.0000 H   0  0  0

+   -1.8561   -3.6817    0.0000 H   0  0  0

+   -3.8770   -2.3579    0.0000 H   0  0  0

+    5.2605   -1.3424    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+  8  9  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16430-32-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -0.0663    0.0011   -0.4040 C   0  0  0

+    0.6079   -1.2049   -0.2227 C   0  0  0

+    0.6142    1.2038   -0.2223 C   0  0  0

+   -1.5204    0.0049   -0.8000 C   0  0  0

+    2.0246   -1.2085    0.1568 C   0  0  0

+   -0.0503   -2.4414   -0.3979 C   0  0  0

+    2.0307    1.2001    0.1572 C   0  0  0

+   -0.0376    2.4436   -0.3971 C   0  0  0

+   -2.3471    0.0035    0.3936 O   0  0  0

+    2.7051   -0.0062    0.3385 C   0  0  0

+    2.6765   -2.4483    0.3326 C   0  0  0

+    0.6363   -3.5976   -0.2129 C   0  0  0

+    2.6890    2.4362    0.3334 C   0  0  0

+    0.6549    3.5964   -0.2117 C   0  0  0

+   -3.6849    0.0063    0.2835 C   0  0  0

+    1.9841   -3.6011    0.1482 C   0  0  0

+    2.0026    3.5928    0.1493 C   0  0  0

+   -4.5429    0.0049    1.5224 C   0  0  0

+   -4.2011    0.0100   -0.8089 O   0  0  0

+   -1.0013    0.9016    0.0000 H   0  0  0

+   -2.0387    0.9021    0.0000 H   0  0  0

+   -1.0862   -2.4656    0.0000 H   0  0  0

+   -1.0733    2.4731    0.0000 H   0  0  0

+    3.7412   -0.0089    0.0000 H   0  0  0

+    3.7122   -2.4777    0.0000 H   0  0  0

+    0.1226   -4.4974    0.0000 H   0  0  0

+    3.7249    2.4602    0.0000 H   0  0  0

+    0.1458    4.4989    0.0000 H   0  0  0

+    2.4932   -4.5035    0.0000 H   0  0  0

+    2.5165    4.4925    0.0000 H   0  0  0

+   -4.5446    1.0410    0.0000 H   0  0  0

+   -5.5790    0.0032    0.0000 H   0  0  0

+   -4.5412   -1.0312    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 11 16  2  0

+ 13 17  2  0

+ 15 18  1  0

+ 15 19  2  0

+  7 10  1  0

+ 12 16  1  0

+ 14 17  1  0

+  4 20  1  0

+  4 21  1  0

+  6 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2851-80-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -4.9450    0.3452   -0.0011 C   0  0  0

+   -3.4653    0.0594   -0.0015 C   0  0  0

+   -2.5597    1.1053   -0.0003 C   0  0  0

+   -3.0144   -1.2485    0.0027 C   0  0  0

+   -1.2054    0.8458   -0.0002 C   0  0  0

+   -1.6617   -1.5173    0.0028 C   0  0  0

+   -0.7419   -0.4668   -0.0014 C   0  0  0

+    0.0000    1.7537    0.0009 C   0  0  0

+    0.7420   -0.4669   -0.0010 C   0  0  0

+    1.2056    0.8461    0.0003 C   0  0  0

+    1.6614   -1.5171   -0.0018 C   0  0  0

+    2.5595    1.1055    0.0009 C   0  0  0

+    3.0146   -1.2483   -0.0012 C   0  0  0

+    3.4653    0.0592    0.0001 C   0  0  0

+    4.9450    0.3449    0.0008 C   0  0  0

+   -4.7470    1.3703    0.0000 H   0  0  0

+   -5.9701    0.5432    0.0000 H   0  0  0

+   -5.1430   -0.6799    0.0000 H   0  0  0

+   -2.9019    2.0917    0.0000 H   0  0  0

+   -3.7008   -2.0351    0.0000 H   0  0  0

+   -1.3256   -2.5058    0.0000 H   0  0  0

+    0.7029    2.5256    0.0000 H   0  0  0

+   -0.7031    2.5255    0.0000 H   0  0  0

+    1.3253   -2.5055    0.0000 H   0  0  0

+    2.9017    2.0918    0.0000 H   0  0  0

+    3.7010   -2.0349    0.0000 H   0  0  0

+    5.1429   -0.6802    0.0000 H   0  0  0

+    5.9701    0.5428    0.0000 H   0  0  0

+    4.7471    1.3700    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  4  2  0

+  7  5  2  0

+  8  5  1  0

+  9  7  1  0

+ 10  8  1  0

+ 11  9  2  0

+ 12 10  2  0

+ 13 11  1  0

+ 14 12  1  0

+ 15 14  1  0

+  6  7  1  0

+  9 10  1  0

+ 13 14  2  0

+  1 16  1  0

+  1 17  1  0

+  1 18  1  0

+  3 19  1  0

+  4 20  1  0

+  6 21  1  0

+  8 22  1  0

+  8 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+542-75-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.0435   -0.3479   -0.4059 C   0  0  0

+   -1.2852   -0.9495   -0.0272 C   0  0  0

+    1.0655   -0.4487    0.4101 C   0  0  0

+   -2.5365    0.3472    0.0339 Cl  0  0  0

+    2.5962    0.2443   -0.0261 Cl  0  0  0

+   -0.1480    0.8135    0.0000 H   0  0  0

+   -2.2198   -1.6651    0.0000 H   0  0  0

+   -0.6807   -1.9595    0.0000 H   0  0  0

+    1.2570   -1.6101    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  3  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1516-21-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.3111   -0.2615    0.0022 C   0  0  0

+   -0.5955   -1.4794    0.0011 C   0  0  0

+   -0.6054    0.9625    0.0022 C   0  0  0

+   -2.6439   -0.2670   -0.0022 N   0  0  0

+    0.7664   -1.4638   -0.0001 C   0  0  0

+    0.7562    0.9582    0.0011 C   0  0  0

+   -3.2573    0.7852   -0.0012 O   0  0  0

+    1.4547   -0.2501    0.0000 C   0  0  0

+    2.8089   -0.2445   -0.0012 O   0  0  0

+    3.2162    1.1252   -0.0009 C   0  0  0

+   -1.1039   -2.3797    0.0000 H   0  0  0

+   -1.1212    1.8586    0.0000 H   0  0  0

+    1.2919   -2.3543    0.0000 H   0  0  0

+    1.2744    1.8530    0.0000 H   0  0  0

+    4.2073    0.8305    0.0000 H   0  0  0

+    3.5109    2.1163    0.0000 H   0  0  0

+    2.2251    1.4199    0.0000 H   0  0  0

+  1  2  2  0

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+  8  9  1  0

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+  6  8  1  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2185-92-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -1.4749   -0.5413   -0.0517 C   0  0  0

+   -2.5903    0.4359   -0.0365 C   0  0  0

+   -0.8175   -0.8708    1.1321 C   0  0  0

+   -1.0838   -1.1380   -1.2493 C   0  0  0

+   -3.9057   -0.0012    0.1609 C   0  0  0

+   -2.3338    1.7930   -0.2127 C   0  0  0

+    0.2201   -1.7810    1.1119 C   0  0  0

+   -0.0452   -2.0465   -1.2575 C   0  0  0

+   -4.9423    0.9209    0.1740 C   0  0  0

+   -4.1729   -1.3577    0.3441 N   0  0  0

+   -3.3754    2.6990   -0.1973 C   0  0  0

+    0.6076   -2.3655   -0.0802 C   0  0  0

+   -4.6753    2.2644   -0.0073 C   0  0  0

+    9.9211    0.7504    0.0381 Cl  0  0  0

+   -0.2396   -0.0121    0.0000 H   0  0  0

+   -1.8646   -1.8175    0.0000 H   0  0  0

+   -1.3560    2.1324    0.0000 H   0  0  0

+    0.9996   -1.1000    0.0000 H   0  0  0

+   -0.6181   -2.9085    0.0000 H   0  0  0

+   -5.9236    0.5916    0.0000 H   0  0  0

+   -5.1524   -1.6922    0.0000 H   0  0  0

+   -3.3934   -2.0387    0.0000 H   0  0  0

+   -3.1732    3.7141    0.0000 H   0  0  0

+    1.3858   -3.0480    0.0000 H   0  0  0

+   -5.4520    2.9486    0.0000 H   0  0  0

+   10.9561    0.7504    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  7 12  2  0

+  9 13  1  0

+  8 12  1  0

+ 11 13  2  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+628-94-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    3.1335    0.0362   -0.0013 C   0  0  0

+    1.7877    0.7144   -0.0001 C   0  0  0

+    4.2606    0.7753   -0.0006 N   0  0  0

+    3.2024   -1.1746    0.0023 O   0  0  0

+    0.6832   -0.3443   -0.0012 C   0  0  0

+   -0.6832    0.3443    0.0000 C   0  0  0

+   -1.7877   -0.7144   -0.0011 C   0  0  0

+   -3.1335   -0.0362    0.0000 C   0  0  0

+   -4.2606   -0.7753   -0.0006 N   0  0  0

+   -3.2024    1.1746    0.0016 O   0  0  0

+    2.4072    1.6598    0.0000 H   0  0  0

+    0.9184    1.4367    0.0000 H   0  0  0

+    5.2700    0.2667    0.0000 H   0  0  0

+    4.1964    1.9037    0.0000 H   0  0  0

+    0.0637   -1.2897    0.0000 H   0  0  0

+    1.5525   -1.0666    0.0000 H   0  0  0

+   -0.0637    1.2897    0.0000 H   0  0  0

+   -1.5525    1.0666    0.0000 H   0  0  0

+   -2.4072   -1.6598    0.0000 H   0  0  0

+   -0.9184   -1.4367    0.0000 H   0  0  0

+   -5.2700   -0.2667    0.0000 H   0  0  0

+   -4.1964   -1.9037    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  1  0

+  8 10  2  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  9 21  1  0

+  9 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+65-45-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.1454   -0.2962   -0.0175 C   0  0  0

+    0.5346    0.9282    0.0288 C   0  0  0

+    0.5815   -1.4886   -0.0604 C   0  0  0

+   -1.6205   -0.3263   -0.0147 C   0  0  0

+    1.9216    0.9443    0.0315 C   0  0  0

+   -0.1604    2.0924    0.0702 O   0  0  0

+    1.9589   -1.4539   -0.0570 C   0  0  0

+   -2.2998   -0.1717   -1.1685 N   0  0  0

+   -2.2233   -0.4904    1.0284 O   0  0  0

+    2.6276   -0.2414   -0.0112 C   0  0  0

+    0.0853   -2.3989    0.0000 H   0  0  0

+    2.4287    1.8486    0.0000 H   0  0  0

+   -0.6918    2.9826    0.0000 H   0  0  0

+    2.4972   -2.3399    0.0000 H   0  0  0

+   -2.6060    0.8188    0.0000 H   0  0  0

+   -3.0045   -0.9321    0.0000 H   0  0  0

+    3.6642   -0.2243    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  2  0

+  7 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115453-71-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    2.2213   -0.4292   -0.3163 C   0  0  1

+    0.8774    0.2372   -0.0152 C   0  0  0

+    3.3411    0.5128    0.0440 C   0  0  0

+    2.3448   -1.6614    0.4738 N   0  0  0

+   -0.4704   -0.8967   -0.4489 S   0  0  0

+    3.8165    1.3717   -0.8715 O   0  0  0

+    3.8109    0.4951    1.1570 O   0  0  0

+   -1.8586    0.0972   -0.0131 C   0  0  0

+   -3.0835   -0.3704   -0.1775 C   0  0  0

+   -4.4512    0.6088    0.2519 Cl  0  0  0

+    3.2381   -0.8421    0.0000 H   0  0  0

+    1.4947    1.1446    0.0000 H   0  0  0

+    0.0628    0.9726    0.0000 H   0  0  0

+    1.4538   -2.3022    0.0000 H   0  0  0

+    3.3452   -2.1126    0.0000 H   0  0  0

+    4.3480    2.3319    0.0000 H   0  0  0

+   -1.7181    1.1857    0.0000 H   0  0  0

+   -3.2240   -1.4589    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  8  9  2  0

+  9 10  1  0

+  1 11  1  0

+  2 12  1  0

+  2 13  1  0

+  4 14  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33448-26-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -2.2802    0.5708    0.0735 C   0  0  0

+   -3.1266   -0.3654    0.6903 C   0  0  0

+   -0.9918    0.2170   -0.3617 C   0  0  0

+   -2.7374    1.8989   -0.1191 C   0  0  0

+   -2.6630   -1.7839    0.8997 C   0  0  0

+   -4.3682    0.0138    1.0988 C   0  0  0

+   -0.4873   -1.1902   -0.1711 C   0  0  0

+   -0.2004    1.1505   -0.9561 C   0  0  0

+   -4.0273    2.2524    0.3113 C   0  0  0

+   -1.8916    2.8358   -0.7372 C   0  0  0

+   -1.6704   -2.1614   -0.2028 C   0  0  0

+   -4.8153    1.3208    0.9148 C   0  0  0

+   -0.6482    2.4576   -1.1410 C   0  0  0

+   -1.1864   -3.5301    0.0218 N   0  0  0

+   -0.8800   -4.0918   -1.3005 C   0  0  0

+   10.8994    0.3365    0.3305 Cl  0  0  0

+   -3.6611   -1.8734    0.0000 H   0  0  0

+   -2.7998   -2.7766    0.0000 H   0  0  0

+   -5.0649   -0.7064    0.0000 H   0  0  0

+    0.0560   -2.0322    0.0000 H   0  0  0

+    0.4112   -0.7466    0.0000 H   0  0  0

+    0.7843    0.9646    0.0000 H   0  0  0

+   -4.3240    3.2095    0.0000 H   0  0  0

+   -2.1595    3.8014    0.0000 H   0  0  0

+   -2.3873   -2.8616    0.0000 H   0  0  0

+   -5.8000    1.5063    0.0000 H   0  0  0

+    0.0479    3.1784    0.0000 H   0  0  0

+   -2.1015   -3.9384    0.0000 H   0  0  0

+   -1.7597   -4.5717    0.0000 H   0  0  0

+   -0.4001   -4.9715    0.0000 H   0  0  0

+   -0.0003   -3.6119    0.0000 H   0  0  0

+   11.9015    0.3365    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  1  0

+ 11 14  1  0

+ 14 15  1  0

+  7 11  1  0

+  9 12  1  0

+ 10 13  2  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142129-81-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 22                          1 V2000

+   -2.1381    0.7204   -0.1918 C   0  0  2

+   -2.1031   -0.7670    0.1944 C   0  0  2

+   -0.7991    1.4403   -0.3853 C   0  0  1

+   -1.5392    1.5144    0.8346 O   0  0  0

+   -0.7341   -1.4290    0.3790 C   0  0  1

+   -1.4765   -1.5327   -0.8372 O   0  0  0

+    0.4954    0.6980   -0.1846 C   0  0  0

+    0.5296   -0.6334    0.1698 C   0  0  0

+    1.6904    1.3845   -0.3642 C   0  0  0

+    1.6914   -1.2486    0.3361 N   0  0  0

+    2.8827    0.7044   -0.1804 C   0  0  0

+    2.8422   -0.6311    0.1746 C   0  0  0

+   -3.0920    1.0274    0.0000 H   0  0  0

+   -3.0428   -1.1150    0.0000 H   0  0  0

+   -0.4932    2.3946    0.0000 H   0  0  0

+   -0.3902   -2.3702    0.0000 H   0  0  0

+    1.6889    2.3866    0.0000 H   0  0  0

+    3.7567    1.1945    0.0000 H   0  0  0

+    3.6942   -1.1586    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

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+  3  4  1  0

+  5  6  1  0

+  7  8  2  0

+ 11 12  1  0

+  1 13  1  0

+  2 14  1  0

+  3 15  1  0

+  5 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+166664-83-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.9008    0.5442    0.0039 C   0  0  0

+   -0.7517   -0.8645    0.0035 C   0  0  0

+    0.2109    1.3533    0.0028 C   0  0  0

+   -2.2668    0.7884   -0.0001 N   0  0  0

+    0.4532   -1.4187    0.0017 N   0  0  0

+   -1.9965   -1.3885    0.0048 N   0  0  0

+    1.4758    0.7371    0.0013 C   0  0  0

+   -2.8888   -0.4268   -0.0027 C   0  0  0

+   -2.9177    2.1009   -0.0009 C   0  0  0

+    1.5633   -0.6788    0.0002 C   0  0  0

+    2.6572    1.4995   -0.0002 C   0  0  0

+   -4.2501   -0.6150   -0.0066 N   0  0  0

+    2.7684   -1.2631   -0.0019 N   0  0  0

+    3.8527    0.8365   -0.0018 C   0  0  0

+    3.8722   -0.5555   -0.0038 C   0  0  0

+    0.1204    2.3800    0.0000 H   0  0  0

+   -1.9943    2.5588    0.0000 H   0  0  0

+   -3.3756    3.0243    0.0000 H   0  0  0

+   -3.8411    1.6430    0.0000 H   0  0  0

+    2.6228    2.5296    0.0000 H   0  0  0

+   -4.8828    0.1986    0.0000 H   0  0  0

+   -4.6383   -1.5698    0.0000 H   0  0  0

+    4.7371    1.3657    0.0000 H   0  0  0

+    4.7800   -1.0436    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

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+ 10 13  1  0

+ 11 14  2  0

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+  6  8  2  0

+  7 10  1  0

+ 14 15  1  0

+  3 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18234-46-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -0.6731   -0.5947   -0.0020 C   0  0  0

+   -1.9146    0.2001   -0.0010 C   0  0  0

+    0.5546    0.1077   -0.0009 C   0  0  0

+   -1.0457   -1.9363    0.0016 C   0  0  0

+   -3.0094   -0.7792   -0.0020 C   0  0  0

+   -1.8174    1.5681    0.0005 C   0  0  0

+    0.5287    1.4564    0.0010 C   0  0  0

+    1.8654   -0.6358   -0.0013 C   0  0  0

+   -2.4153   -2.0509    0.0047 C   0  0  0

+   -4.3860   -0.4974   -0.0015 C   0  0  0

+   -0.6152    2.1499    0.0011 O   0  0  0

+    2.9618    0.3162    0.0000 O   0  0  0

+   -4.7703    0.6559   -0.0002 O   0  0  0

+    4.2307   -0.1215    0.0000 C   0  0  0

+    5.3686    0.8665    0.0013 C   0  0  0

+    4.4606   -1.3077   -0.0012 O   0  0  0

+   -0.3796   -2.7406    0.0000 H   0  0  0

+   -2.6819    2.1539    0.0000 H   0  0  0

+    1.4337    1.9775    0.0000 H   0  0  0

+    1.2508   -1.4801    0.0000 H   0  0  0

+    2.6348   -1.3419    0.0000 H   0  0  0

+   -2.9388   -2.9545    0.0000 H   0  0  0

+   -5.0789   -1.2787    0.0000 H   0  0  0

+    6.0533    0.0780    0.0000 H   0  0  0

+    6.1571    1.5512    0.0000 H   0  0  0

+    4.6839    1.6550    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  8 12  1  0

+ 10 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+  5  9  2  0

+  7 11  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4812-40-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.3430    0.0281   -0.0600 N   0  0  0

+   -0.7113    0.8821    0.1212 C   0  0  0

+    1.4587    0.6833    0.3269 C   0  0  0

+    0.2733   -1.3427   -0.5720 C   0  0  0

+   -0.2040    2.0289    0.6122 C   0  0  0

+   -2.1355    0.5994   -0.1672 N   0  3  0

+    1.1239    1.8792    0.7277 N   0  0  0

+    2.8584    0.1255    0.3006 C   0  0  0

+   -0.0714   -2.2977    0.5727 C   0  0  0

+   -2.6487   -0.4252    0.2456 O   0  0  0

+   -2.7941    1.3913   -0.8173 O   0  5  0

+    3.4626    0.4143   -0.9618 O   0  0  0

+   -0.1394   -3.6348    0.0733 O   0  0  0

+    0.9690   -2.0192    0.0000 H   0  0  0

+    1.1765   -0.9879    0.0000 H   0  0  0

+   -0.6870    2.8705    0.0000 H   0  0  0

+    2.2884   -0.6599    0.0000 H   0  0  0

+    3.4794   -0.6202    0.0000 H   0  0  0

+   -0.7671   -1.6212    0.0000 H   0  0  0

+   -0.9746   -2.6525    0.0000 H   0  0  0

+    4.3381    0.8328    0.0000 H   0  0  0

+   -0.1887   -4.6039    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+ 12 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14698-29-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.4013    0.7493    0.1224 C   0  0  0

+   -0.1743   -0.6306   -0.0264 C   0  0  0

+    0.6626    1.6202    0.2374 N   0  0  0

+   -1.7073    1.2248    0.1581 C   0  0  0

+   -1.2504   -1.5130   -0.1413 C   0  0  0

+    1.2151   -1.1184   -0.0574 C   0  0  0

+    1.9383    1.2138    0.2149 C   0  0  0

+    0.3847    3.0503    0.3911 C   0  0  0

+   -2.7694    0.3456    0.0490 C   0  0  0

+   -2.5400   -1.0260   -0.1084 C   0  0  0

+    2.2842   -0.1147    0.0725 C   0  0  0

+    1.4692   -2.3036   -0.1850 O   0  0  0

+    0.3323    3.7108   -0.9880 C   0  0  0

+   -4.1167    0.5607    0.0553 O   0  0  0

+   -3.7460   -1.6608   -0.1974 O   0  0  0

+    3.6963   -0.5206    0.0515 C   0  0  0

+   -4.7112   -0.7222    0.3251 C   0  0  0

+    4.0217   -1.8214   -0.0877 O   0  0  0

+    4.5711    0.3166    0.1596 O   0  0  0

+   -1.8834    2.2436    0.0000 H   0  0  0

+   -1.0828   -2.5332    0.0000 H   0  0  0

+    2.6887    1.9250    0.0000 H   0  0  0

+   -0.5648    3.4594    0.0000 H   0  0  0

+   -0.4205    2.4019    0.0000 H   0  0  0

+    1.3629    3.7926    0.0000 H   0  0  0

+    0.2505    4.7414    0.0000 H   0  0  0

+   -0.6983    3.6290    0.0000 H   0  0  0

+   -5.5945   -0.1850    0.0000 H   0  0  0

+   -5.3442   -1.5396    0.0000 H   0  0  0

+    4.2726   -2.8244    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+ 16 18  1  0

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+  7 11  2  0

+  9 10  2  0

+ 15 17  1  0

+  4 20  1  0

+  5 21  1  0

+  7 22  1  0

+  8 23  1  0

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+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+529-20-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.8875    0.2917   -0.0001 C   0  0  0

+   -2.7048   -0.6040   -0.0011 O   0  0  0

+   -0.4500   -0.0238   -0.0013 C   0  0  0

+    0.4956    1.0063   -0.0002 C   0  0  0

+   -0.0227   -1.3557    0.0025 C   0  0  0

+    0.0459    2.4446    0.0020 C   0  0  0

+    1.8408    0.7024   -0.0008 C   0  0  0

+    1.3257   -1.6431    0.0018 C   0  0  0

+    2.2556   -0.6177   -0.0024 C   0  0  0

+   -2.2018    1.2812    0.0000 H   0  0  0

+   -0.7190   -2.1257    0.0000 H   0  0  0

+    1.0368    2.7544    0.0000 H   0  0  0

+   -0.2639    3.4355    0.0000 H   0  0  0

+   -0.9450    2.1348    0.0000 H   0  0  0

+    2.5441    1.4661    0.0000 H   0  0  0

+    1.6445   -2.6311    0.0000 H   0  0  0

+    3.2696   -0.8403    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  3  2  0

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+  1 10  1  0

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+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+519-23-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.5204    0.2984    0.0033 C   0  0  0

+    0.2587   -1.0908    0.0008 C   0  0  0

+    1.9900    0.4437    0.0019 C   0  0  0

+   -0.5142    1.2145    0.0013 C   0  0  0

+   -1.0437   -1.5508    0.0010 C   0  0  0

+    1.4718   -1.7590   -0.0019 N   0  0  0

+    2.5203   -0.8539   -0.0014 C   0  0  0

+    2.8407    1.5460    0.0031 C   0  0  0

+   -1.8385    0.7597   -0.0032 C   0  0  0

+   -0.2193    2.6924    0.0046 C   0  0  0

+   -2.1027   -0.6376    0.0036 C   0  0  0

+   -1.3224   -3.0318   -0.0011 C   0  0  0

+    3.9012   -1.0247   -0.0037 C   0  0  0

+    4.2065    1.3570    0.0011 C   0  0  0

+   -2.9266    1.6491   -0.0053 C   0  0  0

+   -3.4473   -1.0585    0.0039 C   0  0  0

+    4.7329    0.0748   -0.0029 C   0  0  0

+   -4.1532    1.1827   -0.0096 N   0  0  0

+   -4.4281   -0.1152    0.0065 C   0  0  0

+    1.5805   -2.7973    0.0000 H   0  0  0

+    2.4457    2.5123    0.0000 H   0  0  0

+    0.8044    2.4881    0.0000 H   0  0  0

+   -0.0150    3.7161    0.0000 H   0  0  0

+   -1.2430    2.8967    0.0000 H   0  0  0

+   -2.3483   -2.8387    0.0000 H   0  0  0

+   -1.5155   -4.0577    0.0000 H   0  0  0

+   -0.2965   -3.2249    0.0000 H   0  0  0

+    4.3078   -1.9862    0.0000 H   0  0  0

+    4.8460    2.1821    0.0000 H   0  0  0

+   -2.7593    2.6795    0.0000 H   0  0  0

+   -3.6866   -2.0746    0.0000 H   0  0  0

+    5.7682   -0.0595    0.0000 H   0  0  0

+   -5.4260   -0.4218    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102234-07-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+    1.6767   -0.1966   -0.0605 C   0  0  0

+    0.3876   -0.8373   -0.5217 C   0  0  0

+    1.3271    1.2180    0.1200 N   0  0  0

+    2.1309   -0.8082    1.2602 C   0  0  0

+    2.7565   -0.3491   -1.1261 C   0  0  0

+   -0.5163    0.1633   -0.5662 N   0  0  0

+    0.2045   -2.0043   -0.7943 O   0  0  0

+    0.0238    1.3321   -0.1997 C   0  0  0

+    3.4211   -0.1274    1.7241 C   0  0  0

+    4.0442    0.3298   -0.6526 C   0  0  0

+   -1.9150   -0.0079   -0.9666 C   0  0  0

+   -0.5929    2.3787   -0.1600 O   0  0  0

+    4.5042   -0.3101    0.6589 C   0  0  0

+   -2.7622   -0.3320    0.2655 C   0  0  0

+   -4.1648   -0.5037   -0.1360 N   0  0  0

+   -4.9192   -0.8110    1.0864 C   0  0  0

+   -4.9185    0.5949    0.4828 C   0  0  0

+    1.9651    1.9634    0.0000 H   0  0  0

+    1.3143   -1.3522    0.0000 H   0  0  0

+    2.6325   -1.6515    0.0000 H   0  0  0

+    2.3249   -1.2303    0.0000 H   0  0  0

+    3.4606   -1.0325    0.0000 H   0  0  0

+    3.8682    0.7460    0.0000 H   0  0  0

+    2.7230    0.5621    0.0000 H   0  0  0

+    4.8664    0.8653    0.0000 H   0  0  0

+    3.5471    1.1758    0.0000 H   0  0  0

+   -1.6058    0.9233    0.0000 H   0  0  0

+   -2.6242    0.6702    0.0000 H   0  0  0

+    4.5986   -1.2868    0.0000 H   0  0  0

+    5.4226    0.0354    0.0000 H   0  0  0

+   -3.0714   -1.2632    0.0000 H   0  0  0

+   -2.0530   -1.0101    0.0000 H   0  0  0

+   -5.8923   -0.9368    0.0000 H   0  0  0

+   -4.6691   -1.7598    0.0000 H   0  0  0

+   -4.3274    1.3781    0.0000 H   0  0  0

+   -5.8488    0.9068    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  2  7  2  0

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+ 14 31  1  0

+ 14 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+525-64-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.7419   -0.4685   -0.0011 C   0  0  0

+   -0.7419   -0.4687   -0.0009 C   0  0  0

+    1.2055    0.8448   -0.0003 C   0  0  0

+    1.6595   -1.5222    0.0034 C   0  0  0

+   -1.2058    0.8450    0.0000 C   0  0  0

+   -1.6592   -1.5220   -0.0021 C   0  0  0

+    0.0000    1.7527    0.0004 C   0  0  0

+    2.5583    1.1051   -0.0003 C   0  0  0

+    3.0117   -1.2592    0.0026 C   0  0  0

+   -2.5581    1.1053    0.0008 C   0  0  0

+   -3.0119   -1.2590   -0.0024 C   0  0  0

+    3.4682    0.0539   -0.0011 C   0  0  0

+   -3.4683    0.0538    0.0007 C   0  0  0

+    4.8395    0.3169   -0.0012 N   0  0  0

+   -4.8395    0.3167    0.0015 N   0  0  0

+    1.3199   -2.5100    0.0000 H   0  0  0

+   -1.3196   -2.5098    0.0000 H   0  0  0

+    0.7034    2.5249    0.0000 H   0  0  0

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+    2.9003    2.0921    0.0000 H   0  0  0

+    3.6959   -2.0485    0.0000 H   0  0  0

+   -2.9001    2.0923    0.0000 H   0  0  0

+   -3.6960   -2.0483    0.0000 H   0  0  0

+    5.5228   -0.4731    0.0000 H   0  0  0

+    5.1820    1.3037    0.0000 H   0  0  0

+   -5.1821    1.3035    0.0000 H   0  0  0

+   -5.5228   -0.4734    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 10 22  1  0

+ 11 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+644-21-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.0350   -0.2027   -0.0703 C   0  0  0

+   -1.3391   -0.4398   -0.1511 N   0  0  0

+    0.8140   -0.9228    0.8263 C   0  0  0

+    0.6266    0.7498   -0.8906 C   0  0  0

+   -2.2371    0.1000    0.8729 C   0  0  0

+   -1.8457   -1.1751   -1.1849 N   0  0  0

+    2.1726   -0.6861    0.9033 C   0  0  0

+    1.9854    0.9814   -0.8084 C   0  0  0

+   -2.4386    1.5980    0.6360 C   0  0  0

+    2.7573    0.2663    0.0892 C   0  0  0

+    0.5765   -1.7281    0.0000 H   0  0  0

+    0.1582    1.4465    0.0000 H   0  0  0

+   -3.0732    0.1765    0.0000 H   0  0  0

+   -2.4982   -0.6979    0.0000 H   0  0  0

+   -2.6826   -1.1083    0.0000 H   0  0  0

+   -1.4851   -1.9333    0.0000 H   0  0  0

+    2.6441   -1.3807    0.0000 H   0  0  0

+    2.2248    1.7861    0.0000 H   0  0  0

+   -1.6065    1.7099    0.0000 H   0  0  0

+   -2.5505    2.4301    0.0000 H   0  0  0

+   -3.2707    1.4861    0.0000 H   0  0  0

+    3.5891    0.3805    0.0000 H   0  0  0

+  1  2  1  0

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+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102059-18-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    3.9611   -0.0827   -0.0685 C   0  0  0

+    2.7923   -0.9882   -0.0212 C   0  0  0

+    5.2501   -0.6071   -0.1776 C   0  0  0

+    3.7793    1.3004   -0.0099 C   0  0  0

+    1.4847   -0.4524    0.0897 C   0  0  0

+    2.9535   -2.1938   -0.0775 O   0  0  0

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+    0.4158   -1.2805    0.1330 C   0  0  0

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+   -1.1265    0.6608    0.3186 C   0  0  0

+   -3.3063   -1.0628    0.4001 C   0  0  0

+   -2.3993    1.1736    0.4267 C   0  0  0

+   -3.4941    0.3149    0.4652 C   0  0  0

+   -4.7827    0.8363    0.5747 N   0  0  0

+   -5.7208    0.5116   -0.3369 C   0  0  0

+   -7.1457    0.9633   -0.1456 C   0  0  0

+   -5.4182   -0.1442   -1.3112 O   0  0  0

+    5.3945   -1.6396    0.0000 H   0  0  0

+    2.8162    1.6997    0.0000 H   0  0  0

+    1.3443    0.5807    0.0000 H   0  0  0

+    7.3019   -0.1489    0.0000 H   0  0  0

+    4.7368    3.1727    0.0000 H   0  0  0

+    0.5563   -2.3136    0.0000 H   0  0  0

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+   -1.9085   -2.6142    0.0000 H   0  0  0

+   -0.3036    1.3010    0.0000 H   0  0  0

+   -4.1312   -1.7003    0.0000 H   0  0  0

+   -2.5459    2.2058    0.0000 H   0  0  0

+   -4.7560    1.8785    0.0000 H   0  0  0

+   -6.8307    1.9571    0.0000 H   0  0  0

+   -8.1395    1.2783    0.0000 H   0  0  0

+   -7.4607   -0.0305    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  2  6  2  0

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+  8 10  1  0

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+  3 21  1  0

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+ 14 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+621-77-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 48                          1 V2000

+   -0.1181   -0.4291   -0.0667 N   0  0  0

+    0.8715   -1.4541   -0.4246 C   0  0  0

+    0.3191    0.8204   -0.7035 C   0  0  0

+   -1.3786   -0.8147   -0.7150 C   0  0  0

+    2.2158   -1.1126    0.2213 C   0  0  0

+    0.2230    1.9674    0.3046 C   0  0  0

+   -2.4644   -0.9951    0.3477 C   0  0  0

+    3.2465   -2.1801   -0.1515 C   0  0  0

+    0.5586    3.2877   -0.3917 C   0  0  0

+   -3.8048   -1.2744   -0.3350 C   0  0  0

+    4.5908   -1.8387    0.4944 C   0  0  0

+    0.4625    4.4347    0.6163 C   0  0  0

+   -4.8906   -1.4548    0.7278 C   0  0  0

+    5.6215   -2.9062    0.1217 C   0  0  0

+    0.7981    5.7551   -0.0799 C   0  0  0

+   -6.2311   -1.7340    0.0451 C   0  0  0

+    0.0252   -2.0267    0.0000 H   0  0  0

+    1.2898   -2.3863    0.0000 H   0  0  0

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+    3.6648   -3.1123    0.0000 H   0  0  0

+    1.3648    2.6599    0.0000 H   0  0  0

+    1.4571    3.7743    0.0000 H   0  0  0

+   -4.1507   -2.2359    0.0000 H   0  0  0

+   -3.1346   -2.0457    0.0000 H   0  0  0

+    5.4371   -1.2661    0.0000 H   0  0  0

+    4.1725   -0.9065    0.0000 H   0  0  0

+   -0.3437    5.0625    0.0000 H   0  0  0

+   -0.4360    3.9481    0.0000 H   0  0  0

+   -4.5447   -0.4934    0.0000 H   0  0  0

+   -5.5608   -0.6835    0.0000 H   0  0  0

+    4.8864   -3.6159    0.0000 H   0  0  0

+    6.3312   -3.6413    0.0000 H   0  0  0

+    6.3566   -2.1965    0.0000 H   0  0  0

+    1.7884    5.5034    0.0000 H   0  0  0

+    1.0498    6.7454    0.0000 H   0  0  0

+   -0.1922    6.0068    0.0000 H   0  0  0

+   -6.4394   -0.7337    0.0000 H   0  0  0

+   -7.2314   -1.9423    0.0000 H   0  0  0

+   -6.0228   -2.7343    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

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+  5  2  1  0

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+  8  5  1  0

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+ 10  7  1  0

+ 11  8  1  0

+ 12  9  1  0

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+  2 17  1  0

+  2 18  1  0

+  3 19  1  0

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+  4 21  1  0

+  4 22  1  0

+  5 23  1  0

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+  7 27  1  0

+  7 28  1  0

+  8 29  1  0

+  8 30  1  0

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+ 15 44  1  0

+ 15 45  1  0

+ 15 46  1  0

+ 16 47  1  0

+ 16 48  1  0

+ 16 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89930-59-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 48                          1 V2000

+    0.6964   -0.3027   -0.4419 C   0  0  0

+   -0.4192   -1.1473   -0.4602 C   0  0  0

+    0.6708    1.1536   -0.5834 C   0  0  0

+    2.0282   -0.7054   -0.2913 C   0  0  0

+   -1.7397   -0.4758   -0.6649 C   0  0  2

+   -0.1513   -2.4678   -0.2947 C   0  0  0

+   -0.6634    1.8443   -0.7380 C   0  0  0

+    1.9360    1.5380   -0.5245 C   0  0  0

+    2.7644    0.4392   -0.3509 N   0  0  0

+    2.2697   -2.0686   -0.1296 C   0  0  0

+   -1.7173    0.9407   -0.0875 C   0  0  1

+   -2.8577   -1.2514   -0.0292 C   0  0  0

+    1.1621   -2.9060   -0.1295 C   0  0  0

+    4.2245    0.5007   -0.2486 C   0  0  0

+   -3.0544    1.5271   -0.2147 N   0  0  0

+   -3.8237   -0.6494    0.6044 C   0  0  0

+    4.6264    0.6650    1.2185 C   0  0  0

+   -3.9046    0.8398    0.7637 C   0  0  0

+   -2.9465    2.9239    0.2272 C   0  0  0

+   -4.9168   -1.4930    1.2081 C   0  0  0

+    6.1513    0.7292    1.3254 C   0  0  0

+   -2.6584    0.0143    0.0000 H   0  0  0

+   -0.9311   -3.1579    0.0000 H   0  0  0

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+   -0.7747    0.4982    0.0000 H   0  0  0

+   -2.8321   -2.2924    0.0000 H   0  0  0

+    1.3307   -3.9335    0.0000 H   0  0  0

+    3.8517   -0.4716    0.0000 H   0  0  0

+    4.9688   -0.2275    0.0000 H   0  0  0

+    4.9992    1.6372    0.0000 H   0  0  0

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+   -4.9101    0.5693    0.0000 H   0  0  0

+   -1.9083    2.8437    0.0000 H   0  0  0

+   -2.8663    3.9621    0.0000 H   0  0  0

+   -3.9847    3.0041    0.0000 H   0  0  0

+   -5.5530   -0.6687    0.0000 H   0  0  0

+   -5.7411   -2.1292    0.0000 H   0  0  0

+   -4.2806   -2.3173    0.0000 H   0  0  0

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+    7.1917    0.7730    0.0000 H   0  0  0

+    6.1075    1.7696    0.0000 H   0  0  0

+  1  2  2  0

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+  5 11  1  0

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+ 14 17  1  0

+ 15 18  1  0

+ 15 19  1  0

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+  7 11  1  0

+  8  9  1  0

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+ 20 40  1  0

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+ 20 42  1  0

+ 21 43  1  0

+ 21 44  1  0

+ 21 45  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+116169-87-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.2809    0.0040   -0.0017 C   0  0  0

+   -0.9367   -0.6379   -0.0003 N   0  0  0

+    0.0614    1.3170   -0.0010 N   0  0  0

+    1.4697   -0.5850    0.0016 N   0  0  0

+   -1.8874    0.3153    0.0012 C   0  0  0

+   -1.1568   -2.0863   -0.0005 C   0  0  0

+   -1.2389    1.5377    0.0007 C   0  0  0

+    2.4837    0.0898    0.0000 O   0  0  0

+   -2.8805    0.1671    0.0000 H   0  0  0

+   -2.1495   -1.9355    0.0000 H   0  0  0

+   -1.3076   -3.0790    0.0000 H   0  0  0

+   -0.1641   -2.2371    0.0000 H   0  0  0

+   -1.6824    2.4385    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  7  2  0

+  5  9  1  0

+  6 10  1  0

+  6 11  1  0

+  6 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2942-42-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.4857   -0.2796    0.0018 C   0  0  0

+   -1.6775    0.4704    0.0020 C   0  0  0

+    0.7396    0.3828    0.0001 C   0  0  0

+   -0.8508   -1.6005   -0.0019 N   0  0  0

+   -2.7705   -0.4965    0.0034 C   0  0  0

+   -1.6156    1.8685    0.0003 C   0  0  0

+    0.7742    1.7483   -0.0015 C   0  0  0

+    2.0011   -0.3911    0.0004 N   0  3  0

+   -2.2467   -1.6889   -0.0040 N   0  0  0

+   -0.4008    2.4902   -0.0013 C   0  0  0

+    3.0718    0.1895   -0.0011 O   0  0  0

+    1.9687   -1.6087    0.0022 O   0  5  0

+   -0.1937   -2.4095    0.0000 H   0  0  0

+   -3.7884   -0.2728    0.0000 H   0  0  0

+   -2.4925    2.4318    0.0000 H   0  0  0

+    1.6932    2.2398    0.0000 H   0  0  0

+   -0.3538    3.5314    0.0000 H   0  0  0

+  1  2  2  0

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+  5  9  2  0

+  7 10  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2598-29-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.5443   -0.1203   -0.2402 C   0  0  0

+   -1.7990    0.4321    0.1165 C   0  0  0

+    0.5582    0.7419   -0.4175 C   0  0  0

+   -0.4220   -1.4397   -0.4085 N   0  0  0

+   -1.9236    1.8209    0.2861 C   0  0  0

+   -2.8981   -0.4291    0.2931 C   0  0  0

+    0.3985    2.0869   -0.2434 C   0  0  0

+    1.7723    0.2367   -0.7592 O   0  0  0

+   -1.4446   -2.2449   -0.2502 C   0  0  0

+   -0.8381    2.6231    0.1064 C   0  0  0

+   -2.7028   -1.7688    0.1109 C   0  0  0

+    2.5478   -0.3367    0.1748 C   0  0  0

+    3.9380   -0.7981   -0.1797 C   0  0  0

+    2.1312   -0.4827    1.2995 O   0  0  0

+   -2.8469    2.2359    0.0000 H   0  0  0

+   -3.8379   -0.0530    0.0000 H   0  0  0

+    1.2105    2.6914    0.0000 H   0  0  0

+   -1.2907   -3.2454    0.0000 H   0  0  0

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+   -3.4919   -2.4029    0.0000 H   0  0  0

+    3.6191   -1.7589    0.0000 H   0  0  0

+    4.8988   -1.1170    0.0000 H   0  0  0

+    4.2569    0.1627    0.0000 H   0  0  0

+  1  2  1  0

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+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92-70-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -1.2081    0.6703    0.0102 C   0  0  0

+   -1.4810   -0.7221   -0.0115 C   0  0  0

+    0.1209    1.1159    0.0173 C   0  0  0

+   -2.2794    1.5825    0.0302 C   0  0  0

+   -0.4183   -1.6406   -0.0257 C   0  0  0

+   -2.8167   -1.1606   -0.0179 C   0  0  0

+    1.1520    0.1895    0.0029 C   0  0  0

+   -3.5587    1.1194    0.0285 C   0  0  0

+    0.8700   -1.1931   -0.0187 C   0  0  0

+   -3.8265   -0.2484   -0.0033 C   0  0  0

+    2.5523    0.6516    0.0102 C   0  0  0

+    1.8914   -2.0867   -0.0321 O   0  0  0

+    2.8288    1.9655   -0.1037 O   0  0  0

+    3.4568   -0.1524    0.1190 O   0  0  0

+    0.3329    2.1395    0.0000 H   0  0  0

+   -2.0933    2.6111    0.0000 H   0  0  0

+   -0.6149   -2.6673    0.0000 H   0  0  0

+   -3.0333   -2.1832    0.0000 H   0  0  0

+   -4.3525    1.7995    0.0000 H   0  0  0

+   -4.8183   -0.5786    0.0000 H   0  0  0

+    2.6781   -2.7750    0.0000 H   0  0  0

+    3.0441    2.9884    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  2  0

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+  7  9  2  0

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+  3 15  1  0

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+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94500-54-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    0.7496   -0.6676   -0.0464 C   0  0  0

+   -0.4107    0.0974   -0.2601 C   0  0  0

+    2.0106   -0.0456   -0.0669 C   0  0  0

+    0.6539   -2.1067    0.2032 C   0  0  0

+   -1.7055   -0.5803   -0.2319 C   0  0  0

+   -0.3012    1.4812   -0.4929 C   0  0  0

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+   -0.5884   -2.7180    0.2291 C   0  0  0

+    1.8849   -2.8674    0.4212 C   0  0  0

+   -1.7603   -1.9765    0.0070 C   0  0  0

+   -2.8928    0.1330   -0.4377 C   0  0  0

+    0.9119    2.0883   -0.5132 C   0  0  0

+   -1.5466    2.2984   -0.7218 C   0  0  0

+    3.3563    1.9544   -0.3212 C   0  0  0

+    3.0830   -2.2445    0.3912 C   0  0  0

+    4.4189   -0.1627    0.1222 C   0  0  0

+   -3.0163   -2.6151    0.0315 C   0  0  0

+   -4.0897   -0.5185   -0.4069 C   0  0  0

+   -2.1598    2.9145    0.8578 Cl  0  0  0

+    4.4907    1.1993   -0.1104 C   0  0  0

+   -4.1492   -1.8901   -0.1726 C   0  0  0

+   -0.6441   -3.7604    0.0000 H   0  0  0

+    1.8462   -3.9106    0.0000 H   0  0  0

+   -2.8706    1.1766    0.0000 H   0  0  0

+    0.9622    3.1310    0.0000 H   0  0  0

+   -2.5347    1.9617    0.0000 H   0  0  0

+   -1.6779    1.2628    0.0000 H   0  0  0

+    3.4280    2.9958    0.0000 H   0  0  0

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+   -3.0679   -3.6577    0.0000 H   0  0  0

+   -4.9753    0.0341    0.0000 H   0  0  0

+    5.4235    1.6678    0.0000 H   0  0  0

+   -5.0756   -2.3713    0.0000 H   0  0  0

+  1  2  2  0

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+  7 13  1  0

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+ 10 16  2  0

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+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52411-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -3.4149    0.1162   -0.0013 C   0  0  0

+   -4.6489    0.7672   -0.0007 C   0  0  0

+   -1.9220    1.0521    0.0007 S   0  0  0

+   -3.3668   -1.2703    0.0023 C   0  0  0

+   -5.8197    0.0247   -0.0018 C   0  0  0

+   -4.7047    2.1662    0.0006 N   0  0  0

+   -0.7062   -0.2942   -0.0010 C   0  0  0

+   -4.5396   -2.0024    0.0064 C   0  0  0

+   -5.7624   -1.3570   -0.0035 C   0  0  0

+    0.7062    0.2942    0.0004 C   0  0  0

+    1.9220   -1.0521   -0.0013 S   0  0  0

+    3.4149   -0.1162    0.0007 C   0  0  0

+    4.6489   -0.7672    0.0001 C   0  0  0

+    3.3668    1.2703   -0.0028 C   0  0  0

+    5.8197   -0.0247    0.0017 C   0  0  0

+    4.7047   -2.1662   -0.0018 N   0  0  0

+    4.5395    2.0024   -0.0012 C   0  0  0

+    5.7624    1.3570    0.0040 C   0  0  0

+   -2.4483   -1.7591    0.0000 H   0  0  0

+   -6.7416    0.5071    0.0000 H   0  0  0

+   -3.8250    2.7219    0.0000 H   0  0  0

+   -5.6258    2.6501    0.0000 H   0  0  0

+   -1.5523   -0.8998    0.0000 H   0  0  0

+   -0.2001   -1.2033    0.0000 H   0  0  0

+   -4.5019   -3.0422    0.0000 H   0  0  0

+   -6.6421   -1.9126    0.0000 H   0  0  0

+    1.5523    0.8998    0.0000 H   0  0  0

+    0.2001    1.2033    0.0000 H   0  0  0

+    2.4483    1.7591    0.0000 H   0  0  0

+    6.7416   -0.5071    0.0000 H   0  0  0

+    3.8250   -2.7219    0.0000 H   0  0  0

+    5.6258   -2.6501    0.0000 H   0  0  0

+    4.5018    3.0422    0.0000 H   0  0  0

+    6.6421    1.9126    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  4  8  2  0

+  5  9  2  0

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+  8  9  1  0

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+  5 20  1  0

+  6 21  1  0

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+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-20-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 51                          1 V2000

+    2.3964    0.2622   -0.4801 C   0  0  0

+    1.1506   -0.5911   -0.2336 C   0  0  0

+    3.5993   -0.6507   -0.7262 C   0  0  0

+    2.1716    1.1510   -1.7050 C   0  0  0

+   -0.0043    0.2855    0.0027 N   0  0  0

+    4.6055   -0.4871    0.4148 C   0  0  0

+    2.5586    2.5922   -1.3674 C   0  0  0

+   -1.1603   -0.5918    0.2310 C   0  0  0

+    5.8596   -1.3090    0.1105 C   0  0  0

+   -2.4051    0.2607    0.4852 C   0  0  0

+    6.8658   -1.1455    1.2514 C   0  0  0

+   -3.6091   -0.6530    0.7230 C   0  0  0

+   -2.1793    1.1380    1.7182 C   0  0  0

+   -4.6151   -0.4779   -0.4164 C   0  0  0

+   -2.4871    2.5957    1.3702 C   0  0  0

+   -5.8701   -1.3010   -0.1196 C   0  0  0

+   -6.8761   -1.1259   -1.2590 C   0  0  0

+    3.3161    0.8709    0.0000 H   0  0  0

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+   -1.8771   -1.4300    0.0000 H   0  0  0

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+   -3.3235    0.8713    0.0000 H   0  0  0

+    7.0427   -2.2341    0.0000 H   0  0  0

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+    6.6889   -0.0569    0.0000 H   0  0  0

+   -4.0609   -1.6591    0.0000 H   0  0  0

+   -2.7459   -1.3395    0.0000 H   0  0  0

+   -1.2831    0.4952    0.0000 H   0  0  0

+   -1.2558    1.7409    0.0000 H   0  0  0

+   -4.1404    0.5176    0.0000 H   0  0  0

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+   -1.4080    2.8236    0.0000 H   0  0  0

+   -2.7150    3.6748    0.0000 H   0  0  0

+   -3.5662    2.3678    0.0000 H   0  0  0

+   -6.3448   -2.2965    0.0000 H   0  0  0

+   -5.0392   -2.0263    0.0000 H   0  0  0

+   -6.6870   -0.0393    0.0000 H   0  0  0

+   -7.9627   -0.9368    0.0000 H   0  0  0

+   -7.0652   -2.2125    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 16 48  1  0

+ 16 49  1  0

+ 17 50  1  0

+ 17 51  1  0

+ 17 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6190-65-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.6800   -0.6669   -0.0372 C   0  0  0

+    0.0536   -1.7730    0.0204 N   0  0  0

+   -0.0853    0.5234   -0.0681 N   0  0  0

+   -2.0569   -0.7521   -0.0708 N   0  0  0

+    1.3794   -1.6870    0.0471 C   0  0  0

+    1.2347    0.6057   -0.0414 C   0  0  0

+   -2.8650    0.4682   -0.1344 C   0  0  0

+    1.9680   -0.4941    0.0159 N   0  0  0

+    2.1448   -2.8337    0.1074 N   0  0  0

+    2.0066    2.1602   -0.0824 Cl  0  0  0

+   -4.1687    0.1782   -0.8809 C   0  0  0

+   -3.1846    0.9427    1.2846 C   0  0  0

+   -2.5017   -1.6453    0.0000 H   0  0  0

+   -2.0352    1.0224    0.0000 H   0  0  0

+    1.7031   -3.7284    0.0000 H   0  0  0

+    3.1405   -2.7689    0.0000 H   0  0  0

+   -4.3854    1.1522    0.0000 H   0  0  0

+   -5.1427   -0.0385    0.0000 H   0  0  0

+   -3.9520   -0.7958    0.0000 H   0  0  0

+   -2.3570    1.5001    0.0000 H   0  0  0

+   -3.7420    1.7703    0.0000 H   0  0  0

+   -4.0122    0.3853    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

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+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+288-32-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  9                          1 V2000

+    0.7463   -0.9071    0.0000 C   0  0  0

+   -0.5976   -0.9932    0.0000 C   0  0  0

+    1.0578    0.4258    0.0000 N   0  0  0

+   -1.0932    0.2531    0.0000 N   0  0  0

+   -0.1075    1.1083    0.0000 C   0  0  0

+    1.3990   -1.6779    0.0000 H   0  0  0

+   -1.1377   -1.8467    0.0000 H   0  0  0

+    1.9858    0.8244    0.0000 H   0  0  0

+   -0.2007    2.1140    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  5  2  0

+  1  6  1  0

+  2  7  1  0

+  3  8  1  0

+  5  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+202-33-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -2.0722   -0.0539   -0.0031 C   0  0  0

+   -1.3031   -1.2176   -0.0050 C   0  0  0

+   -1.5602    1.2479   -0.0018 C   0  0  0

+   -3.4412   -0.3643    0.0033 C   0  0  0

+    0.0963   -1.0497   -0.0034 C   0  0  0

+   -2.2509   -2.3272   -0.0078 C   0  0  0

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+   -2.4905    2.3044    0.0020 C   0  0  0

+   -3.5171   -1.8246    0.0038 C   0  0  0

+   -4.3234    0.7100    0.0073 C   0  0  0

+    0.6394    0.2649   -0.0037 C   0  0  0

+    0.9557   -2.1670   -0.0005 C   0  0  0

+   -3.8280    2.0114    0.0035 C   0  0  0

+    2.1039    0.4096   -0.0023 C   0  0  0

+    2.2981   -2.0291    0.0033 C   0  0  0

+    2.9063   -0.7513    0.0037 C   0  0  0

+    2.7056    1.6683   -0.0071 C   0  0  0

+    4.3020   -0.6201    0.0087 C   0  0  0

+    4.0791    1.7650   -0.0033 C   0  0  0

+    4.8681    0.6215    0.0056 C   0  0  0

+   -1.9983   -3.3462    0.0000 H   0  0  0

+    0.2617    2.3598    0.0000 H   0  0  0

+   -2.1636    3.3021    0.0000 H   0  0  0

+   -4.4007   -2.3916    0.0000 H   0  0  0

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+  1  2  1  0

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+  2  5  2  0

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+ 13 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35144-55-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+   -2.0719    0.2147    0.0751 C   0  0  0

+   -3.2183    0.8570    0.5235 C   0  0  0

+   -0.8475    0.7402    0.3451 O   0  0  0

+   -2.1773   -0.9665   -0.6434 C   0  0  0

+   -4.4619    0.3205    0.2482 C   0  0  0

+   -3.0897    2.3322    1.4295 Cl  0  0  0

+    0.1167   -0.1371   -0.2403 C   0  0  0

+   -3.4225   -1.5023   -0.9120 C   0  0  0

+   -4.5643   -0.8558   -0.4737 C   0  0  0

+    1.5029    0.3916    0.0243 C   0  0  0

+   -6.1274   -1.5282   -0.8179 Cl  0  0  0

+    2.5785   -0.2768   -0.4370 N   0  0  0

+    1.6506    1.4185    0.6524 O   0  0  0

+    3.9261    0.2372   -0.1797 C   0  0  1

+    4.9104   -0.9312   -0.0974 C   0  0  0

+    4.3340    1.1598   -1.2992 C   0  0  0

+    4.5024   -1.8539    1.0221 C   0  0  0

+    5.1746    2.1780   -1.0573 O   0  0  0

+    3.9045    0.9830   -2.4147 O   0  0  0

+    5.2252   -2.9548    1.2816 O   0  0  0

+    3.5247   -1.6027    1.6860 O   0  0  0

+   -1.3790   -1.5445    0.0000 H   0  0  0

+   -5.2610    0.8973    0.0000 H   0  0  0

+   -0.6518   -0.7541    0.0000 H   0  0  0

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+    5.7413   -1.4612    0.0000 H   0  0  0

+    5.5597   -0.1898    0.0000 H   0  0  0

+    5.8020    2.9380    0.0000 H   0  0  0

+    5.7661   -3.7787    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+144561-63-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+    0.8005    0.1074    0.0503 C   0  0  0

+   -0.6720   -0.0664    0.0359 C   0  0  0

+    1.3283    1.3901    0.1983 C   0  0  0

+    1.6524   -0.9804   -0.0746 C   0  0  0

+   -1.4802    1.0410   -0.2189 C   0  0  0

+   -1.2467   -1.3105    0.2722 C   0  0  0

+    2.6939    1.5631    0.2040 C   0  0  0

+    0.4045    2.5671    0.3566 C   0  0  0

+    3.0280   -0.7960   -0.0633 C   0  0  0

+   -2.8527    0.8967   -0.2286 C   0  0  0

+   -0.8526    2.3816   -0.4885 C   0  0  0

+   -2.6213   -1.4430    0.2573 C   0  0  0

+    3.5475    0.4733    0.0700 C   0  0  0

+    3.8973   -2.0192   -0.1949 C   0  0  0

+   -3.4211   -0.3418    0.0088 C   0  0  0

+    5.0300    0.7436    0.0777 C   0  0  0

+    5.3179   -1.6281   -0.5967 C   0  0  0

+   -4.8938   -0.4899   -0.0032 N   0  3  0

+    5.8088   -0.5393    0.3599 C   0  0  0

+   -5.3981   -1.5788    0.2054 O   0  0  0

+   -5.6013    0.4772   -0.2217 O   0  5  0

+    1.2618   -1.9399    0.0000 H   0  0  0

+   -0.6472   -2.1554    0.0000 H   0  0  0

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+   -3.0468   -2.3876    0.0000 H   0  0  0

+    2.9889   -2.5172    0.0000 H   0  0  0

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+    5.9743    1.1697    0.0000 H   0  0  0

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+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+607-35-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.3805   -0.1355    0.0015 C   0  0  0

+   -1.4883    0.7483    0.0014 C   0  0  0

+    0.9200    0.3989    0.0002 C   0  0  0

+   -0.5836   -1.4565   -0.0026 N   0  0  0

+   -1.2693    2.1354   -0.0006 C   0  0  0

+   -2.7893    0.2116    0.0026 C   0  0  0

+    1.0955    1.7482   -0.0011 C   0  0  0

+    2.0938   -0.5030    0.0009 N   0  3  0

+   -1.7942   -1.9599   -0.0069 C   0  0  0

+    0.0046    2.6154   -0.0022 C   0  0  0

+   -2.9257   -1.1477    0.0040 C   0  0  0

+    3.2194   -0.0376   -0.0002 O   0  0  0

+    1.9340   -1.7105    0.0025 O   0  5  0

+   -2.0715    2.7888    0.0000 H   0  0  0

+   -3.6193    0.8293    0.0000 H   0  0  0

+    2.0544    2.1367    0.0000 H   0  0  0

+   -1.9121   -2.9878    0.0000 H   0  0  0

+    0.1650    3.6375    0.0000 H   0  0  0

+   -3.8686   -1.5734    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+  8 13  1  0

+  7 10  1  0

+  9 11  2  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60-24-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    1.0815    0.5004    0.0000 C   0  0  0

+    0.0503   -0.6298    0.0000 C   0  0  0

+    2.3978   -0.0559    0.0000 O   0  0  0

+   -1.6207    0.0764    0.0000 S   0  0  0

+    1.6448    1.5001    0.0000 H   0  0  0

+    0.1519    1.1730    0.0000 H   0  0  0

+   -0.5130   -1.6295    0.0000 H   0  0  0

+    0.9799   -1.3024    0.0000 H   0  0  0

+    3.4547   -0.5026    0.0000 H   0  0  0

+   -2.6776    0.5231    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+126-33-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.5903    0.0009    0.0049 S   0  0  0

+    0.5906   -1.3116    0.5198 C   0  0  0

+    0.5957    1.2133   -0.7151 C   0  0  0

+   -1.4206   -0.5050   -1.0315 O   0  0  0

+   -1.1850    0.5683    1.1640 O   0  0  0

+    1.9484   -0.7626    0.0192 C   0  0  0

+    1.9125    0.7743   -0.0133 C   0  0  0

+   -0.3056   -1.9467    0.0000 H   0  0  0

+    1.1176   -2.2754    0.0000 H   0  0  0

+    1.0958    2.1913    0.0000 H   0  0  0

+   -0.2960    1.8547    0.0000 H   0  0  0

+    2.2350   -1.8230    0.0000 H   0  0  0

+    3.0355   -0.6054    0.0000 H   0  0  0

+    3.0063    0.6737    0.0000 H   0  0  0

+    2.1380    1.8493    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

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+  6  7  1  0

+  2  8  1  0

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+  3 10  1  0

+  3 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96-45-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.1812    0.0000    0.0026 C   0  0  0

+    0.5492   -1.1228    0.0012 N   0  0  0

+    0.5492    1.1228    0.0012 N   0  0  0

+   -1.8932    0.0000   -0.0009 S   0  0  0

+    1.9769   -0.7705   -0.0014 C   0  0  0

+    1.9769    0.7705   -0.0014 C   0  0  0

+    0.1441   -2.1486    0.0000 H   0  0  0

+    0.1441    2.1486    0.0000 H   0  0  0

+    2.1540   -1.8591    0.0000 H   0  0  0

+    3.0762   -0.6817    0.0000 H   0  0  0

+    3.0762    0.6817    0.0000 H   0  0  0

+    2.1540    1.8591    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  6  1  0

+  2  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51630-58-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 54                          1 V2000

+    3.6267   -0.7306    0.3206 C   0  0  0

+    2.2480   -1.2744    0.5934 C   0  0  0

+    4.4157   -0.2908    1.3673 C   0  0  0

+    4.1043   -0.6772   -0.9754 C   0  0  0

+    1.2382   -0.5207   -0.2332 C   0  0  0

+    2.2030   -2.7586    0.2248 C   0  0  0

+    5.6803    0.2075    1.1178 C   0  0  0

+    5.3691   -0.1790   -1.2262 C   0  0  0

+    0.2820    0.2025    0.3706 O   0  0  0

+    1.2892   -0.5674   -1.4395 O   0  0  0

+    3.1213   -3.5450    1.1624 C   0  0  0

+    0.7695   -3.2753    0.3634 C   0  0  0

+    6.1569    0.2662   -0.1799 C   0  0  0

+   -0.6186    1.0207   -0.4217 C   0  0  0

+    7.7454    0.8920   -0.4941 Cl  0  0  0

+   -1.9101    1.2179    0.3296 C   0  0  0

+    0.0047    2.3294   -0.6779 C   0  0  0

+   -3.1099    1.2419   -0.3549 C   0  0  0

+   -1.8936    1.3689    1.7037 C   0  0  0

+    0.4857    3.3393   -0.8756 N   0  0  0

+   -4.2985    1.4235    0.3373 C   0  0  0

+   -3.0769    1.5500    2.3961 C   0  0  0

+   -5.4800    1.4471   -0.3335 O   0  0  0

+   -4.2787    1.5805    1.7160 C   0  0  0

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+   -7.0132   -0.1512   -1.2020 C   0  0  0

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+    4.3221   -1.5548    0.0000 H   0  0  0

+    3.0301   -2.3931    0.0000 H   0  0  0

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+    5.7582   -0.9953    0.0000 H   0  0  0

+    2.5331   -4.2318    0.0000 H   0  0  0

+    3.8081   -4.1332    0.0000 H   0  0  0

+    3.7095   -2.8582    0.0000 H   0  0  0

+    0.4629   -2.4246    0.0000 H   0  0  0

+   -0.0812   -3.5819    0.0000 H   0  0  0

+    1.0761   -4.1260    0.0000 H   0  0  0

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+   -3.1874    0.3410    0.0000 H   0  0  0

+   -1.1765    1.9198    0.0000 H   0  0  0

+   -2.9969    2.4507    0.0000 H   0  0  0

+   -4.8681    2.2663    0.0000 H   0  0  0

+   -7.6389    0.5016    0.0000 H   0  0  0

+   -4.3202   -0.7236    0.0000 H   0  0  0

+   -8.3344   -1.5891    0.0000 H   0  0  0

+   -5.0221   -2.8129    0.0000 H   0  0  0

+   -7.0704   -3.3122    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  3  7  2  0

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+  5  9  1  0

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+ 16 18  1  0

+ 16 19  2  0

+ 17 20  3  0

+ 18 21  2  0

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+ 21 23  1  0

+ 21 24  1  0

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+ 26 28  1  0

+ 27 29  2  0

+ 28 30  2  0

+  8 13  2  0

+ 22 24  2  0

+ 29 30  1  0

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+  3 32  1  0

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+ 24 47  1  0

+ 26 48  1  0

+ 27 49  1  0

+ 28 50  1  0

+ 29 51  1  0

+ 30 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13952-84-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.4509    0.0404   -0.3534 C   0  0  0

+   -0.7551    0.7427    0.2737 C   0  0  0

+    1.7313    0.7841    0.0320 C   0  0  0

+    0.5216   -1.3426    0.1367 N   0  0  0

+   -2.0355   -0.0010   -0.1117 C   0  0  0

+   -0.4702   -0.5209    0.0000 H   0  0  0

+   -0.0604    1.5678    0.0000 H   0  0  0

+   -1.4488    1.5686    0.0000 H   0  0  0

+    2.2730   -0.1486    0.0000 H   0  0  0

+    2.6640    1.3258    0.0000 H   0  0  0

+    1.1896    1.7168    0.0000 H   0  0  0

+   -0.3838   -1.9289    0.0000 H   0  0  0

+    1.4820   -1.8335    0.0000 H   0  0  0

+   -2.5772    0.9317    0.0000 H   0  0  0

+   -2.9682   -0.5427    0.0000 H   0  0  0

+   -1.4938   -0.9337    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17804-35-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+    0.1332   -0.5988    0.3971 N   0  0  0

+    0.6140   -1.8727    0.1218 C   0  0  0

+    1.1428    0.2842    0.1073 C   0  0  0

+   -1.0952   -0.2883    0.8565 C   0  0  0

+    1.9304   -1.7020   -0.3355 C   0  0  0

+    0.0718   -3.1446    0.2132 C   0  0  0

+    2.1918   -0.3675   -0.3209 N   0  0  0

+    1.0622    1.6581    0.2467 N   0  0  0

+   -2.0968   -0.0421   -0.0111 N   0  0  0

+   -1.2997   -0.2302    2.0530 O   0  0  0

+    2.6836   -2.8221   -0.6953 C   0  0  0

+    0.8285   -4.2415   -0.1461 C   0  0  0

+    2.1204    2.4307   -0.0693 C   0  0  0

+   -3.4320    0.2954    0.4883 C   0  0  0

+    2.1293   -4.0790   -0.5984 C   0  0  0

+    2.0419    3.7678    0.0664 O   0  0  0

+    3.1450    1.9205   -0.4766 O   0  0  0

+   -4.3756    0.5253   -0.6939 C   0  0  0

+    3.1819    4.6002   -0.2740 C   0  0  0

+   -5.7701    0.8778   -0.1724 C   0  0  0

+   -6.7137    1.1076   -1.3546 C   0  0  0

+   -0.9251   -3.2451    0.0000 H   0  0  0

+    0.1560    2.0856    0.0000 H   0  0  0

+   -2.3392   -1.0143    0.0000 H   0  0  0

+    3.6817   -2.7337    0.0000 H   0  0  0

+    0.4187   -5.1559    0.0000 H   0  0  0

+   -2.7357    1.0159    0.0000 H   0  0  0

+   -3.7106    1.2579    0.0000 H   0  0  0

+    2.7276   -4.8828    0.0000 H   0  0  0

+   -5.0719   -0.1952    0.0000 H   0  0  0

+   -4.0970   -0.4372    0.0000 H   0  0  0

+    3.7728    3.7910    0.0000 H   0  0  0

+    3.9911    5.1911    0.0000 H   0  0  0

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+   -6.0488    1.8403    0.0000 H   0  0  0

+   -6.4766    2.0811    0.0000 H   0  0  0

+   -7.6872    1.3447    0.0000 H   0  0  0

+   -6.9508    0.1341    0.0000 H   0  0  0

+  1  2  1  0

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+  5  7  1  0

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+ 19 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16683-64-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+    2.1814   -0.1803    0.0029 C   0  0  0

+    1.1220   -1.0759    0.0044 C   0  0  0

+    2.0836    1.2597    0.0020 C   0  0  0

+    3.4426   -0.8972   -0.0041 C   0  0  0

+   -0.2107   -0.4703    0.0036 C   0  0  0

+    1.6849   -2.3696    0.0055 C   0  0  0

+    0.8138    1.8311    0.0027 C   0  0  0

+    3.3046    1.9682    0.0001 C   0  0  0

+    3.0488   -2.3022   -0.0056 C   0  0  0

+    4.5865   -0.1136   -0.0071 C   0  0  0

+   -0.3236    0.9978    0.0027 C   0  0  0

+   -1.3497   -1.2648    0.0033 C   0  0  0

+    4.4822    1.2754   -0.0016 C   0  0  0

+   -1.5956    1.5901    0.0011 C   0  0  0

+   -2.6111   -0.6702    0.0012 C   0  0  0

+   -2.7340    0.7917   -0.0002 C   0  0  0

+   -3.7862   -1.4501   -0.0003 C   0  0  0

+   -4.0260    1.3629   -0.0029 C   0  0  0

+   -4.9977   -0.8366   -0.0040 C   0  0  0

+   -5.1158    0.5539   -0.0038 C   0  0  0

+    1.1314   -3.2613    0.0000 H   0  0  0

+    0.7041    2.8748    0.0000 H   0  0  0

+    3.3078    3.0177    0.0000 H   0  0  0

+    3.7034   -3.1226    0.0000 H   0  0  0

+    5.5326   -0.5678    0.0000 H   0  0  0

+   -1.2613   -2.3106    0.0000 H   0  0  0

+    5.3731    1.8302    0.0000 H   0  0  0

+   -1.6877    2.6355    0.0000 H   0  0  0

+   -3.7247   -2.4978    0.0000 H   0  0  0

+   -4.1424    2.4059    0.0000 H   0  0  0

+   -5.8678   -1.4234    0.0000 H   0  0  0

+   -6.0725    0.9854    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101-84-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    1.0578    0.7120    0.0261 C   0  0  0

+   -0.0700    1.4682    0.0767 O   0  0  0

+    1.5841    0.3297   -1.1998 C   0  0  0

+    1.6885    0.3255    1.1998 C   0  0  0

+   -1.1214    0.6080    0.0439 C   0  0  0

+    2.7305   -0.4390   -1.2484 C   0  0  0

+    2.8351   -0.4435    1.1456 C   0  0  0

+   -2.4153    1.0960   -0.0682 C   0  0  0

+   -0.9025   -0.7605    0.1167 C   0  0  0

+    3.3540   -0.8277   -0.0768 C   0  0  0

+   -3.4825    0.2193   -0.1013 C   0  0  0

+   -1.9729   -1.6326    0.0832 C   0  0  0

+   -3.2620   -1.1433   -0.0228 C   0  0  0

+    0.9918   -0.5187    0.0000 H   0  0  0

+    2.2471    1.1964    0.0000 H   0  0  0

+    2.1686   -1.3078    0.0000 H   0  0  0

+    3.4313    0.4021    0.0000 H   0  0  0

+   -2.5837    2.1169    0.0000 H   0  0  0

+    0.0643   -1.1291    0.0000 H   0  0  0

+    4.2095   -1.4097    0.0000 H   0  0  0

+   -4.4504    0.5851    0.0000 H   0  0  0

+   -1.8076   -2.6540    0.0000 H   0  0  0

+   -4.0638   -1.7973    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+789-47-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    0.0436    0.5821    0.0022 C   0  0  0

+   -0.7732   -0.5643    0.0011 C   0  0  0

+    1.4971    0.4053    0.0015 C   0  0  0

+   -0.5345    1.8638   -0.0019 C   0  0  0

+   -2.2265   -0.3865    0.0012 C   0  0  0

+   -0.1952   -1.8459   -0.0005 C   0  0  0

+    2.0228   -0.9080    0.0000 C   0  0  0

+    2.3634    1.5030    0.0018 C   0  0  0

+   -1.8765    2.0331   -0.0072 C   0  0  0

+   -2.7523    0.9264    0.0026 C   0  0  0

+   -3.0961   -1.4809   -0.0010 C   0  0  0

+    1.1468   -2.0150   -0.0014 C   0  0  0

+    3.4135   -1.0892   -0.0008 C   0  0  0

+    3.7118    1.3052    0.0007 C   0  0  0

+   -4.1443    1.1054    0.0026 C   0  0  0

+   -4.4447   -1.2721   -0.0019 C   0  0  0

+    4.2439    0.0126    0.0000 C   0  0  0

+   -4.9657    0.0177    0.0013 C   0  0  0

+    5.6288   -0.1651   -0.0003 N   0  0  0

+    0.0896    2.7086    0.0000 H   0  0  0

+   -0.8193   -2.6907    0.0000 H   0  0  0

+    1.9753    2.4790    0.0000 H   0  0  0

+   -2.2738    3.0054    0.0000 H   0  0  0

+   -2.7135   -2.4590    0.0000 H   0  0  0

+    1.5442   -2.9872    0.0000 H   0  0  0

+    3.8203   -2.0575    0.0000 H   0  0  0

+    4.3582    2.1330    0.0000 H   0  0  0

+   -4.5514    2.0736    0.0000 H   0  0  0

+   -5.0971   -2.0952    0.0000 H   0  0  0

+   -6.0069    0.1554    0.0000 H   0  0  0

+    6.0339   -1.1341    0.0000 H   0  0  0

+    6.2654    0.6703    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

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+  6 12  2  0

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+ 13 17  2  0

+ 15 18  2  0

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+  7 12  1  0

+  9 10  1  0

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+  9 23  1  0

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+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134998-76-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+    0.3033   -0.1243    0.0038 C   0  0  0

+   -1.0333    0.3127   -0.0024 C   0  0  0

+    1.3504    0.8195   -0.0067 C   0  0  0

+    0.5892   -1.5077    0.0147 C   0  0  0

+   -2.0746   -0.6378    0.0076 C   0  0  0

+   -1.3193    1.6985   -0.0190 C   0  0  0

+    2.6843    0.3722   -0.0020 C   0  0  0

+    1.0386    2.1986   -0.0223 C   0  0  0

+    1.9265   -1.9132    0.0211 C   0  0  0

+   -0.4766   -2.4335    0.0199 C   0  0  0

+   -3.4598   -0.1481    0.0005 C   0  0  0

+   -1.7691   -2.0055    0.0234 C   0  0  0

+   -0.2523    2.6201   -0.0283 C   0  0  0

+   -2.6588    2.1326   -0.0270 C   0  0  0

+    2.9553   -0.9785    0.0171 C   0  0  0

+    3.7681    1.4185   -0.0267 C   0  0  0

+   -3.6876    1.2513   -0.0166 C   0  0  0

+   -4.4766   -0.9978    0.0094 N   0  0  0

+    4.3646   -1.5161    0.0336 C   0  0  0

+    5.1044    0.8219    0.4093 C   0  0  0

+   -5.6204   -0.5790    0.0033 O   0  0  0

+    5.3564   -0.4460   -0.4153 C   0  0  0

+    1.8198    2.9101    0.0000 H   0  0  0

+    2.1587   -2.9440    0.0000 H   0  0  0

+   -0.2690   -3.4696    0.0000 H   0  0  0

+   -2.5527   -2.7144    0.0000 H   0  0  0

+   -0.4606    3.6560    0.0000 H   0  0  0

+   -2.8661    3.1687    0.0000 H   0  0  0

+    4.3182    2.3206    0.0000 H   0  0  0

+    2.9434    2.0791    0.0000 H   0  0  0

+   -4.6800    1.6142    0.0000 H   0  0  0

+    3.8654   -2.4474    0.0000 H   0  0  0

+    5.2247   -2.1299    0.0000 H   0  0  0

+    6.1610    0.8122    0.0000 H   0  0  0

+    5.3294    1.8543    0.0000 H   0  0  0

+    5.9654   -1.3095    0.0000 H   0  0  0

+    6.3275   -0.0294    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  3  7  1  0

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+  4 10  1  0

+  5 11  2  0

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+  8 13  2  0

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+ 19 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2303-16-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    2.8262   -0.1608    0.1433 N   0  0  0

+    1.8056    0.6611   -0.1719 C   0  0  0

+    4.1983    0.3517    0.1692 C   0  0  0

+    2.5627   -1.5653    0.4660 C   0  0  0

+    0.1429    0.0956   -0.0301 S   0  0  0

+    2.0324    1.7931   -0.5543 O   0  0  0

+    4.6122    0.7726   -1.2423 C   0  0  0

+    4.2737    1.5603    1.1045 C   0  0  0

+    3.2431   -2.4628   -0.5695 C   0  0  0

+    3.1159   -1.8815    1.8570 C   0  0  0

+   -1.2277    1.1994   -0.4535 C   0  0  0

+   -2.5351    0.4789   -0.2471 C   0  0  0

+   -3.4164    0.9491    0.6049 C   0  0  0

+   -2.8758   -0.9729   -1.1359 Cl  0  0  0

+   -4.9225    0.1192    0.8427 Cl  0  0  0

+    4.7575   -0.5100    0.0000 H   0  0  0

+    1.5629   -1.8011    0.0000 H   0  0  0

+    5.3447    0.0523    0.0000 H   0  0  0

+    5.3325    1.5051    0.0000 H   0  0  0

+    3.8797    1.4929    0.0000 H   0  0  0

+    5.2990    1.4963    0.0000 H   0  0  0

+    4.3377    2.5856    0.0000 H   0  0  0

+    3.2484    1.6243    0.0000 H   0  0  0

+    2.4245   -3.0834    0.0000 H   0  0  0

+    3.8637   -3.2814    0.0000 H   0  0  0

+    4.0617   -1.8422    0.0000 H   0  0  0

+    2.6061   -2.7734    0.0000 H   0  0  0

+    4.0078   -2.3913    0.0000 H   0  0  0

+    3.6257   -0.9896    0.0000 H   0  0  0

+   -0.4853    1.9094    0.0000 H   0  0  0

+   -1.8357    2.0274    0.0000 H   0  0  0

+   -3.4233    1.9764    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 10 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+ 13 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+27729-95-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+    0.0706   -1.1959   -0.7118 C   0  0  1

+   -0.7313   -1.2306    0.5908 C   0  0  2

+    1.4507   -0.6562   -0.4378 C   0  0  0

+   -0.1269   -2.3992    0.0332 O   0  0  0

+   -2.2046   -1.2272    0.2739 C   0  0  0

+    2.4756   -1.5211   -0.1001 C   0  0  0

+    1.6914    0.7020   -0.5300 C   0  0  0

+   -2.9278    0.0486    0.1507 C   0  0  0

+   -2.7941   -2.2756    0.1204 O   0  0  0

+    3.7415   -1.0290    0.1511 C   0  0  0

+    2.9559    1.1992   -0.2797 C   0  0  0

+   -4.2953    0.0559   -0.1433 C   0  0  0

+   -2.2527    1.2596    0.3326 C   0  0  0

+    3.9844    0.3344    0.0643 C   0  0  0

+   -4.9657    1.2552   -0.2572 C   0  0  0

+   -2.9375    2.4509    0.2154 C   0  0  0

+    5.2291    0.8210    0.3110 O   0  0  0

+   -4.2891    2.4499   -0.0813 C   0  0  0

+    5.1591    2.2384    0.1434 C   0  0  0

+   -0.1412   -0.1924    0.0000 H   0  0  0

+   -0.7523   -0.2052    0.0000 H   0  0  0

+    2.3070   -2.5328    0.0000 H   0  0  0

+    0.8976    1.3515    0.0000 H   0  0  0

+    4.5337   -1.6804    0.0000 H   0  0  0

+    3.1216    2.2114    0.0000 H   0  0  0

+   -4.8166   -0.8274    0.0000 H   0  0  0

+   -1.2271    1.2663    0.0000 H   0  0  0

+   -5.9913    1.2581    0.0000 H   0  0  0

+   -2.4242    3.3388    0.0000 H   0  0  0

+   -4.8059    3.3358    0.0000 H   0  0  0

+    6.1835    2.2890    0.0000 H   0  0  0

+    5.1085    3.2628    0.0000 H   0  0  0

+    4.1347    2.1878    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  1  0

+  3  6  1  0

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+  1 20  1  0

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+ 15 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+34866-46-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 41                          1 V2000

+   -1.5007    0.0135   -0.7214 C   0  0  0

+   -2.3862    0.4877    0.2279 C   0  0  0

+   -0.1291   -0.4510   -0.3042 C   0  0  0

+   -1.8722   -0.0411   -2.0521 C   0  0  0

+   -3.6490    0.9156   -0.1545 C   0  0  0

+   -0.1754   -1.9437    0.0280 C   0  0  0

+    0.7941   -0.2291   -1.3721 O   0  0  0

+   -3.1312    0.3783   -2.4399 C   0  0  0

+   -4.0206    0.8657   -1.4960 C   0  0  0

+   -4.5490    1.3965    0.8065 N   0  0  0

+    1.1616   -2.3965    0.4346 N   0  0  0

+   -5.2574    1.2834   -1.8766 O   0  0  0

+   -4.1829    2.3977    1.6312 C   0  0  0

+    1.0480   -3.8294    0.7378 C   0  0  0

+   -4.9997    2.7778    2.6336 N   0  0  0

+   -3.1158    2.9580    1.4708 O   0  0  0

+    2.4127   -4.3689    1.1706 C   0  0  0

+    0.0373   -4.0328    1.8683 C   0  0  0

+    0.5756   -4.5788   -0.5096 C   0  0  0

+   12.4858    2.2928   -0.0466 Cl  0  0  0

+   -2.0681    1.2212    0.0000 H   0  0  0

+   -0.0929    0.3477    0.0000 H   0  0  0

+   -1.9423   -0.8375    0.0000 H   0  0  0

+   -0.9682   -1.8404    0.0000 H   0  0  0

+   -0.3561   -2.7225    0.0000 H   0  0  0

+    1.5715   -0.0422    0.0000 H   0  0  0

+   -3.4510   -0.3545    0.0000 H   0  0  0

+   -5.2959    1.1113    0.0000 H   0  0  0

+    1.8292   -1.9566    0.0000 H   0  0  0

+   -6.0149    1.5392    0.0000 H   0  0  0

+   -5.0700    3.5742    0.0000 H   0  0  0

+   -5.6543    2.3187    0.0000 H   0  0  0

+    2.1188   -5.1124    0.0000 H   0  0  0

+    3.1562   -4.6628    0.0000 H   0  0  0

+    2.7066   -3.6254    0.0000 H   0  0  0

+   -0.1204   -3.2490    0.0000 H   0  0  0

+   -0.7465   -4.1905    0.0000 H   0  0  0

+    0.1950   -4.8166    0.0000 H   0  0  0

+   -0.1008   -4.1524    0.0000 H   0  0  0

+    0.1492   -5.2552    0.0000 H   0  0  0

+    1.2520   -5.0052    0.0000 H   0  0  0

+   13.2853    2.2928    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

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+  5  9  2  0

+  5 10  1  0

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+  9 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+ 13 15  1  0

+ 13 16  2  0

+ 14 17  1  0

+ 14 18  1  0

+ 14 19  1  0

+  8  9  1  0

+  2 21  1  0

+  3 22  1  0

+  4 23  1  0

+  6 24  1  0

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+ 10 28  1  0

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+ 15 31  1  0

+ 15 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+ 17 35  1  0

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+ 18 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 20 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+141-91-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.4110    0.9383   -0.6444 O   0  0  0

+   -0.9920    0.8777   -0.3882 C   0  0  0

+    1.0485    0.0716    0.2937 C   0  0  0

+   -1.5018   -0.5419   -0.6399 C   0  0  0

+   -1.2620    1.2660    1.0668 C   0  0  0

+    0.5910   -1.3687    0.0595 C   0  0  0

+    2.5660    0.1594    0.1194 C   0  0  0

+   -0.8549   -1.4695    0.2975 N   0  0  0

+   -2.0529    0.7375    0.0000 H   0  0  0

+   -0.0074   -0.1024    0.0000 H   0  0  0

+   -2.4139    0.0179    0.0000 H   0  0  0

+   -2.2360   -1.3204    0.0000 H   0  0  0

+   -0.3834    1.8769    0.0000 H   0  0  0

+   -1.8729    2.1446    0.0000 H   0  0  0

+   -2.1406    0.6551    0.0000 H   0  0  0

+    0.5310   -2.4372    0.0000 H   0  0  0

+    1.6435   -1.5622    0.0000 H   0  0  0

+    2.6278   -0.9090    0.0000 H   0  0  0

+    3.6344    0.2212    0.0000 H   0  0  0

+    2.5042    1.2278    0.0000 H   0  0  0

+   -1.3166   -2.4349    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

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+  5 13  1  0

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+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7364-09-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+   -0.0259    0.1625   -0.0019 C   0  0  0

+   -1.3559    0.2802   -0.0006 C   0  0  0

+    0.8148    1.3606    0.0001 C   0  0  0

+    0.7062   -1.4116    0.0012 Cl  0  0  0

+   -2.2216   -0.9534   -0.0026 C   0  0  0

+   -1.9914    1.6467    0.0030 C   0  0  0

+    2.0234    1.2536   -0.0012 O   0  0  0

+    0.3450    2.3707    0.0000 H   0  0  0

+   -3.1335   -0.3135    0.0000 H   0  0  0

+   -2.8615   -1.8653    0.0000 H   0  0  0

+   -1.3097   -1.5933    0.0000 H   0  0  0

+   -0.9813    2.1165    0.0000 H   0  0  0

+   -2.4612    2.6568    0.0000 H   0  0  0

+   -3.0015    1.1769    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+22316-47-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -0.0022    0.4945    0.1378 C   0  0  0

+    0.4349   -0.8063    0.3743 N   0  0  0

+    0.8256    1.5184   -0.2931 C   0  0  0

+   -1.3586    0.7527    0.3496 C   0  0  0

+   -0.3964   -1.8483   -0.0538 C   0  0  0

+    1.5749   -1.1442    0.9720 C   0  0  0

+    2.1867    1.3613   -0.5388 N   0  0  0

+    0.2899    2.7914   -0.5021 C   0  0  0

+   -1.8773    2.0129    0.1394 C   0  0  0

+   -0.4409   -2.1956   -1.3975 C   0  0  0

+   -1.1740   -2.5408    0.8654 C   0  0  0

+    2.5599   -0.0974    1.4244 C   0  0  0

+    1.8256   -2.3165    1.1563 O   0  0  0

+    3.0339    0.6610    0.2112 C   0  0  0

+    2.7336    2.0244   -1.7252 C   0  0  0

+   -1.0484    3.0371   -0.2849 C   0  0  0

+   -3.5658    2.3145    0.4069 Cl  0  0  0

+   -1.2617   -3.2245   -1.8167 C   0  0  0

+   -1.9925   -3.5684    0.4400 C   0  0  0

+    4.2092    0.6321   -0.0874 O   0  0  0

+   -2.0385   -3.9083   -0.8998 C   0  0  0

+   -1.9825   -0.0122    0.0000 H   0  0  0

+    0.9083    3.5608    0.0000 H   0  0  0

+    0.4682   -2.5804    0.0000 H   0  0  0

+   -1.8909   -1.8622    0.0000 H   0  0  0

+    2.9055   -1.0221    0.0000 H   0  0  0

+    3.5421   -0.1964    0.0000 H   0  0  0

+    3.4951    1.3963    0.0000 H   0  0  0

+    3.3617    2.7859    0.0000 H   0  0  0

+    1.9721    2.6525    0.0000 H   0  0  0

+   -1.3910    3.9629    0.0000 H   0  0  0

+   -0.5470   -3.9054    0.0000 H   0  0  0

+   -2.9003   -3.1808    0.0000 H   0  0  0

+   -2.5046   -4.7785    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  6 13  2  0

+  7 14  1  0

+  7 15  1  0

+  8 16  2  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  2  0

+ 14 20  2  0

+ 18 21  2  0

+  9 16  1  0

+ 12 14  1  0

+ 19 21  1  0

+  4 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105-59-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.0096   -0.7019   -0.1215 N   0  0  0

+   -1.0269   -0.4407    0.8861 C   0  0  0

+    1.2969   -0.6983    0.5864 C   0  0  0

+   -0.2043   -2.0737   -0.6014 C   0  0  0

+   -1.7078    0.8954    0.5828 C   0  0  0

+    2.3181    0.1100   -0.2165 C   0  0  0

+   -2.4671    0.7804   -0.6223 O   0  0  0

+    1.9513    1.4911   -0.2002 O   0  0  0

+   -1.9775   -0.6652    0.0000 H   0  0  0

+   -1.0342   -1.4175    0.0000 H   0  0  0

+    1.0096   -1.6319    0.0000 H   0  0  0

+    2.1031   -1.2498    0.0000 H   0  0  0

+   -1.1694   -1.9232    0.0000 H   0  0  0

+   -0.3548   -3.0388    0.0000 H   0  0  0

+    0.7608   -2.2242    0.0000 H   0  0  0

+   -0.7951    1.2434    0.0000 H   0  0  0

+   -1.9564    1.8400    0.0000 H   0  0  0

+    2.8143   -0.7313    0.0000 H   0  0  0

+    3.2192    0.4870    0.0000 H   0  0  0

+   -3.4329    0.6341    0.0000 H   0  0  0

+    1.7006    2.4352    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2835-97-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.0341   -0.7046   -0.0014 C   0  0  0

+   -1.2693   -0.0740   -0.0006 C   0  0  0

+    1.1328    0.0571   -0.0008 C   0  0  0

+    0.0402   -2.1022    0.0031 N   0  0  0

+   -1.3401    1.3068    0.0007 C   0  0  0

+   -2.5340   -0.8935   -0.0017 C   0  0  0

+    1.0533    1.4395    0.0005 C   0  0  0

+    2.3470   -0.5558   -0.0011 O   0  0  0

+   -0.1822    2.0615    0.0012 C   0  0  0

+   -0.8303   -2.6685    0.0000 H   0  0  0

+    0.9659   -2.5730    0.0000 H   0  0  0

+   -2.2655    1.7780    0.0000 H   0  0  0

+   -3.0987   -0.0220    0.0000 H   0  0  0

+   -3.4055   -1.4582    0.0000 H   0  0  0

+   -1.9693   -1.7650    0.0000 H   0  0  0

+    1.9215    2.0094    0.0000 H   0  0  0

+    3.2741   -1.0238    0.0000 H   0  0  0

+   -0.2399    3.0984    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  7  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101688-02-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 39                          1 V2000

+    2.5462    0.0000    0.0408 C   0  0  0

+    1.0900    0.0229   -0.0233 C   0  0  0

+    3.1740   -0.4084    1.2207 C   0  0  0

+    3.6226    0.3279   -0.8917 C   0  0  0

+    0.3564   -0.3727    1.1222 C   0  0  0

+    0.4101    0.4224   -1.1792 C   0  0  0

+    4.5045   -0.3364    1.0104 O   0  0  0

+    2.4014   -0.7889    2.3240 C   0  0  0

+    4.7704    0.0958   -0.2333 C   0  0  0

+   -1.0460   -0.3570    1.0792 C   0  0  0

+    1.0465   -0.7748    2.2827 C   0  0  0

+   -0.9518    0.4297   -1.1993 C   0  0  0

+    6.1267    0.2919   -0.7937 N   0  3  0

+   -1.6865    0.0422   -0.0745 C   0  0  0

+    7.1075    0.0519   -0.1126 O   0  0  0

+    6.2617    0.6931   -1.9357 O   0  5  0

+   -3.0828    0.0589   -0.1205 N   0  0  0

+   -3.8080   -1.0432   -0.7574 C   0  0  0

+   -3.8217    1.1786    0.4682 C   0  0  0

+   -3.7468   -2.2803    0.1408 C   0  0  0

+   -3.8822    2.3330   -0.5342 C   0  0  0

+   -4.6392   -3.6368   -0.6431 Cl  0  0  0

+   -4.7916    3.7110    0.1903 Cl  0  0  0

+    3.5804    1.2052    0.0000 H   0  0  0

+    0.6429    1.2693    0.0000 H   0  0  0

+    2.5962   -1.6453    0.0000 H   0  0  0

+   -1.2923   -1.2000    0.0000 H   0  0  0

+    0.8131   -1.6215    0.0000 H   0  0  0

+   -1.1606    1.2828    0.0000 H   0  0  0

+   -4.3573   -0.3579    0.0000 H   0  0  0

+   -4.6292   -1.3547    0.0000 H   0  0  0

+   -4.6622    1.4333    0.0000 H   0  0  0

+   -4.3468    0.4746    0.0000 H   0  0  0

+   -3.1975   -2.9656    0.0000 H   0  0  0

+   -2.9256   -1.9688    0.0000 H   0  0  0

+   -3.0417    2.0783    0.0000 H   0  0  0

+   -3.3571    3.0370    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  9 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 13 16  1  0

+ 14 17  1  0

+ 17 18  1  0

+ 17 19  1  0

+ 18 20  1  0

+ 19 21  1  0

+ 20 22  1  0

+ 21 23  1  0

+  7  9  1  0

+  8 11  2  0

+ 12 14  1  0

+  4 24  1  0

+  6 25  1  0

+  8 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+609-31-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.0690    0.6051    0.2891 C   0  0  0

+    0.1017   -0.8238   -0.0324 N   0  3  0

+    1.2876    1.2946   -0.3277 C   0  0  0

+   -1.2094    1.2262   -0.2774 C   0  0  0

+    0.1294   -1.6490    0.8630 O   0  0  0

+    0.1012   -1.1866   -1.1951 O   0  5  0

+    2.5543    0.8370    0.3982 C   0  0  0

+   -2.3475    0.5822    0.2988 O   0  0  0

+    0.0374    1.6147    0.0000 H   0  0  0

+    1.8438    2.1378    0.0000 H   0  0  0

+    0.5981    2.0328    0.0000 H   0  0  0

+   -0.5953    2.0282    0.0000 H   0  0  0

+   -1.8725    1.9882    0.0000 H   0  0  0

+    2.2111   -0.1130    0.0000 H   0  0  0

+    3.5043    0.4938    0.0000 H   0  0  0

+    2.8975    1.7870    0.0000 H   0  0  0

+   -3.2266    0.0847    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  2  0

+  6  2  1  0

+  7  3  1  0

+  8  4  1  0

+  1  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2106-54-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.1208   -0.5810    0.1420 C   0  0  0

+   -1.1449    0.2630   -0.0207 C   0  0  0

+    1.3506    0.2842   -0.1412 C   0  0  0

+    0.1882   -1.0733    1.4497 F   0  0  0

+    0.0864   -1.6514   -0.7581 F   0  0  0

+   -2.3746   -0.6021    0.2625 C   0  0  0

+   -1.1105    1.3335    0.8794 F   0  0  0

+   -1.2317    0.8975   -1.7061 Cl  0  0  0

+    2.6163   -0.5598    0.0214 C   0  0  0

+    1.2832    0.7765   -1.4490 F   0  0  0

+    1.3949    1.6638    1.0188 Cl  0  0  0

+   -3.6214    0.2292    0.1023 C   0  0  0

+   -2.4090   -1.6726   -0.6376 F   0  0  0

+   -2.3073   -1.0945    1.5703 F   0  0  0

+    2.6837   -1.0521    1.3292 F   0  0  0

+    2.5819   -1.6303   -0.8787 F   0  0  0

+    4.0655    0.4597   -0.3123 Cl  0  0  0

+   -3.8063    1.3161    0.8679 O   0  0  0

+   -4.4545   -0.0827   -0.7153 O   0  0  0

+   -3.9410    2.1080    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  9 15  1  0

+  9 16  1  0

+  9 17  1  0

+ 12 18  1  0

+ 12 19  2  0

+ 18 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103-80-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.8567    0.0037   -0.5351 C   0  0  0

+    1.5103   -1.1949   -0.3196 C   0  0  0

+    1.5126    1.1994   -0.3076 C   0  0  0

+   -0.5688    0.0074   -1.0240 C   0  0  0

+    2.8200   -1.1982    0.1234 C   0  0  0

+    2.8218    1.1960    0.1353 C   0  0  0

+   -1.5048   -0.0011    0.1570 C   0  0  0

+    3.4756   -0.0030    0.3508 C   0  0  0

+   -1.0602   -0.0092    1.2799 O   0  0  0

+   -3.2222    0.0010   -0.0966 Cl  0  0  0

+    0.9871   -2.0736    0.0000 H   0  0  0

+    0.9928    2.0800    0.0000 H   0  0  0

+   -0.0586    0.8937    0.0000 H   0  0  0

+   -1.0847    0.8903    0.0000 H   0  0  0

+    3.3399   -2.0788    0.0000 H   0  0  0

+    3.3450    2.0746    0.0000 H   0  0  0

+    4.4982   -0.0043    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  7  9  2  0

+  7 10  1  0

+  6  8  1  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+951-80-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.9091    0.7084    0.0043 C   0  0  0

+   -0.7943   -0.7520    0.0022 C   0  0  0

+    0.1852    1.4669    0.0037 N   0  0  0

+   -2.1935    1.2814    0.0010 C   0  0  0

+    0.4855   -1.3343    0.0001 C   0  0  0

+   -1.9609   -1.5362    0.0028 C   0  0  0

+    1.4080    0.9354    0.0012 C   0  0  0

+   -3.3005    0.4626   -0.0040 C   0  0  0

+    1.6004   -0.4701    0.0001 C   0  0  0

+    0.6452   -2.7035   -0.0024 N   0  0  0

+   -3.1775   -0.9325    0.0053 C   0  0  0

+    2.5405    1.7767    0.0007 C   0  0  0

+   -4.5707    1.0344   -0.0073 N   0  0  0

+    2.9059   -0.9924   -0.0025 C   0  0  0

+    3.7870    1.2354   -0.0013 C   0  0  0

+    3.9717   -0.1468   -0.0029 C   0  0  0

+   -2.3071    2.3233    0.0000 H   0  0  0

+   -1.8922   -2.5821    0.0000 H   0  0  0

+   -0.1957   -3.3292    0.0000 H   0  0  0

+    1.6075   -3.1189    0.0000 H   0  0  0

+   -4.0431   -1.5235    0.0000 H   0  0  0

+    2.4206    2.8179    0.0000 H   0  0  0

+   -4.6760    2.0772    0.0000 H   0  0  0

+   -5.4212    0.4218    0.0000 H   0  0  0

+    3.0574   -2.0295    0.0000 H   0  0  0

+    4.6233    1.8672    0.0000 H   0  0  0

+    4.9436   -0.5391    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+  7  9  1  0

+  8 11  1  0

+ 15 16  1  0

+  4 17  1  0

+  6 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+224-42-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -1.1957    0.1740   -0.0030 C   0  0  0

+   -2.4888   -0.5176   -0.0022 C   0  0  0

+   -1.1642    1.5910    0.0007 C   0  0  0

+   -0.0005   -0.5427   -0.0017 C   0  0  0

+   -3.6720    0.2546    0.0024 C   0  0  0

+   -2.5728   -1.9106   -0.0054 C   0  0  0

+   -0.0011    2.2360    0.0009 N   0  0  0

+   -2.3770    2.3244    0.0054 C   0  0  0

+    1.1939    0.1742   -0.0022 C   0  0  0

+   -3.5768    1.7100    0.0058 C   0  0  0

+   -4.9135   -0.3929    0.0033 C   0  0  0

+   -3.7990   -2.5141   -0.0040 C   0  0  0

+    1.1618    1.5913   -0.0032 C   0  0  0

+    2.4877   -0.5170   -0.0002 C   0  0  0

+   -4.9640   -1.7572   -0.0003 C   0  0  0

+    2.3748    2.3253   -0.0028 C   0  0  0

+    3.6706    0.2555   -0.0001 C   0  0  0

+    2.5717   -1.9097    0.0022 C   0  0  0

+    3.5744    1.7115   -0.0069 C   0  0  0

+    4.9129   -0.3893    0.0023 C   0  0  0

+    3.8082   -2.5155    0.0044 C   0  0  0

+    4.9696   -1.7535    0.0045 C   0  0  0

+   -0.0003   -1.5892    0.0000 H   0  0  0

+   -1.7013   -2.4901    0.0000 H   0  0  0

+   -2.3401    3.3703    0.0000 H   0  0  0

+   -4.4514    2.2848    0.0000 H   0  0  0

+   -5.7982    0.1661    0.0000 H   0  0  0

+   -3.8611   -3.5588    0.0000 H   0  0  0

+   -5.8928   -2.2394    0.0000 H   0  0  0

+    2.3375    3.3712    0.0000 H   0  0  0

+    1.7008   -2.4900    0.0000 H   0  0  0

+    4.4487    2.2867    0.0000 H   0  0  0

+    5.7958    0.1726    0.0000 H   0  0  0

+    3.8736   -3.5600    0.0000 H   0  0  0

+    5.9006   -2.2315    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+ 14 17  1  0

+ 14 18  2  0

+ 16 19  2  0

+ 17 20  2  0

+ 18 21  1  0

+ 20 22  1  0

+  8 10  1  0

+  9 13  1  0

+ 12 15  1  0

+ 17 19  1  0

+ 21 22  2  0

+  4 23  1  0

+  6 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63019-38-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 34                          1 V2000

+    0.0469    0.7405    0.0022 C   0  0  0

+   -0.6680   -0.4720    0.0011 C   0  0  0

+    1.5104    0.6890    0.0016 C   0  0  0

+   -0.6397    1.9673   -0.0020 C   0  0  0

+   -2.1312   -0.4205    0.0011 C   0  0  0

+    0.0185   -1.6986   -0.0003 C   0  0  0

+    2.1466   -0.5735    0.0003 C   0  0  0

+    2.2806    1.8554    0.0020 C   0  0  0

+   -1.9914    2.0201   -0.0075 C   0  0  0

+   -2.7685    0.8420    0.0024 C   0  0  0

+   -2.9029   -1.5859   -0.0006 C   0  0  0

+    1.3707   -1.7508   -0.0011 C   0  0  0

+    3.5537   -0.6322   -0.0004 C   0  0  0

+    3.6429    1.7723    0.0009 C   0  0  0

+   -4.1708    0.9000    0.0022 C   0  0  0

+   -4.2645   -1.4946   -0.0011 C   0  0  0

+    4.2820    0.5381    0.0003 C   0  0  0

+    4.1883   -1.8329   -0.0014 O   0  0  0

+   -4.8951   -0.2547    0.0009 C   0  0  0

+   -0.0908    2.8630    0.0000 H   0  0  0

+   -0.5302   -2.5944    0.0000 H   0  0  0

+    1.8113    2.7952    0.0000 H   0  0  0

+   -2.4712    2.9546    0.0000 H   0  0  0

+   -2.4370   -2.5274    0.0000 H   0  0  0

+    1.8509   -2.6851    0.0000 H   0  0  0

+    4.2159    2.6527    0.0000 H   0  0  0

+   -4.6602    1.8295    0.0000 H   0  0  0

+   -4.8434   -2.3712    0.0000 H   0  0  0

+    5.3317    0.4967    0.0000 H   0  0  0

+    4.6792   -2.7616    0.0000 H   0  0  0

+   -5.9445   -0.2076    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  5 11  1  0

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+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+218-01-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.4137    0.5692    0.0019 C   0  0  0

+   -0.4136   -0.5699    0.0007 C   0  0  0

+    1.8650    0.3786    0.0012 C   0  0  0

+   -0.1528    1.8560   -0.0021 C   0  0  0

+   -1.8653   -0.3790    0.0007 C   0  0  0

+    0.1529   -1.8562   -0.0010 C   0  0  0

+    2.3792   -0.9392   -0.0004 C   0  0  0

+    2.7443    1.4652    0.0025 C   0  0  0

+   -1.4932    2.0376   -0.0075 C   0  0  0

+   -2.3792    0.9390    0.0022 C   0  0  0

+   -2.7446   -1.4649   -0.0001 C   0  0  0

+    1.4938   -2.0376   -0.0020 C   0  0  0

+    3.7697   -1.1304   -0.0012 C   0  0  0

+    4.0910    1.2445    0.0022 C   0  0  0

+   -3.7691    1.1307    0.0022 C   0  0  0

+   -4.0917   -1.2438    0.0004 C   0  0  0

+    4.6006   -0.0500   -0.0004 C   0  0  0

+   -4.6007    0.0503    0.0008 C   0  0  0

+    0.4802    2.6966    0.0000 H   0  0  0

+   -0.4799   -2.6970    0.0000 H   0  0  0

+    2.3697    2.4485    0.0000 H   0  0  0

+   -1.8823    3.0153    0.0000 H   0  0  0

+   -2.3702   -2.4483    0.0000 H   0  0  0

+    1.8831   -3.0152    0.0000 H   0  0  0

+    4.1691   -2.1040    0.0000 H   0  0  0

+    4.7519    2.0633    0.0000 H   0  0  0

+   -4.1681    2.1044    0.0000 H   0  0  0

+   -4.7529   -2.0625    0.0000 H   0  0  0

+    5.6426   -0.1971    0.0000 H   0  0  0

+   -5.6426    0.1978    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

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+  5 10  1  0

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+  8 14  2  0

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+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14064-55-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.5672   -0.3714    0.0074 C   0  0  0

+    2.4092   -1.4868    0.0067 C   0  0  0

+    2.1192    0.9121    0.0043 C   0  0  0

+    0.1040   -0.5482    0.0053 C   0  0  0

+    3.7773   -1.3137    0.0030 C   0  0  0

+    3.4896    1.0698    0.0005 C   0  0  0

+   -0.7019    0.5255    0.0060 C   0  0  0

+    4.3169   -0.0392   -0.0001 C   0  0  0

+   -2.1651    0.3487    0.0039 C   0  0  0

+    5.7866    0.1384   -0.0042 N   0  3  0

+   -3.0069    1.4644    0.0046 C   0  0  0

+   -2.7168   -0.9349   -0.0047 C   0  0  0

+    6.2646    1.2586   -0.0069 O   0  0  0

+    6.5177   -0.8358   -0.0048 O   0  5  0

+   -4.3748    1.2919    0.0021 C   0  0  0

+   -4.0868   -1.0933   -0.0071 C   0  0  0

+   -4.9152    0.0165   -0.0010 C   0  0  0

+   -6.6386   -0.1918   -0.0036 Cl  0  0  0

+    2.0055   -2.4438    0.0000 H   0  0  0

+    1.4992    1.7455    0.0000 H   0  0  0

+   -0.3037   -1.5035    0.0000 H   0  0  0

+    4.4043   -2.1418    0.0000 H   0  0  0

+    3.9014    2.0234    0.0000 H   0  0  0

+   -0.2942    1.4808    0.0000 H   0  0  0

+   -2.6029    2.4213    0.0000 H   0  0  0

+   -2.0965   -1.7680    0.0000 H   0  0  0

+   -5.0015    2.1202    0.0000 H   0  0  0

+   -4.4982   -2.0470    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  9 12  2  0

+ 10 13  2  0

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+  6  8  2  0

+ 16 17  2  0

+  2 19  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  7 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+39413-05-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+    0.8647    0.3707    0.1524 C   0  0  0

+   -0.4055    0.7302    0.9259 C   0  0  0

+    2.0887    0.8762    0.9186 C   0  0  0

+    0.9518   -1.1258   -0.0025 C   0  0  0

+    0.8251    0.9817   -1.1388 O   0  0  0

+   -1.6111    0.2322    0.1713 C   0  0  0

+    3.3398    0.5221    0.1567 C   0  0  0

+    1.0010   -1.9114    1.0848 O   0  0  0

+    0.9774   -1.6185   -1.1054 O   0  0  0

+   -2.8428    0.4360    0.6643 O   0  0  0

+   -1.4690   -0.3504   -0.8776 O   0  0  0

+    4.5421    0.8684    0.6425 O   0  0  0

+    3.2605   -0.0735   -0.8916 O   0  0  0

+   -4.0044   -0.0438   -0.0628 C   0  0  0

+   -5.1213   -0.3825    0.9265 C   0  0  0

+   -4.4880    1.0426   -1.0255 C   0  0  0

+    0.1052    1.5150    0.0000 H   0  0  0

+   -1.0035    1.4507    0.0000 H   0  0  0

+    2.5994    1.6610    0.0000 H   0  0  0

+    1.4907    1.5967    0.0000 H   0  0  0

+    0.7645    1.9161    0.0000 H   0  0  0

+    1.0595   -2.8459    0.0000 H   0  0  0

+    5.4419    1.1276    0.0000 H   0  0  0

+   -3.6894   -0.9256    0.0000 H   0  0  0

+   -5.3930    0.5135    0.0000 H   0  0  0

+   -6.0173   -0.6542    0.0000 H   0  0  0

+   -4.8496   -1.2785    0.0000 H   0  0  0

+   -3.6326    1.4234    0.0000 H   0  0  0

+   -4.8688    1.8980    0.0000 H   0  0  0

+   -5.3434    0.6618    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  2  0

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+  2 17  1  0

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+  8 22  1  0

+ 12 23  1  0

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+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6149-34-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.2811   -1.0810   -0.0320 C   0  0  0

+   -1.0050   -1.6259   -0.0524 N   0  0  0

+    0.8987   -0.7990    1.1804 C   0  0  0

+    0.9478   -0.8252   -1.2236 C   0  0  0

+   -2.1228   -0.7830   -0.0312 C   0  0  0

+    2.1702   -0.2609    1.1969 C   0  0  0

+    2.2195   -0.2869   -1.1996 C   0  0  0

+   -3.3953   -1.3208    0.1097 C   0  0  0

+   -1.9585    0.5915   -0.1452 C   0  0  0

+    2.8290   -0.0026    0.0085 C   0  0  0

+   -4.4977   -0.4894    0.1312 C   0  0  0

+   -3.0606    1.4226   -0.1237 C   0  0  0

+    4.1921    0.5743    0.0301 N   0  3  0

+   -4.3338    0.8843    0.0119 C   0  0  0

+    4.7735    0.8024   -1.0155 O   0  0  0

+    4.7321    0.8210    1.0936 O   0  5  0

+   -5.4513    1.7269    0.0332 N   0  0  0

+   -1.1317   -2.6538    0.0000 H   0  0  0

+    0.4818    0.1490    0.0000 H   0  0  0

+    1.3352   -1.7857    0.0000 H   0  0  0

+    1.7793    0.6981    0.0000 H   0  0  0

+    2.6403   -1.2332    0.0000 H   0  0  0

+   -3.5225   -2.3486    0.0000 H   0  0  0

+   -1.0058    0.9975    0.0000 H   0  0  0

+   -5.4504   -0.8955    0.0000 H   0  0  0

+   -2.9335    2.4504    0.0000 H   0  0  0

+   -5.3248    2.7548    0.0000 H   0  0  0

+   -6.4047    1.3225    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

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+  9 12  2  0

+ 10 13  1  0

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+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+965-52-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -2.4280   -0.0315   -0.0042 C   0  0  0

+   -3.5562   -0.7791   -0.0055 O   0  0  0

+   -2.8534    1.3820    0.0036 C   0  0  0

+   -1.1298   -0.5004   -0.0041 C   0  0  0

+   -4.6227    0.0251    0.0007 C   0  0  0

+   -4.2166    1.3616    0.0064 C   0  0  0

+   -0.1061    0.3629   -0.0027 N   0  0  0

+   -6.0360   -0.4352    0.0013 N   0  3  0

+    1.1072   -0.0753   -0.0026 N   0  0  0

+   -6.9417    0.3792    0.0072 O   0  0  0

+   -6.3295   -1.8204   -0.0048 O   0  5  0

+    2.1375    0.7935   -0.0012 C   0  0  0

+    3.5235    0.2929   -0.0011 C   0  0  0

+    1.9236    1.9895    0.0000 O   0  0  0

+    4.5944    1.1929    0.0003 C   0  0  0

+    3.7722   -1.0841    0.0034 C   0  0  0

+    5.8874    0.7209    0.0009 C   0  0  0

+    5.0679   -1.5471    0.0039 C   0  0  0

+    6.1299   -0.6485    0.0000 C   0  0  0

+    7.4058   -1.1094    0.0001 O   0  0  0

+   -2.2437    2.2151    0.0000 H   0  0  0

+   -0.9480   -1.5166    0.0000 H   0  0  0

+   -4.8376    2.1863    0.0000 H   0  0  0

+    1.2890   -1.0915    0.0000 H   0  0  0

+    4.4152    2.2096    0.0000 H   0  0  0

+    2.9847   -1.7516    0.0000 H   0  0  0

+    6.6783    1.3844    0.0000 H   0  0  0

+    5.2522   -2.5629    0.0000 H   0  0  0

+    8.3767   -1.4601    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+ 12 13  1  0

+ 12 14  2  0

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+ 15 17  1  0

+ 16 18  2  0

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+ 19 20  1  0

+  5  6  2  0

+ 18 19  1  0

+  3 21  1  0

+  4 22  1  0

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+  9 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 20 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+82-33-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.0472   -0.4092    0.0445 C   0  0  0

+   -0.3657   -1.6398    0.0179 C   0  0  0

+   -0.2860    0.8457    0.2289 C   0  0  0

+   -2.4297   -0.3828   -0.1086 C   0  0  0

+    1.1051   -1.6660    0.1744 C   0  0  0

+   -1.0805   -2.8207   -0.1556 C   0  0  0

+    1.1784    0.8257    0.0790 C   0  0  0

+   -0.8628    1.8811    0.5014 O   0  0  0

+   -3.1246   -1.5659   -0.2858 C   0  0  0

+   -3.1551    0.9072   -0.0814 N   0  3  0

+    1.8626   -0.4097    0.0523 C   0  0  0

+    1.6814   -2.7128    0.4008 O   0  0  0

+   -2.4556   -2.7768   -0.3014 C   0  0  0

+    1.9004    2.0164   -0.0379 C   0  0  0

+   -4.1438    1.0353    0.6182 O   0  0  0

+   -2.7631    1.8406   -0.7586 O   0  5  0

+    3.2526   -0.4250   -0.0904 C   0  0  0

+    3.2913    1.9737   -0.1797 C   0  0  0

+    1.2406    3.2355   -0.0129 N   0  0  0

+    3.9519    0.7809   -0.2056 C   0  0  0

+    3.9360   -1.6310   -0.1174 N   0  0  0

+   -0.5845   -3.7344    0.0000 H   0  0  0

+   -4.1642   -1.5522    0.0000 H   0  0  0

+   -2.9981   -3.6637    0.0000 H   0  0  0

+    3.8328    2.8612    0.0000 H   0  0  0

+    1.7850    4.1212    0.0000 H   0  0  0

+    0.2013    3.2641    0.0000 H   0  0  0

+    4.9915    0.7706    0.0000 H   0  0  0

+    3.4089   -2.5271    0.0000 H   0  0  0

+    4.9756   -1.6394    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  2  0

+  7 14  2  0

+ 10 15  2  0

+ 10 16  1  0

+ 11 17  2  0

+ 14 18  1  0

+ 14 19  1  0

+ 17 20  1  0

+ 17 21  1  0

+  7 11  1  0

+  9 13  1  0

+ 18 20  2  0

+  6 22  1  0

+  9 23  1  0

+ 13 24  1  0

+ 18 25  1  0

+ 19 26  1  0

+ 19 27  1  0

+ 20 28  1  0

+ 21 29  1  0

+ 21 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+36712-35-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.0333   -0.8143    0.0791 C   0  0  0

+   -1.5029   -1.0033    0.1600 C   0  0  0

+    0.5473    0.3626    0.5479 C   0  0  0

+    0.7717   -1.8151   -0.4607 C   0  0  0

+   -2.3585   -0.1191   -0.4935 C   0  0  0

+   -2.0319   -2.0691    0.8853 C   0  0  0

+    1.9145    0.5331    0.4701 C   0  0  0

+   -0.3009    1.4281    1.1279 N   0  3  0

+    2.1382   -1.6340   -0.5336 C   0  0  0

+   -3.7248   -0.2997   -0.4148 C   0  0  0

+   -1.8036    1.0120   -1.2704 N   0  3  0

+   -3.3994   -2.2401    0.9573 C   0  0  0

+    2.7085   -0.4616   -0.0721 C   0  0  0

+    0.2077    2.4562    1.5373 O   0  0  0

+   -1.5076    1.2766    1.1956 O   0  5  0

+   -4.2446   -1.3558    0.3111 C   0  0  0

+   -2.5527    1.7843   -1.8413 O   0  0  0

+   -0.5979    1.1705   -1.3388 O   0  5  0

+    4.1744   -0.2731   -0.1529 N   0  3  0

+    4.8755   -1.1474   -0.6298 O   0  0  0

+    4.6795    0.7564    0.2576 O   0  5  0

+    0.4187   -2.6968    0.0000 H   0  0  0

+   -1.4822   -2.8436    0.0000 H   0  0  0

+    2.2725    1.4128    0.0000 H   0  0  0

+    2.6938   -2.4042    0.0000 H   0  0  0

+   -4.2785    0.4719    0.0000 H   0  0  0

+   -3.7177   -3.1349    0.0000 H   0  0  0

+   -5.1833   -1.5003    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  3  7  2  0

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+  5 10  1  0

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+  7 13  1  0

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+  9 13  2  0

+ 12 16  1  0

+  4 22  1  0

+  6 23  1  0

+  7 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24424-99-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 32                          1 V2000

+    3.5885    0.0992   -0.0093 C   0  0  0

+    2.3307    0.8191    0.0802 O   0  0  0

+    3.6239   -0.7060   -1.3098 C   0  0  0

+    4.7490    1.0962    0.0050 C   0  0  0

+    3.7181   -0.8513    1.1827 C   0  0  0

+    1.1665    0.1465    0.0402 C   0  0  0

+    0.0000    0.8204    0.0000 O   0  0  0

+    1.1665   -1.0676    0.0402 O   0  0  0

+   -1.1665    0.1465   -0.0402 C   0  0  0

+   -2.3307    0.8191   -0.0803 O   0  0  0

+   -1.1665   -1.0676   -0.0401 O   0  0  0

+   -3.5885    0.0992    0.0092 C   0  0  0

+   -3.7181   -0.8513   -1.1827 C   0  0  0

+   -3.6239   -0.7060    1.3098 C   0  0  0

+   -4.7490    1.0962   -0.0050 C   0  0  0

+    2.6165   -0.7503    0.0000 H   0  0  0

+    3.6682   -1.7134    0.0000 H   0  0  0

+    4.6313   -0.6617    0.0000 H   0  0  0

+    5.4061    0.3313    0.0000 H   0  0  0

+    5.5139    1.7533    0.0000 H   0  0  0

+    4.0919    1.8611    0.0000 H   0  0  0

+    2.7189   -0.9875    0.0000 H   0  0  0

+    3.8543   -1.8505    0.0000 H   0  0  0

+    4.7173   -0.7151    0.0000 H   0  0  0

+   -4.7173   -0.7151    0.0000 H   0  0  0

+   -3.8543   -1.8505    0.0000 H   0  0  0

+   -2.7189   -0.9875    0.0000 H   0  0  0

+   -4.6313   -0.6617    0.0000 H   0  0  0

+   -3.6682   -1.7134    0.0000 H   0  0  0

+   -2.6165   -0.7503    0.0000 H   0  0  0

+   -4.0919    1.8611    0.0000 H   0  0  0

+   -5.5139    1.7533    0.0000 H   0  0  0

+   -5.4061    0.3313    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  6  7  1  0

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+ 14 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+87-90-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.6579   -1.1763   -0.0003 C   0  0  0

+   -0.6897   -1.1579   -0.0004 N   0  0  0

+    1.3476   -0.0183   -0.0003 N   0  0  0

+    1.2511   -2.2368    0.0048 O   0  0  0

+   -1.3476    0.0183   -0.0005 C   0  0  0

+   -1.5648   -2.6270   -0.0010 Cl  0  0  0

+    0.6897    1.1579   -0.0004 C   0  0  0

+    3.0575   -0.0416   -0.0008 Cl  0  0  0

+   -0.6579    1.1763    0.0000 N   0  0  0

+   -2.5627    0.0349   -0.0005 O   0  0  0

+    1.3115    2.2019   -0.0012 O   0  0  0

+   -1.4927    2.6687    0.0011 Cl  0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  5  9  1  0

+  5 10  2  0

+  7 11  2  0

+  9 12  1  0

+  7  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-18-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.4507    0.7782    1.0811 N   0  0  0

+   -0.8001    0.6165    0.4800 C   0  0  0

+    1.5968    0.2847    0.4527 C   0  0  0

+   -1.5396   -0.5349    0.7131 C   0  0  0

+   -1.3082    1.6106   -0.3478 C   0  0  0

+    2.8165    0.3005    1.1172 C   0  0  0

+    1.5181   -0.2283   -0.8362 C   0  0  0

+   -2.7800   -0.6916    0.1149 C   0  0  0

+   -2.5446    1.4504   -0.9419 C   0  0  0

+    3.9475   -0.1882    0.4931 C   0  0  0

+    2.6527   -0.7153   -1.4542 C   0  0  0

+   -3.5067   -1.8174    0.3414 O   0  0  0

+   -3.2797    0.3019   -0.7152 C   0  0  0

+    3.8667   -0.6928   -0.7917 C   0  0  0

+    0.5790    1.6953    0.0000 H   0  0  0

+   -1.0455   -1.3181    0.0000 H   0  0  0

+   -0.8767    2.4300    0.0000 H   0  0  0

+    2.9982    1.2085    0.0000 H   0  0  0

+    0.7084   -0.6776    0.0000 H   0  0  0

+   -3.0405    2.2324    0.0000 H   0  0  0

+    4.7592    0.2574    0.0000 H   0  0  0

+    2.4747   -1.6241    0.0000 H   0  0  0

+   -4.0089   -2.5954    0.0000 H   0  0  0

+   -4.2045    0.3497    0.0000 H   0  0  0

+    4.4740   -1.3919    0.0000 H   0  0  0

+  2  1  1  0

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+  8  4  1  0

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+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5806-00-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -1.7343   -0.7399    0.1775 C   0  0  0

+   -2.6496    0.3017    0.2814 C   0  0  0

+   -0.3863   -0.5162    0.4551 N   0  0  0

+   -2.1676   -2.0062   -0.1981 C   0  0  0

+   -3.9834    0.0762    0.0063 C   0  0  0

+   -2.1860    1.6752    0.6933 C   0  0  0

+    0.5203   -0.9679   -0.3437 N   0  3  0

+   -3.5043   -2.2252   -0.4666 C   0  0  0

+   -4.4099   -1.1842   -0.3724 C   0  0  0

+   -4.9586    1.1842    0.1170 N   0  3  0

+    1.8156   -0.9672    0.0361 C   0  0  0

+    0.2075   -1.3950   -1.4407 O   0  5  0

+   -5.7631    1.1983    1.0313 O   0  0  0

+   -4.9565    2.0818   -0.7063 O   0  5  0

+    2.6229    0.1536   -0.2099 C   0  0  0

+    2.3619   -2.0854    0.6846 C   0  0  0

+    3.9438    0.1446    0.1815 C   0  0  0

+    2.0472    1.3630   -0.9004 C   0  0  0

+    3.6847   -2.0751    1.0682 C   0  0  0

+    4.4753   -0.9661    0.8154 C   0  0  0

+    4.7977    1.3257   -0.0767 N   0  3  0

+    5.6640    1.2757   -0.9315 O   0  0  0

+    4.6342    2.3476    0.5655 O   0  5  0

+   -1.5215   -2.7706    0.0000 H   0  0  0

+   -1.2377    1.3551    0.0000 H   0  0  0

+   -1.8659    2.6235    0.0000 H   0  0  0

+   -3.1343    1.9953    0.0000 H   0  0  0

+   -3.8439   -3.1667    0.0000 H   0  0  0

+   -5.3918   -1.3780    0.0000 H   0  0  0

+    1.8351   -2.9364    0.0000 H   0  0  0

+    2.9509    1.7932    0.0000 H   0  0  0

+    1.6170    2.2667    0.0000 H   0  0  0

+    1.1435    0.9328    0.0000 H   0  0  0

+    4.1466   -2.9630    0.0000 H   0  0  0

+    5.4724   -1.0526    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  2  0

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+ 16 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115664-51-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.2458   -1.2443   -0.0024 C   0  0  0

+   -1.5214   -0.6353   -0.0020 C   0  0  0

+    0.9281   -0.4638   -0.0016 C   0  0  0

+   -0.1498   -2.6547    0.0024 C   0  0  0

+   -1.6515    0.7681   -0.0009 C   0  0  0

+   -2.6786   -1.4473   -0.0023 C   0  0  0

+    0.8259    1.0056   -0.0005 C   0  0  0

+    2.1686   -1.0930   -0.0015 C   0  0  0

+   -1.3286   -3.4389    0.0078 C   0  0  0

+    1.1144   -3.2544    0.0021 C   0  0  0

+   -0.4454    1.6122   -0.0001 C   0  0  0

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+   -2.5473   -2.8568   -0.0026 C   0  0  0

+   -3.9416   -0.8427   -0.0018 C   0  0  0

+    1.9703    1.8029    0.0004 C   0  0  0

+    2.2509   -2.4747   -0.0016 C   0  0  0

+    3.4067   -0.2812   -0.0006 N   0  3  0

+   -0.5456    3.0038    0.0010 C   0  0  0

+   -4.0542    0.5288   -0.0003 C   0  0  0

+   -3.0609    2.6905    0.0016 O   0  0  0

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+    3.9157    0.0521    1.0545 O   0  5  0

+    0.5971    3.7728    0.0017 C   0  0  0

+   -1.2547   -4.4828    0.0000 H   0  0  0

+    1.1972   -4.2977    0.0000 H   0  0  0

+   -3.4057   -3.4555    0.0000 H   0  0  0

+   -4.8035   -1.4363    0.0000 H   0  0  0

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+    3.1910   -2.9346    0.0000 H   0  0  0

+   -1.4865    3.4621    0.0000 H   0  0  0

+   -5.0041    0.9681    0.0000 H   0  0  0

+   -3.1658    3.7318    0.0000 H   0  0  0

+    2.7091    3.7718    0.0000 H   0  0  0

+    0.5202    4.8165    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 24 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3118-97-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 39                          1 V2000

+    2.3810    0.5119    0.0542 C   0  0  0

+    1.3061   -0.4428    0.3231 C   0  0  0

+    3.7004    0.0270   -0.1163 C   0  0  0

+    2.1304    1.8853   -0.0427 C   0  0  0

+    0.0266   -0.0183    0.4934 N   0  0  0

+    1.6244   -1.8014    0.4015 C   0  0  0

+    3.9495   -1.3541   -0.0239 C   0  0  0

+    4.7378    0.9388   -0.3750 C   0  0  0

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+   -0.9338   -0.5904   -0.1503 N   0  0  0

+    2.9396   -2.2288    0.2261 C   0  0  0

+    0.6477   -2.7096    0.6502 O   0  0  0

+    4.4602    2.2697   -0.4575 C   0  0  0

+   -2.2057   -0.0989   -0.0589 C   0  0  0

+   -3.2676   -0.7830   -0.6567 C   0  0  0

+   -2.4517    1.0877    0.6381 C   0  0  0

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+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88-89-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.4974    1.2003    0.0288 C   0  0  0

+   -1.1919   -0.0001    0.0021 C   0  0  0

+    0.8843    1.1978    0.0282 C   0  0  0

+   -1.2357    2.4830    0.0518 N   0  3  0

+   -0.4969   -1.2006   -0.0251 C   0  0  0

+   -2.5509   -0.0002    0.0023 O   0  0  0

+    1.5745    0.0003    0.0010 C   0  0  0

+   -0.8650    3.4116   -0.6437 O   0  0  0

+   -2.2140    2.6098    0.7662 O   0  5  0

+    0.8844   -1.1978   -0.0256 C   0  0  0

+   -1.2349   -2.4834   -0.0532 N   0  3  0

+    3.0547    0.0005   -0.0001 N   0  3  0

+   -0.8662   -3.4135    0.6414 O   0  0  0

+   -2.2111   -2.6088   -0.7708 O   0  5  0

+    3.6638   -1.0540   -0.0241 O   0  0  0

+    3.6636    1.0551    0.0229 O   0  5  0

+    1.4035    2.0945    0.0000 H   0  0  0

+   -3.5870   -0.0003    0.0000 H   0  0  0

+    1.4038   -2.0943    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+ 12 15  2  0

+ 12 16  1  0

+  7 10  1  0

+  3 17  1  0

+  6 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+206-44-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+   -0.8368   -0.0410    0.0020 C   0  0  0

+   -0.1117   -1.1142    0.0012 C   0  0  0

+   -0.0582    1.1982    0.0013 C   0  0  0

+   -2.3001   -0.0235   -0.0023 C   0  0  0

+    1.3056   -0.7184   -0.0004 C   0  0  0

+   -0.8253   -2.4074    0.0027 C   0  0  0

+    1.3475    0.7651    0.0004 C   0  0  0

+   -0.7137    2.3340    0.0013 C   0  0  0

+   -2.9351   -1.1709   -0.0067 C   0  0  0

+   -2.9468    1.3000   -0.0016 C   0  0  0

+    2.4283   -1.3987   -0.0018 C   0  0  0

+   -2.1446   -2.4200    0.0042 C   0  0  0

+    2.4975    1.3908    0.0005 C   0  0  0

+   -2.1838    2.3764    0.0014 C   0  0  0

+    3.7215   -0.6930   -0.0015 C   0  0  0

+    3.7557    0.6227   -0.0008 C   0  0  0

+   -0.2628   -3.3499    0.0000 H   0  0  0

+   -0.1512    3.2765    0.0000 H   0  0  0

+   -4.0323   -1.2031    0.0000 H   0  0  0

+   -4.0408    1.3889    0.0000 H   0  0  0

+    2.4035   -2.4960    0.0000 H   0  0  0

+   -2.6694   -3.3840    0.0000 H   0  0  0

+    2.5248    2.4881    0.0000 H   0  0  0

+   -2.6737    3.3586    0.0000 H   0  0  0

+    4.6580   -1.2654    0.0000 H   0  0  0

+    4.7198    1.1474    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  6 12  2  0

+  7 13  2  0

+  8 14  1  0

+ 11 15  1  0

+ 13 16  1  0

+  5  7  1  0

+  9 12  1  0

+ 10 14  2  0

+ 15 16  2  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-12-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+    0.0034   -0.4557    0.0000 C   0  0  0

+   -1.1842    0.1815    0.0000 N   0  0  0

+    1.0344    0.1831    0.0000 O   0  0  0

+    0.0333   -1.4155    0.0000 H   0  0  0

+   -1.2141    1.1413    0.0000 H   0  0  0

+   -2.0004   -0.3243    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96563-11-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.2462   -0.6294    0.0131 C   0  0  0

+   -1.2375   -0.6078    0.0012 C   0  0  0

+    0.7301    0.6617   -0.1789 C   0  0  0

+    1.1481   -1.6819    0.1825 C   0  0  0

+   -1.6807    0.6966   -0.1982 C   0  0  0

+   -2.1726   -1.6338    0.1505 C   0  0  0

+   -0.4612    1.5767   -0.3239 C   0  0  0

+    2.0879    0.8985   -0.2067 C   0  0  0

+    2.5048   -1.4383    0.1529 C   0  0  0

+   -3.0309    0.9720   -0.2476 C   0  0  0

+   -3.5212   -1.3491    0.0997 C   0  0  0

+   -0.4555    2.6049    0.8091 C   0  0  0

+    2.9782   -0.1508   -0.0431 C   0  0  0

+   -3.9521   -0.0496   -0.0989 C   0  0  0

+    4.3086    0.0823   -0.0706 F   0  0  0

+    0.8011   -2.6556    0.0000 H   0  0  0

+   -1.8555   -2.6177    0.0000 H   0  0  0

+    0.4673    2.0311    0.0000 H   0  0  0

+    2.4397    1.8705    0.0000 H   0  0  0

+    3.1692   -2.2302    0.0000 H   0  0  0

+   -3.3540    1.9539    0.0000 H   0  0  0

+   -4.2100   -2.1199    0.0000 H   0  0  0

+    0.5782    2.5992    0.0000 H   0  0  0

+   -0.4498    3.6386    0.0000 H   0  0  0

+   -1.4892    2.6106    0.0000 H   0  0  0

+   -4.9638    0.1626    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  2  0

+ 10 14  2  0

+ 13 15  1  0

+  5  7  1  0

+  9 13  1  0

+ 11 14  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64920-31-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.1466    0.6001   -0.1708 C   0  0  0

+   -0.9456   -0.5527   -0.0027 C   0  0  0

+    1.2564    0.4576   -0.2242 C   0  0  0

+   -0.7560    1.8671   -0.2879 C   0  0  0

+   -2.4024   -0.3973    0.0495 C   0  0  0

+   -0.3429   -1.8075    0.1094 C   0  0  0

+    1.8279   -0.8043   -0.1124 C   0  0  0

+    2.1309    1.6325   -0.3967 C   0  0  0

+   -2.0973    2.0114   -0.2450 C   0  0  0

+   -2.9520    0.8990   -0.0699 C   0  0  0

+   -3.2483   -1.4960    0.2130 C   0  0  0

+    1.0282   -1.9242    0.0546 C   0  0  0

+    3.3272   -0.9419   -0.1739 C   0  0  2

+    3.4145    1.5463   -0.0698 C   0  0  0

+   -4.3445    1.0578   -0.0223 C   0  0  0

+   -4.6005   -1.3082    0.2556 C   0  0  0

+    3.9864    0.2698    0.4819 C   0  0  1

+    3.7419   -1.0293   -1.5387 O   0  0  0

+   -5.1452   -0.0347    0.1384 C   0  0  0

+    3.7717    0.2227    1.8939 O   0  0  0

+   -0.1561    2.7166    0.0000 H   0  0  0

+   -0.9335   -2.6635    0.0000 H   0  0  0

+    1.6955    2.5769    0.0000 H   0  0  0

+   -2.5063    2.9675    0.0000 H   0  0  0

+   -2.8545   -2.4585    0.0000 H   0  0  0

+    1.4645   -2.8682    0.0000 H   0  0  0

+    3.1722   -1.9702    0.0000 H   0  0  0

+    4.0088    2.3997    0.0000 H   0  0  0

+   -4.7613    2.0106    0.0000 H   0  0  0

+   -5.2318   -2.1346    0.0000 H   0  0  0

+    5.0256    0.2298    0.0000 H   0  0  0

+    4.7595   -1.2438    0.0000 H   0  0  0

+   -6.1784    0.0838    0.0000 H   0  0  0

+    2.7559   -0.0001    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

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+ 10 15  1  0

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+ 13 17  1  0

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+ 15 19  2  0

+ 17 20  1  0

+  7 12  1  0

+  9 10  1  0

+ 14 17  1  0

+ 16 19  1  0

+  4 21  1  0

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+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55-18-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -0.1824    0.0069    0.0795 N   0  0  0

+   -1.5293    0.2305    0.6106 C   0  0  0

+    0.4941    1.0672   -0.6717 C   0  0  0

+    0.4101   -1.1217    0.2779 N   0  0  0

+   -2.5655   -0.1982   -0.4303 C   0  0  0

+    1.2970    1.9428    0.2925 C   0  0  0

+    1.5299   -1.3075   -0.1637 O   0  0  0

+   -1.0876    1.0343    0.0000 H   0  0  0

+   -2.1411    0.9138    0.0000 H   0  0  0

+    0.1683    1.9245    0.0000 H   0  0  0

+   -0.4182    1.1609    0.0000 H   0  0  0

+   -2.9161    0.6493    0.0000 H   0  0  0

+   -3.4130   -0.5488    0.0000 H   0  0  0

+   -2.2149   -1.0457    0.0000 H   0  0  0

+    1.9730    1.3230    0.0000 H   0  0  0

+    1.9169    2.6188    0.0000 H   0  0  0

+    0.6210    2.5627    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  4  7  2  0

+  2  8  1  0

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+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90-44-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -1.2559    0.9156    0.1605 C   0  0  0

+   -1.2666   -0.4730    0.0385 C   0  0  0

+    0.0001    1.6818    0.4436 C   0  0  0

+   -2.4473    1.6093    0.0209 C   0  0  0

+   -0.0001   -1.2274    0.1707 C   0  0  0

+   -2.4597   -1.1526   -0.2104 C   0  0  0

+    1.2564    0.9155    0.1619 C   0  0  0

+   -3.6265    0.9342   -0.2280 C   0  0  0

+    1.2666   -0.4733    0.0380 C   0  0  0

+   -0.0002   -2.4245    0.3813 O   0  0  0

+   -3.6364   -0.4450   -0.3431 C   0  0  0

+    2.4474    1.6089    0.0228 C   0  0  0

+    2.4591   -1.1527   -0.2115 C   0  0  0

+    3.6266    0.9337   -0.2283 C   0  0  0

+    3.6364   -0.4451   -0.3436 C   0  0  0

+    0.6711    2.4685    0.0000 H   0  0  0

+   -0.6709    2.4685    0.0000 H   0  0  0

+   -2.4435    2.6433    0.0000 H   0  0  0

+   -2.4719   -2.1865    0.0000 H   0  0  0

+   -4.5191    1.4560    0.0000 H   0  0  0

+   -4.5382   -0.9508    0.0000 H   0  0  0

+    2.4437    2.6429    0.0000 H   0  0  0

+    2.4712   -2.1866    0.0000 H   0  0  0

+    4.5193    1.4555    0.0000 H   0  0  0

+    4.5382   -0.9510    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  4  8  2  0

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+  4 18  1  0

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+  8 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120-32-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -0.3268   -0.6092   -0.6975 C   0  0  0

+   -0.5620   -1.7846    0.0002 C   0  0  0

+    0.9338   -0.4532   -1.5085 C   0  0  0

+   -1.2515    0.4164   -0.6532 C   0  0  0

+   -1.7236   -1.9260    0.7458 C   0  0  0

+    0.3439   -2.7968   -0.0467 O   0  0  0

+    2.0169    0.1395   -0.6444 C   0  0  0

+   -2.4116    0.2714    0.0865 C   0  0  0

+   -2.6432   -0.8965    0.7918 C   0  0  0

+    2.8579   -0.6889    0.0753 C   0  0  0

+    2.1731    1.5111   -0.5759 C   0  0  0

+   -3.5718    1.5617    0.1411 Cl  0  0  0

+    3.8512   -0.1453    0.8678 C   0  0  0

+    3.1667    2.0549    0.2169 C   0  0  0

+    4.0038    1.2269    0.9409 C   0  0  0

+    0.6864   -1.3315    0.0000 H   0  0  0

+    1.6477   -1.0215    0.0000 H   0  0  0

+   -0.9331    1.2716    0.0000 H   0  0  0

+   -2.0453   -2.7799    0.0000 H   0  0  0

+    0.9525   -3.4768    0.0000 H   0  0  0

+   -3.5235   -1.1370    0.0000 H   0  0  0

+    2.7319   -1.5927    0.0000 H   0  0  0

+    1.4157    2.0201    0.0000 H   0  0  0

+    4.6092   -0.6533    0.0000 H   0  0  0

+    3.2937    2.9585    0.0000 H   0  0  0

+    4.8641    1.5313    0.0000 H   0  0  0

+  1  2  2  0

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+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+42397-64-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.5373   -0.3047   -0.0010 C   0  0  0

+   -0.5751    0.3774   -0.0022 C   0  0  0

+    1.8367    0.3933   -0.0020 C   0  0  0

+    0.5130   -1.7785    0.0076 C   0  0  0

+   -1.8777   -0.3124   -0.0007 C   0  0  0

+   -0.5421    1.8521   -0.0046 C   0  0  0

+    3.0561   -0.4338    0.0001 C   0  0  0

+    1.8713    1.7046   -0.0039 C   0  0  0

+   -0.7847   -2.4744    0.0137 C   0  0  0

+    1.6496   -2.4346    0.0092 C   0  0  0

+   -2.9779    0.4032   -0.0014 C   0  0  0

+   -1.9096   -1.7846    0.0020 C   0  0  0

+    0.6110    2.4774   -0.0056 C   0  0  0

+   -1.8322    2.5639   -0.0052 C   0  0  0

+    2.9461   -1.7451    0.0027 C   0  0  0

+    4.2788    0.1502   -0.0012 N   0  3  0

+   -2.9511    1.8714   -0.0042 C   0  0  0

+   -4.1748   -0.2321    0.0000 N   0  3  0

+    5.1229   -0.2059   -0.8037 O   0  0  0

+    4.5337    1.0312    0.8003 O   0  5  0

+   -4.9821   -0.0119   -0.8850 O   0  0  0

+   -4.4433   -1.0233    0.8862 O   0  5  0

+    2.7645    2.1893    0.0000 H   0  0  0

+   -0.8141   -3.4902    0.0000 H   0  0  0

+    1.6319   -3.4507    0.0000 H   0  0  0

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+ 16 19  2  0

+ 16 20  1  0

+ 18 21  2  0

+ 18 22  1  0

+  8 13  1  0

+  9 12  2  0

+ 10 15  1  0

+ 14 17  2  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+758-17-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.5031    0.0280   -0.0013 N   0  0  0

+   -0.6783    0.6766    0.0010 C   0  0  0

+    1.7558    0.7875    0.0003 C   0  0  0

+    0.5324   -1.3377    0.0005 N   0  0  0

+   -1.7154    0.0478   -0.0003 O   0  0  0

+   -0.7002    1.6940    0.0000 H   0  0  0

+    2.2834   -0.0827    0.0000 H   0  0  0

+    2.6260    1.3151    0.0000 H   0  0  0

+    1.2282    1.6577    0.0000 H   0  0  0

+   -0.3378   -1.8653    0.0000 H   0  0  0

+    1.4244   -1.8275    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97576-08-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+    0.0167    0.1596   -0.0788 C   0  0  0

+   -1.3144    0.6105   -0.0309 C   0  0  0

+    1.0739    1.0938   -0.1051 C   0  0  0

+    0.2912   -1.2287   -0.0944 C   0  0  0

+   -2.3752   -0.3226   -0.0013 C   0  0  0

+   -1.5852    1.9978   -0.0132 C   0  0  0

+    2.4618    0.5941   -0.1499 C   0  0  0

+    0.7920    2.4563   -0.0868 C   0  0  0

+    1.6833   -1.6860   -0.1553 C   0  0  0

+   -0.7669   -2.1372   -0.0553 C   0  0  0

+   -3.7100    0.1442    0.0448 C   0  0  0

+   -2.0837   -1.6934   -0.0178 C   0  0  0

+   -0.5252    2.9081   -0.0419 C   0  0  0

+   -2.9777    2.4395    0.0346 C   0  0  0

+    2.7060   -0.7939   -0.1946 C   0  0  0

+    3.5463    1.4953   -0.1652 C   0  0  0

+   -3.9875    1.4972    0.0620 C   0  0  0

+   -4.8264   -0.8326    0.0756 N   0  3  0

+    4.1259   -1.2931   -0.2977 C   0  0  2

+    4.7955    1.0691    0.1023 C   0  0  0

+   -5.7857   -0.6845   -0.6603 O   0  0  0

+   -4.7768   -1.9370    0.9605 O   0  5  0

+    5.0586   -0.3644    0.4776 C   0  0  1

+    4.5206   -1.3266   -1.6707 O   0  0  0

+    4.8444   -0.5366    1.8800 O   0  0  0

+    1.5807    3.1511    0.0000 H   0  0  0

+    1.8921   -2.7161    0.0000 H   0  0  0

+   -0.5661   -3.1689    0.0000 H   0  0  0

+   -2.8686   -2.3925    0.0000 H   0  0  0

+   -0.7233    3.9404    0.0000 H   0  0  0

+   -3.2090    3.4648    0.0000 H   0  0  0

+    3.3558    2.5290    0.0000 H   0  0  0

+   -4.9889    1.8167    0.0000 H   0  0  0

+    3.9054   -2.3208    0.0000 H   0  0  0

+    5.5914    1.7556    0.0000 H   0  0  0

+    6.0618   -0.6780    0.0000 H   0  0  0

+    5.5679   -1.4155    0.0000 H   0  0  0

+    4.0252   -1.1952    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

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+  5 12  1  0

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+ 15 19  1  0

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+ 18 22  1  0

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+ 19 24  1  0

+ 23 25  1  0

+  8 13  2  0

+  9 15  1  0

+ 10 12  2  0

+ 14 17  2  0

+ 20 23  1  0

+  8 26  1  0

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+ 17 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 23 36  1  0

+ 24 37  1  0

+ 25 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54954-12-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 51                          1 V2000

+   -0.8660   -1.2034   -0.5828 C   0  0  0

+   -2.0377   -1.6906    0.0177 C   0  0  0

+    0.3062   -1.9677   -0.6131 C   0  0  0

+   -0.8971    0.1547   -1.1625 C   0  0  0

+   -3.2018   -1.0324    0.0082 O   0  0  0

+   -1.9849   -2.9382    0.6393 C   0  0  0

+    1.4128   -1.4971   -1.2414 O   0  0  0

+    0.3279   -3.2063    0.0019 C   0  0  0

+   -2.0627    0.9611   -0.7384 C   0  0  0

+   -0.0409    0.5728   -1.9212 O   0  0  0

+   -3.1482    0.2946   -0.1548 C   0  0  0

+   -0.8174   -3.6806    0.6319 C   0  0  0

+    2.1582   -0.7611   -0.2694 C   0  0  2

+   -2.0736    2.3483   -0.9127 C   0  0  0

+   -4.2365    1.0648    0.2769 C   0  0  0

+   -0.7896   -4.8894    1.2485 O   0  0  0

+    1.3966    0.3657    0.1602 O   0  0  0

+    3.4769   -0.2905   -0.8871 C   0  0  1

+   -3.1653    3.0826   -0.4812 C   0  0  0

+   -1.0204    2.9714   -1.5009 O   0  0  0

+   -4.2357    2.4356    0.1135 C   0  0  0

+   -5.3036    0.4561    0.8618 O   0  0  0

+    2.0908    0.9646    1.2528 C   0  0  1

+    4.2837    0.4659    0.1744 C   0  0  2

+    4.2239   -1.4232   -1.3354 O   0  0  0

+    3.4040    1.5765    0.7598 C   0  0  2

+    1.2193    2.0589    1.8725 C   0  0  0

+    5.4419    1.0446   -0.4304 O   0  0  0

+    4.0827    2.1940    1.8553 O   0  0  0

+   -0.0029    1.4859    2.3414 O   0  0  0

+   -2.8396   -3.4314    0.0000 H   0  0  0

+    1.1531   -3.7473    0.0000 H   0  0  0

+    2.6831   -1.5967    0.0000 H   0  0  0

+   -0.7669   -5.8759    0.0000 H   0  0  0

+    2.9628    0.5518    0.0000 H   0  0  0

+   -3.1414    4.0691    0.0000 H   0  0  0

+   -0.1711    3.4738    0.0000 H   0  0  0

+   -5.0950    2.9206    0.0000 H   0  0  0

+   -6.1607   -0.0328    0.0000 H   0  0  0

+    2.6266    0.1360    0.0000 H   0  0  0

+    4.8476   -0.3439    0.0000 H   0  0  0

+    4.7672   -2.2470    0.0000 H   0  0  0

+    2.8574    2.3980    0.0000 H   0  0  0

+    2.0368    2.6116    0.0000 H   0  0  0

+    0.7320    2.9170    0.0000 H   0  0  0

+    6.3246    1.4856    0.0000 H   0  0  0

+    4.8126    2.8581    0.0000 H   0  0  0

+   -0.8963    1.0670    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  1  0

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+  5 11  1  0

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+ 13  7  1  0

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+  8 12  1  0

+  9 11  2  0

+ 19 21  1  0

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+ 26 43  1  0

+ 27 44  1  0

+ 27 45  1  0

+ 28 46  1  0

+ 29 47  1  0

+ 30 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+136-85-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    0.6551    0.7493    0.0026 C   0  0  0

+    0.4181   -0.6362   -0.0001 C   0  0  0

+    2.0212    0.9022    0.0022 N   0  0  0

+   -0.4166    1.6358   -0.0001 C   0  0  0

+   -0.9032   -1.1032   -0.0003 C   0  0  0

+    1.6150   -1.2561   -0.0020 N   0  0  0

+    2.5665   -0.3903   -0.0007 N   0  0  0

+   -1.6959    1.1550   -0.0053 C   0  0  0

+   -1.9368   -0.2130    0.0020 C   0  0  0

+   -3.3561   -0.7195    0.0017 C   0  0  0

+    2.5479    1.8010    0.0000 H   0  0  0

+   -0.2447    2.6633    0.0000 H   0  0  0

+   -1.0955   -2.1271    0.0000 H   0  0  0

+   -2.4975    1.8204    0.0000 H   0  0  0

+   -3.7062    0.2617    0.0000 H   0  0  0

+   -4.3373   -1.0696    0.0000 H   0  0  0

+   -3.0060   -1.7007    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  4 12  1  0

+  5 13  1  0

+  8 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+22089-22-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 35                          1 V2000

+   -0.2376    0.2745   -1.0297 P   0  0  1

+   -0.8914   -0.4352    0.3492 N   0  0  0

+    1.4267    0.4672   -0.9129 N   0  0  0

+   -0.1920   -0.7441   -2.2698 O   0  0  0

+   -0.9223    1.5412   -1.3717 O   0  0  0

+   -2.3353   -0.1665    0.3180 C   0  0  0

+   -0.7287   -1.8869    0.1944 C   0  0  0

+    1.8597    1.2383   -2.0827 C   0  0  0

+    1.6722    1.3116    0.2638 C   0  0  0

+    0.1621    0.0028   -3.4307 C   0  0  0

+   -2.6460    1.0528    1.1883 C   0  0  0

+    0.3690   -2.3807    1.1389 C   0  0  0

+    1.6334    0.4139   -3.3518 C   0  0  0

+    3.0264    0.9500    0.8774 C   0  0  0

+   -4.4182    1.3826    1.1501 Cl  0  0  0

+    0.5687   -4.1625    0.9490 Cl  0  0  0

+    3.3278    1.9864    2.3216 Cl  0  0  0

+   -3.2738   -0.2654    0.0000 H   0  0  0

+   -2.3726   -1.1095    0.0000 H   0  0  0

+   -1.6703   -1.8242    0.0000 H   0  0  0

+   -0.9572   -2.8025    0.0000 H   0  0  0

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+    0.1300    0.9459    0.0000 H   0  0  0

+   -0.7620    0.1943    0.0000 H   0  0  0

+   -1.7075    1.1517    0.0000 H   0  0  0

+   -2.6087    1.9958    0.0000 H   0  0  0

+    1.3106   -2.4434    0.0000 H   0  0  0

+    0.5975   -1.4651    0.0000 H   0  0  0

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+    3.9345    0.6932    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 14 34  1  0

+ 14 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3531-19-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.9026   -0.7904   -0.0003 C   0  0  0

+   -0.4082   -1.2264    0.0245 C   0  0  0

+    1.1800    0.5697   -0.0270 C   0  0  0

+    2.0102   -1.7724    0.0077 N   0  3  0

+   -1.4436   -0.3103    0.0229 C   0  0  0

+    0.1368    1.4887   -0.0286 C   0  0  0

+    2.5048    1.0140   -0.0516 N   0  0  0

+    2.0575   -2.6439   -0.8418 O   0  0  0

+    2.8742   -1.7088    0.8638 O   0  5  0

+   -1.1717    1.0456   -0.0041 C   0  0  0

+   -2.8465   -0.7816    0.0495 N   0  3  0

+    0.4776    3.1906   -0.0624 Cl  0  0  0

+   -3.7598    0.0242    0.0481 O   0  0  0

+   -3.0876   -1.9753    0.0729 O   0  5  0

+   -0.6159   -2.2424    0.0000 H   0  0  0

+    3.2820    0.3274    0.0000 H   0  0  0

+    2.7108    2.0303    0.0000 H   0  0  0

+   -1.9506    1.7302    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 14  1  0

+  6 10  2  0

+  2 15  1  0

+  7 16  1  0

+  7 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96383-86-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    0.2496    0.7311   -0.1652 C   0  0  0

+   -0.6478   -0.3536   -0.0497 C   0  0  0

+    1.6358    0.4700   -0.2093 C   0  0  0

+   -0.2470    2.0494   -0.2402 C   0  0  0

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+   -0.1570   -1.6591    0.0200 C   0  0  0

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+   -2.5216    1.2678   -0.0822 C   0  0  0

+   -3.0241   -1.1024    0.1058 C   0  0  0

+    1.1996   -1.8919   -0.0253 C   0  0  0

+    3.5776   -1.1045   -0.1913 C   0  0  2

+    3.8774    1.3614    0.0084 C   0  0  0

+   -3.8954    1.5484   -0.0432 C   0  0  0

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+    4.3298    0.0205    0.5168 C   0  0  1

+    4.0015   -1.1767   -1.5541 O   0  0  0

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+   -5.2865   -1.7925    0.2512 O   0  0  0

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+  1  2  2  0

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+ 15 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+124-07-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.6661   -0.2085    0.0000 C   0  0  0

+   -0.6432    0.5830    0.0000 C   0  0  0

+    1.8488    0.7621    0.0000 C   0  0  0

+   -1.8259   -0.3876    0.0000 C   0  0  0

+    3.1385   -0.0176    0.0000 C   0  0  0

+   -3.1353    0.4039    0.0000 C   0  0  0

+    4.3142    0.6300    0.0000 O   0  0  0

+    3.1141   -1.2256    0.0000 O   0  0  0

+   -4.3179   -0.5667    0.0000 C   0  0  0

+   -5.6273    0.2248    0.0000 C   0  0  0

+   -0.0347   -1.1171    0.0000 H   0  0  0

+    1.4896   -1.0075    0.0000 H   0  0  0

+    0.0576    1.4916    0.0000 H   0  0  0

+   -1.4667    1.3820    0.0000 H   0  0  0

+    2.5496    1.6707    0.0000 H   0  0  0

+    1.0253    1.5611    0.0000 H   0  0  0

+   -2.5267   -1.2962    0.0000 H   0  0  0

+   -1.0024   -1.1866    0.0000 H   0  0  0

+   -2.4345    1.3125    0.0000 H   0  0  0

+   -3.9589    1.2029    0.0000 H   0  0  0

+    5.3193    1.1836    0.0000 H   0  0  0

+   -5.0187   -1.4753    0.0000 H   0  0  0

+   -3.4943   -1.3657    0.0000 H   0  0  0

+   -5.0337    1.2068    0.0000 H   0  0  0

+   -6.6093    0.8184    0.0000 H   0  0  0

+   -6.2209   -0.7572    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  5  8  2  0

+  6  9  1  0

+  9 10  1  0

+  1 11  1  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  4 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+27451-21-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    1.3670   -0.4263    0.2918 N   0  0  0

+   -0.0124   -0.2289    0.1647 C   0  0  0

+    2.2265    0.3914   -0.3477 C   0  0  0

+    1.8599   -1.4816    1.0971 O   0  0  0

+   -0.7952   -1.1794   -0.4778 C   0  0  0

+   -0.6024    0.9150    0.6857 C   0  0  0

+    2.5801    0.1337   -1.7898 C   0  0  0

+    2.7155    1.3346    0.2374 O   0  0  0

+   -2.1563   -0.9815   -0.6017 C   0  0  0

+   -1.9644    1.1070    0.5586 C   0  0  0

+   -2.7401    0.1616   -0.0866 C   0  0  0

+   -4.2257    0.3743   -0.2236 C   0  0  0

+    2.2590   -2.3361    0.0000 H   0  0  0

+   -0.4553   -2.0591    0.0000 H   0  0  0

+   -0.0565    1.6840    0.0000 H   0  0  0

+    2.0246   -0.6285    0.0000 H   0  0  0

+    3.3423   -0.4218    0.0000 H   0  0  0

+    3.1356    0.8959    0.0000 H   0  0  0

+   -2.7054   -1.7482    0.0000 H   0  0  0

+   -2.3070    1.9856    0.0000 H   0  0  0

+   -4.0920    1.3079    0.0000 H   0  0  0

+   -5.1593    0.5080    0.0000 H   0  0  0

+   -4.3594   -0.5593    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  5  9  2  0

+  6 10  1  0

+  9 11  1  0

+ 11 12  1  0

+ 10 11  2  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5307-00-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -2.3767   -0.4262   -0.0008 O   0  0  0

+   -2.4749   -1.8519   -0.0033 C   0  0  0

+   -1.0508   -0.1235   -0.0015 C   0  0  0

+   -0.6394    1.2072    0.0006 C   0  0  0

+   -0.1081   -1.1379    0.0016 C   0  0  0

+   -1.5926    2.2365    0.0038 N   0  0  0

+    0.7130    1.5141   -0.0001 C   0  0  0

+    1.2450   -0.8266    0.0009 C   0  0  0

+    1.6527    0.5007   -0.0028 C   0  0  0

+    2.1986   -1.8514    0.0045 N   0  0  0

+    3.1218    0.8366   -0.0040 C   0  0  0

+   -3.5138   -1.7803    0.0000 H   0  0  0

+   -2.5465   -2.8908    0.0000 H   0  0  0

+   -1.4360   -1.9235    0.0000 H   0  0  0

+   -0.4138   -2.1334    0.0000 H   0  0  0

+   -1.2847    3.2313    0.0000 H   0  0  0

+   -2.6081    2.0058    0.0000 H   0  0  0

+    1.0207    2.5090    0.0000 H   0  0  0

+    1.8931   -2.8469    0.0000 H   0  0  0

+    3.2135   -1.6182    0.0000 H   0  0  0

+    3.3539   -0.1786    0.0000 H   0  0  0

+    4.1370    1.0687    0.0000 H   0  0  0

+    2.8897    1.8518    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  4  1  0

+  8  5  2  0

+  9  7  2  0

+ 10  8  1  0

+ 11  9  1  0

+  8  9  1  0

+  2 12  1  0

+  2 13  1  0

+  2 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99-76-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.2491   -0.1324    0.0040 C   0  0  0

+    0.5552   -1.2756    0.0037 C   0  0  0

+    0.3431    1.1341    0.0018 C   0  0  0

+   -1.7181   -0.2619    0.0004 C   0  0  0

+    1.9264   -1.1503    0.0013 C   0  0  0

+    1.7147    1.2504   -0.0006 C   0  0  0

+   -2.4916    0.8414    0.0007 O   0  0  0

+   -2.2309   -1.3634   -0.0027 O   0  0  0

+    2.5110    0.1108   -0.0008 C   0  0  0

+   -3.9380    0.7140   -0.0028 C   0  0  0

+    3.8628    0.2298   -0.0032 O   0  0  0

+    0.1175   -2.2218    0.0000 H   0  0  0

+   -0.2533    1.9892    0.0000 H   0  0  0

+    2.5270   -2.0024    0.0000 H   0  0  0

+    2.1570    2.1944    0.0000 H   0  0  0

+   -4.0295    1.7525    0.0000 H   0  0  0

+   -4.9765    0.6225    0.0000 H   0  0  0

+   -3.8465   -0.3245    0.0000 H   0  0  0

+    4.9013    0.3212    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+  9 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60129-67-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 45                          1 V2000

+    2.2880   -0.1748   -0.0727 C   0  0  0

+    3.1814    0.8155    0.3452 C   0  0  0

+    2.7794   -1.3830   -0.5740 C   0  0  0

+    0.9399    0.0354    0.0138 N   0  0  0

+    4.5398    0.5941    0.2602 C   0  0  0

+    2.6706    2.0989    0.8772 N   0  3  0

+    4.1408   -1.5902   -0.6530 C   0  0  0

+    0.1181   -0.8807   -0.3728 N   0  0  0

+    5.0192   -0.6052   -0.2374 C   0  0  0

+    3.4505    2.9609    1.2409 O   0  0  0

+    1.4705    2.2930    0.9512 O   0  5  0

+   -1.2273   -0.6709   -0.2864 C   0  0  0

+    6.4788   -0.8351   -0.3254 N   0  3  0

+   -2.1201   -1.6633   -0.7051 C   0  0  0

+   -1.7177    0.5352    0.2266 C   0  0  0

+    6.9039   -1.8894   -0.7628 O   0  0  0

+    7.2547    0.0299    0.0396 O   0  5  0

+   -3.4768   -1.4478   -0.6165 C   0  0  0

+   -3.0753    0.7430    0.3120 C   0  0  0

+   -3.9606   -0.2447   -0.1110 C   0  0  0

+   -5.3336   -0.0305   -0.0230 N   0  0  0

+   -5.9928   -0.0321    1.2854 C   0  0  0

+   -6.1191    0.1963   -1.2386 C   0  0  0

+   -6.2510   -1.4748    1.7246 C   0  0  0

+   -5.9981    1.6629   -1.6577 C   0  0  0

+   -5.0543   -2.0256    2.2782 O   0  0  0

+   -4.7888    1.8491   -2.3958 O   0  0  0

+    2.1649   -2.1622    0.0000 H   0  0  0

+    5.1607    1.3682    0.0000 H   0  0  0

+    4.4771   -2.5238    0.0000 H   0  0  0

+   -1.7889   -2.5987    0.0000 H   0  0  0

+   -1.1029    1.3141    0.0000 H   0  0  0

+   -4.0953   -2.2237    0.0000 H   0  0  0

+   -3.4100    1.6772    0.0000 H   0  0  0

+   -5.9359    0.9586    0.0000 H   0  0  0

+   -6.9783    0.0840    0.0000 H   0  0  0

+   -7.1005    0.3432    0.0000 H   0  0  0

+   -6.3306   -0.7732    0.0000 H   0  0  0

+   -7.2095   -1.2179    0.0000 H   0  0  0

+   -6.5881   -2.4081    0.0000 H   0  0  0

+   -6.0719    2.6525    0.0000 H   0  0  0

+   -6.9904    1.6668    0.0000 H   0  0  0

+   -4.1529   -2.4405    0.0000 H   0  0  0

+   -3.8080    2.0001    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  6 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 12 14  2  0

+ 12 15  1  0

+ 13 16  2  0

+ 13 17  1  0

+ 14 18  1  0

+ 15 19  2  0

+ 18 20  2  0

+ 20 21  1  0

+ 21 22  1  0

+ 21 23  1  0

+ 22 24  1  0

+ 23 25  1  0

+ 24 26  1  0

+ 25 27  1  0

+  7  9  2  0

+ 19 20  1  0

+  3 28  1  0

+  5 29  1  0

+  7 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+ 23 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+ 25 41  1  0

+ 25 42  1  0

+ 26 43  1  0

+ 27 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7269-57-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.6249    0.6443   -0.0020 C   0  0  0

+   -1.3245   -0.5734   -0.0021 C   0  0  0

+    0.7805    0.6055   -0.0008 C   0  0  0

+   -1.5491    1.6363    0.0021 N   0  0  0

+   -0.6406   -1.7135   -0.0007 N   0  0  0

+   -2.6565   -0.2449   -0.0030 N   0  0  0

+    1.3833   -0.5779    0.0003 N   0  0  0

+    1.5197    1.7751   -0.0011 N   0  0  0

+   -2.7418    1.1168    0.0045 C   0  0  0

+    0.6823   -1.7048    0.0007 C   0  0  0

+    2.9346    1.7184    0.0002 O   0  0  0

+    1.3591   -2.9134    0.0021 N   0  0  0

+   -3.4419   -0.9008    0.0000 H   0  0  0

+    1.0439    2.6811    0.0000 H   0  0  0

+   -3.6149    1.6505    0.0000 H   0  0  0

+    3.9571    1.6774    0.0000 H   0  0  0

+    0.8359   -3.7928    0.0000 H   0  0  0

+    2.3823   -2.9268    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  8 11  1  0

+ 10 12  1  0

+  6  9  1  0

+  7 10  1  0

+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 12 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-14-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.0519    0.0000    0.4023 N   0  0  0

+    0.7279   -1.1785   -0.1564 C   0  0  0

+    0.7276    1.1787   -0.1564 C   0  0  0

+   -1.2996   -0.0002   -0.1341 N   0  0  0

+   -0.1560   -1.6855    0.0000 H   0  0  0

+    1.2349   -2.0624    0.0000 H   0  0  0

+    1.6118   -0.6715    0.0000 H   0  0  0

+    1.6116    0.6719    0.0000 H   0  0  0

+    1.2344    2.0627    0.0000 H   0  0  0

+   -0.1564    1.6855    0.0000 H   0  0  0

+   -1.8092    0.8822    0.0000 H   0  0  0

+   -1.8090   -0.8827    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+885-11-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -0.1155   -0.1780   -0.0072 N   0  0  0

+   -1.5004    0.0166   -0.0021 C   0  0  0

+    0.8125    0.8012   -0.0194 C   0  0  0

+    0.5288   -1.4172    0.0055 N   0  0  0

+   -2.1964    0.0956   -1.2012 C   0  0  0

+   -2.1835    0.1257    1.2025 C   0  0  0

+    2.1299    0.1234   -0.0195 C   0  0  0

+    0.6086    1.9998   -0.0289 O   0  0  0

+    1.8534   -1.2559   -0.0032 C   0  0  0

+   -0.1543   -2.7130    0.0257 C   0  0  0

+   -3.5642    0.2879   -1.1926 C   0  0  0

+   -3.5509    0.3179    1.2041 C   0  0  0

+    3.3217    0.6974   -0.0299 N   0  0  0

+    2.8775   -2.3615    0.0060 C   0  0  0

+   -4.2404    0.4018    0.0081 C   0  0  0

+    3.4147    1.9092    0.0502 O   0  0  0

+   -2.3239   -0.9081    0.0000 H   0  0  0

+   -2.0333    1.1263    0.0000 H   0  0  0

+   -1.0494   -2.2412    0.0000 H   0  0  0

+   -0.6261   -3.6081    0.0000 H   0  0  0

+    0.7408   -3.1848    0.0000 H   0  0  0

+   -3.7187   -0.7120    0.0000 H   0  0  0

+   -3.4194    1.3211    0.0000 H   0  0  0

+    2.1352   -3.0491    0.0000 H   0  0  0

+    3.5651   -3.1038    0.0000 H   0  0  0

+    3.6198   -1.6739    0.0000 H   0  0  0

+   -5.2417    0.5470    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  2  0

+  7  9  2  0

+ 12 15  1  0

+  5 17  1  0

+  6 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+154-93-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    1.0068   -0.7028   -0.1936 N   0  0  0

+   -0.0986    0.0574   -0.3221 C   0  0  0

+    2.3166   -0.1589   -0.5609 C   0  0  0

+    0.9123   -1.9076    0.2578 N   0  0  0

+   -1.3036   -0.4430    0.0158 N   0  0  0

+   -0.0089    1.1937   -0.7425 O   0  0  0

+    2.9491    0.5149    0.6584 C   0  0  0

+    1.7055   -2.7578   -0.1048 O   0  0  0

+   -2.5052    0.3833   -0.1239 C   0  0  0

+    4.5611    1.1842    0.2064 Cl  0  0  0

+   -3.7296   -0.4172    0.3245 C   0  0  0

+   -5.2084    0.5998    0.1526 Cl  0  0  0

+    2.3278   -1.1650    0.0000 H   0  0  0

+    3.2542   -0.5240    0.0000 H   0  0  0

+   -1.4085   -1.4437    0.0000 H   0  0  0

+    2.9379    1.5210    0.0000 H   0  0  0

+    2.0115    0.8800    0.0000 H   0  0  0

+   -1.8326    1.1316    0.0000 H   0  0  0

+   -3.1602    1.1471    0.0000 H   0  0  0

+   -4.4022   -1.1655    0.0000 H   0  0  0

+   -3.0746   -1.1810    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  7 10  1  0

+  9 11  1  0

+ 11 12  1  0

+  3 13  1  0

+  3 14  1  0

+  5 15  1  0

+  7 16  1  0

+  7 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+499-12-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+   -0.6008   -0.4420    0.3060 C   0  0  0

+   -0.0137    0.7611    0.9981 C   0  0  0

+    0.1984   -1.4477   -0.0858 C   0  0  0

+   -2.0546   -0.5177    0.0644 C   0  0  0

+    0.3640    1.7970   -0.0293 C   0  0  0

+    1.6638   -1.3095    0.0193 C   0  0  0

+   -2.5796   -1.5935   -0.5544 O   0  0  0

+   -2.7779    0.3895    0.4233 O   0  0  0

+    0.9096    2.9601    0.3595 O   0  0  0

+    0.1757    1.5804   -1.2030 O   0  0  0

+    2.3824   -0.9197   -1.0520 O   0  0  0

+    2.2222   -1.5470    1.0713 O   0  0  0

+    0.5138    0.0346    0.0000 H   0  0  0

+    0.8754    0.8857    0.0000 H   0  0  0

+   -0.1534   -2.2737    0.0000 H   0  0  0

+   -2.9734   -2.4004    0.0000 H   0  0  0

+    1.2909    3.7729    0.0000 H   0  0  0

+    3.1716   -0.4916    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

+  6 11  1  0

+  6 12  2  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  7 16  1  0

+  9 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+202-03-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    1.0655   -0.0829   -0.0023 C   0  0  0

+   -0.0473   -1.0333   -0.0023 C   0  0  0

+    0.9636    1.2028   -0.0014 C   0  0  0

+    2.3126   -0.8453    0.0030 C   0  0  0

+   -1.2507   -0.5162   -0.0011 C   0  0  0

+    0.5828   -2.3592   -0.0038 C   0  0  0

+   -0.3902    1.7811    0.0011 C   0  0  0

+    2.2114    1.9828   -0.0025 C   0  0  0

+    1.9013   -2.2543    0.0047 C   0  0  0

+    3.4276   -0.1486    0.0039 C   0  0  0

+   -1.4217    0.9547    0.0008 C   0  0  0

+   -2.4572   -1.3604   -0.0021 C   0  0  0

+    3.3613    1.3273   -0.0027 C   0  0  0

+   -2.7972    1.4882    0.0028 C   0  0  0

+   -3.6448   -0.7967   -0.0005 C   0  0  0

+   -3.8170    0.6601    0.0023 C   0  0  0

+    0.0337   -3.3096    0.0000 H   0  0  0

+   -0.5389    2.8685    0.0000 H   0  0  0

+    2.1891    3.0801    0.0000 H   0  0  0

+    2.5941   -3.1056    0.0000 H   0  0  0

+    4.3992   -0.6590    0.0000 H   0  0  0

+   -2.3655   -2.4541    0.0000 H   0  0  0

+    4.2977    1.8998    0.0000 H   0  0  0

+   -2.9677    2.5724    0.0000 H   0  0  0

+   -4.5364   -1.4368    0.0000 H   0  0  0

+   -4.8340    1.0729    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  8 13  2  0

+ 11 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+  6  9  2  0

+  7 11  2  0

+ 10 13  1  0

+ 15 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24463-15-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.0037   -0.2891   -0.0020 C   0  0  0

+   -1.2496    0.0989   -0.0014 C   0  0  0

+    1.0844    0.7068   -0.0007 C   0  0  0

+    0.3349   -1.7236    0.0022 C   0  0  0

+   -1.5798    1.5365    0.0005 C   0  0  0

+   -2.3429   -0.8897   -0.0022 C   0  0  0

+    2.4697    0.2047   -0.0008 C   0  0  0

+    0.7959    1.9864    0.0000 C   0  0  0

+   -0.7522   -2.7170    0.0060 C   0  0  0

+    1.5979   -2.0804    0.0021 C   0  0  0

+   -0.6156    2.4260    0.0015 C   0  0  0

+   -3.0051    1.9098    0.0017 C   0  0  0

+   -2.0120   -2.3246   -0.0048 C   0  0  0

+   -3.5850   -0.4662   -0.0010 C   0  0  0

+    2.6852   -1.0934   -0.0020 C   0  0  0

+    3.6282    1.1685    0.0001 C   0  0  0

+   -3.9197    0.9637    0.0010 C   0  0  0

+    4.8560    0.4373   -0.0002 O   0  0  0

+    1.6053    2.7334    0.0000 H   0  0  0

+   -0.5127   -3.7921    0.0000 H   0  0  0

+    1.8499   -3.1526    0.0000 H   0  0  0

+   -0.8577    3.5005    0.0000 H   0  0  0

+   -3.3022    2.9704    0.0000 H   0  0  0

+   -2.8196   -3.0735    0.0000 H   0  0  0

+   -4.4013   -1.2057    0.0000 H   0  0  0

+    3.7255   -1.4551    0.0000 H   0  0  0

+    4.2951    2.0451    0.0000 H   0  0  0

+    2.8326    1.9302    0.0000 H   0  0  0

+   -4.9814    1.2567    0.0000 H   0  0  0

+    5.8023   -0.1263    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+ 12 17  2  0

+ 16 18  1  0

+  8 11  1  0

+  9 13  2  0

+ 10 15  1  0

+ 14 17  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63018-94-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -0.9728    0.5593   -0.0039 C   0  0  0

+   -0.8335   -0.9008   -0.0026 C   0  0  0

+    0.1593    1.3717   -0.0030 C   0  0  0

+   -2.2698    1.1167   -0.0001 C   0  0  0

+    0.4319   -1.4844   -0.0006 C   0  0  0

+   -2.0015   -1.6935   -0.0031 C   0  0  0

+    1.4250    0.7880   -0.0010 C   0  0  0

+    0.0161    2.8719   -0.0048 C   0  0  0

+   -3.3512    0.2964    0.0047 C   0  0  0

+    1.5643   -0.6718    0.0002 C   0  0  0

+    0.5750   -2.9846    0.0012 C   0  0  0

+   -3.2187   -1.0927   -0.0046 C   0  0  0

+    2.5930    1.5807    0.0009 C   0  0  0

+   -4.7313    0.9017    0.0087 C   0  0  0

+    2.8611   -1.2293    0.0018 C   0  0  0

+    3.8102    0.9798    0.0039 C   0  0  0

+    3.9427   -0.4092    0.0022 C   0  0  0

+   -2.3967    2.1555    0.0000 H   0  0  0

+   -1.9295   -2.7376    0.0000 H   0  0  0

+    1.0579    2.9713    0.0000 H   0  0  0

+   -0.0833    3.9137    0.0000 H   0  0  0

+   -1.0257    2.7725    0.0000 H   0  0  0

+   -0.4668   -3.0840    0.0000 H   0  0  0

+    0.6744   -4.0264    0.0000 H   0  0  0

+    1.6168   -2.8852    0.0000 H   0  0  0

+   -4.0803   -1.6868    0.0000 H   0  0  0

+    2.5210    2.6248    0.0000 H   0  0  0

+   -4.3109    1.8601    0.0000 H   0  0  0

+   -5.6897    1.3221    0.0000 H   0  0  0

+   -5.1517   -0.0567    0.0000 H   0  0  0

+    2.9878   -2.2682    0.0000 H   0  0  0

+    4.6718    1.5739    0.0000 H   0  0  0

+    4.9011   -0.8297    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 13 16  2  0

+ 15 17  2  0

+  7 10  2  0

+  9 12  1  0

+ 16 17  1  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-96-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.1752    0.0166    0.0032 C   0  0  0

+    0.5593   -1.1686    0.0029 C   0  0  0

+    0.4575    1.1865    0.0008 N   0  0  0

+   -1.6561   -0.0271    0.0001 C   0  0  0

+    1.8794   -1.1245    0.0002 N   0  0  0

+    1.7750    1.2215   -0.0018 C   0  0  0

+   -2.3641    1.1197    0.0004 N   0  0  0

+   -2.2324   -1.0969   -0.0028 O   0  0  0

+    2.5029    0.0405   -0.0022 C   0  0  0

+    0.0887   -2.0481    0.0000 H   0  0  0

+    2.2497    2.0988    0.0000 H   0  0  0

+   -1.8910    1.9979    0.0000 H   0  0  0

+   -3.3612    1.0903    0.0000 H   0  0  0

+    3.5000    0.0709    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6  9  2  0

+  2 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+125239-65-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.5951    0.4821   -0.0052 C   0  0  0

+   -0.5639   -0.9863   -0.0014 C   0  0  0

+    0.5393    1.1747   -0.0056 N   0  0  0

+   -1.8445    1.1370   -0.0024 C   0  0  0

+    0.5988   -1.6306    0.0016 N   0  0  0

+   -1.7839   -1.6929   -0.0005 C   0  0  0

+    1.7029    0.5291   -0.0025 C   0  0  0

+   -2.9897    0.4027    0.0036 C   0  0  0

+    1.7333   -0.9384    0.0012 C   0  0  0

+   -2.9607   -1.0058   -0.0032 C   0  0  0

+    2.9227    1.2327   -0.0024 C   0  0  0

+   -4.1881    1.0420    0.0067 O   0  0  0

+    2.9844   -1.5934    0.0039 C   0  0  0

+   -4.1627   -1.7124   -0.0029 N   0  0  0

+    4.0994    0.5409    0.0012 C   0  0  0

+   -3.9087    2.4434    0.0024 C   0  0  0

+    4.1256   -0.8614    0.0029 C   0  0  0

+    5.3027    1.2443    0.0013 N   0  0  0

+   -1.8902    2.1815    0.0000 H   0  0  0

+   -1.7857   -2.7384    0.0000 H   0  0  0

+    2.9270    2.2782    0.0000 H   0  0  0

+    3.0304   -2.6379    0.0000 H   0  0  0

+   -5.0722   -1.1967    0.0000 H   0  0  0

+   -4.1545   -2.7579    0.0000 H   0  0  0

+   -2.8833    2.2390    0.0000 H   0  0  0

+   -3.7043    3.4688    0.0000 H   0  0  0

+   -4.9341    2.6478    0.0000 H   0  0  0

+    5.0477   -1.3543    0.0000 H   0  0  0

+    6.2110    0.7264    0.0000 H   0  0  0

+    5.2971    2.2898    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+ 15 18  1  0

+  7  9  1  0

+  8 10  1  0

+ 15 17  1  0

+  4 19  1  0

+  6 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3132-64-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -1.5635   -0.0677   -0.5013 C   0  0  0

+   -2.9522   -0.5780   -0.1113 C   0  0  0

+   -2.5057    0.7421    0.2048 O   0  0  0

+   -0.5250   -0.6149    0.4800 C   0  0  0

+    1.2594    0.0409   -0.0211 Br  0  0  0

+   -0.9755    0.7964    0.0000 H   0  0  0

+   -3.9921   -0.4736    0.0000 H   0  0  0

+   -2.8208   -1.6149    0.0000 H   0  0  0

+   -1.2216   -1.3941    0.0000 H   0  0  0

+    0.0623   -1.4794    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  2  3  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  4  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+62-75-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.5168    0.0142   -0.0018 N   0  0  0

+   -0.5976   -0.6355   -0.0011 N   0  0  0

+    0.5106    1.4791    0.0002 C   0  0  0

+    1.7886   -0.7130    0.0015 C   0  0  0

+   -1.6550   -0.0310    0.0012 O   0  0  0

+    1.5437    1.4835    0.0000 H   0  0  0

+    0.5062    2.5122    0.0000 H   0  0  0

+   -0.5225    1.4747    0.0000 H   0  0  0

+    1.2758   -1.6098    0.0000 H   0  0  0

+    2.6854   -1.2258    0.0000 H   0  0  0

+    2.3014    0.1838    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-59-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    0.5033   -1.1776   -0.1115 N   0  0  0

+   -0.5659   -1.1114   -1.1108 C   0  0  0

+    0.5995   -2.3339    0.7829 C   0  0  0

+    1.4344   -0.1409   -0.0152 C   0  0  0

+   -1.7121   -0.2981   -0.5670 C   0  0  0

+    1.8091   -3.1839    0.3891 C   0  0  0

+    1.4279    0.7001    1.0902 C   0  0  0

+    2.3727    0.0478   -1.0222 C   0  0  0

+   -1.6843    1.0809   -0.6556 C   0  0  0

+   -2.7942   -0.9317    0.0155 C   0  0  0

+    2.3504    1.7240    1.1824 C   0  0  0

+    3.2921    1.0734   -0.9237 C   0  0  0

+   -2.7358    1.8270   -0.1566 C   0  0  0

+   -3.8454   -0.1858    0.5143 C   0  0  0

+    3.2795    1.9123    0.1759 C   0  0  0

+   -3.8149    1.1939    0.4308 C   0  0  0

+   -1.3554   -1.6693    0.0000 H   0  0  0

+   -0.3018   -2.0413    0.0000 H   0  0  0

+   -0.3565   -2.1905    0.0000 H   0  0  0

+    0.2403   -3.2314    0.0000 H   0  0  0

+    1.2533   -3.9749    0.0000 H   0  0  0

+    2.6001   -3.7397    0.0000 H   0  0  0

+    2.3649   -2.3929    0.0000 H   0  0  0

+    0.5241    1.0432    0.0000 H   0  0  0

+    2.8524   -0.7915    0.0000 H   0  0  0

+   -0.8210    1.5159    0.0000 H   0  0  0

+   -2.8364   -1.8975    0.0000 H   0  0  0

+    1.8711    2.5636    0.0000 H   0  0  0

+    4.1975    0.7347    0.0000 H   0  0  0

+   -2.6940    2.7928    0.0000 H   0  0  0

+   -4.7091   -0.6200    0.0000 H   0  0  0

+    3.8858    2.6653    0.0000 H   0  0  0

+   -4.6484    1.6836    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  9  5  2  0

+ 10  5  1  0

+ 11  7  1  0

+ 12  8  2  0

+ 13  9  1  0

+ 14 10  2  0

+ 15 11  2  0

+ 16 13  2  0

+ 12 15  1  0

+ 14 16  1  0

+  2 17  1  0

+  2 18  1  0

+  3 19  1  0

+  3 20  1  0

+  6 21  1  0

+  6 22  1  0

+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+528-29-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.2875    0.7427    0.0489 C   0  0  0

+    0.5006   -0.6206   -0.0313 C   0  0  0

+    1.3639    1.6083    0.1092 C   0  0  0

+   -1.0931    1.2764    0.0640 N   0  3  0

+    1.7901   -1.1187   -0.0511 C   0  0  0

+   -0.6518   -1.5472   -0.0953 N   0  3  0

+    2.6531    1.1103    0.0894 C   0  0  0

+   -1.4219    2.1374   -0.7322 O   0  0  0

+   -1.9003    0.8544    0.8726 O   0  5  0

+    2.8662   -0.2534    0.0087 C   0  0  0

+   -0.4700   -2.7502   -0.0368 O   0  0  0

+   -1.7820   -1.1069   -0.2066 O   0  5  0

+    1.2047    2.6314    0.0000 H   0  0  0

+    1.9492   -2.1418    0.0000 H   0  0  0

+    3.4591    1.7602    0.0000 H   0  0  0

+    3.8318   -0.6271    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  7 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52101-49-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+    0.7355    0.4159    0.0206 C   0  0  0

+   -0.6782    0.2736   -0.0202 C   0  0  0

+    0.9851    1.7852    0.0343 C   0  0  0

+    1.7386   -0.6715    0.0491 C   0  0  0

+   -1.2008    1.5305   -0.0288 C   0  0  0

+   -1.4383   -1.0002   -0.0486 C   0  0  0

+   -0.2046    2.4227    0.0037 O   0  0  0

+    2.2535    2.3969    0.0732 C   0  0  0

+    2.6871   -0.7770   -0.9693 C   0  0  0

+    1.7438   -1.5925    1.0974 C   0  0  0

+   -2.6438    1.8583   -0.0677 N   0  3  0

+   -2.3432   -1.2974    0.9683 C   0  0  0

+   -1.2540   -1.9014   -1.0956 C   0  0  0

+    2.3652    3.8998    0.0837 C   0  0  0

+    3.2574    1.7129    0.0983 O   0  0  0

+    3.6194   -1.7931   -0.9368 C   0  0  0

+    2.6818   -2.6042    1.1181 C   0  0  0

+   -3.0041    3.0218   -0.0723 O   0  0  0

+   -3.4709    0.9645   -0.0950 O   0  5  0

+   -3.0477   -2.4840    0.9368 C   0  0  0

+   -1.9636   -3.0847   -1.1170 C   0  0  0

+    3.6156   -2.7066    0.1026 C   0  0  0

+   -2.8566   -3.3773   -0.1017 C   0  0  0

+    3.1452    0.1257    0.0000 H   0  0  0

+    0.8024   -1.9648    0.0000 H   0  0  0

+   -2.9767   -0.5078    0.0000 H   0  0  0

+   -0.2562   -2.0719    0.0000 H   0  0  0

+    3.3747    3.8248    0.0000 H   0  0  0

+    2.4402    4.9093    0.0000 H   0  0  0

+    1.3557    3.9748    0.0000 H   0  0  0

+    4.5635   -1.4279    0.0000 H   0  0  0

+    2.2268   -3.5085    0.0000 H   0  0  0

+   -4.0467   -2.3202    0.0000 H   0  0  0

+   -1.3321   -3.8759    0.0000 H   0  0  0

+    4.2897   -3.4618    0.0000 H   0  0  0

+   -3.3611   -4.2549    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  2  0

+  6 13  1  0

+  8 14  1  0

+  8 15  2  0

+  9 16  2  0

+ 10 17  1  0

+ 11 18  2  0

+ 11 19  1  0

+ 12 20  1  0

+ 13 21  2  0

+ 16 22  1  0

+ 20 23  2  0

+  5  7  1  0

+ 17 22  2  0

+ 21 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+116-06-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    2.0425   -0.7145    0.0000 C   0  0  0

+    0.6287   -1.2364    0.0000 C   0  0  0

+    2.0175    1.0993    0.0000 S   0  0  0

+    2.7707   -1.2146    1.2492 C   0  0  0

+    2.7707   -1.2146   -1.2493 C   0  0  0

+   -0.3552   -0.4183    0.0000 N   0  0  0

+    3.7995    1.4388    0.0000 C   0  0  0

+   -1.4979   -0.8401    0.0000 O   0  0  0

+   -2.5331    0.0206    0.0000 C   0  0  0

+   -3.7975   -0.4460    0.0000 N   0  0  0

+   -2.3275    1.2183    0.0000 O   0  0  0

+   -4.9240    0.4906    0.0000 C   0  0  0

+    0.4579   -2.2315    0.0000 H   0  0  0

+    2.1991   -2.0469    0.0000 H   0  0  0

+    3.6030   -1.7862    0.0000 H   0  0  0

+    3.3423   -0.3823    0.0000 H   0  0  0

+    2.1991   -2.0469    0.0000 H   0  0  0

+    3.6030   -1.7862    0.0000 H   0  0  0

+    3.3423   -0.3823    0.0000 H   0  0  0

+    3.9885    0.4469    0.0000 H   0  0  0

+    4.7914    1.6278    0.0000 H   0  0  0

+    3.6105    2.4307    0.0000 H   0  0  0

+   -3.9684   -1.4411    0.0000 H   0  0  0

+   -4.2785    1.2670    0.0000 H   0  0  0

+   -5.7004    1.1361    0.0000 H   0  0  0

+   -5.5695   -0.2858    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  3  7  1  0

+  6  8  1  0

+  8  9  1  0

+  9 10  1  0

+  9 11  2  0

+ 10 12  1  0

+  2 13  1  0

+  4 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  5 19  1  0

+  7 20  1  0

+  7 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+642-31-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.1317   -2.4062    0.0385 C   0  0  0

+    1.2285   -2.9179   -0.0619 O   0  0  0

+    0.0044   -0.9967    0.0234 C   0  0  0

+    1.1539   -0.1745    0.0141 C   0  0  0

+   -1.2741   -0.3937    0.0115 C   0  0  0

+    1.0127    1.2825   -0.0021 C   0  0  0

+    2.4430   -0.7307    0.0205 C   0  0  0

+   -1.3962    1.0648   -0.0046 C   0  0  0

+   -2.4426   -1.1720    0.0153 C   0  0  0

+   -0.2543    1.8685   -0.0083 C   0  0  0

+    2.1795    2.0764   -0.0106 C   0  0  0

+    3.5295    0.0890    0.0116 C   0  0  0

+   -2.6863    1.6367   -0.0157 C   0  0  0

+   -3.6584   -0.5603    0.0040 C   0  0  0

+    3.3985    1.4759   -0.0037 C   0  0  0

+   -3.7780    0.8276   -0.0113 C   0  0  0

+   -0.7277   -3.0097    0.0000 H   0  0  0

+    2.5682   -1.7733    0.0000 H   0  0  0

+   -2.3789   -2.2202    0.0000 H   0  0  0

+   -0.3487    2.9144    0.0000 H   0  0  0

+    2.1062    3.1240    0.0000 H   0  0  0

+    4.4904   -0.3345    0.0000 H   0  0  0

+   -2.8019    2.6805    0.0000 H   0  0  0

+   -4.5279   -1.1492    0.0000 H   0  0  0

+    4.2631    2.0720    0.0000 H   0  0  0

+   -4.7354    1.2592    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  4  1  0

+  8  5  2  0

+  9  5  1  0

+ 10  6  2  0

+ 11  6  1  0

+ 12  7  2  0

+ 13  8  1  0

+ 14  9  2  0

+ 15 11  2  0

+ 16 13  2  0

+  8 10  1  0

+ 12 15  1  0

+ 14 16  1  0

+  1 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+26651-23-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.8559   -0.4850   -0.0126 C   0  0  0

+   -1.9935    0.1542   -0.0011 C   0  0  0

+    0.4157    0.2622   -0.0304 C   0  0  0

+   -0.8237   -1.9585   -0.0019 C   0  0  0

+   -2.0168    1.6291   -0.0058 C   0  0  0

+   -3.2687   -0.5847    0.0172 C   0  0  0

+    1.6658   -0.5176   -0.0421 C   0  0  0

+    0.4002    1.5738   -0.0357 C   0  0  0

+   -2.0938   -2.7034    0.0209 C   0  0  0

+    0.3371   -2.5707   -0.0134 C   0  0  0

+   -0.8886    2.2980   -0.0217 C   0  0  0

+   -3.3329    2.2913    0.0085 C   0  0  0

+   -3.2443   -2.0571    0.0213 C   0  0  0

+   -4.3953    0.0884    0.0290 C   0  0  0

+    1.6061   -1.8321   -0.0365 C   0  0  0

+    3.2254    0.3021   -0.0641 S   0  0  0

+   -4.4245    1.5566    0.0245 C   0  0  0

+    3.5323    0.7345    1.3625 O   0  0  0

+    4.1834   -0.6993   -0.3785 O   0  0  0

+    3.0203    1.5028   -0.7958 O   0  0  0

+    1.3474    2.1356    0.0000 H   0  0  0

+   -2.0836   -3.8046    0.0000 H   0  0  0

+    0.3601   -3.6717    0.0000 H   0  0  0

+   -0.9014    3.3991    0.0000 H   0  0  0

+   -3.4024    3.3903    0.0000 H   0  0  0

+   -4.1901   -2.6212    0.0000 H   0  0  0

+   -5.3476   -0.4646    0.0000 H   0  0  0

+    2.5480   -2.4026    0.0000 H   0  0  0

+   -5.4017    2.0644    0.0000 H   0  0  0

+    4.1697    1.6325    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+ 12 17  2  0

+ 16 18  1  0

+ 16 19  2  0

+ 16 20  2  0

+  8 11  1  0

+  9 13  2  0

+ 10 15  1  0

+ 14 17  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1464-53-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 13                          1 V2000

+    0.6098    0.4733   -0.4620 C   0  0  0

+   -0.6098    0.4733    0.4620 C   0  0  0

+    1.8874    0.4733    0.3798 C   0  0  0

+    1.3777   -0.7106   -0.2371 O   0  0  0

+   -1.8874    0.4733   -0.3798 C   0  0  0

+   -1.3777   -0.7106    0.2371 O   0  0  0

+    0.6098    1.4400    0.0000 H   0  0  0

+   -0.6098    1.4400    0.0000 H   0  0  0

+    2.8188    0.2145    0.0000 H   0  0  0

+    2.0180    1.4312    0.0000 H   0  0  0

+   -2.0180    1.4312    0.0000 H   0  0  0

+   -2.8188    0.2145    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  4  1  0

+  5  6  1  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+584-48-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.0058   -0.6646   -0.0029 C   0  0  0

+   -1.3816   -0.8001   -0.0026 C   0  0  0

+    0.5648    0.5952   -0.0006 C   0  0  0

+    0.8564   -1.8678    0.0005 N   0  3  0

+   -2.1868    0.3234    0.0000 C   0  0  0

+   -0.2415    1.7193    0.0020 C   0  0  0

+    2.4467    0.7811   -0.0004 Br  0  0  0

+    0.3537   -2.9772    0.0035 O   0  0  0

+    2.0685   -1.7484    0.0002 O   0  5  0

+   -1.6168    1.5830    0.0023 C   0  0  0

+   -3.6598    0.1779   -0.0002 N   0  3  0

+   -4.3696    1.1677    0.0021 O   0  0  0

+   -4.1622   -0.9317   -0.0026 O   0  5  0

+   -1.8095   -1.7445    0.0000 H   0  0  0

+    0.1859    2.6640    0.0000 H   0  0  0

+   -2.2212    2.4255    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  6 10  2  0

+  2 14  1  0

+  6 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26196-45-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.1528    0.1493    0.0126 C   0  0  0

+   -0.6166   -1.1272   -0.0886 C   0  0  0

+   -0.3163    1.2453    0.1009 C   0  0  0

+   -2.6210    0.3367    0.0197 N   0  3  0

+    0.7610   -1.3030   -0.1007 C   0  0  0

+   -1.4646   -2.2375   -0.1780 N   0  0  0

+    1.0605    1.0706    0.0884 C   0  0  0

+   -3.1448    1.0738   -0.7963 O   0  0  0

+   -3.3053   -0.2462    0.8415 O   0  5  0

+    1.5978   -0.2072   -0.0124 C   0  0  0

+    1.9084    2.1820    0.1775 N   0  0  0

+    3.3198   -0.4263   -0.0280 Cl  0  0  0

+   -0.7179    2.2049    0.0000 H   0  0  0

+    1.1621   -2.2628    0.0000 H   0  0  0

+   -2.4963   -2.1040    0.0000 H   0  0  0

+   -1.0644   -3.1977    0.0000 H   0  0  0

+    2.9401    2.0491    0.0000 H   0  0  0

+    1.5076    3.1420    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 11  1  0

+ 10 12  1  0

+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117929-14-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.3073   -0.0030   -0.0342 C   0  0  0

+   -1.7704   -0.0040    0.0096 C   0  0  0

+    0.3772    1.2282    0.0080 C   0  0  0

+    0.3863   -1.2072   -0.1657 C   0  0  0

+   -2.4551    1.2265   -0.0530 C   0  0  0

+   -2.4630   -1.2062    0.1622 C   0  0  0

+    1.7780    1.2107    0.0549 C   0  0  0

+   -0.3636    2.4327   -0.0191 C   0  0  0

+    1.7506   -1.1880   -0.1342 C   0  0  0

+   -0.3765   -2.4836   -0.3905 C   0  0  0

+   -1.7146    2.4314   -0.0629 C   0  0  0

+   -3.8562    1.2086   -0.0936 C   0  0  0

+   -1.7025   -2.4879    0.3614 C   0  0  0

+   -3.8281   -1.1861    0.1381 C   0  0  0

+    2.4369    0.0164   -0.0126 C   0  0  0

+   -4.5147    0.0158   -0.0009 C   0  0  0

+    3.9159    0.0028    0.0444 N   0  3  0

+    4.5179   -1.0544   -0.0146 O   0  0  0

+    4.5309    1.0487    0.1503 O   0  5  0

+    2.3130    2.1042    0.0000 H   0  0  0

+    0.1441    3.3420    0.0000 H   0  0  0

+    2.2802   -2.0847    0.0000 H   0  0  0

+   -0.5603   -3.5087    0.0000 H   0  0  0

+    0.5989   -2.8485    0.0000 H   0  0  0

+   -2.2233    3.3401    0.0000 H   0  0  0

+   -4.3912    2.1021    0.0000 H   0  0  0

+   -2.6779   -2.8529    0.0000 H   0  0  0

+   -1.5154   -3.5124    0.0000 H   0  0  0

+   -4.3575   -2.0829    0.0000 H   0  0  0

+   -5.5561    0.0082    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+ 12 16  2  0

+ 15 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+  8 11  2  0

+  9 15  1  0

+ 10 13  1  0

+ 14 16  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100593-23-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.4824   -0.7130    0.0114 C   0  0  0

+   -0.9810   -0.5501   -0.0008 C   0  0  0

+    1.2657    0.3393    0.0032 C   0  0  0

+    1.0371   -2.0784    0.0389 C   0  0  0

+   -1.5134    0.6487   -0.0199 C   0  0  0

+   -1.8228   -1.7601    0.0095 C   0  0  0

+    2.7265    0.1530    0.0158 C   0  0  0

+    0.6728    1.6873   -0.0188 C   0  0  0

+    2.3421   -2.2417    0.0502 C   0  0  0

+    0.1212   -3.2288    0.0528 C   0  0  0

+   -2.9795    0.7882   -0.0317 C   0  0  0

+   -0.6382    1.8333   -0.0288 C   0  0  0

+   -1.1827   -3.0838    0.0308 C   0  0  0

+   -3.1317   -1.6323   -0.0011 C   0  0  0

+    3.2292   -1.0646    0.0350 C   0  0  0

+    3.5499    1.2291    0.0071 N   0  3  0

+   -3.7379   -0.2889   -0.0230 C   0  0  0

+   -3.5458    2.0191   -0.0510 N   0  0  0

+    4.4604    1.2928   -0.7994 O   0  0  0

+    3.3796    2.1326    0.8060 O   0  5  0

+   -4.7585    2.1314   -0.0607 O   0  0  0

+    1.2745    2.5062    0.0000 H   0  0  0

+    2.7381   -3.1776    0.0000 H   0  0  0

+    0.5111   -4.1672    0.0000 H   0  0  0

+   -1.0449    2.7646    0.0000 H   0  0  0

+   -1.7695   -3.9135    0.0000 H   0  0  0

+   -3.7239   -2.4581    0.0000 H   0  0  0

+    4.2372   -1.1935    0.0000 H   0  0  0

+   -4.7496   -0.1927    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+ 11 17  2  0

+ 11 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+ 18 21  2  0

+  8 12  2  0

+  9 15  1  0

+ 10 13  2  0

+ 14 17  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33203-82-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 52                          1 V2000

+    4.7720    0.6144   -0.2676 N   0  0  0

+    5.5980    1.0927    0.8437 C   0  0  0

+    5.2300    0.7879   -1.6484 C   0  0  0

+    3.5621   -0.0063   -0.0130 C   0  0  0

+    4.9577    2.3408    1.4547 C   0  0  0

+    5.8480   -0.5192   -2.1487 C   0  0  0

+    2.3791    0.6696   -0.2805 C   0  0  0

+    3.5520   -1.3094    0.5054 C   0  0  0

+    1.1659    0.0542   -0.0279 C   0  0  0

+    2.3883   -1.9530    0.7689 C   0  0  0

+    1.1549   -1.3044    0.5191 C   0  0  0

+    0.0027    0.6891   -0.2794 O   0  3  0

+    0.0043   -1.9164    0.7705 N   0  0  0

+   -1.1596    0.0560   -0.0203 C   0  0  0

+   -1.1469   -1.3023    0.5284 C   0  0  0

+   -2.3736    0.6734   -0.2638 C   0  0  0

+   -2.3796   -1.9463    0.7935 C   0  0  0

+   -3.5558   -0.0006    0.0125 C   0  0  0

+   -3.5440   -1.3005    0.5390 C   0  0  0

+   -4.7663    0.6222   -0.2328 N   0  0  0

+   -5.4352    1.3696    0.8351 C   0  0  0

+   -5.3796    0.5345   -1.5603 C   0  0  0

+   -4.8218    2.7673    0.9407 C   0  0  0

+   -6.0553   -0.8288   -1.7209 C   0  0  0

+    6.0935    0.2024    0.0000 H   0  0  0

+    6.4965    1.5731    0.0000 H   0  0  0

+    6.1623    1.1988    0.0000 H   0  0  0

+    4.8439    1.7308    0.0000 H   0  0  0

+    5.8642    2.8059    0.0000 H   0  0  0

+    4.4926    3.2473    0.0000 H   0  0  0

+    4.0512    1.8757    0.0000 H   0  0  0

+    4.9269   -0.9547    0.0000 H   0  0  0

+    6.2835   -1.4403    0.0000 H   0  0  0

+    6.7691   -0.0837    0.0000 H   0  0  0

+    2.4044    1.6882    0.0000 H   0  0  0

+    4.4276   -1.8303    0.0000 H   0  0  0

+    2.3990   -2.9718    0.0000 H   0  0  0

+   -2.3979    1.6920    0.0000 H   0  0  0

+   -2.3923   -2.9651    0.0000 H   0  0  0

+   -4.4196   -1.8215    0.0000 H   0  0  0

+   -6.3006    1.9073    0.0000 H   0  0  0

+   -6.0903    0.5892    0.0000 H   0  0  0

+   -5.3198    1.5516    0.0000 H   0  0  0

+   -6.3644    0.7959    0.0000 H   0  0  0

+   -3.8888    2.3578    0.0000 H   0  0  0

+   -4.4123    3.7003    0.0000 H   0  0  0

+   -5.7548    3.1768    0.0000 H   0  0  0

+   -6.9682   -0.3763    0.0000 H   0  0  0

+   -6.5078   -1.7417    0.0000 H   0  0  0

+   -5.1424   -1.2813    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  9  7  1  0

+ 10  8  2  0

+ 11  9  2  0

+ 12  9  1  0

+ 13 11  1  0

+ 14 12  2  0

+ 15 13  2  0

+ 16 14  1  0

+ 17 15  1  0

+ 18 16  2  0

+ 19 17  2  0

+ 20 18  1  0

+ 21 20  1  0

+ 22 20  1  0

+ 23 21  1  0

+ 24 22  1  0

+ 10 11  1  0

+ 14 15  1  0

+ 18 19  1  0

+  2 25  1  0

+  2 26  1  0

+  3 27  1  0

+  3 28  1  0

+  5 29  1  0

+  5 30  1  0

+  5 31  1  0

+  6 32  1  0

+  6 33  1  0

+  6 34  1  0

+  7 35  1  0

+  8 36  1  0

+ 10 37  1  0

+ 16 38  1  0

+ 17 39  1  0

+ 19 40  1  0

+ 21 41  1  0

+ 21 42  1  0

+ 22 43  1  0

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+ 23 45  1  0

+ 23 46  1  0

+ 23 47  1  0

+ 24 48  1  0

+ 24 49  1  0

+ 24 50  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+646-06-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    0.7708   -1.0242   -0.0768 C   0  0  0

+   -0.7709   -1.0242   -0.0768 C   0  0  0

+    1.1429    0.3495    0.1609 O   0  0  0

+   -1.1429    0.3496    0.1609 O   0  0  0

+    0.0000    1.1170   -0.2750 C   0  0  0

+    0.6768   -2.0875    0.0000 H   0  0  0

+    1.8216   -1.2115    0.0000 H   0  0  0

+   -1.8218   -1.2114    0.0000 H   0  0  0

+   -0.6769   -2.0875    0.0000 H   0  0  0

+    0.7044    1.9190    0.0000 H   0  0  0

+   -0.7044    1.9190    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-74-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.6708   -0.2693   -0.3161 N   0  0  0

+    0.2611   -1.3011    0.1578 C   0  0  0

+   -0.2066    1.0069    0.2437 C   0  0  0

+   -1.9700   -0.5558    0.3068 C   0  0  0

+    1.6770   -0.9665   -0.3135 C   0  0  0

+    1.2210    1.2837   -0.2297 C   0  0  0

+   -2.9938    0.4870   -0.1464 C   0  0  0

+    2.0970    0.2701    0.2628 O   0  0  0

+   -0.6082   -1.8547    0.0000 H   0  0  0

+    0.6620   -2.2505    0.0000 H   0  0  0

+   -0.2183    2.0375    0.0000 H   0  0  0

+   -1.2226    1.1800    0.0000 H   0  0  0

+   -2.8265   -1.1290    0.0000 H   0  0  0

+   -1.5654   -1.5037    0.0000 H   0  0  0

+    1.7239   -1.9961    0.0000 H   0  0  0

+    2.6974   -1.1113    0.0000 H   0  0  0

+    2.1055    1.8127    0.0000 H   0  0  0

+    0.8529    2.2463    0.0000 H   0  0  0

+   -2.2584    1.2090    0.0000 H   0  0  0

+   -3.7158    1.2224    0.0000 H   0  0  0

+   -3.7292   -0.2350    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  6  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  7 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10443-65-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+   -0.4644   -0.6556   -0.0014 C   0  0  0

+   -1.6521    0.2109   -0.0004 C   0  0  0

+    1.2647    0.1101   -0.0001 Br  0  0  0

+   -0.6061   -1.9795    0.0022 C   0  0  0

+   -2.7633   -0.2812   -0.0012 O   0  0  0

+   -1.5085    1.5512    0.0015 O   0  0  0

+   -1.5305   -2.3889    0.0000 H   0  0  0

+    0.2107   -2.5753    0.0000 H   0  0  0

+   -1.4008    2.5564    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  2  2  0

+  6  2  1  0

+  4  7  1  0

+  4  8  1  0

+  6  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+627-18-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+   -1.4224   -0.1958    0.0000 C   0  0  0

+   -2.7727    0.5236    0.0000 C   0  0  0

+   -0.2941    0.8376    0.0000 C   0  0  0

+   -3.8266   -0.4416    0.0000 O   0  0  0

+    1.4411   -0.0867    0.0000 Br  0  0  0

+   -2.0729   -1.1411    0.0000 H   0  0  0

+   -0.5567   -0.9490    0.0000 H   0  0  0

+   -2.1221    1.4689    0.0000 H   0  0  0

+   -3.6384    1.2768    0.0000 H   0  0  0

+    0.3564    1.7829    0.0000 H   0  0  0

+   -1.1598    1.5908    0.0000 H   0  0  0

+   -4.6728   -1.2166    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+39156-41-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+   -6.0579   -0.8831    0.0489 C   0  0  0

+   -6.9565    0.0575   -0.4506 C   0  0  0

+   -4.8678   -0.4674    0.6208 C   0  0  0

+   -6.3529   -2.2101   -0.0205 O   0  0  0

+   -6.6564    1.4088   -0.3737 C   0  0  0

+   -8.1603   -0.3612   -1.0286 N   0  0  0

+   -4.5689    0.8806    0.6973 C   0  0  0

+   -5.2525   -2.9089    0.5650 C   0  0  0

+   -5.4614    1.8210    0.2008 C   0  0  0

+   -5.1565    3.1843    0.2790 N   0  0  0

+    7.9693   -0.1145   -0.0513 S   0  0  0

+    6.9878    0.9129   -0.5969 O   0  0  0

+    9.1639    0.6476    0.5041 O   0  0  0

+    7.3287   -0.7012    1.0733 O   0  0  0

+    8.4555   -0.8229   -1.1831 O   0  0  0

+   -4.1377   -1.1161    0.0000 H   0  0  0

+   -7.3851    2.0591    0.0000 H   0  0  0

+   -8.8994    0.2772    0.0000 H   0  0  0

+   -8.3437   -1.3205    0.0000 H   0  0  0

+   -3.6278    1.1416    0.0000 H   0  0  0

+   -5.7761   -3.7334    0.0000 H   0  0  0

+   -4.4281   -3.4325    0.0000 H   0  0  0

+   -4.7289   -2.0844    0.0000 H   0  0  0

+   -4.2245    3.4762    0.0000 H   0  0  0

+   -5.8753    3.8455    0.0000 H   0  0  0

+    6.3132    1.6191    0.0000 H   0  0  0

+    9.9873    1.1729    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 11 12  1  0

+ 11 13  1  0

+ 11 14  2  0

+ 11 15  2  0

+  7  9  2  0

+  3 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+230-27-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    0.7361   -0.3686   -0.0015 C   0  0  0

+   -0.7303   -0.3649   -0.0010 C   0  0  0

+    1.4199    0.8680   -0.0007 C   0  0  0

+    1.4622   -1.5615    0.0031 C   0  0  0

+   -1.3999    0.8795    0.0002 C   0  0  0

+   -1.4256   -1.4979   -0.0013 N   0  0  0

+    0.6889    2.0785    0.0009 C   0  0  0

+    2.8222    0.8734   -0.0012 C   0  0  0

+    2.8273   -1.5224    0.0024 C   0  0  0

+   -0.6599    2.0831    0.0014 C   0  0  0

+   -2.8043    0.8922    0.0007 C   0  0  0

+   -2.7399   -1.4942   -0.0004 C   0  0  0

+    3.5037   -0.3081   -0.0023 C   0  0  0

+   -3.4630   -0.3076   -0.0001 C   0  0  0

+    0.9634   -2.4797    0.0000 H   0  0  0

+    1.2040    2.9877    0.0000 H   0  0  0

+    3.3431    1.7792    0.0000 H   0  0  0

+    3.3696   -2.4156    0.0000 H   0  0  0

+   -1.1683    2.9960    0.0000 H   0  0  0

+   -3.3324    1.7939    0.0000 H   0  0  0

+   -3.2529   -2.4045    0.0000 H   0  0  0

+    4.5486   -0.3003    0.0000 H   0  0  0

+   -4.5077   -0.3312    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+ 11 14  2  0

+  7 10  1  0

+  9 13  1  0

+ 12 14  1  0

+  4 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1321-74-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.7038   -0.2139   -0.0021 C   0  0  0

+   -0.7038   -0.2139   -0.0005 C   0  0  0

+    1.3917    0.9989   -0.0018 C   0  0  0

+    1.4465   -1.4892    0.0022 C   0  0  0

+   -1.3917    0.9989    0.0012 C   0  0  0

+   -1.4466   -1.4892   -0.0012 C   0  0  0

+    0.6927    2.1883   -0.0001 C   0  0  0

+    2.7737   -1.4842    0.0007 C   0  0  0

+   -0.6926    2.1883    0.0014 C   0  0  0

+   -2.7737   -1.4841    0.0002 C   0  0  0

+    2.4340    1.0069    0.0000 H   0  0  0

+    0.9287   -2.3939    0.0000 H   0  0  0

+   -2.4340    1.0069    0.0000 H   0  0  0

+   -0.9289   -2.3939    0.0000 H   0  0  0

+    1.2104    3.0930    0.0000 H   0  0  0

+    3.2983   -2.3849    0.0000 H   0  0  0

+    3.2915   -0.5795    0.0000 H   0  0  0

+   -1.2103    3.0930    0.0000 H   0  0  0

+   -3.2914   -0.5794    0.0000 H   0  0  0

+   -3.2983   -2.3848    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7  9  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4569-77-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.4385    0.7511   -0.0044 C   0  0  0

+   -0.4498   -0.7185   -0.0013 C   0  0  0

+    0.7153    1.4105   -0.0046 N   0  0  0

+   -1.6676    1.4410   -0.0013 C   0  0  0

+    0.6931   -1.3953    0.0013 N   0  0  0

+   -1.6905   -1.3901   -0.0007 C   0  0  0

+    1.8590    0.7320   -0.0020 C   0  0  0

+   -2.8352    0.7378    0.0045 C   0  0  0

+    1.8474   -0.7349    0.0011 C   0  0  0

+   -2.8453   -0.6712   -0.0030 C   0  0  0

+    3.1018    1.3998   -0.0016 C   0  0  0

+   -4.0459    1.4277    0.0076 N   0  0  0

+    3.0794   -1.4223    0.0034 C   0  0  0

+   -4.0350   -1.3264   -0.0029 O   0  0  0

+    4.2514    0.6772    0.0016 C   0  0  0

+    4.2403   -0.7180    0.0026 C   0  0  0

+   -1.6834    2.4746    0.0000 H   0  0  0

+   -1.7219   -2.4233    0.0000 H   0  0  0

+    3.1370    2.4329    0.0000 H   0  0  0

+   -4.0517    2.4614    0.0000 H   0  0  0

+   -4.9382    0.9058    0.0000 H   0  0  0

+    3.0982   -2.4558    0.0000 H   0  0  0

+   -4.9404   -1.8251    0.0000 H   0  0  0

+    5.1581    1.1735    0.0000 H   0  0  0

+    5.1390   -1.2287    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 11 15  2  0

+ 13 16  2  0

+  7  9  1  0

+  8 10  2  0

+ 15 16  1  0

+  4 17  1  0

+  6 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+161697-04-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+   -0.3573    0.3952    0.0034 C   0  0  0

+   -0.6021   -1.0020    0.0007 C   0  0  0

+    0.9662    0.8632    0.0030 C   0  0  0

+   -1.3897    1.2467    0.0007 N   0  0  0

+   -1.8617   -1.4503    0.0007 N   0  0  0

+    0.4841   -1.8961   -0.0022 C   0  0  0

+    2.0065   -0.0398    0.0000 C   0  0  0

+    1.2471    2.3438    0.0063 C   0  0  0

+   -2.6180    0.7805   -0.0044 C   0  0  0

+   -2.8584   -0.5945    0.0031 C   0  0  0

+    1.7558   -1.4186   -0.0026 C   0  0  0

+    3.3221    0.4227   -0.0004 N   0  0  0

+   -3.7798    1.7404   -0.0069 C   0  0  0

+   -4.2770   -1.1029    0.0030 C   0  0  0

+    3.9765   -0.1649    1.1763 C   0  0  0

+    3.9740   -0.1600   -1.1809 C   0  0  0

+    0.3126   -2.9278    0.0000 H   0  0  0

+    2.2747    2.1488    0.0000 H   0  0  0

+    1.4421    3.3714    0.0000 H   0  0  0

+    0.2195    2.5388    0.0000 H   0  0  0

+    2.5586   -2.0890    0.0000 H   0  0  0

+   -3.1136    2.5467    0.0000 H   0  0  0

+   -4.5861    2.4066    0.0000 H   0  0  0

+   -4.4460    0.9341    0.0000 H   0  0  0

+   -4.6299   -0.1183    0.0000 H   0  0  0

+   -5.2616   -1.4558    0.0000 H   0  0  0

+   -3.9241   -2.0875    0.0000 H   0  0  0

+    3.2777   -0.9431    0.0000 H   0  0  0

+    4.7547   -0.8637    0.0000 H   0  0  0

+    4.6753    0.6133    0.0000 H   0  0  0

+    3.2770   -0.9398    0.0000 H   0  0  0

+    4.7538   -0.8570    0.0000 H   0  0  0

+    4.6710    0.6198    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 12 15  1  0

+ 12 16  1  0

+  7 11  1  0

+  9 10  1  0

+  6 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 11 21  1  0

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+ 14 25  1  0

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+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-11-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.4026    0.0001   -0.0275 C   0  0  0

+    1.0936   -1.1972   -0.0099 C   0  0  0

+    1.0935    1.1971   -0.0098 C   0  0  0

+   -1.3586    0.0002   -0.0799 S   0  0  0

+    2.4753   -1.1973    0.0254 C   0  0  0

+    2.4756    1.1970    0.0254 C   0  0  0

+   -1.8566   -0.0033    1.3584 O   0  0  0

+   -1.7290    1.2640   -0.6136 O   0  0  0

+   -1.7289   -1.2610   -0.6197 O   0  0  0

+    3.1664    0.0000    0.0430 C   0  0  0

+    0.5752   -2.0948    0.0000 H   0  0  0

+    0.5752    2.0948    0.0000 H   0  0  0

+    2.9936   -2.0950    0.0000 H   0  0  0

+    2.9940    2.0946    0.0000 H   0  0  0

+   -2.8931   -0.0106    0.0000 H   0  0  0

+    4.2029    0.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  4  9  2  0

+  5 10  1  0

+  6 10  2  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107097-80-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 60                          1 V2000

+   -1.4109    0.8176   -0.5532 C   0  0  0

+   -2.0487   -0.4891   -0.9490 C   0  0  0

+    0.0355    0.7413   -0.7730 N   0  0  0

+   -1.9966    1.9485   -1.4012 C   0  0  0

+   -2.8049   -1.1659   -0.0621 N   0  0  0

+   -1.8816   -0.9318   -2.0657 O   0  0  0

+    0.8383    0.2469    0.1901 C   0  0  0

+   -1.7572    3.2875   -0.7009 C   0  0  0

+   -2.9264   -0.6831    1.3157 C   0  0  0

+   -3.5054   -2.3843   -0.4758 C   0  0  0

+    2.3051    0.2634    0.0100 C   0  0  0

+    0.3559   -0.2127    1.2068 O   0  0  0

+   -2.3341    4.4014   -1.5361 C   0  0  0

+   -4.1042    0.2886    1.4136 C   0  0  0

+   -2.5235   -3.5576   -0.4883 C   0  0  0

+    3.1392   -0.2482    1.0060 C   0  0  0

+    2.8615    0.7851   -1.1591 C   0  0  0

+   -2.2407    5.6728   -1.1159 O   0  0  0

+   -2.8807    4.1500   -2.5839 O   0  0  0

+   -4.2311    0.7928    2.8526 C   0  0  0

+   -3.2551   -4.8301   -0.9204 C   0  0  0

+    4.5079   -0.2304    0.8318 C   0  0  0

+    4.2311    0.7977   -1.3223 C   0  0  0

+   -5.4088    1.7645    2.9505 C   0  0  0

+   -2.3381   -5.9260   -0.9321 O   0  0  0

+    5.0544    0.2945   -0.3293 C   0  0  0

+    5.5473   -0.8658    2.0686 Cl  0  0  0

+   -5.5357    2.2688    4.3894 C   0  0  0

+   -3.0771   -7.0785   -1.3413 C   0  0  0

+    6.7772    0.3144   -0.5419 Cl  0  0  0

+   -2.3665    0.8062    0.0000 H   0  0  0

+    0.3201    1.6536    0.0000 H   0  0  0

+   -2.8433    2.3917    0.0000 H   0  0  0

+   -2.6738    1.2742    0.0000 H   0  0  0

+   -0.9105    2.8443    0.0000 H   0  0  0

+   -1.0800    3.9618    0.0000 H   0  0  0

+   -1.9728   -0.7457    0.0000 H   0  0  0

+   -2.5740    0.2052    0.0000 H   0  0  0

+   -4.2724   -1.8142    0.0000 H   0  0  0

+   -4.1614   -3.0792    0.0000 H   0  0  0

+   -5.0578    0.3512    0.0000 H   0  0  0

+   -4.4566   -0.5997    0.0000 H   0  0  0

+   -1.7565   -4.1277    0.0000 H   0  0  0

+   -1.8675   -2.8627    0.0000 H   0  0  0

+    2.8856   -1.1696    0.0000 H   0  0  0

+    2.5060    1.6721    0.0000 H   0  0  0

+   -2.1707    6.6259    0.0000 H   0  0  0

+   -3.2775    0.7302    0.0000 H   0  0  0

+   -3.8787    1.6811    0.0000 H   0  0  0

+   -4.0221   -4.2600    0.0000 H   0  0  0

+   -3.9111   -5.5250    0.0000 H   0  0  0

+    4.4857    1.7188    0.0000 H   0  0  0

+   -6.3624    1.8272    0.0000 H   0  0  0

+   -5.7613    0.8762    0.0000 H   0  0  0

+   -4.6089    2.5020    0.0000 H   0  0  0

+   -5.7689    3.1956    0.0000 H   0  0  0

+   -6.4625    2.0356    0.0000 H   0  0  0

+   -3.8816   -6.5627    0.0000 H   0  0  0

+   -3.5929   -7.8830    0.0000 H   0  0  0

+   -2.2726   -7.5943    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 15 21  1  0

+ 16 22  2  0

+ 17 23  1  0

+ 20 24  1  0

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+ 22 27  1  0

+ 24 28  1  0

+ 25 29  1  0

+ 26 30  1  0

+ 23 26  2  0

+  1 31  1  0

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+ 28 55  1  0

+ 28 56  1  0

+ 28 57  1  0

+ 29 58  1  0

+ 29 59  1  0

+ 29 60  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1070-70-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    4.2865   -0.0649   -0.0010 C   0  0  0

+    3.0490    0.4697   -0.0002 O   0  0  0

+    5.4657    0.8119   -0.0001 C   0  0  0

+    4.4269   -1.2721    0.0026 O   0  0  0

+    1.8839   -0.3968   -0.0011 C   0  0  0

+    6.6874    0.2842   -0.0008 C   0  0  0

+    0.6139    0.4565    0.0000 C   0  0  0

+   -0.6139   -0.4565   -0.0009 C   0  0  0

+   -1.8839    0.3968    0.0002 C   0  0  0

+   -3.0490   -0.4697   -0.0007 O   0  0  0

+   -4.2865    0.0649    0.0001 C   0  0  0

+   -5.4657   -0.8119   -0.0008 C   0  0  0

+   -4.4269    1.2721    0.0016 O   0  0  0

+   -6.6874   -0.2842    0.0000 C   0  0  0

+    5.3399    1.8936    0.0000 H   0  0  0

+    1.1783   -1.2263    0.0000 H   0  0  0

+    2.6284   -1.1916    0.0000 H   0  0  0

+    6.8133   -0.7975    0.0000 H   0  0  0

+    7.5612    0.9341    0.0000 H   0  0  0

+    1.3195    1.2860    0.0000 H   0  0  0

+   -0.1305    1.2513    0.0000 H   0  0  0

+   -1.3195   -1.2860    0.0000 H   0  0  0

+    0.1305   -1.2513    0.0000 H   0  0  0

+   -1.1783    1.2263    0.0000 H   0  0  0

+   -2.6284    1.1916    0.0000 H   0  0  0

+   -5.3399   -1.8936    0.0000 H   0  0  0

+   -6.8133    0.7975    0.0000 H   0  0  0

+   -7.5612   -0.9341    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  7  8  1  0

+  8  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+ 12 14  2  0

+  3 15  1  0

+  5 16  1  0

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+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+496-72-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.6724    0.7696    0.0018 C   0  0  0

+   -1.0749   -0.5658    0.0004 C   0  0  0

+    0.6785    1.0823    0.0017 C   0  0  0

+   -1.6296    1.7915   -0.0025 N   0  0  0

+   -0.1219   -1.5730   -0.0011 C   0  0  0

+   -2.4374   -0.8884    0.0010 N   0  0  0

+    1.6221    0.0716    0.0001 C   0  0  0

+    1.2231   -1.2521   -0.0012 C   0  0  0

+    3.0897    0.4139    0.0000 C   0  0  0

+    0.9820    2.0770    0.0000 H   0  0  0

+   -1.3278    2.7867    0.0000 H   0  0  0

+   -2.6424    1.5553    0.0000 H   0  0  0

+   -0.4187   -2.5697    0.0000 H   0  0  0

+   -3.1509   -0.1318    0.0000 H   0  0  0

+   -2.7359   -1.8846    0.0000 H   0  0  0

+    1.9366   -2.0087    0.0000 H   0  0  0

+    3.3259   -0.5989    0.0000 H   0  0  0

+    4.1025    0.6501    0.0000 H   0  0  0

+    2.8535    1.4267    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+103-50-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    2.3973   -0.4940   -0.0405 C   0  0  0

+    1.1471   -1.3352   -0.0151 C   0  0  0

+    3.3232   -0.6007    0.9807 C   0  0  0

+    2.6209    0.3800   -1.0876 C   0  0  0

+    0.0000   -0.4832    0.0018 O   0  0  0

+    4.4697    0.1708    0.9574 C   0  0  0

+    3.7678    1.1518   -1.1109 C   0  0  0

+   -1.1470   -1.3352    0.0255 C   0  0  0

+    4.6906    1.0493   -0.0871 C   0  0  0

+   -2.3972   -0.4941    0.0442 C   0  0  0

+   -3.3228   -0.6091   -0.9757 C   0  0  0

+   -2.6211    0.3885    1.0847 C   0  0  0

+   -4.4699    0.1627   -0.9585 C   0  0  0

+   -3.7677    1.1599    1.1019 C   0  0  0

+   -4.6909    1.0491    0.0786 C   0  0  0

+    0.5541   -1.9691    0.0000 H   0  0  0

+    1.7099   -1.9960    0.0000 H   0  0  0

+    3.5285   -1.4441    0.0000 H   0  0  0

+    1.9117    0.8804    0.0000 H   0  0  0

+    5.1799   -0.3282    0.0000 H   0  0  0

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+   -1.7098   -1.9960    0.0000 H   0  0  0

+   -0.5540   -1.9690    0.0000 H   0  0  0

+    5.4036    1.5443    0.0000 H   0  0  0

+   -3.5243   -1.4534    0.0000 H   0  0  0

+   -1.9114    0.8882    0.0000 H   0  0  0

+   -5.1806   -0.3356    0.0000 H   0  0  0

+   -3.5644    2.0037    0.0000 H   0  0  0

+   -5.4056    1.5417    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+632-79-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+    0.7056   -1.7229    0.0017 C   0  0  0

+   -0.7056   -1.7229    0.0015 C   0  0  0

+    1.3954   -0.5193    0.0010 C   0  0  0

+    1.1108   -3.1416   -0.0033 C   0  0  0

+   -1.3954   -0.5194    0.0007 C   0  0  0

+   -1.1106   -3.1417    0.0024 C   0  0  0

+    0.6918    0.6773    0.0002 C   0  0  0

+    3.2864   -0.5088    0.0018 Br  0  0  0

+    0.0001   -3.9052   -0.0061 O   0  0  0

+    2.2534   -3.5524   -0.0052 O   0  0  0

+   -0.6918    0.6773    0.0000 C   0  0  0

+   -3.2864   -0.5089    0.0012 Br  0  0  0

+   -2.2532   -3.5526    0.0029 O   0  0  0

+    1.6307    2.3187   -0.0001 Br  0  0  0

+   -1.6308    2.3187   -0.0017 Br  0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+ 11 15  1  0

+  6  9  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+102000-59-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.1126    0.0000    0.0172 C   0  0  0

+    0.5961   -1.2138    0.0044 C   0  0  0

+    0.5955    1.2138    0.0056 C   0  0  0

+   -1.5812   -0.0002    0.0365 C   0  0  0

+    1.9831   -1.2001   -0.0196 C   0  0  0

+   -0.0892   -2.4215    0.0152 N   0  0  0

+    1.9829    1.2006   -0.0184 C   0  0  0

+   -0.0901    2.4212    0.0176 N   0  0  0

+   -2.2706    0.0030   -1.1221 O   0  0  0

+   -2.1752   -0.0034    1.0972 O   0  0  0

+    2.6681    0.0006   -0.0308 C   0  0  0

+    2.5102   -2.0973    0.0000 H   0  0  0

+   -1.1298   -2.4293    0.0000 H   0  0  0

+    0.4378   -3.3188    0.0000 H   0  0  0

+    2.5096    2.0980    0.0000 H   0  0  0

+    0.4366    3.3186    0.0000 H   0  0  0

+   -1.1307    2.4287    0.0000 H   0  0  0

+   -3.3112    0.0078    0.0000 H   0  0  0

+    3.7087    0.0008    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  7 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25057-89-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -1.5225    0.6964   -0.3726 C   0  0  0

+   -1.4003   -0.6580   -0.0241 C   0  0  0

+   -0.3767    1.4212   -0.6752 N   0  0  0

+   -2.7739    1.2930   -0.4053 C   0  0  0

+   -0.0721   -1.2892    0.0003 C   0  0  0

+   -2.5447   -1.3926    0.2931 C   0  0  0

+    1.0274    1.0879    0.1385 S   0  0  0

+   -3.8961    0.5530   -0.0899 C   0  0  0

+    1.0539   -0.5609    0.0308 N   0  0  0

+    0.0074   -2.5026   -0.0077 O   0  0  0

+   -3.7806   -0.7841    0.2567 C   0  0  0

+    2.0933    1.5685   -0.6690 O   0  0  0

+    0.7966    1.4098    1.5032 O   0  0  0

+    2.3463   -1.2478   -0.0332 C   0  0  0

+    2.9833   -1.0093   -1.4037 C   0  0  0

+    3.2682   -0.7029    1.0595 C   0  0  0

+   -0.5442    2.4242    0.0000 H   0  0  0

+   -2.8441    2.3074    0.0000 H   0  0  0

+   -2.4872   -2.4078    0.0000 H   0  0  0

+   -4.8114    0.9961    0.0000 H   0  0  0

+   -4.6200   -1.3580    0.0000 H   0  0  0

+    2.2801   -2.2625    0.0000 H   0  0  0

+    3.3398   -1.9616    0.0000 H   0  0  0

+    3.9356   -0.6528    0.0000 H   0  0  0

+    2.6268   -0.0570    0.0000 H   0  0  0

+    3.7856   -1.5783    0.0000 H   0  0  0

+    4.1436   -0.1855    0.0000 H   0  0  0

+    2.7508    0.1725    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  7 12  2  0

+  7 13  2  0

+  9 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+  7  9  1  0

+  8 11  1  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+ 11 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6281-23-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.1572    0.0788   -0.0037 C   0  0  0

+   -0.9824   -0.6441   -0.0035 O   0  0  0

+   -0.1908    1.4142   -0.0009 C   0  0  0

+    1.4740   -0.4400   -0.0011 C   0  0  0

+   -2.0358    0.1841   -0.0006 C   0  0  0

+   -1.5928    1.4612    0.0011 C   0  0  0

+    2.5365    0.4050   -0.0017 C   0  0  0

+   -3.4564   -0.2326    0.0010 N   0  3  0

+    3.8510   -0.1129    0.0009 C   0  0  0

+   -4.3377    0.6082    0.0036 O   0  0  0

+   -3.7439   -1.4161   -0.0003 O   0  5  0

+    4.9076    0.7275    0.0003 O   0  0  0

+    4.0308   -1.3166    0.0036 O   0  0  0

+    0.4425    2.2059    0.0000 H   0  0  0

+    1.6238   -1.4427    0.0000 H   0  0  0

+   -2.1667    2.2970    0.0000 H   0  0  0

+    2.3867    1.4077    0.0000 H   0  0  0

+    5.7010    1.3586    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+  9 13  2  0

+  5  6  2  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+133831-61-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.6103   -0.6688    0.2170 C   0  0  0

+   -2.8189   -0.1267   -0.2241 C   0  0  0

+   -0.4754    0.3245    1.1282 S   0  0  0

+   -1.3070   -2.0032   -0.0618 C   0  0  0

+   -3.7031   -0.9093   -0.9363 C   0  0  0

+   -3.1506    1.2850    0.0725 N   0  3  0

+    1.1769   -0.4211    1.7298 S   0  0  0

+   -2.2015   -2.7768   -0.7702 C   0  0  0

+   -3.3943   -2.2302   -1.2141 C   0  0  0

+   -4.2054    1.7566   -0.3130 O   0  0  0

+   -2.2418    2.0872    0.8044 O   0  5  0

+    2.5670   -0.3368    0.7340 C   0  0  0

+    2.4947    0.2613   -0.4857 C   0  0  0

+    3.7358   -0.8642    1.1596 F   0  0  0

+    3.9043    0.3469   -1.4954 Cl  0  0  0

+    0.9929    0.9390   -1.0325 Cl  0  0  0

+   -0.3517   -2.3167    0.0000 H   0  0  0

+   -4.6611   -0.6042    0.0000 H   0  0  0

+   -2.0595   -3.7721    0.0000 H   0  0  0

+   -4.1727   -2.8666    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 13 16  1  0

+  8  9  1  0

+  4 17  1  0

+  5 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53-94-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.1077   -0.3835   -0.0011 C   0  0  0

+   -1.5909   -0.4220   -0.0007 C   0  0  0

+    0.3214    0.9416   -0.0002 C   0  0  0

+    0.8371   -1.4126    0.0031 C   0  0  0

+   -2.0889    0.8780    0.0005 C   0  0  0

+   -2.4821   -1.4971   -0.0012 C   0  0  0

+   -0.9078    1.8173    0.0008 C   0  0  0

+    1.6667    1.2373    0.0000 C   0  0  0

+    2.1819   -1.1145    0.0016 C   0  0  0

+   -3.4497    1.1010    0.0006 C   0  0  0

+   -3.8415   -1.2645   -0.0006 C   0  0  0

+    2.6040    0.2103   -0.0006 C   0  0  0

+   -4.3269    0.0310   -0.0003 C   0  0  0

+    3.9673    0.5089   -0.0004 N   0  0  0

+    4.9213   -0.5374   -0.0011 O   0  0  0

+    0.5236   -2.4085    0.0000 H   0  0  0

+   -2.1196   -2.4762    0.0000 H   0  0  0

+   -0.2254    2.6075    0.0000 H   0  0  0

+   -1.6310    2.5704    0.0000 H   0  0  0

+    1.9826    2.2325    0.0000 H   0  0  0

+    2.8861   -1.8854    0.0000 H   0  0  0

+   -3.8183    2.0779    0.0000 H   0  0  0

+   -4.5068   -2.0692    0.0000 H   0  0  0

+   -5.3570    0.2016    0.0000 H   0  0  0

+    4.2838    1.5039    0.0000 H   0  0  0

+    5.6248   -1.3089    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+ 10 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134785-76-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 39                          1 V2000

+    2.0340   -1.0591    0.0945 C   0  0  0

+    0.8293   -0.1981    0.1211 C   0  0  0

+    3.3792   -0.4477   -0.0072 C   0  0  0

+    1.9108   -2.3539    0.1659 N   0  0  0

+   -0.4350   -0.7736    0.0700 C   0  0  0

+    0.9671    1.1918    0.2033 C   0  0  0

+    3.9446   -0.2051   -1.2588 C   0  0  0

+    4.0823   -0.1073    1.1487 C   0  0  0

+    3.0643   -3.1718    0.2410 O   0  0  0

+   -1.5643    0.0447    0.0960 C   0  0  0

+   -0.1365    1.9967    0.2290 C   0  0  0

+    5.1977    0.3645   -1.3483 C   0  0  0

+    5.3344    0.4617    1.0490 C   0  0  0

+   -1.4074    1.4398    0.1734 C   0  0  0

+   -2.8996   -0.2059    0.0612 N   0  0  0

+    5.8946    0.6956   -0.1972 C   0  0  0

+   -2.6851    1.9695    0.1815 N   0  0  0

+   -3.5591    0.9231    0.1114 C   0  0  0

+    7.1217    1.2533   -0.2899 F   0  0  0

+   -4.9384    1.0392    0.0948 N   0  0  0

+   -5.7047   -0.0551   -0.0834 C   0  0  0

+   -7.0394    0.0707   -0.2070 O   0  0  0

+   -5.1910   -1.1550   -0.1326 O   0  0  0

+   -7.8650   -1.1082   -0.3989 C   0  0  0

+   -0.5376   -1.7964    0.0000 H   0  0  0

+    1.9053    1.6118    0.0000 H   0  0  0

+    4.3600   -1.1454    0.0000 H   0  0  0

+    3.6456    0.8233    0.0000 H   0  0  0

+    3.9029   -3.7664    0.0000 H   0  0  0

+   -0.0251    3.0186    0.0000 H   0  0  0

+    5.6310   -0.5677    0.0000 H   0  0  0

+    4.9237    1.4041    0.0000 H   0  0  0

+   -2.9304    2.9678    0.0000 H   0  0  0

+   -5.3744    1.9702    0.0000 H   0  0  0

+   -8.7070   -0.5185    0.0000 H   0  0  0

+   -8.4547   -1.9502    0.0000 H   0  0  0

+   -7.0230   -1.6979    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  2  0

+ 10 14  2  0

+ 10 15  1  0

+ 12 16  2  0

+ 14 17  1  0

+ 15 18  2  0

+ 16 19  1  0

+ 18 20  1  0

+ 20 21  1  0

+ 21 22  1  0

+ 21 23  2  0

+ 22 24  1  0

+ 11 14  1  0

+ 13 16  1  0

+ 17 18  1  0

+  5 25  1  0

+  6 26  1  0

+  7 27  1  0

+  8 28  1  0

+  9 29  1  0

+ 11 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 17 33  1  0

+ 20 34  1  0

+ 24 35  1  0

+ 24 36  1  0

+ 24 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2310-17-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+   -2.2603    0.1979    0.2722 C   0  0  0

+   -3.3172    1.0361   -0.0818 C   0  0  0

+   -1.1299    1.0077    0.3846 N   0  0  0

+   -2.4765   -1.1617    0.4335 C   0  0  0

+   -2.8203    2.2940   -0.1732 O   0  0  0

+   -4.5841    0.5047   -0.2661 C   0  0  0

+   -1.5079    2.2714    0.1076 C   0  0  0

+    0.2209    0.5655    0.7397 C   0  0  0

+   -3.7409   -1.6839    0.2427 C   0  0  0

+   -4.7939   -0.8511   -0.0985 C   0  0  0

+   -0.7739    3.2408    0.1117 O   0  0  0

+    1.1284    0.1241   -0.7676 S   0  0  0

+   -6.3812   -1.5151   -0.3290 Cl  0  0  0

+    2.9851   -0.4543    0.0765 P   0  0  0

+    3.8735   -1.1997   -1.0403 O   0  0  0

+    3.7669    0.8523    0.6000 O   0  0  0

+    2.6841   -1.6120    1.5054 S   0  0  0

+    5.0299   -1.7111   -0.3745 C   0  0  0

+    3.8307    1.7633   -0.4991 C   0  0  0

+    5.9215   -2.4354   -1.3850 C   0  0  0

+    4.5657    3.0336   -0.0665 C   0  0  0

+   -1.6815   -1.7895    0.0000 H   0  0  0

+   -5.3822    1.1287    0.0000 H   0  0  0

+    1.0335    1.1704    0.0000 H   0  0  0

+    0.0577    1.5653    0.0000 H   0  0  0

+   -3.8810   -2.6872    0.0000 H   0  0  0

+    5.9405   -1.2672    0.0000 H   0  0  0

+    5.0111   -0.6982    0.0000 H   0  0  0

+    3.1983    2.5547    0.0000 H   0  0  0

+    2.8636    1.4619    0.0000 H   0  0  0

+    5.2828   -3.2217    0.0000 H   0  0  0

+    6.7078   -3.0741    0.0000 H   0  0  0

+    6.5602   -1.6491    0.0000 H   0  0  0

+    5.4425    2.5263    0.0000 H   0  0  0

+    5.0730    3.9104    0.0000 H   0  0  0

+    3.6889    3.5409    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+  7 11  2  0

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+ 15 18  1  0

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+ 18 20  1  0

+ 19 21  1  0

+  5  7  1  0

+  9 10  1  0

+  4 22  1  0

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+  8 24  1  0

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+ 18 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+313-80-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 28                          1 V2000

+    0.7533    0.0442   -0.0019 C   0  0  0

+   -0.7176   -0.0086   -0.0012 C   0  0  0

+    1.3814    1.1955   -0.0008 C   0  0  0

+    1.4898   -1.2336    0.0022 C   0  0  0

+   -1.4527    1.2713    0.0009 C   0  0  0

+   -1.3547   -1.1542   -0.0020 C   0  0  0

+    0.6418    2.4665    0.0015 C   0  0  0

+    2.8579    1.1972   -0.0015 C   0  0  0

+    0.7019   -2.4785    0.0067 C   0  0  0

+    2.8007   -1.2283    0.0015 C   0  0  0

+   -0.6743    2.5181    0.0020 C   0  0  0

+   -2.7656    1.2335    0.0012 C   0  0  0

+   -0.6121   -2.4256   -0.0038 C   0  0  0

+   -2.7105   -1.1649   -0.0008 N   0  0  0

+    3.5199    0.0599   -0.0032 C   0  0  0

+   -3.4078   -0.0985   -0.0006 C   0  0  0

+    1.2100    3.4112    0.0000 H   0  0  0

+    3.4068    2.1532    0.0000 H   0  0  0

+    1.2140   -3.4547    0.0000 H   0  0  0

+    3.3607   -2.1779    0.0000 H   0  0  0

+   -1.1899    3.4924    0.0000 H   0  0  0

+   -3.3653    2.1585    0.0000 H   0  0  0

+   -1.1800   -3.3704    0.0000 H   0  0  0

+    4.6222    0.0698    0.0000 H   0  0  0

+   -4.5079   -0.1700    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  8 15  2  0

+ 12 16  1  0

+  7 11  2  0

+  9 13  2  0

+ 10 15  1  0

+ 14 16  2  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+619-17-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -1.4731    0.1183    0.0023 C   0  0  0

+   -0.7347   -1.0468    0.0208 C   0  0  0

+   -0.8395    1.3512   -0.0088 C   0  0  0

+   -2.9517    0.0514   -0.0121 N   0  3  0

+    0.6538   -0.9910    0.0286 C   0  0  0

+    0.5356    1.4273   -0.0014 C   0  0  0

+   -3.6076    1.0776   -0.0285 O   0  0  0

+   -3.5125   -1.0298   -0.0075 O   0  5  0

+    1.2987    0.2561    0.0174 C   0  0  0

+    1.3992   -2.1621    0.0477 N   0  0  0

+    2.7697    0.3299    0.0249 C   0  0  0

+    3.4529    0.2798   -1.1357 O   0  0  0

+    3.3674    0.4360    1.0777 O   0  0  0

+   -1.2174   -1.9676    0.0000 H   0  0  0

+   -1.4055    2.2233    0.0000 H   0  0  0

+    1.0055    2.3547    0.0000 H   0  0  0

+    0.9188   -3.0841    0.0000 H   0  0  0

+    2.4379   -2.1172    0.0000 H   0  0  0

+    4.4897    0.2038    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  9 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+  6  9  1  0

+  2 14  1  0

+  3 15  1  0

+  6 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+116374-66-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    1.2093    0.6804   -0.1596 C   0  0  0

+    0.4264   -0.4374   -0.5085 C   0  0  0

+    2.5341    0.4847    0.3110 C   0  0  0

+    0.6987    1.9852   -0.2765 C   0  0  0

+    1.0068   -1.7138   -0.3708 C   0  0  0

+   -0.8645   -0.2876   -0.9689 N   0  0  0

+    3.0422   -0.7411    0.4249 N   0  0  0

+    3.3080    1.6140    0.6573 C   0  0  0

+    1.4762    3.0473    0.0669 C   0  0  0

+   -0.6797    2.2024   -0.7720 N   0  3  0

+    2.3390   -1.8265    0.1072 C   0  0  0

+    0.2862   -2.8747   -0.7000 C   0  0  0

+   -1.7480   -0.4397    0.1948 C   0  0  0

+    2.7767    2.8608    0.5357 C   0  0  0

+    4.5717    1.4569    1.1083 F   0  0  0

+   -0.9444    2.0015   -1.9437 O   0  0  0

+   -1.5488    2.5820   -0.0077 O   0  5  0

+    2.9081   -3.1098    0.2404 C   0  0  0

+    0.8719   -4.0945   -0.5576 C   0  0  0

+   -3.2062   -0.4400   -0.2685 C   0  0  0

+    2.1802   -4.2096   -0.0875 C   0  0  0

+   -4.1264   -0.5984    0.9435 C   0  0  0

+   -5.5264   -0.5986    0.4987 N   0  0  0

+   -6.3522   -0.7532    1.7037 C   0  0  0

+   -5.8009    0.7434   -0.0319 C   0  0  0

+   -0.8921    0.7147    0.0000 H   0  0  0

+    1.0874    3.9716    0.0000 H   0  0  0

+   -0.7151   -2.8206    0.0000 H   0  0  0

+   -2.1991   -1.3352    0.0000 H   0  0  0

+   -1.1513   -1.2456    0.0000 H   0  0  0

+    3.3877    3.6559    0.0000 H   0  0  0

+    3.9073   -3.1936    0.0000 H   0  0  0

+    0.3012   -4.9190    0.0000 H   0  0  0

+   -2.7551    0.4555    0.0000 H   0  0  0

+   -3.8029    0.3659    0.0000 H   0  0  0

+    2.6156   -5.1128    0.0000 H   0  0  0

+   -4.5775   -1.4939    0.0000 H   0  0  0

+   -3.5298   -1.4043    0.0000 H   0  0  0

+   -6.5367    0.2324    0.0000 H   0  0  0

+   -7.3378   -0.9377    0.0000 H   0  0  0

+   -6.1677   -1.7388    0.0000 H   0  0  0

+   -4.8185    0.9443    0.0000 H   0  0  0

+   -6.0018    1.7258    0.0000 H   0  0  0

+   -6.7833    0.5425    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  8 14  2  0

+  8 15  1  0

+ 10 16  2  0

+ 10 17  1  0

+ 11 18  1  0

+ 12 19  2  0

+ 13 20  1  0

+ 18 21  2  0

+ 20 22  1  0

+ 22 23  1  0

+ 23 24  1  0

+ 23 25  1  0

+  7 11  1  0

+  9 14  1  0

+ 19 21  1  0

+  6 26  1  0

+  9 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 18 32  1  0

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+ 20 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

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+ 24 39  1  0

+ 24 40  1  0

+ 24 41  1  0

+ 25 42  1  0

+ 25 43  1  0

+ 25 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102-70-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+   -0.1244   -0.2374   -0.1376 N   0  0  0

+    0.8191   -1.2766   -0.5711 C   0  0  0

+    0.2821    1.0067   -0.8046 C   0  0  0

+   -1.4365   -0.6023   -0.6883 C   0  0  0

+    2.1929   -0.9619   -0.0375 C   0  0  0

+    0.1881    2.1527    0.1694 C   0  0  0

+   -2.3921   -0.8918    0.4404 C   0  0  0

+    2.7968   -1.8099    0.7577 C   0  0  0

+    1.2304    2.9165    0.3848 C   0  0  0

+   -3.5356   -0.2564    0.5098 C   0  0  0

+   -0.0088   -1.8032    0.0000 H   0  0  0

+    1.1974   -2.1819    0.0000 H   0  0  0

+    1.0282    0.3695    0.0000 H   0  0  0

+    1.1556    1.4536    0.0000 H   0  0  0

+   -1.1988    0.3496    0.0000 H   0  0  0

+   -2.1472    0.0741    0.0000 H   0  0  0

+    2.5416   -0.0448    0.0000 H   0  0  0

+   -0.7044    2.5602    0.0000 H   0  0  0

+   -2.4964   -1.8674    0.0000 H   0  0  0

+    2.3893   -2.7024    0.0000 H   0  0  0

+    3.7735   -1.7166    0.0000 H   0  0  0

+    2.1283    2.5211    0.0000 H   0  0  0

+    1.1239    3.8918    0.0000 H   0  0  0

+   -3.5517    0.7246    0.0000 H   0  0  0

+   -4.3771   -0.7608    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  2  0

+  6  9  2  0

+  7 10  2  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71711-58-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+    0.1945    0.5200    0.0036 C   0  0  0

+   -0.0914   -0.8672    0.0017 C   0  0  0

+    1.6001    0.9499    0.0025 C   0  0  0

+   -0.7797    1.4185    0.0008 N   0  0  0

+   -1.4325   -1.2914    0.0025 C   0  0  0

+    0.9541   -1.8185   -0.0015 C   0  0  0

+    2.6149   -0.0317   -0.0002 C   0  0  0

+    1.9462    2.3020    0.0038 C   0  0  0

+   -2.0661    1.0663   -0.0041 C   0  0  0

+   -2.4380   -0.3027    0.0052 C   0  0  0

+   -1.7544   -2.6338    0.0002 N   0  0  0

+    2.2499   -1.4443   -0.0020 C   0  0  0

+    0.6127   -3.2863   -0.0038 C   0  0  0

+    3.9571    0.3690   -0.0013 C   0  0  0

+    3.2644    2.6625    0.0023 C   0  0  0

+   -3.0775    2.0463   -0.0075 C   0  0  0

+   -3.7979   -0.6535    0.0060 C   0  0  0

+    3.3306   -2.4947   -0.0044 C   0  0  0

+    4.2652    1.6989    0.0004 C   0  0  0

+   -4.3844    1.6698   -0.0130 C   0  0  0

+   -4.7459    0.3235    0.0087 C   0  0  0

+    1.1963    3.0397    0.0000 H   0  0  0

+   -2.7629   -2.9328    0.0000 H   0  0  0

+   -0.9912   -3.3577    0.0000 H   0  0  0

+   -0.4119   -3.0480    0.0000 H   0  0  0

+    0.3744   -4.3109    0.0000 H   0  0  0

+    1.6373   -3.5246    0.0000 H   0  0  0

+    4.7238   -0.3512    0.0000 H   0  0  0

+    3.5244    3.6818    0.0000 H   0  0  0

+   -2.8228    3.0669    0.0000 H   0  0  0

+   -4.0825   -1.6662    0.0000 H   0  0  0

+    2.5974   -3.2490    0.0000 H   0  0  0

+    4.0849   -3.2279    0.0000 H   0  0  0

+    4.0638   -1.7404    0.0000 H   0  0  0

+    5.2737    1.9980    0.0000 H   0  0  0

+   -5.1350    2.4068    0.0000 H   0  0  0

+   -5.7641    0.0592    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  6 13  1  0

+  7 14  1  0

+  8 15  2  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+ 14 19  2  0

+ 16 20  2  0

+ 17 21  2  0

+  7 12  1  0

+  9 10  1  0

+ 15 19  1  0

+ 20 21  1  0

+  8 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 13 25  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+103-69-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.0472   -0.2619    0.0029 C   0  0  0

+    0.8829   -1.2933    0.0014 C   0  0  0

+    0.3845    1.0587    0.0019 C   0  0  0

+   -1.4136   -0.5516   -0.0003 N   0  0  0

+    2.2334   -1.0033   -0.0012 C   0  0  0

+    1.7360    1.3415   -0.0007 C   0  0  0

+   -2.3933    0.5377    0.0013 C   0  0  0

+    2.6596    0.3120   -0.0022 C   0  0  0

+   -3.8069   -0.0478   -0.0029 C   0  0  0

+    0.5624   -2.2844    0.0000 H   0  0  0

+   -0.3106    1.8345    0.0000 H   0  0  0

+   -1.7360   -1.5421    0.0000 H   0  0  0

+    2.9315   -1.7764    0.0000 H   0  0  0

+    2.0603    2.3313    0.0000 H   0  0  0

+   -1.5451    1.1423    0.0000 H   0  0  0

+   -2.8981    1.4488    0.0000 H   0  0  0

+    3.6786    0.5281    0.0000 H   0  0  0

+   -4.2055    0.9145    0.0000 H   0  0  0

+   -4.7692   -0.4464    0.0000 H   0  0  0

+   -3.4083   -1.0101    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  7  9  1  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5869-25-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -1.2157   -0.0079    0.0021 C   0  0  0

+   -0.5771   -1.1324    0.0017 C   0  0  0

+   -0.2900    1.1239    0.0013 C   0  0  0

+   -2.6640    0.1602   -0.0025 C   0  0  0

+    0.8616   -0.8242    0.0005 C   0  0  0

+   -1.4058   -2.3530    0.0026 C   0  0  0

+    1.0383    0.4920    0.0006 C   0  0  0

+   -0.8137    2.3243    0.0011 C   0  0  0

+   -3.1573    1.5479   -0.0015 C   0  0  0

+   -3.4014   -0.9242   -0.0067 C   0  0  0

+    2.0416   -1.7089   -0.0015 C   0  0  0

+   -2.7219   -2.2385    0.0036 C   0  0  0

+    2.3985    1.0522    0.0005 C   0  0  0

+   -2.2715    2.5278    0.0013 C   0  0  0

+    3.2547   -1.2040   -0.0023 C   0  0  0

+    3.4457    0.2565   -0.0005 C   0  0  0

+    4.6961    0.7785   -0.0004 N   0  0  0

+   -0.9356   -3.3420    0.0000 H   0  0  0

+   -0.1518    3.1967    0.0000 H   0  0  0

+   -4.2312    1.7619    0.0000 H   0  0  0

+   -4.4945   -0.8585    0.0000 H   0  0  0

+    1.9056   -2.7955    0.0000 H   0  0  0

+   -3.3313   -3.1483    0.0000 H   0  0  0

+    2.5400    2.1381    0.0000 H   0  0  0

+   -2.6455    3.5570    0.0000 H   0  0  0

+    4.1243   -1.8695    0.0000 H   0  0  0

+    5.5667    0.1143    0.0000 H   0  0  0

+    4.8360    1.8646    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+ 11 15  2  0

+ 13 16  2  0

+ 16 17  1  0

+  5  7  2  0

+  9 14  2  0

+ 10 12  1  0

+ 15 16  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120693-41-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 45                          1 V2000

+   -1.3115   -0.1703    0.2808 C   0  0  0

+   -1.9925   -1.4641    0.6185 C   0  0  1

+    0.0965   -0.1457    0.1448 C   0  0  0

+   -2.0169    0.9758    0.1089 C   0  0  0

+   -3.4625   -1.5580    0.2574 C   0  0  2

+   -2.4458   -2.1745   -0.5356 O   0  0  0

+    0.7567    1.1220   -0.1778 C   0  0  0

+    0.8506   -1.3059    0.3152 C   0  0  0

+   -3.5191    0.9504    0.2458 C   0  0  1

+   -1.3838    2.1847   -0.1966 C   0  0  0

+   -4.0644   -0.3247   -0.3951 C   0  0  1

+    2.1425    1.1770   -0.3171 C   0  0  0

+   -0.0388    2.2763   -0.3413 C   0  0  0

+    2.2362   -1.2513    0.1775 C   0  0  0

+   -3.8719    0.9803    1.6302 O   0  0  0

+   -3.7600   -0.3278   -1.7913 O   0  0  0

+    2.8966    0.0177   -0.1461 C   0  0  0

+    2.8205    2.4811   -0.6498 C   0  0  0

+    3.0310   -2.4061    0.3441 C   0  0  0

+    4.3019    0.0366   -0.2785 C   0  0  0

+    3.1794    3.2140    0.6444 C   0  0  0

+    4.3781   -2.3179    0.2033 C   0  0  0

+    5.0064   -1.1106   -0.1047 C   0  0  0

+   -1.0951   -1.9854    0.0000 H   0  0  0

+   -4.2290   -2.2577    0.0000 H   0  0  0

+    0.3736   -2.2276    0.0000 H   0  0  0

+   -3.4840    1.9876    0.0000 H   0  0  0

+   -1.9510    3.0538    0.0000 H   0  0  0

+   -5.1019   -0.3506    0.0000 H   0  0  0

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+   -4.9060    1.0679    0.0000 H   0  0  0

+   -2.7223   -0.3384    0.0000 H   0  0  0

+    3.3856    1.6106    0.0000 H   0  0  0

+    3.8564    2.5435    0.0000 H   0  0  0

+    2.5784   -3.3400    0.0000 H   0  0  0

+    4.8025    0.9457    0.0000 H   0  0  0

+    4.1114    2.7576    0.0000 H   0  0  0

+    3.6358    4.1460    0.0000 H   0  0  0

+    2.2474    3.6704    0.0000 H   0  0  0

+    4.9452   -3.1870    0.0000 H   0  0  0

+    6.0436   -1.0738    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  7 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 11 16  1  0

+ 12 17  2  0

+ 12 18  1  0

+ 14 19  1  0

+ 17 20  1  0

+ 18 21  1  0

+ 19 22  2  0

+ 20 23  2  0

+  5  6  1  0

+  9 11  1  0

+ 10 13  2  0

+ 14 17  1  0

+ 22 23  1  0

+  2 24  1  0

+  5 25  1  0

+  8 26  1  0

+  9 27  1  0

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+ 11 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84736-60-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -1.0392   -0.1294    0.0043 C   0  0  0

+   -0.2805   -1.2929    0.0040 C   0  0  0

+   -0.4081    1.1074    0.0028 C   0  0  0

+   -2.4364   -0.2036    0.0004 N   0  0  0

+    1.0983   -1.2163    0.0022 C   0  0  0

+    0.9715    1.1772    0.0010 C   0  0  0

+   -3.1712    0.9263    0.0007 C   0  0  0

+   -3.0785   -1.4656   -0.0040 O   0  0  0

+    1.7238    0.0172    0.0007 C   0  0  0

+   -4.3824    0.8620   -0.0028 O   0  0  0

+    3.2020    0.0956   -0.0013 N   0  3  0

+    3.7542    1.1812   -0.0026 O   0  0  0

+    3.8660   -0.9255   -0.0016 O   0  5  0

+   -0.7489   -2.2180    0.0000 H   0  0  0

+   -0.9718    1.9777    0.0000 H   0  0  0

+    1.6653   -2.0845    0.0000 H   0  0  0

+    1.4434    2.1006    0.0000 H   0  0  0

+   -2.7010    1.8505    0.0000 H   0  0  0

+   -3.5487   -2.3898    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  2  0

+  9 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  6  9  2  0

+  2 14  1  0

+  3 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+603-85-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.4969   -0.3639    0.0361 C   0  0  0

+   -0.4902    0.6060   -0.0612 C   0  0  0

+    1.9242    0.0277    0.0147 N   0  3  0

+    0.1471   -1.6955    0.1587 C   0  0  0

+   -1.8324    0.2331   -0.0401 C   0  0  0

+   -0.1387    1.9556   -0.1796 N   0  0  0

+    2.6793   -0.4675   -0.8026 O   0  0  0

+    2.3435    0.8451    0.8144 O   0  5  0

+   -1.1852   -2.0641    0.1848 C   0  0  0

+   -2.1744   -1.1038    0.0777 C   0  0  0

+   -2.8045    1.1797   -0.1347 O   0  0  0

+    0.8837   -2.4225    0.0000 H   0  0  0

+    0.8591    2.2305    0.0000 H   0  0  0

+   -0.8756    2.6823    0.0000 H   0  0  0

+   -1.4416   -3.0668    0.0000 H   0  0  0

+   -3.1705   -1.3847    0.0000 H   0  0  0

+   -3.5460    1.9017    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  9 10  2  0

+  4 12  1  0

+  6 13  1  0

+  6 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7417-67-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.1951   -0.2487   -0.0012 N   0  0  0

+   -1.0914    0.1528   -0.0003 C   0  0  0

+    1.1437    0.6255    0.0000 N   0  0  0

+    0.5163   -1.6781    0.0027 C   0  0  0

+   -1.4218    1.6232    0.0020 C   0  0  0

+   -1.9798   -0.6659   -0.0014 O   0  0  0

+    2.3064    0.2626   -0.0008 O   0  0  0

+   -0.4488   -1.8950    0.0000 H   0  0  0

+    0.7332   -2.6432    0.0000 H   0  0  0

+    1.4814   -1.4612    0.0000 H   0  0  0

+   -0.4567    1.8401    0.0000 H   0  0  0

+   -1.6387    2.5883    0.0000 H   0  0  0

+   -2.3869    1.4063    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3032-55-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+   -0.0001    0.6790   -0.6038 C   0  0  0

+   -1.2494    1.0831    0.1816 C   0  0  0

+    1.2491    1.0835    0.1816 C   0  0  0

+    0.0001   -0.8360   -0.8175 C   0  0  0

+   -0.0002    1.3855   -1.9610 C   0  0  0

+   -2.4161    0.7053   -0.5520 O   0  0  0

+    2.4159    0.7061   -0.5520 O   0  0  0

+    0.0002   -1.4958    0.4500 O   0  0  0

+   -3.5330    1.1036    0.2220 N   0  3  0

+    3.5327    1.1046    0.2220 N   0  3  0

+    0.0004   -2.8872    0.1872 N   0  3  0

+   -3.3649    1.6557    1.2946 O   0  0  0

+   -4.6617    0.8940   -0.1849 O   0  5  0

+    4.6615    0.8954   -0.1849 O   0  0  0

+    3.3644    1.6567    1.2946 O   0  5  0

+    0.0005   -3.2898   -0.9624 O   0  0  0

+    0.0006   -3.6814    1.1106 O   0  5  0

+   -0.7354    1.7914    0.0000 H   0  0  0

+   -1.7637    1.7912    0.0000 H   0  0  0

+    1.7631    1.7918    0.0000 H   0  0  0

+    0.7348    1.7916    0.0000 H   0  0  0

+   -0.7579   -0.3985    0.0000 H   0  0  0

+   -0.7578   -1.2737    0.0000 H   0  0  0

+    0.8750    1.3856    0.0000 H   0  0  0

+   -0.0003    2.2607    0.0000 H   0  0  0

+   -0.8754    1.3854    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 11 17  1  0

+  2 18  1  0

+  2 19  1  0

+  3 20  1  0

+  3 21  1  0

+  4 22  1  0

+  4 23  1  0

+  5 24  1  0

+  5 25  1  0

+  5 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+42017-89-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 38                          1 V2000

+   -3.9245    0.6526    0.2991 C   0  0  0

+   -5.2114    1.2706   -0.1839 C   0  0  0

+   -3.8016   -0.6682   -0.2322 O   0  0  0

+   -2.7426    1.5033   -0.1703 C   0  0  0

+   -3.9317    0.5889    1.8278 C   0  0  0

+   -5.5396    2.5169    0.1912 O   0  0  0

+   -5.9476    0.6441   -0.9087 O   0  0  0

+   -2.4866   -0.9964   -0.1667 C   0  0  0

+   -1.9256   -1.3721    1.0486 C   0  0  0

+   -1.7052   -0.9614   -1.3166 C   0  0  0

+   -0.5919   -1.7059    1.1195 C   0  0  0

+   -0.3710   -1.2935   -1.2548 C   0  0  0

+    0.1988   -1.6666   -0.0331 C   0  0  0

+    1.6283   -2.0229    0.0381 C   0  0  0

+    2.6558   -0.9617    0.0203 C   0  0  0

+    1.9610   -3.1901    0.1115 O   0  0  0

+    4.0095   -1.2974   -0.0563 C   0  0  0

+    2.2772    0.3822    0.0741 C   0  0  0

+    4.9637   -0.3022   -0.0726 C   0  0  0

+    3.2408    1.3678    0.0572 C   0  0  0

+    4.5823    1.0281   -0.0131 C   0  0  0

+    5.7898    2.2752   -0.0341 Cl  0  0  0

+   -2.1402    0.6664    0.0000 H   0  0  0

+   -1.9057    2.1057    0.0000 H   0  0  0

+   -3.3450    2.3402    0.0000 H   0  0  0

+   -4.9564    0.7047    0.0000 H   0  0  0

+   -4.0475   -0.4358    0.0000 H   0  0  0

+   -2.9070    0.4731    0.0000 H   0  0  0

+   -5.8022    3.5141    0.0000 H   0  0  0

+   -2.3439   -2.3146    0.0000 H   0  0  0

+   -1.6027    0.0647    0.0000 H   0  0  0

+   -0.6926   -2.7322    0.0000 H   0  0  0

+    0.0418   -0.3485    0.0000 H   0  0  0

+    4.2961   -2.2879    0.0000 H   0  0  0

+    1.2780    0.6371    0.0000 H   0  0  0

+    5.9647   -0.5499    0.0000 H   0  0  0

+    2.9614    2.3604    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  2  7  2  0

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+ 11 32  1  0

+ 12 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+55804-66-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 45                          1 V2000

+   -2.5083   -1.8376    0.3725 O   0  0  0

+   -1.7755   -0.9632   -0.0507 C   0  0  0

+   -0.5657   -1.2568   -0.5873 O   0  0  0

+   -2.1712    0.4556   -0.0056 C   0  0  0

+    0.4596   -0.3996   -0.3546 C   0  0  0

+   -3.5860    0.8504    0.0466 C   0  0  0

+   -1.1566    1.4079   -0.0136 C   0  0  0

+    1.7635   -0.8320   -0.3635 C   0  0  0

+    0.1852    0.9622   -0.0997 C   0  0  0

+   -4.5492   -0.0929    0.0537 O   0  0  0

+   -3.8876    2.0274    0.0832 O   0  0  0

+    2.8267    0.0547   -0.1402 C   0  0  0

+    2.1147   -2.2762   -0.6286 C   0  0  0

+    1.2537    1.8529    0.0751 C   0  0  0

+   -5.9469    0.2972    0.1052 C   0  0  0

+    2.5447    1.4041    0.0457 C   0  0  0

+    4.0891   -0.5051   -0.1374 N   0  0  0

+    3.0899   -2.7260    0.4590 C   0  0  0

+   -6.8262   -0.9549    0.1026 C   0  0  0

+    3.6451    2.4265    0.2144 C   0  0  0

+    4.1150   -1.6522    0.7666 C   0  0  0

+    5.0788    0.4321    0.3938 C   0  0  0

+    4.9506    1.7953   -0.2884 C   0  0  0

+   -1.3794    2.4207    0.0000 H   0  0  0

+    1.0778   -2.2917    0.0000 H   0  0  0

+    1.9000   -3.2907    0.0000 H   0  0  0

+    1.0679    2.8731    0.0000 H   0  0  0

+   -5.5569    1.2581    0.0000 H   0  0  0

+   -6.8575    0.7934    0.0000 H   0  0  0

+    2.5548   -3.6143    0.0000 H   0  0  0

+    3.9141   -3.3554    0.0000 H   0  0  0

+   -7.6749   -0.3589    0.0000 H   0  0  0

+   -7.4222   -1.8036    0.0000 H   0  0  0

+   -5.9775   -1.5509    0.0000 H   0  0  0

+    4.2084    3.2972    0.0000 H   0  0  0

+    2.8507    3.0931    0.0000 H   0  0  0

+    4.6540   -2.5381    0.0000 H   0  0  0

+    5.1103   -1.3611    0.0000 H   0  0  0

+    5.6090   -0.4591    0.0000 H   0  0  0

+    6.0647    0.7536    0.0000 H   0  0  0

+    5.9836    1.7046    0.0000 H   0  0  0

+    5.2262    2.7950    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

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+  5  3  1  0

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+  7  4  2  0

+  8  5  2  0

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+ 10  6  1  0

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+ 12  8  1  0

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+ 15 10  1  0

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+ 23 20  1  0

+  7  9  1  0

+ 14 16  1  0

+ 18 21  1  0

+ 22 23  1  0

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+ 13 25  1  0

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+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109460-96-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.6411   -0.7970   -0.5234 C   0  0  0

+   -0.5474    0.0501   -0.6642 C   0  0  0

+    1.8596   -0.2394   -0.1119 C   0  0  0

+    0.5644   -2.1697   -0.7938 C   0  0  0

+   -1.7265   -0.3107   -0.0516 C   0  0  0

+    2.9726   -1.0448    0.0176 C   0  0  0

+    1.9780    1.6101    0.2638 Br  0  0  0

+    1.6861   -2.9581   -0.6590 C   0  0  0

+   -2.9573    0.4478   -0.3210 C   0  0  0

+   -1.7543   -1.4245    0.8480 C   0  0  0

+    2.8877   -2.3982   -0.2574 C   0  0  0

+   -4.1117    0.0945    0.2790 O   0  0  0

+   -2.9337    1.3933   -1.0846 O   0  0  0

+   -1.7763   -2.3081    1.5616 N   0  0  0

+   -5.3269    0.8434    0.0130 C   0  0  0

+   -0.3842    1.0540    0.0000 H   0  0  0

+   -0.3509   -2.6131    0.0000 H   0  0  0

+    3.8924   -0.6108    0.0000 H   0  0  0

+    1.5964   -3.9712    0.0000 H   0  0  0

+    3.7279   -2.9714    0.0000 H   0  0  0

+   -4.7933    1.7092    0.0000 H   0  0  0

+   -6.1927    1.3770    0.0000 H   0  0  0

+   -5.8605   -0.0224    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+  9 12  1  0

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+  8 11  1  0

+  2 16  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 11 20  1  0

+ 15 21  1  0

+ 15 22  1  0

+ 15 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5443-49-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.3249   -0.8728    0.1164 C   0  0  0

+    0.0399   -1.5872    0.1273 C   0  0  0

+    1.5439    0.1943    0.9943 C   0  0  0

+    2.3377   -1.2603   -0.7683 C   0  0  0

+   -1.1214   -0.8922    0.0867 C   0  0  0

+    2.7518    0.8590    0.9777 C   0  0  0

+    3.5396   -0.5854   -0.7723 C   0  0  0

+   -2.3507   -1.5607    0.2708 C   0  0  0

+   -1.0962    0.9742   -0.2165 Br  0  0  0

+    3.7462    0.4732    0.0957 C   0  0  0

+   -3.3922   -0.9374    0.2343 O   0  0  0

+    0.0237   -2.6021    0.0000 H   0  0  0

+    0.7268    0.7965    0.0000 H   0  0  0

+    2.4118   -2.2726    0.0000 H   0  0  0

+    2.6844    1.8718    0.0000 H   0  0  0

+    4.3622   -1.1801    0.0000 H   0  0  0

+   -2.3716   -2.5755    0.0000 H   0  0  0

+    4.6350    0.9634    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

+  8 11  2  0

+  7 10  1  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101-90-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    1.1968    0.1925    0.0869 C   0  0  0

+    0.0003    0.8870    0.0019 C   0  0  0

+    2.3716    0.8700    0.1752 O   0  0  0

+    1.1937   -1.1955    0.0876 C   0  0  0

+   -1.1967    0.1929   -0.0875 C   0  0  0

+    3.4091   -0.1100    0.2476 C   0  0  0

+   -0.0006   -1.8848    0.0036 C   0  0  0

+   -2.3714    0.8710   -0.1714 O   0  0  0

+   -1.1941   -1.1946   -0.0918 C   0  0  0

+    4.7657    0.5901    0.3492 C   0  0  0

+   -3.4090   -0.1084   -0.2501 C   0  0  0

+    5.8765   -0.4591    0.4267 C   0  0  0

+    5.5679    0.2406   -0.7805 O   0  0  0

+   -4.7656    0.5924   -0.3472 C   0  0  0

+   -5.8765   -0.4562   -0.4315 C   0  0  0

+   -5.5678    0.2356    0.7802 O   0  0  0

+    0.0005    1.9247    0.0000 H   0  0  0

+    2.0917   -1.7154    0.0000 H   0  0  0

+    2.6164   -0.7796    0.0000 H   0  0  0

+    3.9855   -0.9729    0.0000 H   0  0  0

+   -0.0010   -2.9225    0.0000 H   0  0  0

+   -2.0925   -1.7140    0.0000 H   0  0  0

+    4.7317    1.6272    0.0000 H   0  0  0

+   -3.9857   -0.9711    0.0000 H   0  0  0

+   -2.6165   -0.7783    0.0000 H   0  0  0

+    5.5050   -1.4280    0.0000 H   0  0  0

+    6.9139   -0.4335    0.0000 H   0  0  0

+   -4.7353    1.6296    0.0000 H   0  0  0

+   -6.9138   -0.4275    0.0000 H   0  0  0

+   -5.5066   -1.4257    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  8 11  1  0

+ 10 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+  7  9  1  0

+ 12 13  1  0

+ 15 16  1  0

+  2 17  1  0

+  4 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50-33-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

+    0.2359    0.8426   -0.2286 N   0  0  0

+   -0.0688   -0.5123   -0.3251 N   0  0  0

+    1.5116    1.3427    0.0550 C   0  0  0

+   -0.8466    1.6127   -0.4475 C   0  0  0

+    0.8626   -1.5415   -0.1489 C   0  0  0

+   -1.3701   -0.7106   -0.6080 C   0  0  0

+    2.2400    1.9916   -0.9331 C   0  0  0

+    2.0496    1.1962    1.3271 C   0  0  0

+   -1.9959    0.6643   -0.7190 C   0  0  0

+   -0.8924    2.8246   -0.4300 O   0  0  0

+    0.8008   -2.3504    0.9780 C   0  0  0

+    1.8474   -1.7599   -1.1037 C   0  0  0

+   -1.9285   -1.7776   -0.7526 O   0  0  0

+    3.4991    2.4841   -0.6499 C   0  0  0

+    3.3088    1.6908    1.6038 C   0  0  0

+   -3.0585    0.8257    0.3699 C   0  0  0

+    1.7218   -3.3656    1.1490 C   0  0  0

+    2.7652   -2.7764   -0.9269 C   0  0  0

+    4.0341    2.3316    0.6158 C   0  0  0

+   -4.3612    0.1660   -0.0869 C   0  0  0

+    2.7044   -3.5767    0.1995 C   0  0  0

+   -5.4237    0.3275    1.0021 C   0  0  0

+   -6.7264   -0.3323    0.5452 C   0  0  0

+    1.7237    2.8331    0.0000 H   0  0  0

+    2.1031    0.2104    0.0000 H   0  0  0

+   -2.2588    1.6159    0.0000 H   0  0  0

+   -0.1331   -2.6706    0.0000 H   0  0  0

+    2.3442   -0.9068    0.0000 H   0  0  0

+    3.4521    3.4702    0.0000 H   0  0  0

+    3.8239    0.8486    0.0000 H   0  0  0

+   -2.6133    1.7069    0.0000 H   0  0  0

+   -3.7569    1.5235    0.0000 H   0  0  0

+    1.2288   -4.2210    0.0000 H   0  0  0

+    3.6994   -2.4571    0.0000 H   0  0  0

+    4.9969    2.5499    0.0000 H   0  0  0

+   -4.8065   -0.7151    0.0000 H   0  0  0

+   -3.6628   -0.5318    0.0000 H   0  0  0

+    3.2953   -4.3676    0.0000 H   0  0  0

+   -4.9785    1.2086    0.0000 H   0  0  0

+   -6.1221    1.0253    0.0000 H   0  0  0

+   -7.1725    0.5484    0.0000 H   0  0  0

+   -7.6071   -0.7784    0.0000 H   0  0  0

+   -6.2803   -1.2130    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+  8 15  2  0

+  9 16  1  0

+ 11 17  1  0

+ 12 18  2  0

+ 14 19  2  0

+ 16 20  1  0

+ 17 21  2  0

+ 20 22  1  0

+ 22 23  1  0

+  6  9  1  0

+ 15 19  1  0

+ 18 21  1  0

+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+ 23 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+584-84-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -1.2630    0.3405    0.0038 C   0  0  0

+   -0.2682   -0.6443    0.0044 C   0  0  0

+   -0.8833    1.7642    0.0003 C   0  0  0

+   -2.5419   -0.0064    0.0009 N   0  0  0

+    1.0789   -0.2646    0.0016 C   0  0  0

+    0.4481    2.1279   -0.0024 C   0  0  0

+   -1.9521    2.8266   -0.0008 C   0  0  0

+   -2.8617   -1.2148   -0.0013 C   0  0  0

+    1.4364    1.1651   -0.0019 C   0  0  0

+    2.0298   -1.1875    0.0025 N   0  0  0

+   -3.1707   -2.3826   -0.0035 O   0  0  0

+    3.2322   -0.8461    0.0000 C   0  0  0

+    4.3943   -0.5161   -0.0024 O   0  0  0

+   -0.5270   -1.6462    0.0000 H   0  0  0

+    0.7070    3.1298    0.0000 H   0  0  0

+   -1.2226    3.5605    0.0000 H   0  0  0

+   -2.6860    3.5561    0.0000 H   0  0  0

+   -2.6816    2.0927    0.0000 H   0  0  0

+    2.4318    1.4478    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  8 11  2  0

+ 10 12  2  0

+ 12 13  2  0

+  6  9  2  0

+  2 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110-05-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+   -1.7846   -0.0140    0.0028 C   0  0  0

+   -0.4767    0.5589   -0.0549 O   0  0  0

+   -2.0022   -0.9123   -1.2164 C   0  0  0

+   -1.9212   -0.8454    1.2799 C   0  0  0

+   -2.8306    1.1026    0.0069 C   0  0  0

+    0.4767   -0.5588   -0.0559 O   0  0  0

+    1.7846    0.0140    0.0029 C   0  0  0

+    2.8306   -1.1026    0.0049 C   0  0  0

+    2.0022    0.9145   -1.2148 C   0  0  0

+    1.9212    0.8432    1.2814 C   0  0  0

+   -3.0430   -0.6602    0.0000 H   0  0  0

+   -2.2543   -1.9531    0.0000 H   0  0  0

+   -0.9614   -1.1644    0.0000 H   0  0  0

+   -2.9779   -0.6718    0.0000 H   0  0  0

+   -2.0948   -1.9021    0.0000 H   0  0  0

+   -0.8645   -1.0190    0.0000 H   0  0  0

+   -2.0491    1.8347    0.0000 H   0  0  0

+   -3.5627    1.8841    0.0000 H   0  0  0

+   -3.6121    0.3705    0.0000 H   0  0  0

+    2.0491   -1.8347    0.0000 H   0  0  0

+    3.5627   -1.8841    0.0000 H   0  0  0

+    3.6121   -0.3705    0.0000 H   0  0  0

+    3.0431    0.6630    0.0000 H   0  0  0

+    2.2537    1.9554    0.0000 H   0  0  0

+    0.9613    1.1660    0.0000 H   0  0  0

+    2.9778    0.6691    0.0000 H   0  0  0

+    2.0953    1.8998    0.0000 H   0  0  0

+    0.8646    1.0173    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  7  8  1  0

+  7  9  1  0

+  7 10  1  0

+  3 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  5 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+132335-15-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+    0.0478    1.8364   -0.2456 C   0  0  0

+   -0.5163    0.4423   -0.1130 C   0  0  0

+    1.5757    1.9962   -0.2714 C   0  0  0

+    0.8058    2.1712    0.9674 N   0  0  0

+    0.3254   -0.6464   -0.0192 C   0  0  0

+   -1.9076    0.2579   -0.0845 C   0  0  0

+    2.4148    0.7448   -0.1644 C   0  0  0

+    1.8018   -0.4971   -0.0449 C   0  0  0

+   -0.2160   -1.9424    0.1055 C   0  0  0

+   -2.4360   -1.0514    0.0407 C   0  0  0

+   -2.7881    1.3505   -0.1785 C   0  0  0

+    3.7914    0.8432   -0.1849 C   0  0  0

+    2.5954   -1.6438    0.0541 C   0  0  0

+   -1.5565   -2.1445    0.1353 C   0  0  0

+   -3.8288   -1.2321    0.0689 C   0  0  0

+   -4.1317    1.1368   -0.1477 C   0  0  0

+    4.5698   -0.2959   -0.0877 C   0  0  0

+    3.9696   -1.5366    0.0331 C   0  0  0

+   -4.6507   -0.1508   -0.0243 C   0  0  0

+   -0.6999    2.5610    0.0000 H   0  0  0

+    2.1652    2.8545    0.0000 H   0  0  0

+    0.7058    3.2076    0.0000 H   0  0  0

+    0.4243   -2.7634    0.0000 H   0  0  0

+   -2.4141    2.3222    0.0000 H   0  0  0

+    4.2443    1.7807    0.0000 H   0  0  0

+    2.1484   -2.5841    0.0000 H   0  0  0

+   -1.9348   -3.1146    0.0000 H   0  0  0

+   -4.2303   -2.1928    0.0000 H   0  0  0

+   -4.7805    1.9512    0.0000 H   0  0  0

+    5.6081   -0.2185    0.0000 H   0  0  0

+    4.5567   -2.3965    0.0000 H   0  0  0

+   -5.6826   -0.2893    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+  8 13  1  0

+  9 14  2  0

+ 10 15  1  0

+ 11 16  2  0

+ 12 17  2  0

+ 13 18  2  0

+ 15 19  2  0

+  3  4  1  0

+  7  8  2  0

+ 10 14  1  0

+ 16 19  1  0

+ 17 18  1  0

+  1 20  1  0

+  3 21  1  0

+  4 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+527-85-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    1.6164   -0.2797   -0.0161 C   0  0  0

+    2.2830   -0.6610    1.0915 N   0  0  0

+    2.2302    0.0293   -1.0187 O   0  0  0

+    0.1384   -0.2430   -0.0134 C   0  0  0

+   -0.5322    0.9773    0.0802 C   0  0  0

+   -0.5925   -1.4284   -0.1103 C   0  0  0

+    0.2486    2.2625    0.1789 C   0  0  0

+   -1.9117    1.0046    0.0817 C   0  0  0

+   -1.9712   -1.3871   -0.1077 C   0  0  0

+   -2.6300   -0.1742   -0.0093 C   0  0  0

+    2.2872   -1.6962    0.0000 H   0  0  0

+    3.1775   -0.1398    0.0000 H   0  0  0

+   -0.1015   -2.3398    0.0000 H   0  0  0

+    1.1334    1.7250    0.0000 H   0  0  0

+    0.7861    3.1473    0.0000 H   0  0  0

+   -0.6362    2.8000    0.0000 H   0  0  0

+   -2.4097    1.9122    0.0000 H   0  0  0

+   -2.5137   -2.2688    0.0000 H   0  0  0

+   -3.6649   -0.1485    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  5  1  0

+  9  6  2  0

+ 10  8  2  0

+  9 10  1  0

+  2 11  1  0

+  2 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80-43-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+    3.0048   -0.2712   -0.0002 C   0  0  0

+    1.5943   -0.8018    0.0030 C   0  0  0

+    4.0729   -1.1475   -0.0521 C   0  0  0

+    3.2306    1.0917    0.0430 C   0  0  0

+    0.6747    0.2904    0.0608 O   0  0  0

+    1.3496   -1.6075   -1.2744 C   0  0  0

+    1.3917   -1.7041    1.2219 C   0  0  0

+    5.3665   -0.6609   -0.0550 C   0  0  0

+    4.5246    1.5785    0.0400 C   0  0  0

+   -0.6747   -0.2902    0.0611 O   0  0  0

+    5.5925    0.7022   -0.0060 C   0  0  0

+   -1.5944    0.8019    0.0023 C   0  0  0

+   -3.0049    0.2713   -0.0005 C   0  0  0

+   -1.3917    1.7054    1.2203 C   0  0  0

+   -1.3496    1.6065   -1.2759 C   0  0  0

+   -4.0726    1.1473   -0.0532 C   0  0  0

+   -3.2307   -1.0920    0.0440 C   0  0  0

+   -5.3667    0.6605   -0.0557 C   0  0  0

+   -4.5243   -1.5786    0.0415 C   0  0  0

+   -5.5925   -0.7021   -0.0054 C   0  0  0

+    3.9041   -2.1700    0.0000 H   0  0  0

+    2.4297    1.7494    0.0000 H   0  0  0

+    0.3580   -1.3063    0.0000 H   0  0  0

+    1.0484   -2.5991    0.0000 H   0  0  0

+    2.3412   -1.9087    0.0000 H   0  0  0

+    0.3805   -1.4771    0.0000 H   0  0  0

+    1.1647   -2.7153    0.0000 H   0  0  0

+    2.4029   -1.9311    0.0000 H   0  0  0

+    6.1673   -1.3187    0.0000 H   0  0  0

+    4.6935    2.6010    0.0000 H   0  0  0

+    6.5625    1.0669    0.0000 H   0  0  0

+   -0.3805    1.4785    0.0000 H   0  0  0

+   -1.1648    2.7166    0.0000 H   0  0  0

+   -2.4029    1.9323    0.0000 H   0  0  0

+   -0.3581    1.3048    0.0000 H   0  0  0

+   -1.0479    2.5980    0.0000 H   0  0  0

+   -2.3411    1.9082    0.0000 H   0  0  0

+   -3.9038    2.1698    0.0000 H   0  0  0

+   -2.4298   -1.7497    0.0000 H   0  0  0

+   -6.1675    1.3183    0.0000 H   0  0  0

+   -4.6932   -2.6011    0.0000 H   0  0  0

+   -6.5625   -1.0669    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  8 11  1  0

+ 10 12  1  0

+ 12 13  1  0

+ 12 14  1  0

+ 12 15  1  0

+ 13 16  2  0

+ 13 17  1  0

+ 16 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+  9 11  2  0

+ 19 20  1  0

+  3 21  1  0

+  4 22  1  0

+  6 23  1  0

+  6 24  1  0

+  6 25  1  0

+  7 26  1  0

+  7 27  1  0

+  7 28  1  0

+  8 29  1  0

+  9 30  1  0

+ 11 31  1  0

+ 14 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+ 15 35  1  0

+ 15 36  1  0

+ 15 37  1  0

+ 16 38  1  0

+ 17 39  1  0

+ 18 40  1  0

+ 19 41  1  0

+ 20 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109-21-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.1693   -0.4197    0.0000 O   0  0  0

+   -1.0442    0.1540    0.0000 C   0  0  0

+    1.3631    0.4070    0.0000 C   0  0  0

+   -2.2832   -0.7040    0.0000 C   0  0  0

+   -1.1432    1.3582    0.0000 O   0  0  0

+    2.6036   -0.4887    0.0000 C   0  0  0

+   -3.5236    0.1916    0.0000 C   0  0  0

+    3.8614    0.3824    0.0000 C   0  0  0

+   -4.7815   -0.6794    0.0000 C   0  0  0

+    5.1019   -0.5132    0.0000 C   0  0  0

+    2.1356    1.2554    0.0000 H   0  0  0

+    0.6074    1.2705    0.0000 H   0  0  0

+   -3.0557   -1.5524    0.0000 H   0  0  0

+   -1.5275   -1.5675    0.0000 H   0  0  0

+    1.8311   -1.3371    0.0000 H   0  0  0

+    3.3593   -1.3522    0.0000 H   0  0  0

+   -2.7511    1.0400    0.0000 H   0  0  0

+   -4.2793    1.0551    0.0000 H   0  0  0

+    4.6339    1.2309    0.0000 H   0  0  0

+    3.1057    1.2458    0.0000 H   0  0  0

+   -5.4347    0.2640    0.0000 H   0  0  0

+   -5.7249   -1.3326    0.0000 H   0  0  0

+   -4.1283   -1.6228    0.0000 H   0  0  0

+    4.4302   -1.4435    0.0000 H   0  0  0

+    6.0322   -1.1849    0.0000 H   0  0  0

+    5.7736    0.4171    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  6 15  1  0

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+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+305-03-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+   -1.0672    0.2902    0.1064 C   0  0  0

+   -2.3814   -0.1773    0.0339 N   0  0  0

+   -0.3821    0.2568    1.3141 C   0  0  0

+   -0.4403    0.7844   -1.0308 C   0  0  0

+   -2.6537   -1.5196   -0.4861 C   0  0  0

+   -3.4874    0.6746    0.4780 C   0  0  0

+    0.9176    0.7195    1.3821 C   0  0  0

+    0.8591    1.2454   -0.9557 C   0  0  0

+   -2.2125   -2.5638    0.5414 C   0  0  0

+   -3.8771    1.6331   -0.6491 C   0  0  0

+    1.5366    1.2155    0.2497 C   0  0  0

+   -2.5477   -4.2157   -0.0986 Cl  0  0  0

+   -5.2383    2.6815   -0.1026 Cl  0  0  0

+    2.9545    1.7199    0.3279 C   0  0  0

+    3.9216    0.5693    0.0419 C   0  0  0

+    5.3612    1.0815    0.1212 C   0  0  0

+    6.3137   -0.0518   -0.1605 C   0  0  0

+    7.6383    0.1652   -0.1451 O   0  0  0

+    5.8851   -1.1558   -0.4001 O   0  0  0

+   -0.2310   -0.7662    0.0000 H   0  0  0

+   -0.9399    1.6898    0.0000 H   0  0  0

+   -3.5491   -1.0024    0.0000 H   0  0  0

+   -3.4288   -2.2041    0.0000 H   0  0  0

+   -4.5207    0.6346    0.0000 H   0  0  0

+   -3.8017   -0.3105    0.0000 H   0  0  0

+    1.4213   -0.1836    0.0000 H   0  0  0

+    0.7062    2.2681    0.0000 H   0  0  0

+   -1.3171   -3.0810    0.0000 H   0  0  0

+   -1.4374   -1.8793    0.0000 H   0  0  0

+   -2.8438    1.6731    0.0000 H   0  0  0

+   -3.5628    2.6182    0.0000 H   0  0  0

+    3.8195    2.2865    0.0000 H   0  0  0

+    2.4947    2.6461    0.0000 H   0  0  0

+    3.0566    0.0027    0.0000 H   0  0  0

+    4.3815   -0.3569    0.0000 H   0  0  0

+    6.2262    1.6481    0.0000 H   0  0  0

+    4.9013    2.0077    0.0000 H   0  0  0

+    8.6588    0.3324    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+ 14 15  1  0

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+ 16 17  1  0

+ 17 18  1  0

+ 17 19  2  0

+  8 11  1  0

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+ 10 30  1  0

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+ 14 32  1  0

+ 14 33  1  0

+ 15 34  1  0

+ 15 35  1  0

+ 16 36  1  0

+ 16 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142-96-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    0.0000   -0.3893    0.0000 O   0  0  0

+   -1.1472    0.4627    0.0000 C   0  0  0

+    1.1472    0.4627    0.0000 C   0  0  0

+   -2.4167   -0.3913    0.0000 C   0  0  0

+    2.4167   -0.3913    0.0000 C   0  0  0

+   -3.6450    0.5209    0.0000 C   0  0  0

+    3.6450    0.5209    0.0000 C   0  0  0

+   -4.9145   -0.3331    0.0000 C   0  0  0

+    4.9145   -0.3331    0.0000 C   0  0  0

+   -0.3633    1.3007    0.0000 H   0  0  0

+   -1.8912    1.3363    0.0000 H   0  0  0

+    1.8912    1.3363    0.0000 H   0  0  0

+    0.3633    1.3007    0.0000 H   0  0  0

+   -3.2006   -1.2293    0.0000 H   0  0  0

+   -1.6727   -1.2649    0.0000 H   0  0  0

+    1.6727   -1.2649    0.0000 H   0  0  0

+    3.2006   -1.2293    0.0000 H   0  0  0

+   -2.8611    1.3589    0.0000 H   0  0  0

+   -4.3890    1.3945    0.0000 H   0  0  0

+    4.3890    1.3945    0.0000 H   0  0  0

+    2.8611    1.3589    0.0000 H   0  0  0

+   -5.5550    0.6190    0.0000 H   0  0  0

+   -5.8666   -0.9736    0.0000 H   0  0  0

+   -4.2740   -1.2852    0.0000 H   0  0  0

+    4.2740   -1.2852    0.0000 H   0  0  0

+    5.8666   -0.9736    0.0000 H   0  0  0

+    5.5550    0.6190    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  2 10  1  0

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+  7 20  1  0

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+  8 22  1  0

+  8 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+  9 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4067-16-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+    0.6309   -0.4326   -0.0047 C   0  0  0

+   -0.6309    0.4326    0.0047 C   0  0  0

+    1.8180    0.4328    0.0047 N   0  0  0

+   -1.8180   -0.4328   -0.0047 N   0  0  0

+    2.9880   -0.4555   -0.0050 C   0  0  0

+   -2.9880    0.4555    0.0050 C   0  0  0

+    4.2664    0.3850    0.0042 C   0  0  0

+   -4.2664   -0.3850   -0.0042 C   0  0  0

+    5.4364   -0.5033   -0.0055 N   0  0  0

+   -5.4364    0.5033    0.0055 N   0  0  0

+    6.6235    0.3621    0.0040 C   0  0  0

+   -6.6235   -0.3621   -0.0040 C   0  0  0

+    7.8853   -0.5031   -0.0055 C   0  0  0

+   -7.8853    0.5031    0.0055 C   0  0  0

+    9.0724    0.3623    0.0040 N   0  0  0

+   -9.0724   -0.3623   -0.0040 N   0  0  0

+   -0.0909   -1.2650    0.0000 H   0  0  0

+    1.3764   -1.2439    0.0000 H   0  0  0

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+   -5.0276   -1.1816    0.0000 H   0  0  0

+   -3.5609   -1.2313    0.0000 H   0  0  0

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+   -7.3453   -1.1945    0.0000 H   0  0  0

+   -5.8780   -1.1734    0.0000 H   0  0  0

+    7.1635   -1.3355    0.0000 H   0  0  0

+    8.6308   -1.3144    0.0000 H   0  0  0

+   -7.1635    1.3355    0.0000 H   0  0  0

+   -8.6308    1.3144    0.0000 H   0  0  0

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+  -10.0797    0.0842    0.0000 H   0  0  0

+   -8.9555   -1.4579    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 39  1  0

+ 14 40  1  0

+ 15 41  1  0

+ 15 42  1  0

+ 16 43  1  0

+ 16 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+600-24-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.4350   -0.5813   -0.4884 C   0  0  0

+   -0.7544    0.1310   -0.0147 N   0  3  0

+    1.6686   -0.0641    0.2542 C   0  0  0

+    0.2714   -2.0793   -0.2239 C   0  0  0

+   -1.0718    0.0724    1.1597 O   0  0  0

+   -1.4257    0.7817   -0.7954 O   0  5  0

+    1.8322    1.4340   -0.0102 C   0  0  0

+    0.5078    0.4376    0.0000 H   0  0  0

+    1.8999   -1.0591    0.0000 H   0  0  0

+    2.6883   -0.0030    0.0000 H   0  0  0

+   -0.7441   -1.9684    0.0000 H   0  0  0

+    0.1605   -3.0948    0.0000 H   0  0  0

+    1.2869   -2.1902    0.0000 H   0  0  0

+    2.8477    1.3231    0.0000 H   0  0  0

+    1.9431    2.4495    0.0000 H   0  0  0

+    0.8167    1.5449    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24305-27-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 50                          1 V2000

+   -2.6520    0.6761    0.3883 N   0  0  0

+   -2.8146    1.7916   -0.5555 C   0  0  1

+   -1.5131   -0.0120    0.6024 C   0  0  0

+   -3.9394    0.4391    1.0663 C   0  0  0

+   -4.2873    2.2462   -0.4783 C   0  0  0

+   -1.9154    2.9300   -0.1474 C   0  0  0

+   -0.4836   -0.1247   -0.4924 C   0  0  2

+   -1.3167   -0.5405    1.6762 O   0  0  0

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+   -1.2089    2.8234    0.8326 O   0  0  0

+   -0.9105   -1.2086   -1.4842 C   0  0  0

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+   -1.0668   -2.5201   -0.7585 C   0  0  0

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+   -2.1921   -2.9706   -0.1717 C   0  0  0

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+    5.2801    0.7550    0.1151 C   0  0  0

+    6.2756    1.3299   -0.2714 O   0  0  0

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+   -5.4416    0.2019    0.0000 H   0  0  0

+   -1.1020    4.5078    0.0000 H   0  0  0

+   -2.6757    4.5341    0.0000 H   0  0  0

+   -1.5349   -0.5484    0.0000 H   0  0  0

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+   -0.1956   -5.2644    0.0000 H   0  0  0

+    3.2975    1.0798    0.0000 H   0  0  0

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+    4.8273   -0.5940    0.0000 H   0  0  0

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+  1  2  1  0

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+  5  9  1  0

+ 20 21  1  0

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+ 21 43  1  0

+ 22 44  1  0

+ 22 45  1  0

+ 23 46  1  0

+ 24 47  1  0

+ 24 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21738-42-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+    0.0465   -0.1513    0.0622 C   0  0  0

+    0.5612   -1.4376    0.0213 C   0  0  0

+    0.9053    0.9426    0.0531 C   0  0  0

+   -1.3344    0.0672    0.1188 N   0  0  0

+    1.9329   -1.6236   -0.0233 C   0  0  0

+   -0.3384   -2.6453    0.0188 C   0  0  0

+    2.2710    0.7482    0.0067 C   0  0  0

+   -2.2430   -1.0507   -0.1698 C   0  0  0

+    2.7840   -0.5357   -0.0307 C   0  0  0

+   -1.7178   -2.2861    0.5706 C   0  0  0

+    3.1852    1.9121   -0.0041 N   0  3  0

+   -3.6465   -0.7107    0.3355 C   0  0  0

+    4.2751   -0.7482   -0.0794 C   0  0  0

+    3.1919    2.6900    0.9331 O   0  0  0

+    3.9309    2.0920   -0.9502 O   0  5  0

+   -4.1302    0.5005   -0.3405 N   0  0  0

+    4.5558   -2.1490   -0.1116 O   0  0  0

+   -5.4745    0.7700    0.1871 C   0  0  0

+   -5.7411    2.2763    0.1581 C   0  0  0

+   -6.5143    0.0514   -0.6751 C   0  0  0

+    0.5180    1.9068    0.0000 H   0  0  0

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+   -3.6795   -1.7493    0.0000 H   0  0  0

+    5.3105   -0.6603    0.0000 H   0  0  0

+    4.3047    0.2905    0.0000 H   0  0  0

+   -3.4653    1.2990    0.0000 H   0  0  0

+    4.7600   -3.1678    0.0000 H   0  0  0

+   -5.2646   -0.2477    0.0000 H   0  0  0

+   -4.7179    2.4574    0.0000 H   0  0  0

+   -5.9222    3.2995    0.0000 H   0  0  0

+   -6.7643    2.0952    0.0000 H   0  0  0

+   -7.1051    0.9062    0.0000 H   0  0  0

+   -7.3691   -0.5394    0.0000 H   0  0  0

+   -5.9235   -0.8034    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 11 14  2  0

+ 11 15  1  0

+ 12 16  1  0

+ 13 17  1  0

+ 16 18  1  0

+ 18 19  1  0

+ 18 20  1  0

+  7  9  1  0

+  8 10  1  0

+  3 21  1  0

+  4 22  1  0

+  5 23  1  0

+  6 24  1  0

+  6 25  1  0

+  8 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-38-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -1.5781   -0.3672    0.0635 C   0  0  0

+   -2.6254    0.6227    0.0363 C   0  0  0

+   -0.1592    0.0170    0.1338 C   0  0  0

+   -1.9651   -1.6909    0.0264 C   0  0  0

+   -3.8936    0.1720   -0.0282 C   0  0  0

+    0.7959   -0.9336    0.1577 N   0  0  0

+    0.1516    1.1925    0.1705 O   0  0  0

+   -3.6928   -1.5977   -0.0430 S   0  0  0

+   -5.1484    0.9564   -0.0684 N   0  3  0

+    2.1456   -0.5710    0.0914 C   0  0  0

+   -6.2224    0.3847   -0.1267 O   0  0  0

+   -5.1069    2.1734   -0.0433 O   0  5  0

+    3.1245   -1.5502   -0.0197 C   0  0  0

+    2.5086    0.7687    0.1308 C   0  0  0

+    4.4558   -1.1896   -0.0854 C   0  0  0

+    3.8418    1.1240    0.0647 C   0  0  0

+    4.8152    0.1463   -0.0407 C   0  0  0

+    6.4898    0.5962   -0.1229 Cl  0  0  0

+   -2.4113    1.6379    0.0000 H   0  0  0

+   -1.3654   -2.5376    0.0000 H   0  0  0

+    0.5289   -1.9362    0.0000 H   0  0  0

+    2.8572   -2.5527    0.0000 H   0  0  0

+    1.7765    1.5039    0.0000 H   0  0  0

+    5.1901   -1.9226    0.0000 H   0  0  0

+    4.1121    2.1257    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 17 18  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 19  1  0

+  4 20  1  0

+  6 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17683-09-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    2.5069   -0.4167    0.0006 C   0  0  0

+    3.4404   -1.4535   -0.0106 C   0  0  0

+    2.9446    0.9084    0.0106 C   0  0  0

+    1.1640   -0.6986   -0.0040 N   0  0  0

+    4.7894   -1.1632   -0.0117 C   0  0  0

+    4.2961    1.1852    0.0094 C   0  0  0

+    0.3032    0.2621    0.0064 N   0  0  0

+    5.2168    0.1524   -0.0017 C   0  0  0

+   -1.0679   -0.0258    0.0017 N   0  0  0

+    6.6917    0.4621   -0.0030 C   0  0  0

+   -2.0455    1.0653    0.0135 C   0  0  0

+   -3.4389    0.4913    0.0055 C   0  0  0

+   -4.0790    0.2142    1.1987 C   0  0  0

+   -4.0791    0.2472   -1.1954 C   0  0  0

+   -5.3573   -0.3124    1.1913 C   0  0  0

+   -5.3570   -0.2791   -1.2027 C   0  0  0

+   -5.9951   -0.5617   -0.0092 C   0  0  0

+    3.1213   -2.4399    0.0000 H   0  0  0

+    2.2557    1.6831    0.0000 H   0  0  0

+    5.4841   -1.9327    0.0000 H   0  0  0

+    4.6226    2.1692    0.0000 H   0  0  0

+   -1.3907   -1.0110    0.0000 H   0  0  0

+    6.9047   -0.5525    0.0000 H   0  0  0

+    7.7063    0.6751    0.0000 H   0  0  0

+    6.4787    1.4767    0.0000 H   0  0  0

+   -1.2001    1.6654    0.0000 H   0  0  0

+   -2.5462    1.9731    0.0000 H   0  0  0

+   -3.6756   -0.7408    0.0000 H   0  0  0

+   -4.4612    1.2109    0.0000 H   0  0  0

+   -4.9711   -1.2745    0.0000 H   0  0  0

+   -5.7643    0.6742    0.0000 H   0  0  0

+   -6.9521   -0.9604    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  5  8  2  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 11 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+  6  8  1  0

+ 16 17  1  0

+  2 18  1  0

+  3 19  1  0

+  5 20  1  0

+  6 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63-25-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.9015   -0.1429    0.2621 C   0  0  0

+   -0.1347    0.7866    0.4835 C   0  0  0

+    2.1674    0.3202   -0.1748 C   0  0  0

+    0.7054   -1.5175    0.4716 C   0  0  0

+   -1.3554    0.3630    0.9029 O   0  0  0

+    0.0972    2.1169    0.2738 C   0  0  0

+    2.3655    1.6964   -0.3785 C   0  0  0

+    3.2011   -0.6062   -0.3957 C   0  0  0

+    1.7296   -2.3859    0.2479 C   0  0  0

+   -2.2753   -0.0359    0.0037 C   0  0  0

+    1.3425    2.5670   -0.1554 C   0  0  0

+    2.9731   -1.9317   -0.1876 C   0  0  0

+   -3.5192   -0.3585    0.4101 N   0  0  0

+   -1.9838   -0.1050   -1.1739 O   0  0  0

+   -4.5198   -0.7924   -0.5680 C   0  0  0

+   -0.2363   -1.8751    0.0000 H   0  0  0

+   -0.6743    2.7645    0.0000 H   0  0  0

+    3.3077    2.0525    0.0000 H   0  0  0

+    4.1524   -0.2752    0.0000 H   0  0  0

+    1.5527   -3.3775    0.0000 H   0  0  0

+    1.5220    3.5582    0.0000 H   0  0  0

+    3.7464   -2.5771    0.0000 H   0  0  0

+   -3.8470    0.5940    0.0000 H   0  0  0

+   -4.9205    0.1317    0.0000 H   0  0  0

+   -5.4439   -1.1931    0.0000 H   0  0  0

+   -4.1191   -1.7165    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  1  0

+  7 11  1  0

+  9 12  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+645-62-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+   -0.9151   -0.0703   -0.0727 C   0  0  0

+    0.1776   -0.0878    0.6933 C   0  0  0

+   -1.4706   -1.3588   -0.6226 C   0  0  0

+   -1.5770    1.1988   -0.3737 C   0  0  0

+    1.4421   -0.7331    0.1877 C   0  0  0

+   -2.5586   -1.8862    0.3150 C   0  0  0

+   -1.1326    2.2357    0.0730 O   0  0  0

+    2.5633    0.3070    0.1445 C   0  0  0

+    3.8471   -0.3482   -0.3688 C   0  0  0

+    0.4333    0.9394    0.0000 H   0  0  0

+   -1.2965   -2.4029    0.0000 H   0  0  0

+   -0.4198   -1.4865    0.0000 H   0  0  0

+   -2.6348    1.1587    0.0000 H   0  0  0

+    0.8542   -1.6133    0.0000 H   0  0  0

+    2.2477   -1.4198    0.0000 H   0  0  0

+   -3.0203   -0.9337    0.0000 H   0  0  0

+   -3.5111   -2.3479    0.0000 H   0  0  0

+   -2.0969   -2.8387    0.0000 H   0  0  0

+    3.1513    1.1872    0.0000 H   0  0  0

+    1.7577    0.9937    0.0000 H   0  0  0

+    3.3659   -1.2911    0.0000 H   0  0  0

+    4.7900   -0.8294    0.0000 H   0  0  0

+    4.3283    0.5947    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  8  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104-85-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.8926    0.0001    0.0033 C   0  0  0

+   -0.1912   -1.2075    0.0023 C   0  0  0

+   -0.1914    1.2073    0.0023 C   0  0  0

+   -2.3246    0.0001   -0.0005 C   0  0  0

+    1.1880   -1.2002    0.0002 C   0  0  0

+    1.1882    1.2000    0.0002 C   0  0  0

+   -3.4606    0.0000   -0.0035 N   0  0  0

+    1.8768    0.0001   -0.0008 C   0  0  0

+    3.3838    0.0001   -0.0030 C   0  0  0

+   -0.7066   -2.1084    0.0000 H   0  0  0

+   -0.7068    2.1082    0.0000 H   0  0  0

+    1.7105   -2.0970    0.0000 H   0  0  0

+    1.7107    2.0968    0.0000 H   0  0  0

+    3.3838   -1.0378    0.0000 H   0  0  0

+    4.4217    0.0001    0.0000 H   0  0  0

+    3.3838    1.0380    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  3  0

+  5  8  1  0

+  8  9  1  0

+  6  8  2  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  9 14  1  0

+  9 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+687-48-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.2964   -0.3416   -0.0013 C   0  0  0

+   -0.8738    0.3243   -0.0002 O   0  0  0

+    1.4594    0.3394   -0.0004 N   0  0  0

+    0.3039   -1.5567    0.0021 O   0  0  0

+   -2.1267   -0.4094   -0.0011 C   0  0  0

+    1.4503    1.8044    0.0016 C   0  0  0

+    2.7326   -0.3852   -0.0015 C   0  0  0

+   -3.2957    0.5777    0.0003 C   0  0  0

+   -2.9188   -1.1567    0.0000 H   0  0  0

+   -1.4737   -1.2809    0.0000 H   0  0  0

+    2.5392    1.8112    0.0000 H   0  0  0

+    1.4435    2.8933    0.0000 H   0  0  0

+    0.3614    1.7976    0.0000 H   0  0  0

+    2.1940   -1.3316    0.0000 H   0  0  0

+    3.6790   -0.9238    0.0000 H   0  0  0

+    3.2712    0.5612    0.0000 H   0  0  0

+   -2.5932    1.4097    0.0000 H   0  0  0

+   -4.1277    1.2802    0.0000 H   0  0  0

+   -3.9982   -0.2543    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  5  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89-75-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.5984    0.2581    0.0029 C   0  0  0

+    0.1683   -0.9128    0.0013 C   0  0  0

+    0.0391    1.5033    0.0029 C   0  0  0

+   -2.0679    0.1797   -0.0016 C   0  0  0

+    1.5463   -0.8306   -0.0002 C   0  0  0

+   -0.6113   -2.4639    0.0019 Cl  0  0  0

+    1.4151    1.5693    0.0014 C   0  0  0

+   -2.6177   -0.9019   -0.0066 O   0  0  0

+   -3.0147    1.6347    0.0004 Cl  0  0  0

+    2.1689    0.4060   -0.0002 C   0  0  0

+    3.9024    0.5001   -0.0016 Cl  0  0  0

+   -0.5295    2.3850    0.0000 H   0  0  0

+    2.1230   -1.7071    0.0000 H   0  0  0

+    1.8940    2.5028    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+ 10 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+253-52-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+    0.0717    0.7104    0.0029 C   0  0  0

+    0.0717   -0.7104    0.0009 C   0  0  0

+    1.2912    1.4007    0.0023 C   0  0  0

+   -1.1727    1.3638   -0.0005 C   0  0  0

+   -1.1727   -1.3638    0.0011 C   0  0  0

+    1.2912   -1.4007   -0.0017 C   0  0  0

+    2.4580    0.6969   -0.0002 C   0  0  0

+   -2.2701    0.6404   -0.0052 N   0  0  0

+   -2.2701   -0.6404    0.0031 N   0  0  0

+    2.4580   -0.6969   -0.0022 C   0  0  0

+    1.3057    2.4459    0.0000 H   0  0  0

+   -1.2246    2.4079    0.0000 H   0  0  0

+   -1.2246   -2.4079    0.0000 H   0  0  0

+    1.3057   -2.4459    0.0000 H   0  0  0

+    3.3683    1.2109    0.0000 H   0  0  0

+    3.3683   -1.2109    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  2  1  0

+  7  3  2  0

+  8  4  2  0

+  9  5  2  0

+ 10  6  2  0

+  8  9  1  0

+  7 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+125676-80-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 83 87                          1 V2000

+   -3.4227   -0.5935    0.3122 C   0  0  2

+   -4.8460   -0.4256    0.8687 C   0  0  1

+   -2.4810    0.1769    1.0616 O   0  0  0

+   -3.3412   -0.2729   -1.1464 C   0  0  0

+   -3.1781   -2.1171    0.4959 C   0  0  0

+   -5.5125    0.8255    0.3125 C   0  0  1

+   -5.5922   -1.6689    0.4366 C   0  0  0

+   -1.2183    0.0356    0.4077 C   0  0  1

+   -4.2639    0.3185   -1.8399 C   0  0  0

+   -4.5543   -2.7475    0.1952 C   0  0  0

+   -5.5652    0.7234   -1.2141 C   0  0  0

+   -6.9338    0.9386    0.8676 C   0  0  0

+   -4.7564    1.9781    0.6890 O   0  0  0

+   -6.7877   -1.7810    0.3089 O   0  0  0

+   -0.4026    1.3175    0.5910 C   0  0  1

+   -0.5133   -1.0700    0.9690 O   0  0  0

+   -4.0381    0.5769   -3.3073 C   0  0  0

+   -4.6105   -3.2110   -1.2618 C   0  0  0

+   -4.8026   -3.9324    1.1308 C   0  0  0

+   -6.8712    0.2585   -1.8552 C   0  0  0

+   -6.4390    1.7223   -1.9692 C   0  0  0

+    0.9339    1.1684   -0.1447 C   0  0  2

+   -1.1368    2.4415    0.0380 O   0  0  0

+    0.6501   -1.2889    0.1734 C   0  0  1

+    1.6186   -0.1155    0.3375 C   0  0  1

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+   -0.9809    3.6677    0.5613 C   0  0  0

+    1.3360   -2.5823    0.6179 C   0  0  0

+    2.7910   -0.3526   -0.4444 O   0  0  0

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+   -0.2297    3.8362    1.4925 O   0  0  0

+    0.4927   -3.6962    0.3175 O   0  0  0

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+    3.6669   -0.0551    1.5770 O   0  0  0

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+    8.6872   -0.0414    1.0189 C   0  0  0

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+    9.9655   -0.0889    0.5111 C   0  0  0

+    9.0824   -0.4198   -1.7077 C   0  0  0

+   10.1682   -0.2750   -0.8519 C   0  0  0

+   11.4309   -0.3206   -1.3478 O   0  0  0

+   -4.2912    0.3864    0.0000 H   0  0  0

+   -2.4264    0.0882    0.0000 H   0  0  0

+   -2.8507   -3.0444    0.0000 H   0  0  0

+   -2.2251   -1.8745    0.0000 H   0  0  0

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+   -3.6342   -3.3294    0.0000 H   0  0  0

+   -5.7651   -3.7307    0.0000 H   0  0  0

+   -5.0043   -4.8949    0.0000 H   0  0  0

+   -3.8401   -4.1341    0.0000 H   0  0  0

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+   -6.7415   -0.7163    0.0000 H   0  0  0

+   -5.8331    2.4969    0.0000 H   0  0  0

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+    7.4262   -1.2836    0.0000 H   0  0  0

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+    9.1300   -1.4021    0.0000 H   0  0  0

+   12.4137   -0.3561    0.0000 H   0  0  0

+  1  2  1  0

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+ 38 79  1  0

+ 39 80  1  0

+ 40 81  1  0

+ 41 82  1  0

+ 43 83  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83-38-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.1068   -1.6937    0.0033 C   0  0  0

+   -1.2226   -2.1688    0.0055 O   0  0  0

+    0.0706   -0.2346    0.0035 C   0  0  0

+    1.3569    0.3184    0.0009 C   0  0  0

+   -1.0460    0.6108    0.0005 C   0  0  0

+    2.7500   -0.7175   -0.0033 Cl  0  0  0

+    1.5140    1.6899    0.0012 C   0  0  0

+   -2.6467   -0.0611   -0.0041 Cl  0  0  0

+   -0.8699    1.9796    0.0008 C   0  0  0

+    0.4053    2.5173    0.0041 C   0  0  0

+    0.7277   -2.3210    0.0000 H   0  0  0

+    2.4724    2.1040    0.0000 H   0  0  0

+   -1.7011    2.6113    0.0000 H   0  0  0

+    0.5314    3.5537    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  4  1  0

+  8  5  1  0

+  9  5  2  0

+ 10  7  2  0

+  9 10  1  0

+  1 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+498-02-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.2335   -0.3873   -0.0028 C   0  0  0

+   -0.0985   -0.7492   -0.0024 C   0  0  0

+    1.5903    0.9612   -0.0009 C   0  0  0

+    2.1983   -1.3457    0.0006 O   0  0  0

+   -1.0892    0.2406   -0.0001 C   0  0  0

+    0.6082    1.9438    0.0014 C   0  0  0

+    2.9010    1.3144   -0.0009 O   0  0  0

+    1.5272   -2.6073    0.0042 C   0  0  0

+   -0.7228    1.5920    0.0018 C   0  0  0

+   -2.5082   -0.1377   -0.0001 C   0  0  0

+   -3.5724    0.9293    0.0024 C   0  0  0

+   -2.8236   -1.3089   -0.0022 O   0  0  0

+   -0.3667   -1.7582    0.0000 H   0  0  0

+    0.8803    2.9518    0.0000 H   0  0  0

+    3.9091    1.5861    0.0000 H   0  0  0

+    0.6054   -2.1170    0.0000 H   0  0  0

+    1.0369   -3.5291    0.0000 H   0  0  0

+    2.4490   -3.0976    0.0000 H   0  0  0

+   -1.4587    2.3326    0.0000 H   0  0  0

+   -2.8332    1.6666    0.0000 H   0  0  0

+   -4.3097    1.6685    0.0000 H   0  0  0

+   -4.3116    0.1920    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

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+  6  9  2  0

+  2 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+28995-89-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.0002    0.2043   -0.0018 C   0  0  0

+    0.0003   -1.2132   -0.0012 C   0  0  0

+    1.2245    0.8933    0.0170 C   0  0  0

+   -1.2248    0.8932   -0.0153 C   0  0  0

+    1.2248   -1.9018    0.0181 C   0  0  0

+   -1.2246   -1.9021   -0.0195 C   0  0  0

+    2.3914    0.1926    0.0355 C   0  0  0

+    1.2454    2.3734    0.0162 N   0  3  0

+   -2.3913    0.1924   -0.0276 C   0  0  0

+   -1.2460    2.3733   -0.0166 N   0  3  0

+    2.3915   -1.2008    0.0360 C   0  0  0

+   -2.3911   -1.2014   -0.0375 C   0  0  0

+    1.7743    2.9745   -0.9016 O   0  0  0

+    0.7336    2.9902    0.9334 O   0  5  0

+   -1.7771    2.9756    0.8992 O   0  0  0

+   -0.7324    2.9889   -0.9335 O   0  5  0

+    3.6797   -1.9296    0.0568 N   0  3  0

+   -3.6792   -1.9304   -0.0572 N   0  3  0

+    4.7290   -1.3115    0.0729 O   0  0  0

+    3.6903   -3.1476    0.0579 O   0  5  0

+   -4.7286   -1.3124   -0.0734 O   0  0  0

+   -3.6897   -3.1484   -0.0573 O   0  5  0

+    1.2395   -2.9225    0.0000 H   0  0  0

+   -1.2392   -2.9228    0.0000 H   0  0  0

+    3.2798    0.6954    0.0000 H   0  0  0

+   -3.2798    0.6950    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  7 11  2  0

+  9 12  1  0

+  5 23  1  0

+  6 24  1  0

+  7 25  1  0

+  9 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+333-27-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.7230   -0.4273    0.0948 S   0  0  0

+   -1.0248    0.0496    0.0046 C   0  0  0

+    1.4098    0.6038   -0.7895 O   0  0  0

+    1.2734   -0.1591    1.3771 O   0  0  0

+    0.9694   -1.6461   -0.5929 O   0  0  0

+   -1.3153    0.5155   -1.2822 F   0  0  0

+   -1.8265   -1.0607    0.2906 F   0  0  0

+   -1.2807    1.0618    0.9358 F   0  0  0

+    1.2251    1.8744   -0.1623 C   0  0  0

+    2.1463    2.0083    0.0000 H   0  0  0

+    1.0912    2.7956    0.0000 H   0  0  0

+    0.3039    1.7405    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  1  2  0

+  6  2  1  0

+  7  2  1  0

+  8  2  1  0

+  9  3  1  0

+  9 10  1  0

+  9 11  1  0

+  9 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+70853-94-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.7759   -0.0020    0.0021 C   0  0  0

+    0.0479   -1.1202    0.0006 C   0  0  0

+   -0.2160    1.2695    0.0022 C   0  0  0

+   -2.1642   -0.1554   -0.0024 N   0  0  0

+    1.4204   -0.9649   -0.0007 C   0  0  0

+   -0.5550   -2.5013    0.0010 C   0  0  0

+    1.1569    1.4176    0.0009 C   0  0  0

+   -3.0026    0.9857   -0.0009 O   0  0  0

+    1.9743    0.3019   -0.0006 C   0  0  0

+    3.4722    0.4675   -0.0015 C   0  0  0

+   -0.8312    2.1103    0.0000 H   0  0  0

+   -2.5829   -1.1094    0.0000 H   0  0  0

+    2.0389   -1.8033    0.0000 H   0  0  0

+   -1.5098   -2.0845    0.0000 H   0  0  0

+   -0.9718   -3.4561    0.0000 H   0  0  0

+    0.3998   -2.9181    0.0000 H   0  0  0

+    1.5775    2.3708    0.0000 H   0  0  0

+   -3.6195    1.8253    0.0000 H   0  0  0

+    3.5867   -0.5680    0.0000 H   0  0  0

+    4.5077    0.5820    0.0000 H   0  0  0

+    3.3577    1.5030    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

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+  7  9  1  0

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+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88-95-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.5251    0.5496   -0.4070 C   0  0  0

+   -2.8992    0.8141    0.6205 Cl  0  0  0

+   -1.2473    1.3574   -1.2681 O   0  0  0

+   -0.6922   -0.6540   -0.2289 C   0  0  0

+    0.6944   -0.5306   -0.0024 C   0  0  0

+   -1.2707   -1.9208   -0.2776 C   0  0  0

+    1.3209    0.8028    0.0580 C   0  0  0

+    1.4683   -1.6774    0.1645 C   0  0  0

+   -0.4854   -3.0460   -0.1096 C   0  0  0

+    3.0469    0.9464    0.1762 Cl  0  0  0

+    0.6303    1.7993    0.0251 O   0  0  0

+    0.8760   -2.9252    0.1075 C   0  0  0

+   -2.3073   -2.0148    0.0000 H   0  0  0

+    2.5062   -1.5992    0.0000 H   0  0  0

+   -0.9254   -3.9893    0.0000 H   0  0  0

+    1.4706   -3.7795    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  5  1  0

+  9  6  2  0

+ 10  7  1  0

+ 11  7  2  0

+ 12  8  2  0

+  9 12  1  0

+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 12 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-98-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.5454    0.0211   -0.0014 C   0  0  0

+   -0.7857    0.6827    0.0009 C   0  0  0

+    1.8010    0.8545    0.0002 C   0  0  0

+    0.6207   -1.1844    0.0005 O   0  0  0

+   -1.7921    0.0147   -0.0003 O   0  0  0

+   -0.8487    1.6911    0.0000 H   0  0  0

+    2.3598    0.0127    0.0000 H   0  0  0

+    2.6428    1.4133    0.0000 H   0  0  0

+    1.2422    1.6963    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97-86-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    1.0618   -0.4381   -0.0214 C   0  0  0

+   -0.1365    0.1540    0.1534 O   0  0  0

+    2.2929    0.3616    0.0432 C   0  0  0

+    1.1243   -1.6343   -0.2273 O   0  0  0

+   -1.3530   -0.6362    0.0896 C   0  0  0

+    2.2158    1.8437    0.3047 C   0  0  0

+    3.4760   -0.2230   -0.1293 C   0  0  0

+   -2.5632    0.2712    0.3197 C   0  0  0

+   -2.6013    1.3541   -0.7605 C   0  0  0

+   -3.8450   -0.5614    0.2525 C   0  0  0

+   -2.1029   -1.4244    0.0000 H   0  0  0

+   -0.6578   -1.4731    0.0000 H   0  0  0

+    3.3023    1.9002    0.0000 H   0  0  0

+    2.1593    2.9302    0.0000 H   0  0  0

+    1.1293    1.7872    0.0000 H   0  0  0

+    3.5463   -1.3087    0.0000 H   0  0  0

+    4.3811    0.3807    0.0000 H   0  0  0

+   -1.5988    0.7749    0.0000 H   0  0  0

+   -1.5140    1.3924    0.0000 H   0  0  0

+   -2.6396    2.4414    0.0000 H   0  0  0

+   -3.6886    1.3158    0.0000 H   0  0  0

+   -4.4376    0.3510    0.0000 H   0  0  0

+   -4.7574   -1.1540    0.0000 H   0  0  0

+   -3.2524   -1.4738    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

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+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71432-00-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+   -0.2216    0.0782    0.0199 C   0  0  0

+   -1.5951    0.4100    0.0400 C   0  0  0

+    0.7515    1.0825   -0.0163 C   0  0  0

+    0.1555   -1.3380    0.0126 C   0  0  0

+   -2.5602   -0.6032    0.1663 C   0  0  0

+   -1.9717    1.7670   -0.0615 C   0  0  0

+    2.1577    0.6756    0.0032 C   0  0  0

+    0.3484    2.4294   -0.0806 C   0  0  0

+    1.4811   -1.6929    0.0345 C   0  0  0

+   -0.9524   -2.3140   -0.0430 C   0  0  0

+   -2.1767   -1.8904    0.3652 O   0  0  0

+   -3.8943   -0.2517    0.1081 C   0  0  0

+   -0.9690    2.7599   -0.1088 C   0  0  0

+   -3.3374    2.0797   -0.1153 C   0  0  0

+    2.4861   -0.7023    0.0385 C   0  0  0

+    3.1809    1.6291   -0.0110 C   0  0  0

+   -0.7755   -3.4499   -0.4384 O   0  0  0

+   -4.2646    1.0802   -0.0364 C   0  0  0

+    3.8417   -1.0788    0.0720 C   0  0  0

+    4.4843    1.2277    0.0161 C   0  0  0

+    4.8121   -0.1240    0.0592 C   0  0  0

+    1.0732    3.1876    0.0000 H   0  0  0

+    1.7490   -2.7071    0.0000 H   0  0  0

+   -4.6310   -0.9984    0.0000 H   0  0  0

+   -1.2461    3.7716    0.0000 H   0  0  0

+   -3.6463    3.0821    0.0000 H   0  0  0

+    2.9462    2.6515    0.0000 H   0  0  0

+   -5.2839    1.3279    0.0000 H   0  0  0

+    4.1045   -2.0943    0.0000 H   0  0  0

+    5.2482    1.9465    0.0000 H   0  0  0

+    5.8208   -0.4117    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

+  7 16  1  0

+ 10 17  2  0

+ 12 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 19 21  2  0

+  8 13  2  0

+  9 15  1  0

+ 10 11  1  0

+ 14 18  2  0

+ 20 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1948-33-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+    1.7065    0.7352   -0.0004 C   0  0  0

+    0.3220    0.1401   -0.0020 C   0  0  0

+    1.6054    2.2619   -0.0047 C   0  0  0

+    2.4570    0.2773    1.2517 C   0  0  0

+    2.4627    0.2707   -1.2467 C   0  0  0

+    0.1592   -1.2371   -0.0002 C   0  0  0

+   -0.7851    0.9665    0.0004 C   0  0  0

+   -1.1153   -1.7849   -0.0007 C   0  0  0

+    1.2489   -2.0505    0.0026 O   0  0  0

+   -2.0592    0.4189   -0.0005 C   0  0  0

+   -2.2220   -0.9587   -0.0035 C   0  0  0

+   -3.1489    1.2323    0.0023 O   0  0  0

+    2.6412    2.3305    0.0000 H   0  0  0

+    1.5368    3.2977    0.0000 H   0  0  0

+    0.5696    2.1933    0.0000 H   0  0  0

+    1.9163   -0.6089    0.0000 H   0  0  0

+    3.3432   -0.2634    0.0000 H   0  0  0

+    2.9977    1.1635    0.0000 H   0  0  0

+    1.9193   -0.6139    0.0000 H   0  0  0

+    3.3473   -0.2727    0.0000 H   0  0  0

+    3.0060    1.1553    0.0000 H   0  0  0

+   -0.6632    1.9974    0.0000 H   0  0  0

+   -1.2372   -2.8158    0.0000 H   0  0  0

+    2.0808   -2.6715    0.0000 H   0  0  0

+   -3.1758   -1.3686    0.0000 H   0  0  0

+   -3.9808    1.8533    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  6  9  1  0

+  7 10  2  0

+  8 11  2  0

+ 10 12  1  0

+ 10 11  1  0

+  3 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  4 18  1  0

+  5 19  1  0

+  5 20  1  0

+  5 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-44-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.1158    0.0017   -0.4904 C   0  0  0

+    0.7660   -1.1962   -0.2612 C   0  0  0

+    0.7686    1.1981   -0.2579 C   0  0  0

+   -1.3025    0.0038   -0.9997 C   0  0  0

+    2.0691   -1.1982    0.2006 C   0  0  0

+    2.0713    1.1961    0.2037 C   0  0  0

+   -2.4426   -0.0011    0.3970 Cl  0  0  0

+    2.7217   -0.0022    0.4330 C   0  0  0

+    0.2427   -2.0741    0.0000 H   0  0  0

+    0.2476    2.0774    0.0000 H   0  0  0

+   -0.7919    0.8891    0.0000 H   0  0  0

+   -1.8156    0.8877    0.0000 H   0  0  0

+    2.5901   -2.0775    0.0000 H   0  0  0

+    2.5946    2.0740    0.0000 H   0  0  0

+    3.7437   -0.0033    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  6  8  1  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92180-79-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.8597   -0.3377   -0.0016 C   0  0  0

+   -0.5926   -0.1797   -0.0008 C   0  0  0

+    1.6598    0.8079   -0.0012 C   0  0  0

+    1.6852   -1.4091    0.0027 N   0  0  0

+   -1.1349    1.1297    0.0003 C   0  0  0

+   -1.4070   -1.2339   -0.0015 N   0  0  0

+    1.0769    2.0776   -0.0001 C   0  0  0

+    2.9698    0.3606   -0.0017 N   0  0  0

+    2.9321   -1.0024   -0.0001 C   0  0  0

+   -0.2702    2.2407    0.0011 C   0  0  0

+   -2.4623    1.2900    0.0011 N   0  0  0

+   -2.7100   -1.0514   -0.0012 C   0  0  0

+    4.1730    1.1964   -0.0015 C   0  0  0

+    4.0374   -1.8281    0.0029 N   0  0  0

+   -3.2467    0.2350    0.0008 C   0  0  0

+   -3.6308   -2.2444   -0.0020 C   0  0  0

+   -4.7425    0.4185    0.0021 C   0  0  0

+    1.6889    2.9162    0.0000 H   0  0  0

+   -0.6692    3.1992    0.0000 H   0  0  0

+    4.7653    0.3437    0.0000 H   0  0  0

+    5.0257    1.7887    0.0000 H   0  0  0

+    3.5807    2.0491    0.0000 H   0  0  0

+    3.9152   -2.8591    0.0000 H   0  0  0

+    4.9914   -1.4185    0.0000 H   0  0  0

+   -4.4527   -1.6101    0.0000 H   0  0  0

+   -4.2651   -3.0663    0.0000 H   0  0  0

+   -2.8089   -2.8787    0.0000 H   0  0  0

+   -4.6161    1.4490    0.0000 H   0  0  0

+   -5.7730    0.5449    0.0000 H   0  0  0

+   -4.8689   -0.6120    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 15 17  1  0

+  7 10  2  0

+  8  9  1  0

+ 12 15  1  0

+  7 18  1  0

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+ 14 23  1  0

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+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3626-28-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 78 81                          1 V2000

+   -5.2793    0.5925   -0.0002 C   0  0  0

+   -5.7894    0.2289    1.2710 C   0  0  0

+   -3.9327    0.3164   -0.3138 C   0  0  0

+   -6.1213    1.2291   -0.9300 C   0  0  0

+   -4.9472   -0.4026    2.2055 C   0  0  0

+   -7.1330    0.5033    1.5868 C   0  0  0

+   -3.1241   -0.3132    0.6393 C   0  0  0

+   -3.4168    0.6634   -1.5498 N   0  0  0

+   -7.4484    1.4921   -0.5824 C   0  0  0

+   -5.6498    1.5840   -2.1498 O   0  0  0

+   -3.6522   -0.6643    1.8955 C   0  0  0

+   -7.9390    1.1130    0.6807 C   0  0  0

+   -1.8232   -0.5862    0.3506 N   0  0  0

+   -8.2737    2.1078   -1.4736 N   0  0  0

+   -2.6176   -1.4552    3.0823 S   0  0  0

+   -9.6183    1.4466    1.0969 S   0  0  0

+   -1.3359   -1.7520    0.6104 N   0  0  0

+   -8.9950    3.1096   -1.0991 N   0  0  0

+   -2.7562   -2.8497    2.8470 O   0  0  0

+   -1.3920   -0.7362    3.0663 O   0  0  0

+   -3.2259   -1.2050    4.4549 O   0  0  0

+   -9.6208    2.7404    1.6844 O   0  0  0

+  -10.3817    1.0564   -0.0364 O   0  0  0

+  -10.0106    0.4860    2.2104 O   0  0  0

+   -0.0303   -2.0261    0.3206 C   0  0  0

+   -9.8234    3.7278   -1.9938 C   0  0  0

+    0.4990   -3.2902    0.6020 C   0  0  0

+    0.7783   -1.0449   -0.2633 C   0  0  0

+  -10.6062    4.8132   -1.5917 C   0  0  0

+   -9.8873    3.2808   -3.3165 C   0  0  0

+    1.8049   -3.5657    0.3127 C   0  0  0

+    2.0940   -1.3254   -0.5538 C   0  0  0

+  -11.4398    5.4319   -2.5000 C   0  0  0

+  -10.7253    3.9092   -4.2133 C   0  0  0

+    2.6169   -2.5875   -0.2648 C   0  0  0

+  -11.5020    4.9802   -3.8063 C   0  0  0

+    4.0326   -2.8907   -0.5764 C   0  0  0

+    4.6040   -2.4150   -1.7583 C   0  0  0

+    4.7964   -3.6471    0.3149 C   0  0  0

+    5.9198   -2.6975   -2.0466 C   0  0  0

+    6.1022   -3.9290    0.0315 C   0  0  0

+    6.6798   -3.4606   -1.1535 C   0  0  0

+    7.9853   -3.7431   -1.4356 N   0  0  0

+    8.6855   -4.4467   -0.6117 N   0  0  0

+    9.9906   -4.7292   -0.8937 C   0  0  0

+   10.7520   -5.4921   -0.0017 C   0  0  0

+   10.5696   -4.2617   -2.0780 C   0  0  0

+   12.0682   -5.7748   -0.2909 C   0  0  0

+   11.8869   -4.5498   -2.3583 C   0  0  0

+   12.6406   -5.3035   -1.4667 C   0  0  0

+   13.9390   -5.5849   -1.7474 O   0  0  0

+   20.6149    8.6932    1.4122 Na  0  3  0

+   27.1019   14.3989    0.8091 Na  0  3  0

+   -5.3304   -1.2574    0.0000 H   0  0  0

+   -7.5188   -0.3503    0.0000 H   0  0  0

+   -2.5754    0.2517    0.0000 H   0  0  0

+   -3.4809    1.5980    0.0000 H   0  0  0

+   -4.9014    2.1473    0.0000 H   0  0  0

+   -0.0981   -4.0120    0.0000 H   0  0  0

+    0.4697   -0.1605    0.0000 H   0  0  0

+   -9.9393    5.4710    0.0000 H   0  0  0

+   -9.5288    2.4154    0.0000 H   0  0  0

+    2.1129   -4.4504    0.0000 H   0  0  0

+    2.6932   -0.6053    0.0000 H   0  0  0

+  -11.8026    6.2955    0.0000 H   0  0  0

+  -11.3930    3.2521    0.0000 H   0  0  0

+  -12.4107    4.7527    0.0000 H   0  0  0

+    4.3801   -1.5054    0.0000 H   0  0  0

+    4.3501   -4.4707    0.0000 H   0  0  0

+    6.3685   -1.8752    0.0000 H   0  0  0

+    6.3197   -4.8401    0.0000 H   0  0  0

+   10.3037   -6.3146    0.0000 H   0  0  0

+   10.3542   -3.3500    0.0000 H   0  0  0

+   12.2896   -6.6850    0.0000 H   0  0  0

+   12.3363   -3.7279    0.0000 H   0  0  0

+   14.8545   -5.7833    0.0000 H   0  0  0

+   -4.0922   -0.8487    0.0000 H   0  0  0

+  -10.3648   -0.3812    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  2  0

+  3  8  1  0

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+ 33 36  2  0

+ 35 37  1  0

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+ 50 51  1  0

+  7 11  1  0

+  9 12  1  0

+ 32 35  2  0

+ 34 36  1  0

+ 41 42  1  0

+ 49 50  2  0

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+ 27 59  1  0

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+ 47 73  1  0

+ 48 74  1  0

+ 49 75  1  0

+ 51 76  1  0

+ 21 77  1  0

+ 24 78  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3385-21-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.2751    0.9775   -0.7209 C   0  0  0

+   -1.2102    0.7081   -0.4720 C   0  0  0

+    1.1129    0.1802    0.2808 C   0  0  0

+   -1.4936   -0.7854   -0.6449 C   0  0  0

+   -1.5599    1.1178    0.8947 N   0  0  0

+    0.8295   -1.3134    0.1078 C   0  0  0

+    2.5391    0.4388    0.0418 N   0  0  0

+   -0.6559   -1.5828    0.3568 C   0  0  0

+    1.1910    1.6040    0.0000 H   0  0  0

+   -0.1464    2.0039    0.0000 H   0  0  0

+   -2.2827    0.4234    0.0000 H   0  0  0

+    1.4309    1.2433    0.0000 H   0  0  0

+   -2.5246   -0.3753    0.0000 H   0  0  0

+   -2.0921   -1.7198    0.0000 H   0  0  0

+   -1.1892    2.1637    0.0000 H   0  0  0

+   -2.6510    0.9159    0.0000 H   0  0  0

+    0.8928   -2.4212    0.0000 H   0  0  0

+    1.9368   -1.3857    0.0000 H   0  0  0

+    3.2565   -0.4078    0.0000 H   0  0  0

+    2.9136    1.4833    0.0000 H   0  0  0

+   -1.5718   -2.2092    0.0000 H   0  0  0

+   -0.2344   -2.6093    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  8  1  0

+  1  9  1  0

+  1 10  1  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51483-40-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.0000    0.3290    0.0331 C   0  0  0

+   -1.2492    0.9111    0.6976 C   0  0  0

+    1.2492    0.9111    0.6976 C   0  0  0

+    0.0000   -1.4642    0.2203 Cl  0  0  0

+   -2.8545    0.1631   -0.1562 Br  0  0  0

+    2.8545    0.1631   -0.1562 Br  0  0  0

+    0.0000    1.6573    0.0000 H   0  0  0

+   -0.4255    1.9531    0.0000 H   0  0  0

+   -2.0729    1.9531    0.0000 H   0  0  0

+    2.0729    1.9531    0.0000 H   0  0  0

+    0.4255    1.9531    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94-25-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    1.0985    0.3573   -0.0006 C   0  0  0

+   -0.2840    0.8681    0.0000 C   0  0  0

+    2.1754    1.2496    0.0001 C   0  0  0

+    1.3364   -1.0209    0.0041 C   0  0  0

+   -1.3205    0.0070   -0.0006 O   0  0  0

+   -0.4891    2.0659    0.0011 O   0  0  0

+    3.4642    0.7664   -0.0006 C   0  0  0

+    2.6177   -1.4937    0.0035 C   0  0  0

+   -2.6825    0.5102    0.0000 C   0  0  0

+    3.6915   -0.6073   -0.0018 C   0  0  0

+   -3.6608   -0.6661   -0.0008 C   0  0  0

+    4.9933   -1.0949   -0.0029 N   0  0  0

+   -5.0960   -0.1358   -0.0002 C   0  0  0

+   -6.0743   -1.3121   -0.0011 C   0  0  0

+    2.0018    2.2817    0.0000 H   0  0  0

+    0.5320   -1.6904    0.0000 H   0  0  0

+    4.2727    1.4310    0.0000 H   0  0  0

+    2.7930   -2.5255    0.0000 H   0  0  0

+   -2.2111    1.4446    0.0000 H   0  0  0

+   -3.5577    1.0842    0.0000 H   0  0  0

+   -4.1322   -1.6005    0.0000 H   0  0  0

+   -2.7856   -1.2401    0.0000 H   0  0  0

+    5.1654   -2.1272    0.0000 H   0  0  0

+    5.8013   -0.4297    0.0000 H   0  0  0

+   -4.6246    0.7986    0.0000 H   0  0  0

+   -5.9712    0.4382    0.0000 H   0  0  0

+   -6.8790   -0.6429    0.0000 H   0  0  0

+   -6.7435   -2.1168    0.0000 H   0  0  0

+   -5.2696   -1.9813    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  7 10  2  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 13 14  1  0

+  8 10  1  0

+  3 15  1  0

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+  8 18  1  0

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+  9 20  1  0

+ 11 21  1  0

+ 11 22  1  0

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+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99217-04-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.6732    0.0823    0.1454 C   0  0  0

+   -1.9028    0.5084    0.0501 C   0  0  0

+    0.4284    1.0371    0.3703 C   0  0  0

+   -0.3672   -1.3555    0.0364 C   0  0  0

+   -2.2011    1.9483    0.1664 C   0  0  0

+   -3.0095   -0.4390   -0.1741 C   0  0  0

+    1.7941    0.4930    0.4695 C   0  0  0

+    0.1683    2.3185    0.4743 C   0  0  0

+    0.8801   -1.7510    0.1374 C   0  0  0

+   -1.4683   -2.3082   -0.1831 C   0  0  0

+   -1.2248    2.8013    0.3663 C   0  0  0

+   -3.6094    2.3655    0.0505 C   0  0  0

+   -2.7105   -1.8762   -0.2907 C   0  0  0

+   -4.2349    0.0222   -0.2648 C   0  0  0

+    1.9813   -0.8046    0.3559 C   0  0  0

+    2.8525    1.3250    0.6763 O   0  0  0

+    1.1602   -3.0730    0.0371 N   0  3  0

+   -4.5377    1.4545   -0.1496 C   0  0  0

+    3.4453    1.9286   -0.3658 C   0  0  0

+    1.7457   -3.6418    0.9411 O   0  0  0

+    0.8265   -3.6925   -0.9571 O   0  5  0

+    4.6829    2.7611   -0.1502 C   0  0  0

+    2.9867    1.8045   -1.4767 O   0  0  0

+    0.9297    2.9846    0.0000 H   0  0  0

+   -1.2780   -3.3017    0.0000 H   0  0  0

+   -1.4181    3.7943    0.0000 H   0  0  0

+   -3.8538    3.3471    0.0000 H   0  0  0

+   -3.4706   -2.5437    0.0000 H   0  0  0

+   -5.0023   -0.6369    0.0000 H   0  0  0

+    2.9285   -1.1598    0.0000 H   0  0  0

+   -5.5061    1.7469    0.0000 H   0  0  0

+    5.2475    1.9217    0.0000 H   0  0  0

+    5.5223    3.3257    0.0000 H   0  0  0

+    4.1183    3.6005    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  4 10  1  0

+  5 11  2  0

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+ 14 29  1  0

+ 15 30  1  0

+ 18 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96287-03-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.3552   -0.7936   -0.0007 C   0  0  0

+   -1.0263   -0.7810   -0.0005 N   0  0  0

+    0.7589    0.5555    0.0001 C   0  0  0

+    1.2559   -1.7635    0.0033 N   0  0  0

+   -1.4234    0.5329    0.0004 C   0  0  0

+   -1.9524   -1.7840   -0.0014 C   0  0  0

+   -0.3528    1.3136    0.0008 N   0  0  0

+    2.1284    0.8544   -0.0003 C   0  0  0

+    2.5469   -1.5093    0.0020 C   0  0  0

+   -2.8015    0.8408    0.0004 C   0  0  0

+   -3.2722   -1.5031   -0.0015 C   0  0  0

+    3.0273   -0.2008   -0.0015 C   0  0  0

+    2.6099    2.2824    0.0001 C   0  0  0

+   -3.7118   -0.1688   -0.0005 C   0  0  0

+   -3.2592    2.2767    0.0009 C   0  0  0

+    4.4043    0.0453   -0.0020 N   0  0  0

+   -1.6380   -2.7731    0.0000 H   0  0  0

+    3.2208   -2.2986    0.0000 H   0  0  0

+   -3.9652   -2.2757    0.0000 H   0  0  0

+    3.5934    1.9508    0.0000 H   0  0  0

+    2.9415    3.2659    0.0000 H   0  0  0

+    1.6264    2.6140    0.0000 H   0  0  0

+   -4.7274    0.0453    0.0000 H   0  0  0

+   -2.2703    2.5919    0.0000 H   0  0  0

+   -3.5744    3.2656    0.0000 H   0  0  0

+   -4.2481    1.9615    0.0000 H   0  0  0

+    5.0733   -0.7482    0.0000 H   0  0  0

+    4.7570    1.0214    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+482-89-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.6884   -0.0071   -0.0023 C   0  0  0

+   -0.6884    0.0071   -0.0022 C   0  0  0

+    1.5768    1.1752   -0.0023 C   0  0  0

+    1.4942   -1.1271    0.0038 N   0  0  0

+   -1.5768   -1.1752   -0.0022 C   0  0  0

+   -1.4942    1.1271    0.0037 N   0  0  0

+    2.9469    0.6300   -0.0023 C   0  0  0

+    1.2478    2.3467   -0.0023 O   0  0  0

+    2.8331   -0.7689    0.0018 C   0  0  0

+   -2.9469   -0.6300   -0.0022 C   0  0  0

+   -1.2478   -2.3467   -0.0025 O   0  0  0

+   -2.8331    0.7689    0.0017 C   0  0  0

+    4.2061    1.2322   -0.0023 C   0  0  0

+    3.9913   -1.5415    0.0059 C   0  0  0

+   -4.2061   -1.2322   -0.0022 C   0  0  0

+   -3.9913    1.5415    0.0058 C   0  0  0

+    5.3395    0.4479   -0.0022 C   0  0  0

+    5.2298   -0.9341    0.0024 C   0  0  0

+   -5.3394   -0.4479   -0.0022 C   0  0  0

+   -5.2298    0.9341    0.0024 C   0  0  0

+    1.1447   -2.1063    0.0000 H   0  0  0

+   -1.1447    2.1063    0.0000 H   0  0  0

+    4.2888    2.2687    0.0000 H   0  0  0

+    3.9226   -2.5790    0.0000 H   0  0  0

+   -4.2888   -2.2687    0.0000 H   0  0  0

+   -3.9226    2.5790    0.0000 H   0  0  0

+    6.2788    0.8937    0.0000 H   0  0  0

+    6.0897   -1.5186    0.0000 H   0  0  0

+   -6.2787   -0.8937    0.0000 H   0  0  0

+   -6.0897    1.5186    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3319-31-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 93 93                          1 V2000

+   -0.4081    0.6590   -0.7246 C   0  0  0

+   -0.6184   -0.7236   -0.5650 C   0  0  0

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+   -1.5430    1.5499   -1.0469 C   0  0  0

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+    1.9401    0.3365   -0.2851 C   0  0  0

+   -1.8948    2.5290   -0.1912 O   0  0  0

+   -2.1582    1.3991   -2.0831 O   0  0  0

+    1.7244   -1.0339   -0.1281 C   0  0  0

+   -2.1953   -2.5955   -0.4701 O   0  0  0

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+   -3.5295   -3.1496   -0.6153 C   0  0  0

+    4.3348    0.0748    0.1531 O   0  0  0

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+   -3.1966    4.4201    0.6207 C   0  0  0

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+  1  2  2  0

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+ 39 92  1  0

+ 39 93  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    2.1637    0.0002    0.3060 C   0  0  0

+    2.8850   -1.2493   -0.2033 C   0  0  0

+    2.8850    1.2491   -0.2046 C   0  0  0

+    0.7212   -0.0001   -0.2040 C   0  0  0

+    0.0000   -1.2491    0.3066 C   0  0  0

+    0.0000    1.2494    0.3054 C   0  0  0

+   -1.4425   -1.2493   -0.2034 C   0  0  0

+   -1.4425    1.2491   -0.2046 C   0  0  0

+   -2.1637    0.0001    0.3060 C   0  0  0

+   -3.6062   -0.0001   -0.2041 C   0  0  0

+    1.6227    0.9371    0.0000 H   0  0  0

+    1.9480   -1.7902    0.0000 H   0  0  0

+    3.4259   -2.1863    0.0000 H   0  0  0

+    3.8220   -0.7084    0.0000 H   0  0  0

+    3.8219    0.7080    0.0000 H   0  0  0

+    3.4261    2.1860    0.0000 H   0  0  0

+    1.9481    1.7902    0.0000 H   0  0  0

+    1.2622   -0.9370    0.0000 H   0  0  0

+   -0.1878   -2.3146    0.0000 H   0  0  0

+    1.0166   -1.6191    0.0000 H   0  0  0

+    1.0166    1.6194    0.0000 H   0  0  0

+   -0.1880    2.3148    0.0000 H   0  0  0

+   -2.4591   -1.6193    0.0000 H   0  0  0

+   -1.2546   -2.3147    0.0000 H   0  0  0

+   -1.2548    2.3146    0.0000 H   0  0  0

+   -2.4591    1.6191    0.0000 H   0  0  0

+   -2.7047    0.9370    0.0000 H   0  0  0

+   -3.6063    1.0818    0.0000 H   0  0  0

+   -4.6881   -0.0003    0.0000 H   0  0  0

+   -3.6061   -1.0820    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  4  1  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

+  9  7  1  0

+ 10  9  1  0

+  8  9  1  0

+  1 11  1  0

+  2 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  5 20  1  0

+  6 21  1  0

+  6 22  1  0

+  7 23  1  0

+  7 24  1  0

+  8 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2564-65-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -0.5683    0.0381    0.1386 C   0  0  0

+    0.0574   -1.2852    0.1598 C   0  0  0

+    0.2100    1.1834    0.1529 C   0  0  0

+   -2.0358    0.1228    0.1082 C   0  0  0

+    1.4422   -1.4021    0.1950 C   0  0  0

+   -0.7906   -2.4761    0.1439 C   0  0  0

+    1.6034    1.0720    0.1877 C   0  0  0

+   -0.4412    2.5422    0.1304 C   0  0  0

+   -2.7949   -1.0660    0.1003 C   0  0  0

+   -2.6830    1.3593    0.0877 C   0  0  0

+    2.2327   -0.2503    0.2101 C   0  0  0

+    2.0872   -2.7639    0.2173 C   0  0  0

+   -2.1321   -2.3663    0.1103 C   0  0  0

+    2.4264    2.2157    0.2032 C   0  0  0

+   -0.3345    3.0999   -1.1810 O   0  0  0

+   -4.1942   -0.9832    0.0713 C   0  0  0

+   -4.0584    1.4078    0.0598 C   0  0  0

+    3.6398   -0.3308    0.2453 C   0  0  0

+    2.3248   -3.2004   -1.1225 O   0  0  0

+    3.7769    2.0692    0.2373 C   0  0  0

+   -4.8052    0.2366    0.0512 C   0  0  0

+    4.3762    0.8109    0.2586 C   0  0  0

+   -0.3489   -3.4262    0.0000 H   0  0  0

+   -1.3603    3.0451    0.0000 H   0  0  0

+   -1.2017    1.8215    0.0000 H   0  0  0

+   -2.1248    2.2459    0.0000 H   0  0  0

+    1.0415   -2.6984    0.0000 H   0  0  0

+    1.5241   -3.6474    0.0000 H   0  0  0

+   -2.7155   -3.2366    0.0000 H   0  0  0

+    1.9997    3.1726    0.0000 H   0  0  0

+   -0.1376    4.1290    0.0000 H   0  0  0

+   -4.7708   -1.8580    0.0000 H   0  0  0

+   -4.5459    2.3352    0.0000 H   0  0  0

+    4.1147   -1.2647    0.0000 H   0  0  0

+    2.8257   -4.1206    0.0000 H   0  0  0

+    4.3833    2.9236    0.0000 H   0  0  0

+   -5.8515    0.2907    0.0000 H   0  0  0

+    5.4218    0.7437    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

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+ 10 17  2  0

+ 11 18  1  0

+ 12 19  1  0

+ 14 20  2  0

+ 16 21  2  0

+ 18 22  2  0

+  7 11  2  0

+  9 13  1  0

+ 17 21  1  0

+ 20 22  1  0

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+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4106-66-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    0.3342   -0.5672   -0.0008 C   0  0  0

+   -1.1405   -0.5163   -0.0004 C   0  0  0

+    0.7598    0.7693    0.0001 C   0  0  0

+    1.2644   -1.6016    0.0031 C   0  0  0

+   -1.4735    0.8453    0.0007 C   0  0  0

+   -2.1409   -1.4825   -0.0013 C   0  0  0

+   -0.3310    1.5671    0.0010 O   0  0  0

+    2.1197    1.0484   -0.0001 C   0  0  0

+    2.6116   -1.3122    0.0013 C   0  0  0

+   -2.8130    1.2152    0.0007 C   0  0  0

+   -3.4649   -1.0963   -0.0010 C   0  0  0

+    3.0404    0.0123   -0.0011 C   0  0  0

+   -3.7971    0.2491   -0.0005 C   0  0  0

+    4.4070    0.2989   -0.0017 N   0  0  0

+    0.9433   -2.5926    0.0000 H   0  0  0

+   -1.8912   -2.4938    0.0000 H   0  0  0

+    2.4483    2.0369    0.0000 H   0  0  0

+    3.3099   -2.0852    0.0000 H   0  0  0

+   -3.0741    2.2236    0.0000 H   0  0  0

+   -4.2167   -1.8174    0.0000 H   0  0  0

+   -4.7993    0.5333    0.0000 H   0  0  0

+    5.1019   -0.4771    0.0000 H   0  0  0

+    4.7316    1.2887    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

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+ 12 14  1  0

+  5  7  1  0

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+ 11 13  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6111-78-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.4650    0.0647   -0.0025 C   0  0  0

+   -1.8742   -0.3544   -0.0019 C   0  0  0

+   -0.1592    1.4964    0.0003 C   0  0  0

+    0.5554   -0.8715    0.0001 C   0  0  0

+   -2.8858    0.6287    0.0013 C   0  0  0

+   -2.2209   -1.7065   -0.0041 C   0  0  0

+    1.1623    1.9279    0.0003 C   0  0  0

+   -1.2579    2.4609    0.0036 C   0  0  0

+    1.8865   -0.4434   -0.0006 C   0  0  0

+   -2.5388    2.0463    0.0036 C   0  0  0

+   -4.2291    0.2271    0.0019 C   0  0  0

+   -3.5488   -2.0692   -0.0030 C   0  0  0

+    2.1960    0.9882   -0.0024 C   0  0  0

+    2.9500   -1.3678    0.0026 C   0  0  0

+   -4.5443   -1.1005   -0.0006 C   0  0  0

+    3.5476    1.3894   -0.0025 C   0  0  0

+    4.2314   -0.9152    0.0024 C   0  0  0

+    2.6684   -2.8482    0.0067 C   0  0  0

+    4.5264    0.4471   -0.0051 C   0  0  0

+    0.3311   -1.8954    0.0000 H   0  0  0

+   -1.4739   -2.4419    0.0000 H   0  0  0

+    1.3819    2.9528    0.0000 H   0  0  0

+   -1.0458    3.4874    0.0000 H   0  0  0

+   -3.3065    2.7600    0.0000 H   0  0  0

+   -4.9913    0.9467    0.0000 H   0  0  0

+   -3.8107   -3.0842    0.0000 H   0  0  0

+   -5.5508   -1.3932    0.0000 H   0  0  0

+    3.7957    2.4078    0.0000 H   0  0  0

+    5.0179   -1.6082    0.0000 H   0  0  0

+    1.6387   -2.6523    0.0000 H   0  0  0

+    2.4725   -3.8779    0.0000 H   0  0  0

+    3.6981   -3.0441    0.0000 H   0  0  0

+    5.5292    0.7524    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+  8 10  2  0

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+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-76-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.0000   -0.3467    0.0000 C   0  0  0

+   -1.2492    0.5367    0.0000 C   0  0  0

+    1.2492    0.5367    0.0000 C   0  0  0

+   -2.4487   -0.3115    0.0000 N   0  0  0

+    2.4487   -0.3115    0.0000 N   0  0  0

+   -0.7490   -1.1857    0.0000 H   0  0  0

+    0.7490   -1.1857    0.0000 H   0  0  0

+   -0.5002    1.3757    0.0000 H   0  0  0

+   -1.9982    1.3757    0.0000 H   0  0  0

+    1.9982    1.3757    0.0000 H   0  0  0

+    0.5002    1.3757    0.0000 H   0  0  0

+   -3.4702    0.1591    0.0000 H   0  0  0

+   -2.3455   -1.4314    0.0000 H   0  0  0

+    2.3455   -1.4314    0.0000 H   0  0  0

+    3.4702    0.1591    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

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+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-54-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.0434   -2.5921    0.0048 O   0  0  0

+   -0.1555   -1.3823    0.0046 C   0  0  0

+    1.0500   -0.5272    0.0013 C   0  0  0

+   -1.4978   -0.7634    0.0015 C   0  0  0

+    0.9201    0.8730    0.0012 C   0  0  0

+    2.3180   -1.1014   -0.0006 C   0  0  0

+   -1.6276    0.6368    0.0014 C   0  0  0

+   -2.6386   -1.5610   -0.0017 C   0  0  0

+   -0.4220    1.4919    0.0037 C   0  0  0

+    2.0604    1.6713   -0.0010 C   0  0  0

+    3.4414   -0.2930   -0.0027 C   0  0  0

+   -2.8952    1.2118   -0.0020 C   0  0  0

+   -3.8914   -0.9730   -0.0050 C   0  0  0

+   -0.5342    2.7017    0.0039 O   0  0  0

+    3.3136    1.0839   -0.0029 C   0  0  0

+    4.8129   -0.9175   -0.0043 C   0  0  0

+   -4.0190    0.4040   -0.0052 C   0  0  0

+    2.4215   -2.1402    0.0000 H   0  0  0

+   -2.5493   -2.6011    0.0000 H   0  0  0

+    1.9705    2.7114    0.0000 H   0  0  0

+   -2.9981    2.2507    0.0000 H   0  0  0

+   -4.7458   -1.5729    0.0000 H   0  0  0

+    4.1678    1.6841    0.0000 H   0  0  0

+    4.3803   -1.8676    0.0000 H   0  0  0

+    5.7630   -1.3501    0.0000 H   0  0  0

+    5.2455    0.0326    0.0000 H   0  0  0

+   -4.9690    0.8369    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

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+  7  4  2  0

+  8  4  1  0

+  9  5  1  0

+ 10  5  1  0

+ 11  6  2  0

+ 12  7  1  0

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+ 15 10  2  0

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+  7  9  1  0

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+ 10 20  1  0

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+ 13 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93-45-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -2.4565   -0.1817   -0.5762 C   0  0  0

+   -2.8975    0.2828    0.6888 C   0  0  0

+   -1.1962    0.2104   -1.0542 C   0  0  0

+   -3.2927   -1.0225   -1.3318 C   0  0  0

+   -2.0673    1.1282    1.4452 C   0  0  0

+   -4.1599   -0.1112    1.1643 C   0  0  0

+   -0.4075    1.0403   -0.2871 C   0  0  0

+   -4.5108   -1.3786   -0.8407 C   0  0  0

+   -0.8511    1.4940    0.9610 C   0  0  0

+   -4.9400   -0.9303    0.4073 C   0  0  0

+    0.8467    1.4324   -0.7591 N   0  0  0

+    1.9852    0.6934   -0.4181 C   0  0  0

+    3.2472    1.1669   -0.7534 C   0  0  0

+    1.8541   -0.5109    0.2607 C   0  0  0

+    4.3699    0.4371   -0.4166 C   0  0  0

+    2.9783   -1.2395    0.5968 C   0  0  0

+    4.2377   -0.7687    0.2565 C   0  0  0

+    5.3440   -1.4869    0.5878 O   0  0  0

+   -0.6935   -0.5982    0.0000 H   0  0  0

+   -2.8062   -1.8410    0.0000 H   0  0  0

+   -2.5595    1.9433    0.0000 H   0  0  0

+   -4.6626    0.6975    0.0000 H   0  0  0

+   -4.7568   -2.2984    0.0000 H   0  0  0

+   -0.6135    2.4160    0.0000 H   0  0  0

+   -5.8922   -0.9315    0.0000 H   0  0  0

+    0.9761    2.3757    0.0000 H   0  0  0

+    3.3505    2.1134    0.0000 H   0  0  0

+    0.9941   -0.9196    0.0000 H   0  0  0

+    5.2303    0.8449    0.0000 H   0  0  0

+    2.8751   -2.1860    0.0000 H   0  0  0

+    6.1426   -2.0054    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

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+  7  9  2  0

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+ 16 17  2  0

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+ 11 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64188-65-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 46                          1 V2000

+   -0.2148    1.0550    0.7353 C   0  0  0

+   -0.5475   -0.4446    0.7583 C   0  0  0

+   -0.8744    0.3971   -0.4005 N   0  0  0

+    1.1822    1.4638    0.3330 C   0  0  0

+    0.5427   -1.4174    0.3764 C   0  0  0

+   -2.3049    0.7160   -0.3005 C   0  0  0

+    2.1238    0.4976   -0.0027 C   0  0  0

+    1.5173    2.8027    0.3015 C   0  0  0

+    1.8021   -0.9502    0.0180 C   0  0  0

+    0.2796   -2.7726    0.3853 C   0  0  0

+   -3.0563    0.0583   -1.4596 C   0  0  0

+   -2.8533    0.1890    1.0271 C   0  0  0

+    3.4111    0.8975   -0.3720 C   0  0  0

+    2.7932    3.1905   -0.0649 C   0  0  0

+    2.7967   -1.8675   -0.3322 C   0  0  0

+    1.2691   -3.6741    0.0375 C   0  0  0

+   -4.5461    0.3905   -1.3555 C   0  0  0

+   -4.3431    0.5212    1.1313 C   0  0  0

+    3.7373    2.2366   -0.4007 C   0  0  0

+    2.5255   -3.2191   -0.3208 C   0  0  0

+   -5.0945   -0.1365   -0.0279 C   0  0  0

+   -0.7302    1.9258    0.0000 H   0  0  0

+   -1.3790   -1.0212    0.0000 H   0  0  0

+   -2.5551    1.6964    0.0000 H   0  0  0

+    0.7842    3.5001    0.0000 H   0  0  0

+   -0.6809   -3.0910    0.0000 H   0  0  0

+   -3.4783   -0.8614    0.0000 H   0  0  0

+   -2.2453   -0.5468    0.0000 H   0  0  0

+   -3.2610   -0.7371    0.0000 H   0  0  0

+   -2.0239   -0.3907    0.0000 H   0  0  0

+    4.1485    0.2046    0.0000 H   0  0  0

+    3.0413    4.1715    0.0000 H   0  0  0

+    3.7591   -1.5551    0.0000 H   0  0  0

+    1.0723   -4.6666    0.0000 H   0  0  0

+   -4.1384    1.3166    0.0000 H   0  0  0

+   -5.3755    0.9702    0.0000 H   0  0  0

+   -3.9211    1.4409    0.0000 H   0  0  0

+   -5.1541    1.1263    0.0000 H   0  0  0

+    4.7123    2.5071    0.0000 H   0  0  0

+    3.2924   -3.8792    0.0000 H   0  0  0

+   -6.0620    0.1598    0.0000 H   0  0  0

+   -4.8827   -1.1259    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  2  0

+ 11 17  1  0

+ 12 18  1  0

+ 13 19  2  0

+ 15 20  2  0

+ 17 21  1  0

+  2  3  1  0

+  7  9  1  0

+ 14 19  1  0

+ 16 20  1  0

+ 18 21  1  0

+  1 22  1  0

+  2 23  1  0

+  6 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 14 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+ 21 41  1  0

+ 21 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+149-57-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.6910   -0.5433   -0.2267 C   0  0  0

+   -0.6465   -0.8692    0.4410 C   0  0  0

+    1.0739    0.8806    0.0845 C   0  0  0

+    1.7700   -1.4892    0.3043 C   0  0  0

+   -1.7781   -0.1721   -0.3168 C   0  0  0

+    1.2254    1.7678   -0.9114 O   0  0  0

+    1.2446    1.2237    1.2303 O   0  0  0

+    2.9617   -1.4934   -0.6552 C   0  0  0

+   -3.1156   -0.4980    0.3509 C   0  0  0

+   -4.2472    0.1992   -0.4069 C   0  0  0

+    0.4537   -1.5115    0.0000 H   0  0  0

+   -1.3699   -1.5551    0.0000 H   0  0  0

+   -0.1696   -1.7445    0.0000 H   0  0  0

+    0.9287   -2.0239    0.0000 H   0  0  0

+    2.0468   -2.4469    0.0000 H   0  0  0

+   -1.0547    0.5138    0.0000 H   0  0  0

+   -2.2550    0.7032    0.0000 H   0  0  0

+    1.3932    2.7504    0.0000 H   0  0  0

+    2.9582   -2.4902    0.0000 H   0  0  0

+    3.9585   -1.4969    0.0000 H   0  0  0

+    2.9652   -0.4966    0.0000 H   0  0  0

+   -3.8390   -1.1838    0.0000 H   0  0  0

+   -2.6387   -1.3734    0.0000 H   0  0  0

+   -3.7243    1.0479    0.0000 H   0  0  0

+   -5.0959    0.7221    0.0000 H   0  0  0

+   -4.7701   -0.6495    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+  1 11  1  0

+  2 12  1  0

+  2 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+760-23-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+   -0.6195    0.2592   -0.1910 C   0  0  0

+   -1.9425    0.7083    0.3739 C   0  0  0

+    0.5175    0.9665    0.5491 C   0  0  0

+   -0.4527   -1.5242    0.0145 Cl  0  0  0

+   -2.8189    1.2985   -0.4005 C   0  0  0

+    2.1003    0.4291   -0.1268 Cl  0  0  0

+   -0.7393    1.3002    0.0000 H   0  0  0

+   -2.4077   -0.2307    0.0000 H   0  0  0

+    1.0708    1.8564    0.0000 H   0  0  0

+   -0.2235    1.7074    0.0000 H   0  0  0

+   -2.7466    2.3439    0.0000 H   0  0  0

+   -3.7604    0.8385    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+134-29-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -2.6789   -0.5223    0.0597 C   0  0  0

+   -3.5865    0.4459   -0.3656 C   0  0  0

+   -1.4758   -0.1370    0.6267 C   0  0  0

+   -2.9764   -1.8424   -0.0767 O   0  0  0

+   -3.2800    1.7905   -0.2187 C   0  0  0

+   -4.8039    0.0623   -0.9399 N   0  0  0

+   -1.1770    1.2059    0.7701 C   0  0  0

+   -1.8638   -2.5725    0.4438 C   0  0  0

+   -2.0766    2.1668    0.3485 C   0  0  0

+    8.7094    0.0015   -0.1578 Cl  0  0  0

+   -0.7407   -0.8081    0.0000 H   0  0  0

+   -4.0110    2.4660    0.0000 H   0  0  0

+   -5.5376    0.7349    0.0000 H   0  0  0

+   -5.0195   -0.9094    0.0000 H   0  0  0

+   -0.2169    1.4683    0.0000 H   0  0  0

+   -2.4099   -3.4046    0.0000 H   0  0  0

+   -1.0317   -3.1186    0.0000 H   0  0  0

+   -1.3177   -1.7404    0.0000 H   0  0  0

+   -1.8230    3.1293    0.0000 H   0  0  0

+    9.7047    0.0015    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7  9  2  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+659-70-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    1.1248    0.6546    0.2607 C   0  0  0

+   -0.0107    0.0217    0.5949 O   0  0  0

+    2.4435    0.1790    0.8138 C   0  0  0

+    1.0903    1.6026   -0.4877 O   0  0  0

+   -1.2812    0.4800    0.0620 C   0  0  0

+    3.3375   -0.2936   -0.3344 C   0  0  0

+   -2.4078   -0.4073    0.5953 C   0  0  0

+    4.7901   -0.3545    0.1422 C   0  0  0

+    2.8911   -1.6847   -0.7889 C   0  0  0

+   -3.7466    0.0757    0.0337 C   0  0  0

+   -3.7164   -0.0016   -1.4941 C   0  0  0

+   -4.8732   -0.8116    0.5670 C   0  0  0

+    3.3067    0.7793    0.0000 H   0  0  0

+    2.3064    1.2214    0.0000 H   0  0  0

+   -0.7479    1.3861    0.0000 H   0  0  0

+   -2.0731    1.1716    0.0000 H   0  0  0

+    3.6119    0.7213    0.0000 H   0  0  0

+   -2.9412   -1.3134    0.0000 H   0  0  0

+   -1.6159   -1.0989    0.0000 H   0  0  0

+    4.7461   -1.4050    0.0000 H   0  0  0

+    5.8406   -0.3985    0.0000 H   0  0  0

+    4.8341    0.6960    0.0000 H   0  0  0

+    1.8900   -1.3634    0.0000 H   0  0  0

+    2.5698   -2.6858    0.0000 H   0  0  0

+    3.8922   -2.0060    0.0000 H   0  0  0

+   -3.9146    1.1136    0.0000 H   0  0  0

+   -4.6957   -0.3842    0.0000 H   0  0  0

+   -3.3338   -0.9809    0.0000 H   0  0  0

+   -2.7371    0.3810    0.0000 H   0  0  0

+   -5.5237    0.0144    0.0000 H   0  0  0

+   -5.6992   -1.4621    0.0000 H   0  0  0

+   -4.2227   -1.6376    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  6  9  1  0

+  7 10  1  0

+ 10 11  1  0

+ 10 12  1  0

+  3 13  1  0

+  3 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 12 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56-40-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.4439   -0.0053   -0.0013 C   0  0  0

+   -0.7900    0.8599    0.0013 C   0  0  0

+    1.6608    0.5613   -0.0001 O   0  0  0

+    0.3379   -1.2088    0.0007 O   0  0  0

+   -1.9860    0.0069   -0.0006 N   0  0  0

+   -0.0911    1.6492    0.0000 H   0  0  0

+   -1.4952    1.6435    0.0000 H   0  0  0

+    2.6165    1.0063    0.0000 H   0  0  0

+   -2.9453    0.4441    0.0000 H   0  0  0

+   -1.8850   -1.0425    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6810-26-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -0.1760    0.0962   -0.0325 C   0  0  0

+   -1.6560    0.0001   -0.0048 C   0  0  0

+    0.4392    1.2907   -0.4052 C   0  0  0

+    0.6016   -1.0056    0.3196 C   0  0  0

+   -2.2901   -1.1578   -0.4506 C   0  0  0

+   -2.4174    1.0656    0.4727 C   0  0  0

+    1.8145    1.3780   -0.4298 C   0  0  0

+    1.9771   -0.9140    0.2937 C   0  0  0

+   -3.6676   -1.2419   -0.4221 C   0  0  0

+   -3.7938    0.9705    0.4966 C   0  0  0

+    2.5884    0.2761   -0.0833 C   0  0  0

+   -4.4182   -0.1796    0.0478 C   0  0  0

+    3.9808    0.3666   -0.1089 N   0  0  0

+    4.7699   -0.7550    0.2438 O   0  0  0

+   -0.1145    2.1371    0.0000 H   0  0  0

+    0.1664   -1.9186    0.0000 H   0  0  0

+   -1.7482   -2.0118    0.0000 H   0  0  0

+   -1.9860    1.9804    0.0000 H   0  0  0

+    2.2522    2.2898    0.0000 H   0  0  0

+    2.5326   -1.7592    0.0000 H   0  0  0

+   -4.1051   -2.1538    0.0000 H   0  0  0

+   -4.3406    1.8214    0.0000 H   0  0  0

+   -5.4279   -0.2391    0.0000 H   0  0  0

+    4.4174    1.2789    0.0000 H   0  0  0

+    5.3519   -1.5822    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  9 12  2  0

+ 11 13  1  0

+ 13 14  1  0

+  8 11  2  0

+ 10 12  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52517-34-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+    3.1978   -0.0994   -0.0830 C   0  0  0

+    2.0994   -0.9354   -0.2935 C   0  0  0

+    3.1772    1.3626   -0.1256 C   0  0  0

+    4.5029   -0.5119    0.2100 C   0  0  0

+    0.7935   -0.2650   -0.5986 C   0  0  2

+    2.3559   -2.2668   -0.1967 C   0  0  0

+    1.8704    2.0571   -0.4102 C   0  0  0

+    4.4214    1.7420    0.1222 C   0  0  0

+    5.2304    0.6339    0.3249 N   0  0  0

+    4.7323   -1.8833    0.3072 C   0  0  0

+    0.7293    1.1271    0.0304 C   0  0  1

+   -0.3523   -1.1244   -0.0518 C   0  0  0

+    3.6436   -2.7172    0.0911 C   0  0  0

+   -0.5497    1.7669   -0.3028 N   0  0  0

+   -1.6812   -0.4034   -0.2924 C   0  0  2

+   -1.6137    0.9891    0.3389 C   0  0  0

+   -0.5428    3.0861    0.3434 C   0  0  0

+   -2.8177   -1.2006    0.3510 C   0  0  0

+   -4.5243   -0.2747    0.0420 Br  0  0  0

+   -0.1490    0.1794    0.0000 H   0  0  0

+    1.5673   -2.9478    0.0000 H   0  0  0

+    2.4770    2.9044    0.0000 H   0  0  0

+    1.1109    2.7705    0.0000 H   0  0  0

+    4.7513    2.7304    0.0000 H   0  0  0

+    6.2719    0.6677    0.0000 H   0  0  0

+    5.7016   -2.2656    0.0000 H   0  0  0

+    1.6806    0.7018    0.0000 H   0  0  0

+   -0.9750   -1.9599    0.0000 H   0  0  0

+    0.3856   -1.8601    0.0000 H   0  0  0

+    3.8082   -3.7461    0.0000 H   0  0  0

+   -2.5938    0.0996    0.0000 H   0  0  0

+   -2.0240    1.9469    0.0000 H   0  0  0

+   -2.6392    0.8045    0.0000 H   0  0  0

+    0.4992    3.0807    0.0000 H   0  0  0

+   -0.5373    4.1281    0.0000 H   0  0  0

+   -1.5848    3.0916    0.0000 H   0  0  0

+   -3.4492   -2.0294    0.0000 H   0  0  0

+   -2.0955   -1.9518    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+ 11 14  1  0

+ 12 15  1  0

+ 14 16  1  0

+ 14 17  1  0

+ 15 18  1  0

+ 18 19  1  0

+  7 11  1  0

+  8  9  1  0

+ 10 13  1  0

+ 15 16  1  0

+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+479-50-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 50                          1 V2000

+    0.8395    0.5923   -0.1098 C   0  0  0

+    1.7935    1.6313   -0.0391 C   0  0  0

+   -0.5238    0.9477   -0.0183 C   0  0  0

+    1.2262   -0.7986   -0.2842 C   0  0  0

+    3.4955    1.1297   -0.1185 S   0  0  0

+    1.4228    2.9510    0.0894 C   0  0  0

+   -0.8800    2.2781    0.1153 C   0  0  0

+   -1.5047   -0.0353   -0.0626 N   0  0  0

+    2.5362   -1.4037   -0.0703 C   0  0  0

+    0.3450   -1.5537   -0.6552 O   0  0  0

+    3.7115   -0.6277    0.0174 C   0  0  0

+    0.0792    3.2754    0.1658 C   0  0  0

+    2.4705    4.0327    0.1470 C   0  0  0

+   -2.9187    0.3360    0.0326 C   0  0  0

+    2.6633   -2.7965    0.0519 C   0  0  0

+    4.9498   -1.2050    0.2000 C   0  0  0

+   -3.7830   -0.9243   -0.0415 C   0  0  0

+    3.8927   -3.3580    0.2373 C   0  0  0

+    5.0401   -2.5803    0.3094 C   0  0  0

+   -5.2009   -0.5519    0.0540 N   0  0  0

+   -5.8647   -1.1102   -1.1316 C   0  0  0

+   -5.7467   -1.2632    1.2176 C   0  0  0

+   -6.5605    0.0131   -1.9029 C   0  0  0

+   -6.3163   -0.2506    2.2132 C   0  0  0

+   -1.8876    2.5377    0.0000 H   0  0  0

+   -1.2323   -1.0396    0.0000 H   0  0  0

+   -0.2123    4.2743    0.0000 H   0  0  0

+    3.2179    3.3088    0.0000 H   0  0  0

+    3.1944    4.7801    0.0000 H   0  0  0

+    1.7231    4.7566    0.0000 H   0  0  0

+   -2.5409    1.3055    0.0000 H   0  0  0

+   -3.8386    0.8224    0.0000 H   0  0  0

+    1.8144   -3.3983    0.0000 H   0  0  0

+    5.8086   -0.6174    0.0000 H   0  0  0

+   -4.1608   -1.8938    0.0000 H   0  0  0

+   -2.8631   -1.4107    0.0000 H   0  0  0

+    3.9796   -4.3949    0.0000 H   0  0  0

+    5.9749   -3.0374    0.0000 H   0  0  0

+   -6.7218   -1.7002    0.0000 H   0  0  0

+   -5.2341   -1.9379    0.0000 H   0  0  0

+   -6.5769   -1.8905    0.0000 H   0  0  0

+   -5.0137   -2.0017    0.0000 H   0  0  0

+   -5.6759    0.5610    0.0000 H   0  0  0

+   -7.1084    0.8977    0.0000 H   0  0  0

+   -7.4451   -0.5348    0.0000 H   0  0  0

+   -5.4094    0.2596    0.0000 H   0  0  0

+   -6.8265    0.6563    0.0000 H   0  0  0

+   -7.2232   -0.7608    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  2  0

+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 14 17  1  0

+ 15 18  2  0

+ 16 19  2  0

+ 17 20  1  0

+ 20 21  1  0

+ 20 22  1  0

+ 21 23  1  0

+ 22 24  1  0

+  7 12  1  0

+  9 11  2  0

+ 18 19  1  0

+  7 25  1  0

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+ 12 27  1  0

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+ 23 43  1  0

+ 23 44  1  0

+ 23 45  1  0

+ 24 46  1  0

+ 24 47  1  0

+ 24 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21247-98-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.5476    0.0701    0.0571 C   0  0  0

+   -1.9528    0.1003    0.0151 C   0  0  0

+    0.1801    1.2710   -0.0188 C   0  0  0

+    0.1475   -1.2115    0.1858 C   0  0  0

+   -2.6179    1.3425   -0.1039 C   0  0  0

+   -2.6906   -1.1019    0.0919 C   0  0  0

+    1.6394    1.2041    0.0276 C   0  0  0

+   -0.5043    2.4954   -0.1360 C   0  0  0

+    1.5315   -1.2412    0.2267 C   0  0  0

+   -0.6460   -2.4383    0.2680 C   0  0  0

+   -1.8598    2.5324   -0.1781 C   0  0  0

+   -4.0172    1.3605   -0.1447 C   0  0  0

+   -1.9945   -2.3800    0.2156 C   0  0  0

+   -4.0851   -1.0407    0.0477 C   0  0  0

+    2.2795   -0.0552    0.1468 C   0  0  0

+    2.4134    2.3688   -0.0446 C   0  0  0

+    2.2438   -2.5626    0.3592 C   0  0  0

+   -4.7257    0.1795   -0.0693 C   0  0  0

+    3.6872   -0.1030    0.1899 C   0  0  0

+    3.7731    2.2837    0.0001 C   0  0  0

+    2.5062   -3.0947   -0.9408 O   0  0  0

+    4.4070    1.0491    0.1172 C   0  0  0

+    0.0403    3.3953    0.0000 H   0  0  0

+   -0.1633   -3.3728    0.0000 H   0  0  0

+   -2.3531    3.4614    0.0000 H   0  0  0

+   -4.5296    2.2791    0.0000 H   0  0  0

+   -2.5511   -3.2725    0.0000 H   0  0  0

+   -4.6488   -1.9287    0.0000 H   0  0  0

+    1.9456    3.3109    0.0000 H   0  0  0

+    3.2941   -2.6187    0.0000 H   0  0  0

+    2.8069   -1.6742    0.0000 H   0  0  0

+   -5.7771    0.2094    0.0000 H   0  0  0

+    4.1815   -1.0315    0.0000 H   0  0  0

+    4.3491    3.1638    0.0000 H   0  0  0

+    2.9714   -4.0381    0.0000 H   0  0  0

+    5.4579    1.0049    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

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+  6 13  1  0

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+  9 17  1  0

+ 12 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 17 21  1  0

+ 19 22  2  0

+  8 11  2  0

+  9 15  1  0

+ 10 13  2  0

+ 14 18  2  0

+ 20 22  1  0

+  8 23  1  0

+ 10 24  1  0

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+ 14 28  1  0

+ 16 29  1  0

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+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+459-56-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -2.5276   -0.3468   -0.4345 C   0  0  0

+   -3.1956    0.3896    0.5919 O   0  0  0

+   -1.0369   -0.2056   -0.2649 C   0  0  0

+   -0.2560   -1.3273   -0.0583 C   0  0  0

+   -0.4505    1.0453   -0.3218 C   0  0  0

+    1.1114   -1.1990    0.0974 C   0  0  0

+    0.9162    1.1760   -0.1664 C   0  0  0

+    1.6988    0.0535    0.0463 C   0  0  0

+    3.0353    0.1800    0.1983 F   0  0  0

+   -3.4198   -0.8608    0.0000 H   0  0  0

+   -2.2149   -1.3279    0.0000 H   0  0  0

+   -3.8874    1.1523    0.0000 H   0  0  0

+   -0.6895   -2.2613    0.0000 H   0  0  0

+   -1.0437    1.8870    0.0000 H   0  0  0

+    1.7037   -2.0413    0.0000 H   0  0  0

+    1.3485    2.1105    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

+  9  8  1  0

+  7  8  1  0

+  1 10  1  0

+  1 11  1  0

+  2 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+198-55-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -1.4345   -0.0003    0.0023 C   0  0  0

+   -0.7375   -1.2285    0.0023 C   0  0  0

+   -0.7373    1.2282    0.0019 C   0  0  0

+   -2.8487    0.0001   -0.0031 C   0  0  0

+    0.7374   -1.2286    0.0012 C   0  0  0

+   -1.4534   -2.4158    0.0030 C   0  0  0

+    0.7376    1.2282    0.0009 C   0  0  0

+   -1.4524    2.4156    0.0019 C   0  0  0

+   -3.5365   -1.2256   -0.0084 C   0  0  0

+   -3.5362    1.2264   -0.0027 C   0  0  0

+    1.4347   -0.0002    0.0003 C   0  0  0

+    1.4529   -2.4158    0.0005 C   0  0  0

+   -2.8425   -2.3998    0.0036 C   0  0  0

+    1.4526    2.4156    0.0003 C   0  0  0

+   -2.8420    2.4001    0.0023 C   0  0  0

+    2.8486    0.0000   -0.0012 C   0  0  0

+    2.8425   -2.3999   -0.0011 C   0  0  0

+    2.8422    2.4000   -0.0010 C   0  0  0

+    3.5365   -1.2261   -0.0014 C   0  0  0

+    3.5363    1.2262   -0.0015 C   0  0  0

+   -0.9432   -3.3315    0.0000 H   0  0  0

+   -0.9418    3.3310    0.0000 H   0  0  0

+   -4.5846   -1.2374    0.0000 H   0  0  0

+   -4.5843    1.2385    0.0000 H   0  0  0

+    0.9426   -3.3314    0.0000 H   0  0  0

+   -3.3672   -3.3072    0.0000 H   0  0  0

+    0.9420    3.3310    0.0000 H   0  0  0

+   -3.3664    3.3077    0.0000 H   0  0  0

+    3.3671   -3.3074    0.0000 H   0  0  0

+    3.3667    3.3076    0.0000 H   0  0  0

+    4.5846   -1.2380    0.0000 H   0  0  0

+    4.5844    1.2382    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  4 10  1  0

+  5 11  1  0

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+  6 13  2  0

+  7 14  2  0

+  8 15  1  0

+ 11 16  2  0

+ 12 17  1  0

+ 14 18  1  0

+ 16 19  1  0

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+  7 11  1  0

+  9 13  1  0

+ 10 15  2  0

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+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112-56-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+   -0.6315   -1.9201   -0.1644 C   0  0  0

+   -2.0758   -1.7579    0.3136 C   0  0  0

+    0.1502   -0.8171    0.2986 O   0  0  0

+   -2.6153   -0.5406   -0.2052 O   0  0  0

+    1.4813   -1.0254   -0.1776 C   0  0  0

+   -3.9584   -0.4469    0.2738 C   0  0  0

+    2.3749    0.1269    0.2858 C   0  0  0

+   -4.5973    0.8415   -0.2483 C   0  0  0

+    4.0609   -0.1370   -0.3174 S   0  0  0

+   -6.0353    0.9418    0.2645 C   0  0  0

+    5.3588    1.0639    0.0692 C   0  0  0

+   -6.6743    2.2303   -0.2576 C   0  0  0

+    6.1733    1.8177    0.3119 N   0  0  0

+   -0.9297   -2.9567    0.0000 H   0  0  0

+    0.3405   -2.3876    0.0000 H   0  0  0

+   -3.1233   -2.0152    0.0000 H   0  0  0

+   -2.0063   -2.8343    0.0000 H   0  0  0

+    1.1386   -2.0481    0.0000 H   0  0  0

+    2.4323   -1.5344    0.0000 H   0  0  0

+   -4.9939   -0.7488    0.0000 H   0  0  0

+   -3.8432   -1.5194    0.0000 H   0  0  0

+    2.7177    1.1496    0.0000 H   0  0  0

+    1.4239    0.6360    0.0000 H   0  0  0

+   -3.5618    1.1434    0.0000 H   0  0  0

+   -4.7125    1.9140    0.0000 H   0  0  0

+   -7.0708    0.6399    0.0000 H   0  0  0

+   -5.9201   -0.1307    0.0000 H   0  0  0

+   -5.7080    2.7095    0.0000 H   0  0  0

+   -7.1535    3.1966    0.0000 H   0  0  0

+   -7.6406    1.7511    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  3  0

+  1 14  1  0

+  1 15  1  0

+  2 16  1  0

+  2 17  1  0

+  5 18  1  0

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+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95896-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.4261   -0.5489   -0.0015 C   0  0  0

+   -1.0002   -0.2331   -0.0006 C   0  0  0

+    1.3467    0.5024   -0.0012 C   0  0  0

+    1.1295   -1.7041    0.0027 N   0  0  0

+   -1.3961    1.1278    0.0006 C   0  0  0

+   -1.9250   -1.1918   -0.0012 N   0  0  0

+    0.9061    1.8282   -0.0001 C   0  0  0

+    2.5999   -0.0854   -0.0018 N   0  0  0

+    2.4134   -1.4362   -0.0002 C   0  0  0

+   -0.4151    2.1376    0.0013 C   0  0  0

+   -2.6981    1.4323    0.0015 N   0  0  0

+   -3.2002   -0.8680   -0.0008 C   0  0  0

+    1.9222    2.9410    0.0002 C   0  0  0

+    3.8873    0.6137   -0.0018 C   0  0  0

+    3.4217   -2.3778    0.0026 N   0  0  0

+   -3.5931    0.4694    0.0013 C   0  0  0

+   -4.2459   -1.9531   -0.0015 C   0  0  0

+   -0.7069    3.1339    0.0000 H   0  0  0

+    2.6888    2.2410    0.0000 H   0  0  0

+    2.6222    3.7076    0.0000 H   0  0  0

+    1.1556    3.6410    0.0000 H   0  0  0

+    4.3827   -0.2986    0.0000 H   0  0  0

+    4.7996    1.1091    0.0000 H   0  0  0

+    3.3919    1.5260    0.0000 H   0  0  0

+    3.1874   -3.3892    0.0000 H   0  0  0

+    4.4147   -2.0750    0.0000 H   0  0  0

+   -4.6035    0.7077    0.0000 H   0  0  0

+   -4.9934   -1.2327    0.0000 H   0  0  0

+   -4.9663   -2.7006    0.0000 H   0  0  0

+   -3.4984   -2.6735    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

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+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

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+  7 10  2  0

+  8  9  1  0

+ 12 16  1  0

+ 10 18  1  0

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+ 15 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17796-82-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -2.1547    0.6396   -0.3457 C   0  0  0

+   -2.2847   -0.5256    0.4372 C   0  0  0

+   -0.8341    0.5403   -1.0023 C   0  0  0

+   -3.1780    1.5730   -0.3669 C   0  0  0

+   -1.0387   -1.2933    0.2297 C   0  0  0

+   -3.4330   -0.7285    1.1850 C   0  0  0

+   -0.2494   -0.6086   -0.6176 N   0  0  0

+   -0.3568    1.3588   -1.7619 O   0  0  0

+   -4.3237    1.3542    0.3828 C   0  0  0

+   -0.7721   -2.3631    0.7389 O   0  0  0

+   -4.4470    0.2168    1.1579 C   0  0  0

+    1.2451   -1.1137   -1.1212 S   0  0  0

+    2.2810   -0.3642    0.1655 C   0  0  0

+    3.7489   -0.7054   -0.0986 C   0  0  0

+    2.0991    1.1548    0.1462 C   0  0  0

+    4.6227   -0.0733    0.9866 C   0  0  0

+    2.9729    1.7869    1.2315 C   0  0  0

+    4.4408    1.4457    0.9673 C   0  0  0

+   -2.9162    2.4996    0.0000 H   0  0  0

+   -3.7062   -1.6518    0.0000 H   0  0  0

+   -5.0315    2.0070    0.0000 H   0  0  0

+   -5.3494   -0.1190    0.0000 H   0  0  0

+    2.4713   -1.3081    0.0000 H   0  0  0

+    3.3153   -1.5652    0.0000 H   0  0  0

+    4.4817   -1.3300    0.0000 H   0  0  0

+    1.6740    2.0188    0.0000 H   0  0  0

+    1.1759    0.8811    0.0000 H   0  0  0

+    5.0478   -0.9373    0.0000 H   0  0  0

+    5.5459    0.2004    0.0000 H   0  0  0

+    3.4065    2.6467    0.0000 H   0  0  0

+    2.2401    2.4115    0.0000 H   0  0  0

+    5.4037    1.4489    0.0000 H   0  0  0

+    4.5489    2.4025    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  2  0

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+  7 12  1  0

+ 12 13  1  0

+ 13 14  1  0

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+ 14 16  1  0

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+  5  7  1  0

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+ 17 18  1  0

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+ 11 22  1  0

+ 13 23  1  0

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+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3058-37-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  7                          1 V2000

+   -3.7710   -0.4442   -0.3769 N   0  0  0

+   -4.5824    0.2370    0.3591 N   0  0  0

+   -2.5290   -0.9699    0.1952 C   0  0  0

+   -5.6150    0.6741   -0.1165 O   0  0  0

+    6.0677    0.0963   -0.0059 K   0  3  0

+   -2.8568   -1.7444    0.0000 H   0  0  0

+   -1.7545   -1.2977    0.0000 H   0  0  0

+   -2.2012   -0.1954    0.0000 H   0  0  0

+   -6.3894    1.0019    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  3  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+137-05-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.7835   -0.6134   -0.0014 C   0  0  0

+   -0.6652   -0.3299   -0.0008 C   0  0  0

+    1.7243    0.4661   -0.0007 C   0  0  0

+    1.2205   -1.8879    0.0028 C   0  0  0

+   -1.1022    0.9446    0.0006 O   0  0  0

+   -1.4634   -1.2457   -0.0014 O   0  0  0

+    2.4707    1.3225   -0.0001 N   0  0  0

+   -2.5272    1.2235    0.0013 C   0  0  0

+    0.5566   -2.6497    0.0000 H   0  0  0

+    2.2122   -2.0820    0.0000 H   0  0  0

+   -2.3331    2.2152    0.0000 H   0  0  0

+   -3.5189    1.4176    0.0000 H   0  0  0

+   -2.7213    0.2318    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  1  0

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+  5  8  1  0

+  4  9  1  0

+  4 10  1  0

+  8 11  1  0

+  8 12  1  0

+  8 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+28911-01-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    1.2909   -0.8654   -0.1433 C   0  0  0

+    0.0131   -0.4896   -0.5627 C   0  0  0

+    2.3610    0.0300   -0.1481 N   0  0  0

+    1.5259   -2.1711    0.2759 C   0  0  0

+   -0.3279    0.8824   -0.9553 C   0  0  0

+   -1.0021   -1.4574   -0.5952 C   0  0  0

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+   -1.6340    1.3894   -0.4756 C   0  0  0

+    0.3693    1.7007   -1.6658 N   0  0  0

+   -0.7501   -2.7493   -0.1914 C   0  0  0

+    1.6722    1.3252   -2.2255 C   0  0  0

+    3.7115    1.5754   -0.7646 N   0  0  0

+    4.1831    1.0565    0.3157 N   0  0  0

+    3.5709   -0.7307    1.9769 C   0  0  0

+   -1.8549    1.5757    0.8904 C   0  0  0

+   -2.6468    1.6882   -1.3867 C   0  0  0

+   -2.0184   -3.9338   -0.2385 Cl  0  0  0

+   -3.0754    2.0493    1.3307 C   0  0  0

+   -0.5990    1.2125    2.0326 Cl  0  0  0

+   -3.8614    2.1607   -0.9337 C   0  0  0

+   -4.0767    2.3385    0.4214 C   0  0  0

+    2.4541   -2.4822    0.0000 H   0  0  0

+   -1.9349   -1.1603    0.0000 H   0  0  0

+    0.7411   -4.0589    0.0000 H   0  0  0

+    2.4066    1.9726    0.0000 H   0  0  0

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+   -2.9631    0.7617    0.0000 H   0  0  0

+   -2.7622    2.9768    0.0000 H   0  0  0

+   -4.3569    1.3163    0.0000 H   0  0  0

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+ 18 32  1  0

+ 20 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2746-81-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 79                          1 V2000

+    3.7077    1.0059    0.0698 C   0  0  0

+    4.0148   -0.2448   -0.4657 N   0  0  0

+    4.1586    1.3915    1.3262 C   0  0  0

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+    5.1620   -0.9571   -0.1167 C   0  0  0

+    3.0915   -0.8365   -1.4372 C   0  0  0

+    5.1457    0.3281    2.3182 S   0  0  0

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+    2.6098    3.1301   -0.1883 C   0  0  0

+    5.7752   -0.7913    1.1189 C   0  0  0

+    5.6962   -1.8519   -1.0375 C   0  0  0

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+   -3.7629   -4.2991    0.1433 C   0  0  0

+   -4.6421   -3.3860    1.0000 C   0  0  0

+   -5.3122   -2.4203    0.1475 O   0  0  0

+   -6.1408   -1.5115    0.6852 C   0  0  0

+   -6.8363   -0.5093   -0.1996 C   0  0  0

+   -6.3290   -1.4969    1.8786 O   0  0  0

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+ 38 75  1  0

+ 38 76  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18463-85-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -3.6760    0.5389   -0.0027 C   0  0  0

+   -4.1249   -0.8038   -0.0023 C   0  0  0

+   -2.3474    0.8726   -0.0020 C   0  0  0

+   -5.2045    1.4421    0.0029 S   0  0  0

+   -3.1273   -1.8076   -0.0016 C   0  0  0

+   -5.4653   -0.9435   -0.0028 N   0  0  0

+   -1.3873   -0.1443   -0.0008 C   0  0  0

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+   -1.8108   -1.4822   -0.0012 C   0  0  0

+   -0.0566    0.1604   -0.0005 N   0  0  0

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+    2.1517   -0.4801    0.0008 C   0  0  0

+    3.1054   -1.5035    0.0020 C   0  0  0

+    2.5653    0.8566   -0.0059 C   0  0  0

+    4.4465   -1.1922    0.0023 C   0  0  0

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+   -2.0548    1.8751    0.0000 H   0  0  0

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+ 19 29  1  0

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+ 19 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86-50-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -3.3833    0.4464   -0.1528 C   0  0  0

+   -3.8449   -0.8458    0.1797 C   0  0  0

+   -1.9537    0.6191   -0.4529 C   0  0  0

+   -4.2729    1.5189   -0.1851 C   0  0  0

+   -2.9662   -1.8783    0.2127 N   0  0  0

+   -5.1990   -1.0345    0.4687 C   0  0  0

+   -1.1673   -0.4812   -0.3901 N   0  0  0

+   -1.4959    1.7082   -0.7464 O   0  0  0

+   -5.6021    1.3085    0.1092 C   0  0  0

+   -1.7200   -1.7188   -0.0501 N   0  0  0

+   -6.0620    0.0368    0.4258 C   0  0  0

+    0.2650   -0.3742   -0.6787 C   0  0  0

+    1.1654   -0.0147    0.8545 S   0  0  0

+    3.1468    0.0738    0.1057 P   0  0  0

+    3.3525    1.4484   -0.7069 O   0  0  0

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+    3.4459   -1.3712   -1.0323 S   0  0  0

+    2.9155    2.5046    0.1507 C   0  0  0

+    5.4891   -0.1385    0.7635 C   0  0  0

+   -3.9141    2.4702    0.0000 H   0  0  0

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+  1  2  2  0

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+ 19 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92134-93-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.5014   -0.4175   -0.4600 C   0  0  0

+   -0.8930   -0.1243   -0.0773 N   0  0  0

+    1.3745    1.1659   -0.1040 S   0  0  0

+    1.0569   -1.5205    0.4432 C   0  0  0

+   -1.1259    1.1714    0.5543 C   0  0  0

+   -1.8500   -0.9631   -0.2887 N   0  0  0

+   -0.1277    2.2378    0.0147 C   0  0  0

+    2.4075   -1.8045    0.0726 O   0  0  0

+   -2.9885   -0.6839    0.0419 O   0  0  0

+   -0.1298   -1.2379    0.0000 H   0  0  0

+    0.0519   -1.7685    0.0000 H   0  0  0

+    1.0749   -2.5554    0.0000 H   0  0  0

+   -1.7145    2.0228    0.0000 H   0  0  0

+   -2.0827    0.7766    0.0000 H   0  0  0

+    0.5102    3.0530    0.0000 H   0  0  0

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+  1  2  1  0

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+  5 13  1  0

+  5 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+606-31-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.0765   -0.1467   -0.0099 C   0  0  0

+   -1.3345    0.4628    0.0284 C   0  0  0

+    1.0761    0.6455   -0.0254 C   0  0  0

+    0.0342   -1.6141   -0.0277 C   0  0  0

+   -1.4298    1.8384    0.0506 C   0  0  0

+   -2.5606   -0.3663    0.0445 N   0  3  0

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+    1.1238   -2.1408    0.0471 O   0  0  0

+   -0.2847    2.6152    0.0351 C   0  0  0

+   -3.4855   -0.1003   -0.7020 O   0  0  0

+   -2.6445   -1.3146    0.8043 O   0  5  0

+    3.2286    0.2521    0.8049 O   0  0  0

+    2.6961   -0.7539   -0.9713 O   0  5  0

+   -0.8221   -2.1973    0.0000 H   0  0  0

+   -2.3614    2.2916    0.0000 H   0  0  0

+    1.8172    2.6073    0.0000 H   0  0  0

+   -0.3628    3.6482    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  8 14  1  0

+  7 10  1  0

+  4 15  1  0

+  5 16  1  0

+  7 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54755-20-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.0860   -0.0150    0.0007 C   0  0  0

+   -1.0438    1.0296   -0.0233 C   0  0  0

+    1.2820    0.3038   -0.0329 C   0  0  0

+   -0.5231   -1.3493    0.0635 C   0  0  0

+   -2.4122    0.7104    0.0102 C   0  0  0

+   -0.6067    2.3637   -0.0807 C   0  0  0

+    1.6684    1.6079   -0.0879 C   0  0  0

+    2.2976   -0.7728   -0.0081 N   0  3  0

+   -1.8562   -1.6201    0.1003 C   0  0  0

+   -2.7983   -0.5934    0.0652 C   0  0  0

+    0.7269    2.6347   -0.1124 C   0  0  0

+    3.2534   -0.6911    0.7425 O   0  0  0

+    2.1775   -1.7402   -0.7382 O   0  5  0

+   -4.2664   -0.9317    0.1011 C   0  0  0

+    0.1717   -2.1299    0.0000 H   0  0  0

+   -3.1292    1.4708    0.0000 H   0  0  0

+   -1.3015    3.1443    0.0000 H   0  0  0

+    2.6867    1.8431    0.0000 H   0  0  0

+   -2.1790   -2.6141    0.0000 H   0  0  0

+    1.0498    3.6286    0.0000 H   0  0  0

+   -4.5011    0.0867    0.0000 H   0  0  0

+   -5.2848   -1.1664    0.0000 H   0  0  0

+   -4.0317   -1.9501    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+  8 13  1  0

+ 10 14  1  0

+  7 11  2  0

+  9 10  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66-56-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.5014   -0.1185   -0.0024 C   0  0  0

+   -0.5087    0.8242   -0.0004 C   0  0  0

+    1.8277    0.2878   -0.0021 C   0  0  0

+    0.1685   -1.5607    0.0014 N   0  3  0

+   -1.9241    0.3914   -0.0007 N   0  3  0

+   -0.1984    2.1714    0.0014 C   0  0  0

+    2.1364    1.6406    0.0001 C   0  0  0

+    2.8230   -0.6375   -0.0036 O   0  0  0

+    0.0278   -2.1560   -1.0518 O   0  0  0

+    0.0354   -2.1523    1.0578 O   0  5  0

+   -2.8150    1.2220    0.0011 O   0  0  0

+   -2.1980   -0.7954   -0.0027 O   0  5  0

+    1.1230    2.5790    0.0016 C   0  0  0

+   -0.9573    2.8770    0.0000 H   0  0  0

+    3.1264    1.9466    0.0000 H   0  0  0

+    3.5819   -1.3431    0.0000 H   0  0  0

+    1.3531    3.5894    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  6 13  1  0

+  7 13  2  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 13 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118244-44-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 92 95                          1 V2000

+   -4.4266    0.4892   -1.0107 C   0  0  1

+   -3.7159    1.7749   -0.6301 C   0  0  1

+   -4.8423   -0.2103    0.2934 C   0  0  1

+   -5.6715    0.8087   -1.8405 C   0  0  0

+   -2.4202    1.3711    0.1234 C   0  0  1

+   -3.1539    2.5933   -1.7974 C   0  0  0

+   -5.5156   -1.5426   -0.0487 C   0  0  2

+   -3.6426   -0.4694    1.1998 C   0  0  2

+   -6.3594   -0.4947   -2.2580 C   0  0  0

+   -1.6127    2.6647    0.1491 C   0  0  2

+   -2.8453    0.8165    1.4694 C   0  0  0

+   -1.6668    0.3021   -0.6707 C   0  0  0

+   -2.0389    3.4387   -1.1234 C   0  0  0

+   -6.6459   -1.2997   -1.0042 C   0  0  0

+   -5.9206   -2.2614    1.1926 C   0  0  0

+   -4.4819   -2.4182   -0.7597 C   0  0  0

+   -2.7884   -1.4411    0.5933 O   0  0  0

+   -0.1374    2.3604    0.1056 C   0  0  0

+   -1.9271    3.4215    1.3197 O   0  0  0

+   -7.8773   -1.7449   -0.7963 C   0  0  0

+   -7.1443   -2.7095    1.4241 C   0  0  0

+    0.5208    1.6545    1.2630 C   0  0  0

+    0.5174    2.6822   -0.8567 O   0  0  0

+   -8.2040   -2.4999    0.4233 C   0  0  0

+    1.9345    1.4788    0.9821 O   0  0  0

+   -9.3242   -2.9406    0.6011 O   0  0  0

+    2.7296    0.8672    1.8824 C   0  0  0

+    4.1604    0.6894    1.5981 C   0  0  0

+    2.2633    0.4628    2.9294 O   0  0  0

+    4.8185    1.6084    0.8958 C   0  0  0

+    5.9932    1.2059    0.0419 C   0  0  0

+    4.3890    3.0517    0.9543 C   0  0  0

+    5.5041    0.8511   -1.3637 C   0  0  0

+    6.6789    0.4485   -2.2175 C   0  0  0

+    6.8579   -0.8100   -2.5339 C   0  0  0

+    8.0949   -1.5350   -2.0699 C   0  0  0

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+   -4.1144   -1.2725    0.0000 H   0  0  0

+   -6.8926    0.2690    0.0000 H   0  0  0

+   -7.2825   -0.6189    0.0000 H   0  0  0

+   -3.2304    1.6646    0.0000 H   0  0  0

+   -3.7748    0.8764    0.0000 H   0  0  0

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+    8.5663   -1.9399    0.0000 H   0  0  0

+    7.9318   -3.0942    0.0000 H   0  0  0

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+ 42 91  1  0

+ 42 92  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20426-12-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    1.6600    1.0029   -0.0036 C   0  0  0

+    0.3740    0.4067   -0.0034 C   0  0  0

+    1.7687    2.2156    0.0000 O   0  0  0

+    2.8699    0.1518   -0.0021 C   0  0  0

+   -0.7324    1.1849    0.0008 C   0  0  0

+    4.1377    0.7357   -0.0023 C   0  0  0

+    2.7487   -1.2391    0.0054 C   0  0  0

+   -2.0648    0.5671    0.0010 C   0  0  0

+    5.2620   -0.0638   -0.0009 C   0  0  0

+    3.8808   -2.0269    0.0067 C   0  0  0

+   -3.2118    1.3704    0.0053 C   0  0  0

+   -2.1928   -0.8277   -0.0089 C   0  0  0

+    5.1349   -1.4415    0.0007 C   0  0  0

+   -4.4582    0.7862    0.0056 C   0  0  0

+   -3.4436   -1.4013   -0.0086 C   0  0  0

+   -4.5795   -0.5988    0.0015 C   0  0  0

+   -5.8107   -1.1697    0.0022 O   0  0  0

+    0.2811   -0.6295    0.0000 H   0  0  0

+   -0.6395    2.2211    0.0000 H   0  0  0

+    4.2346    1.7715    0.0000 H   0  0  0

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+    3.7918   -3.0635    0.0000 H   0  0  0

+   -3.1221    2.4069    0.0000 H   0  0  0

+   -1.3438   -1.4289    0.0000 H   0  0  0

+    5.9858   -2.0401    0.0000 H   0  0  0

+   -5.3110    1.3821    0.0000 H   0  0  0

+   -3.5397   -2.4372    0.0000 H   0  0  0

+   -6.7545   -1.6073    0.0000 H   0  0  0

+  2  1  1  0

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+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+31335-69-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.2480    0.0726   -0.0010 C   0  0  0

+   -1.1420    0.2331   -0.0003 N   0  0  0

+    1.0770    1.1865    0.0002 C   0  0  0

+    0.8014   -1.2013    0.0027 C   0  0  0

+   -1.9454   -0.8490   -0.0015 C   0  0  0

+   -1.7046    1.5326    0.0017 O   0  0  0

+    2.4488    1.0246   -0.0006 C   0  0  0

+    2.1736   -1.3564    0.0019 C   0  0  0

+   -3.1502   -0.7099   -0.0008 O   0  0  0

+    2.9966   -0.2449   -0.0026 C   0  0  0

+    0.6667    2.1390    0.0000 H   0  0  0

+    0.1847   -2.0352    0.0000 H   0  0  0

+   -1.5333   -1.8007    0.0000 H   0  0  0

+   -2.1167    2.4844    0.0000 H   0  0  0

+    3.0685    1.8562    0.0000 H   0  0  0

+    2.5874   -2.3074    0.0000 H   0  0  0

+    4.0269   -0.3639    0.0000 H   0  0  0

+  1  2  1  0

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+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+577-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.7817    0.4844   -0.0039 C   0  0  0

+   -0.4838   -0.9508   -0.0019 C   0  0  0

+    0.2545    1.4177   -0.0030 C   0  0  0

+   -2.1335    0.8981   -0.0008 C   0  0  0

+    0.8444   -1.3922   -0.0001 C   0  0  0

+   -1.5530   -1.8696   -0.0024 C   0  0  0

+    1.5780    0.9807   -0.0002 C   0  0  0

+   -3.1301   -0.0521    0.0040 C   0  0  0

+   -2.4465    2.2214   -0.0030 O   0  0  0

+    1.8820   -0.4536   -0.0001 C   0  0  0

+    1.1236   -2.7200    0.0013 O   0  0  0

+   -2.8336   -1.4174   -0.0047 C   0  0  0

+    2.6489    1.9006    0.0006 C   0  0  0

+   -4.4305    0.3469    0.0069 O   0  0  0

+    3.2317   -0.8609    0.0014 C   0  0  0

+    3.9264    1.4412    0.0032 C   0  0  0

+    4.2147    0.0762    0.0009 C   0  0  0

+    0.0393    2.4417    0.0000 H   0  0  0

+   -1.3603   -2.8980    0.0000 H   0  0  0

+   -2.6873    3.2396    0.0000 H   0  0  0

+    1.3389   -3.7439    0.0000 H   0  0  0

+   -3.6184   -2.1094    0.0000 H   0  0  0

+    2.4593    2.9296    0.0000 H   0  0  0

+   -5.4308    0.6538    0.0000 H   0  0  0

+    3.4745   -1.8787    0.0000 H   0  0  0

+    4.7152    2.1287    0.0000 H   0  0  0

+    5.2141   -0.2336    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  2  6  2  0

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+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-73-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.9602    0.2025   -0.0033 C   0  0  0

+   -0.2054   -0.5399   -0.0028 C   0  0  0

+    0.9003    1.5838   -0.0010 C   0  0  0

+    2.2728   -0.4811   -0.0001 N   0  3  0

+   -1.4326    0.0994    0.0000 C   0  0  0

+   -0.3253    2.2230    0.0018 C   0  0  0

+    3.3002    0.1731   -0.0005 O   0  0  0

+    2.3257   -1.6980    0.0030 O   0  5  0

+   -1.4919    1.4814    0.0023 C   0  0  0

+   -2.8972   -0.8326    0.0000 Cl  0  0  0

+   -0.1604   -1.5758    0.0000 H   0  0  0

+    1.7751    2.1404    0.0000 H   0  0  0

+   -0.3696    3.2589    0.0000 H   0  0  0

+   -2.4112    1.9610    0.0000 H   0  0  0

+  1  2  2  0

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+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93673-39-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+   -2.3884   -0.1192   -0.0031 C   0  0  0

+   -1.5385   -1.2250   -0.0056 C   0  0  0

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+    0.2936    0.3930   -0.0035 C   0  0  0

+    0.7828   -2.0094   -0.0039 C   0  0  0

+   -4.2872    1.8156    0.0038 C   0  0  0

+    1.7440    0.6426   -0.0020 C   0  0  0

+    2.1126   -1.7747    0.0010 C   0  0  0

+    2.6267   -0.4583    0.0013 C   0  0  0

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+    4.8810   -1.2720    0.0082 O   0  0  0

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+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146-22-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -0.0357    0.5618   -0.0690 C   0  0  0

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+    2.3762    0.5410    0.0006 C   0  0  0

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+ 16 30  1  0

+ 17 31  1  0

+ 21 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+868-18-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 15                          1 V2000

+   -3.5375   -0.4794   -0.6055 C   0  0  2

+   -4.4459   -0.0621    0.5528 C   0  0  2

+   -2.3663   -1.2614   -0.0688 C   0  0  0

+   -3.0622    0.6862   -1.2819 O   0  0  0

+   -5.6170    0.7198    0.0161 C   0  0  0

+   -3.7085    0.7519    1.4669 O   0  0  0

+   -2.5558   -2.3010    0.5476 O   0  0  0

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+   -6.3812    0.2027   -0.7874 O   0  0  0

+    7.7638   -0.1544    0.0014 Na  0  3  0

+   16.4013    0.4732   -0.0016 Na  0  3  0

+   -3.9645   -1.2433    0.0000 H   0  0  0

+   -4.8728   -0.8260    0.0000 H   0  0  0

+   -2.7318    1.4965    0.0000 H   0  0  0

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+  8 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1622-62-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+    0.0381    0.4995    0.2935 C   0  0  0

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+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6459-94-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 86 89                          1 V2000

+   -9.6330    1.4739   -0.3143 C   0  0  0

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+ 51 80  1  0

+ 52 81  1  0

+ 54 82  1  0

+ 54 83  1  0

+ 54 84  1  0

+ 17 85  1  0

+ 22 86  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5466-84-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.6373    0.5222    0.0031 C   0  0  0

+   -1.0569   -0.8240    0.0011 C   0  0  0

+    0.7163    0.8221    0.0028 C   0  0  0

+   -1.8722    1.3320   -0.0007 C   0  0  0

+   -2.5332   -0.7886    0.0021 C   0  0  0

+   -0.1133   -1.8398   -0.0007 C   0  0  0

+    1.6474   -0.2042    0.0005 C   0  0  0

+   -2.9317    0.4989   -0.0046 O   0  0  0

+   -1.9243    2.5449   -0.0004 O   0  0  0

+   -3.2653   -1.7571    0.0010 O   0  0  0

+    1.2359   -1.5242   -0.0007 C   0  0  0

+    3.0927    0.1150   -0.0003 N   0  3  0

+    3.9148   -0.7837   -0.0023 O   0  0  0

+    3.4600    1.2763    0.0009 O   0  5  0

+    1.0313    1.8124    0.0000 H   0  0  0

+   -0.4167   -2.8338    0.0000 H   0  0  0

+    1.9437   -2.2852    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+  5  8  1  0

+  7 11  1  0

+  3 15  1  0

+  6 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3680-02-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.3683   -0.0045   -0.0645 S   0  0  0

+   -1.1716   -0.2646    0.7513 C   0  0  0

+    1.2138    1.1814    1.0169 C   0  0  0

+    0.9749   -1.2884   -0.0092 O   0  0  0

+   -0.0229    0.5935   -1.2928 O   0  0  0

+   -2.2938    0.0210    0.1387 C   0  0  0

+   -1.2152   -1.3287    0.0000 H   0  0  0

+    2.0810    0.5631    0.0000 H   0  0  0

+    1.8321    2.0486    0.0000 H   0  0  0

+    0.3466    1.7997    0.0000 H   0  0  0

+   -2.5824    1.0461    0.0000 H   0  0  0

+   -3.0373   -0.7415    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  6 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-11-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    1.2772    0.0574   -0.2254 C   0  0  0

+    0.0579   -0.4059    0.5744 C   0  0  0

+    2.0491    1.1032    0.5816 C   0  0  0

+    2.1859   -1.1403   -0.5094 C   0  0  0

+   -1.2039   -0.2334   -0.2736 C   0  0  0

+   -2.3811   -0.9244    0.4174 C   0  0  0

+   -1.4901    1.1585   -0.4240 O   0  0  0

+    0.6722    0.8549    0.0000 H   0  0  0

+   -0.4160   -1.2876    0.0000 H   0  0  0

+    0.7182   -1.1582    0.0000 H   0  0  0

+    2.8545    0.5087    0.0000 H   0  0  0

+    2.6436    1.9086    0.0000 H   0  0  0

+    1.2437    1.6977    0.0000 H   0  0  0

+    1.3884   -1.7453    0.0000 H   0  0  0

+    2.7909   -1.9378    0.0000 H   0  0  0

+    2.9834   -0.5353    0.0000 H   0  0  0

+   -1.0075   -1.2150    0.0000 H   0  0  0

+   -2.8878   -0.0611    0.0000 H   0  0  0

+   -3.2444   -1.4311    0.0000 H   0  0  0

+   -1.8744   -1.7877    0.0000 H   0  0  0

+   -1.6917    2.1390    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  5  7  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+139953-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    3.6945    0.5541   -0.0006 C   0  0  0

+    3.2520   -0.7674    0.0010 C   0  0  0

+    5.1637    0.4995   -0.0014 C   0  0  0

+    2.8089    1.5633    0.0037 N   0  0  0

+    4.3483   -1.6028    0.0012 N   0  0  0

+    1.8576   -1.0128    0.0016 C   0  0  0

+    5.5108   -0.8623   -0.0002 C   0  0  0

+    6.1624    1.4739   -0.0030 C   0  0  0

+    1.5414    1.3468    0.0094 N   0  0  0

+    1.0205    0.0481    0.0006 N   0  0  0

+    1.4230   -2.1524    0.0025 O   0  0  0

+    6.8572   -1.2202   -0.0009 C   0  0  0

+    7.4770    1.1007   -0.0033 C   0  0  0

+   -0.3661   -0.1520    0.0006 N   0  0  0

+    7.8269   -0.2424   -0.0029 C   0  0  0

+   -1.1700    0.8692   -0.0003 C   0  0  0

+   -2.6281    0.6588   -0.0003 C   0  0  0

+   -3.4934    1.7576   -0.0013 C   0  0  0

+   -3.1475   -0.6399   -0.0050 C   0  0  0

+   -4.8553    1.5576   -0.0012 C   0  0  0

+   -4.4989   -0.8374   -0.0049 C   0  0  0

+   -5.3682    0.2573   -0.0001 C   0  0  0

+   -6.8284    0.0400    0.0000 C   0  0  0

+   -7.3231   -1.2133    0.0011 O   0  0  0

+   -7.5841    0.9912   -0.0009 O   0  0  0

+   -8.7592   -1.4270    0.0012 C   0  0  0

+    4.3044   -2.6467    0.0000 H   0  0  0

+    5.9057    2.4867    0.0000 H   0  0  0

+    7.1307   -2.2286    0.0000 H   0  0  0

+    8.2238    1.8315    0.0000 H   0  0  0

+    8.8358   -0.5142    0.0000 H   0  0  0

+   -0.7821    1.8394    0.0000 H   0  0  0

+   -3.1068    2.7283    0.0000 H   0  0  0

+   -2.5005   -1.4604    0.0000 H   0  0  0

+   -5.5045    2.3763    0.0000 H   0  0  0

+   -4.8838   -1.8088    0.0000 H   0  0  0

+   -8.9130   -0.3935    0.0000 H   0  0  0

+   -9.7927   -1.5808    0.0000 H   0  0  0

+   -8.6054   -2.4605    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  6 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+ 16 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+ 18 20  1  0

+ 19 21  2  0

+ 20 22  2  0

+ 22 23  1  0

+ 23 24  1  0

+ 23 25  2  0

+ 24 26  1  0

+  5  7  1  0

+  9 10  1  0

+ 13 15  1  0

+ 21 22  1  0

+  5 27  1  0

+  8 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 26 37  1  0

+ 26 38  1  0

+ 26 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-55-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.5631   -0.3557   -0.0029 C   0  0  0

+   -1.6090   -1.2856   -0.0011 C   0  0  0

+   -0.8540    1.0129   -0.0021 C   0  0  0

+    0.8338   -0.8144    0.0005 C   0  0  0

+   -2.9158   -0.8473    0.0015 C   0  0  0

+   -2.1667    1.4348    0.0005 C   0  0  0

+    1.8425    0.0882   -0.0012 C   0  0  0

+   -3.1952    0.5087    0.0023 C   0  0  0

+    3.1823   -0.3518    0.0020 C   0  0  0

+    4.0873    0.4580    0.0004 O   0  0  0

+   -1.4011   -2.3028    0.0000 H   0  0  0

+   -0.0836    1.7088    0.0000 H   0  0  0

+    1.0465   -1.8306    0.0000 H   0  0  0

+   -3.6927   -1.5359    0.0000 H   0  0  0

+   -2.3842    2.4500    0.0000 H   0  0  0

+    1.6298    1.1044    0.0000 H   0  0  0

+   -4.1816    0.8326    0.0000 H   0  0  0

+    3.3950   -1.3680    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  9 10  2  0

+  6  8  2  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86803-19-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.9266   -0.5467   -0.0455 C   0  0  0

+   -2.1585    0.1313   -0.0533 C   0  0  0

+    0.2654    0.1669   -0.2632 C   0  0  0

+   -0.8938   -1.9900    0.1953 C   0  0  0

+   -2.1824    1.5264   -0.2806 C   0  0  0

+   -3.3604   -0.5790    0.1642 C   0  0  0

+    1.5286   -0.5684   -0.2487 C   0  0  0

+    0.2164    1.5556   -0.4870 C   0  0  0

+    0.3195   -2.6577    0.2025 C   0  0  0

+   -2.1555   -2.6952    0.4236 C   0  0  0

+   -0.9685    2.2163   -0.4967 C   0  0  0

+   -3.4150    2.1911   -0.2861 C   0  0  0

+   -3.3253   -2.0205    0.3983 C   0  0  0

+   -4.5684    0.1208    0.1509 C   0  0  0

+    1.5224   -1.9670   -0.0181 C   0  0  0

+    2.7451    0.0919   -0.4608 C   0  0  0

+   -4.5806    1.4862   -0.0721 C   0  0  0

+    2.7484   -2.6617   -0.0081 C   0  0  0

+    3.9116   -0.6131   -0.4440 C   0  0  0

+    2.7646    1.5784   -0.7074 C   0  0  0

+    3.9111   -1.9874   -0.2179 C   0  0  0

+    2.9142    2.4467    0.8656 Cl  0  0  0

+    1.1074    2.1003    0.0000 H   0  0  0

+    0.3290   -3.7020    0.0000 H   0  0  0

+   -2.1625   -3.7395    0.0000 H   0  0  0

+   -0.9728    3.2606    0.0000 H   0  0  0

+   -3.4408    3.2351    0.0000 H   0  0  0

+   -4.2232   -2.5538    0.0000 H   0  0  0

+   -5.4709   -0.4047    0.0000 H   0  0  0

+   -5.4926    1.9951    0.0000 H   0  0  0

+    2.7536   -3.7060    0.0000 H   0  0  0

+    4.8213   -0.1002    0.0000 H   0  0  0

+    1.9280    2.2035    0.0000 H   0  0  0

+    1.8279    1.1167    0.0000 H   0  0  0

+    4.8159   -2.5088    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

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+ 12 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+ 18 21  2  0

+ 20 22  1  0

+  8 11  2  0

+  9 15  1  0

+ 10 13  2  0

+ 14 17  1  0

+ 19 21  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110-96-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    2.4488   -0.0020   -0.3321 C   0  0  0

+    1.1786   -0.6992    0.1593 C   0  0  0

+    2.4701    1.4395    0.1803 C   0  0  0

+    3.6763   -0.7485    0.1941 C   0  0  0

+    0.0000    0.0176   -0.3459 N   0  0  0

+   -1.1786   -0.6992    0.1593 C   0  0  0

+   -2.4488   -0.0020   -0.3321 C   0  0  0

+   -3.6763   -0.7485    0.1941 C   0  0  0

+   -2.4701    1.4395    0.1803 C   0  0  0

+    3.3935    0.5200    0.0000 H   0  0  0

+    0.4664   -1.5103    0.0000 H   0  0  0

+    1.8540   -1.5411    0.0000 H   0  0  0

+    3.5494    1.4236    0.0000 H   0  0  0

+    2.4860    2.5188    0.0000 H   0  0  0

+    1.3908    1.4554    0.0000 H   0  0  0

+    3.1155   -1.6707    0.0000 H   0  0  0

+    4.5985   -1.3093    0.0000 H   0  0  0

+    4.2371    0.1737    0.0000 H   0  0  0

+    0.0000    1.0970    0.0000 H   0  0  0

+   -1.8540   -1.5411    0.0000 H   0  0  0

+   -0.4664   -1.5103    0.0000 H   0  0  0

+   -3.3935    0.5200    0.0000 H   0  0  0

+   -4.2371    0.1737    0.0000 H   0  0  0

+   -4.5985   -1.3093    0.0000 H   0  0  0

+   -3.1155   -1.6707    0.0000 H   0  0  0

+   -1.3908    1.4554    0.0000 H   0  0  0

+   -2.4860    2.5188    0.0000 H   0  0  0

+   -3.5494    1.4236    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  7  9  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+  9 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2052-07-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -0.7256   -1.7071    0.1217 Br  0  0  0

+   -1.2728    0.0993    0.0058 C   0  0  0

+   -0.3202    1.1142   -0.0710 C   0  0  0

+   -2.6174    0.4157   -0.0086 C   0  0  0

+    1.1256    0.7806   -0.0627 C   0  0  0

+   -0.7309    2.4430   -0.1561 C   0  0  0

+   -3.0184    1.7363   -0.0932 C   0  0  0

+    1.9523    1.2787    0.9421 C   0  0  0

+    1.6605   -0.0367   -1.0567 C   0  0  0

+   -2.0768    2.7476   -0.1639 C   0  0  0

+    3.2965    0.9648    0.9452 C   0  0  0

+    3.0058   -0.3440   -1.0439 C   0  0  0

+    3.8230    0.1576   -0.0467 C   0  0  0

+   -3.3257   -0.3392    0.0000 H   0  0  0

+   -0.0277    3.2027    0.0000 H   0  0  0

+   -4.0269    1.9697    0.0000 H   0  0  0

+    1.7910    2.3012    0.0000 H   0  0  0

+    1.0692   -0.8864    0.0000 H   0  0  0

+   -2.3820    3.7368    0.0000 H   0  0  0

+    3.8905    1.8126    0.0000 H   0  0  0

+    3.1738   -1.3655    0.0000 H   0  0  0

+    4.8330   -0.0695    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  2  0

+  8  5  2  0

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+ 10  6  2  0

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+ 13 11  2  0

+  7 10  1  0

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+  4 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+141-86-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.0001   -0.9348    0.0000 N   0  0  0

+   -1.1560   -0.2878   -0.0001 C   0  0  0

+    1.1561   -0.2876   -0.0001 C   0  0  0

+   -1.1911    1.1018    0.0001 C   0  0  0

+   -2.3461   -1.0058    0.0001 N   0  0  0

+    1.1911    1.1015    0.0001 C   0  0  0

+    2.3462   -1.0057    0.0001 N   0  0  0

+   -0.0001    1.8090   -0.0001 C   0  0  0

+   -2.1019    1.6051    0.0000 H   0  0  0

+   -3.2572   -0.5029    0.0000 H   0  0  0

+   -2.3261   -2.0462    0.0000 H   0  0  0

+    2.1019    1.6048    0.0000 H   0  0  0

+    2.3261   -2.0461    0.0000 H   0  0  0

+    3.2573   -0.5029    0.0000 H   0  0  0

+    0.0000    2.8496    0.0000 H   0  0  0

+  1  2  2  0

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+  5 10  1  0

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+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+37962-27-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -4.1403   -0.1207   -0.0042 C   0  0  0

+   -5.3264   -0.7723   -0.0057 O   0  0  0

+   -4.4463    1.3184    0.0045 C   0  0  0

+   -2.8832   -0.6964   -0.0046 C   0  0  0

+   -6.3230    0.1174    0.0012 C   0  0  0

+   -5.8097    1.4112    0.0076 C   0  0  0

+   -1.7931    0.0782   -0.0030 N   0  0  0

+   -7.7642   -0.2234    0.0019 N   0  3  0

+   -0.6202   -0.4590   -0.0034 N   0  0  0

+   -8.5996    0.6630    0.0085 O   0  0  0

+   -8.1711   -1.5796   -0.0050 O   0  5  0

+    0.4784    0.3216   -0.0017 C   0  0  0

+    1.7612   -0.2658   -0.0022 C   0  0  0

+    0.3640    1.5343    0.0002 O   0  0  0

+    2.8736    0.5245   -0.0004 C   0  0  0

+    4.1548   -0.0622   -0.0009 C   0  0  0

+    5.3328    0.5974    0.0006 O   0  0  0

+    4.4326   -1.4227    0.0030 C   0  0  0

+    6.3385   -0.2873   -0.0004 C   0  0  0

+    5.8253   -1.5434    0.0008 C   0  0  0

+    7.7796    0.0513    0.0007 N   0  3  0

+    8.6137   -0.8363   -0.0004 O   0  0  0

+    8.1884    1.4070    0.0031 O   0  5  0

+   -3.7751    2.0920    0.0000 H   0  0  0

+   -2.7869   -1.7160    0.0000 H   0  0  0

+   -6.3560    2.2775    0.0000 H   0  0  0

+   -0.5239   -1.4786    0.0000 H   0  0  0

+    1.8575   -1.2854    0.0000 H   0  0  0

+    2.7773    1.5441    0.0000 H   0  0  0

+    3.7512   -2.1873    0.0000 H   0  0  0

+    6.3591   -2.4175    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+ 15 16  1  0

+ 16 17  1  0

+ 16 18  2  0

+ 17 19  1  0

+ 18 20  1  0

+ 19 21  1  0

+ 21 22  2  0

+ 21 23  1  0

+  5  6  2  0

+ 19 20  2  0

+  3 24  1  0

+  4 25  1  0

+  6 26  1  0

+  9 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 18 30  1  0

+ 20 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+771-29-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.2491    0.2401    0.1296 C   0  0  0

+   -1.1684   -0.7686   -0.0500 C   0  0  0

+    1.2291   -0.0224    0.2529 C   0  0  0

+   -0.6807    1.5581    0.2087 C   0  0  0

+   -0.7723   -2.2186   -0.1492 C   0  0  0

+   -2.5190   -0.4591   -0.1482 C   0  0  0

+    1.5729   -1.4152   -0.2711 C   0  0  0

+    1.9510    0.9591   -0.4938 O   0  0  0

+   -2.0224    1.8633    0.1126 C   0  0  0

+    0.6377   -2.4286    0.3992 C   0  0  0

+   -2.9455    0.8504   -0.0707 C   0  0  0

+    3.2416    1.1431    0.1833 O   0  0  0

+    2.2435   -0.2239    0.0000 H   0  0  0

+    0.0159    2.3225    0.0000 H   0  0  0

+   -1.7980   -2.3511    0.0000 H   0  0  0

+   -0.7823   -3.2528    0.0000 H   0  0  0

+   -3.2168   -1.2224    0.0000 H   0  0  0

+    2.1831   -2.2503    0.0000 H   0  0  0

+    2.5102   -0.9780    0.0000 H   0  0  0

+   -2.3320    2.8501    0.0000 H   0  0  0

+    0.2860   -3.4012    0.0000 H   0  0  0

+    1.5215   -2.9658    0.0000 H   0  0  0

+   -3.9566    1.0681    0.0000 H   0  0  0

+    4.2655    1.2891    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+  7 10  1  0

+  9 11  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97919-22-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -2.6714    1.4095   -0.0356 C   0  0  0

+   -3.2669    0.1244   -0.0139 C   0  0  0

+   -1.3377    1.5213   -0.0789 N   0  0  0

+   -3.4923    2.5495   -0.0053 C   0  0  0

+   -2.4918   -0.9671   -0.0369 N   0  0  0

+   -4.6683    0.0160    0.0321 C   0  0  0

+   -0.5920    0.4331   -0.1009 C   0  0  0

+   -4.8453    2.4069    0.0443 C   0  0  0

+   -1.1877   -0.8407   -0.0793 C   0  0  0

+   -5.4325    1.1438    0.0552 C   0  0  0

+   -5.4213   -1.5479    0.0589 Cl  0  0  0

+    0.7894    0.5462   -0.1458 N   0  0  0

+    1.7356   -0.8070   -0.0189 S   0  0  0

+    3.4151   -0.2749    0.0070 C   0  0  0

+    1.4787   -1.3378    1.2739 O   0  0  0

+    1.5718   -1.5088   -1.2436 O   0  0  0

+    4.0589   -0.0811    1.2157 C   0  0  0

+    4.0882   -0.0574   -1.1810 C   0  0  0

+    5.3750    0.3358    1.2397 C   0  0  0

+    5.4048    0.3597   -1.1643 C   0  0  0

+    6.0526    0.5607    0.0478 C   0  0  0

+    7.3838    0.9830    0.0684 N   0  0  0

+   -3.0721    3.4883    0.0000 H   0  0  0

+   -5.4432    3.2438    0.0000 H   0  0  0

+   -0.5943   -1.6808    0.0000 H   0  0  0

+   -6.4578    1.0614    0.0000 H   0  0  0

+    1.2270    1.4771    0.0000 H   0  0  0

+    4.3625   -1.0639    0.0000 H   0  0  0

+    3.7747    0.9223    0.0000 H   0  0  0

+    5.6923   -0.6426    0.0000 H   0  0  0

+    5.0971    1.3412    0.0000 H   0  0  0

+    8.1434    0.2894    0.0000 H   0  0  0

+    7.6047    1.9876    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+ 13 16  2  0

+ 14 17  1  0

+ 14 18  2  0

+ 17 19  2  0

+ 18 20  1  0

+ 19 21  1  0

+ 21 22  1  0

+  7  9  1  0

+  8 10  1  0

+ 20 21  2  0

+  4 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58-55-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.9824    0.6813   -0.0021 C   0  0  0

+   -0.9769   -0.7084   -0.0020 C   0  0  0

+    0.3036    1.3806   -0.0010 C   0  0  0

+   -2.2767    1.0810    0.0021 N   0  0  0

+    0.2271   -1.3745   -0.0009 N   0  0  0

+   -2.2792   -1.0973   -0.0026 N   0  0  0

+    1.4367    0.6455    0.0001 N   0  0  0

+    0.3507    2.5970   -0.0014 O   0  0  0

+   -3.0464    0.0312    0.0047 C   0  0  0

+    1.3886   -0.6970    0.0006 C   0  0  0

+    0.2437   -2.8394   -0.0007 C   0  0  0

+    2.7363    1.3217    0.0007 C   0  0  0

+    2.4320   -1.3215    0.0023 O   0  0  0

+   -2.6203   -2.0561    0.0000 H   0  0  0

+   -4.0639    0.0493    0.0000 H   0  0  0

+   -0.7739   -2.8509    0.0000 H   0  0  0

+    0.2552   -3.8570    0.0000 H   0  0  0

+    1.2613   -2.8279    0.0000 H   0  0  0

+    3.2060    0.4189    0.0000 H   0  0  0

+    3.6391    1.7914    0.0000 H   0  0  0

+    2.2666    2.2245    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  7 12  1  0

+ 10 13  2  0

+  6  9  1  0

+  7 10  1  0

+  6 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+30747-87-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -0.5434   -0.0141   -0.0027 C   0  0  0

+   -0.6183   -1.4264   -0.0009 C   0  0  0

+    0.7497    0.5564   -0.0021 C   0  0  0

+   -1.8496    0.6183    0.0009 C   0  0  0

+    0.5115   -2.2166    0.0009 C   0  0  0

+   -2.3648   -1.7265   -0.0017 S   0  0  0

+    1.8517   -0.2402    0.0001 C   0  0  0

+   -2.9231   -0.1120    0.0052 N   0  0  0

+   -1.9766    2.3496    0.0000 Cl  0  0  0

+    1.7475   -1.6261    0.0010 C   0  0  0

+    3.1941    0.3835    0.0002 N   0  3  0

+    4.1908   -0.3166    0.0022 O   0  0  0

+    3.3020    1.5967   -0.0016 O   0  5  0

+    0.8601    1.6018    0.0000 H   0  0  0

+    0.4251   -3.2642    0.0000 H   0  0  0

+    2.6150   -2.2197    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  6  8  1  0

+  7 10  1  0

+  3 14  1  0

+  5 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-31-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.6580   -0.5641    0.0000 C   0  0  0

+   -0.6843   -0.5730    0.0000 O   0  0  0

+    1.2552    0.4862    0.0000 O   0  0  0

+   -1.4186    0.6797    0.0000 C   0  0  0

+    1.1671   -1.4326    0.0000 H   0  0  0

+   -0.5501    1.1888    0.0000 H   0  0  0

+   -1.9277    1.5482    0.0000 H   0  0  0

+   -2.2871    0.1706    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  1  5  1  0

+  4  6  1  0

+  4  7  1  0

+  4  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+619-23-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    1.2955    0.1968   -0.0434 C   0  0  0

+    0.0949   -0.3571   -0.4458 C   0  0  0

+    1.3631    1.5388    0.2823 C   0  0  0

+    2.5077   -0.6481    0.0448 N   0  3  0

+   -1.0386    0.4308   -0.5227 C   0  0  0

+    0.2299    2.3264    0.2054 C   0  0  0

+    3.5657   -0.1600    0.3995 O   0  0  0

+    2.4471   -1.8314   -0.2372 O   0  5  0

+   -0.9711    1.7724   -0.1971 C   0  0  0

+   -2.3476   -0.1730   -0.9620 C   0  0  0

+   -3.2394   -0.7881    0.4793 Cl  0  0  0

+    0.0068   -1.3607    0.0000 H   0  0  0

+    2.2674    1.9829    0.0000 H   0  0  0

+    0.3180    3.3300    0.0000 H   0  0  0

+   -1.8058    2.3366    0.0000 H   0  0  0

+   -2.3131    0.8339    0.0000 H   0  0  0

+   -3.2314    0.3105    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+ 10 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+546-88-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.5568    0.0110   -0.0013 C   0  0  0

+   -0.5983    0.7054    0.0009 N   0  0  0

+    1.8750    0.7414    0.0001 C   0  0  0

+    0.5354   -1.2016    0.0005 O   0  0  0

+   -1.8369    0.0191   -0.0004 O   0  0  0

+   -0.5800    1.7417    0.0000 H   0  0  0

+    2.3773   -0.1652    0.0000 H   0  0  0

+    2.7816    1.2437    0.0000 H   0  0  0

+    1.3727    1.6480    0.0000 H   0  0  0

+   -2.7435   -0.4832    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112022-07-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+   -0.6535    0.6411    0.0746 C   0  0  0

+   -1.7049    1.5763   -0.0293 C   0  0  0

+    0.6812    1.0291   -0.0012 C   0  0  0

+   -1.1365   -1.0535    0.2941 S   0  0  0

+   -3.1034    1.1797    0.0865 C   0  0  0

+   -1.3649    2.9217   -0.2427 C   0  0  0

+    0.9811    2.3793   -0.2097 C   0  0  0

+    1.7604    0.0337    0.1356 C   0  0  0

+   -2.8764   -1.3191    0.0573 C   0  0  0

+   -3.6727   -0.1575   -0.0319 C   0  0  0

+   -3.8950    2.0777    0.3106 O   0  0  0

+   -0.0441    3.3000   -0.3304 C   0  0  0

+    3.0488    0.4220    0.0605 N   0  0  0

+    1.4879   -1.1375    0.3163 O   0  0  0

+   -3.4217   -2.5814   -0.0363 C   0  0  0

+   -5.0515   -0.3264   -0.2377 C   0  0  0

+    4.1210   -0.5669    0.1964 C   0  0  0

+   -4.7841   -2.7117   -0.2326 C   0  0  0

+   -5.5808   -1.5799   -0.3334 C   0  0  0

+    5.4770    0.1309    0.0735 C   0  0  0

+    6.5522   -0.8608    0.2098 N   0  0  0

+    6.4584   -1.7482   -0.9571 C   0  0  0

+    7.8198   -0.1292    0.0830 C   0  0  0

+   -2.1131    3.6467    0.0000 H   0  0  0

+    1.9732    2.6974    0.0000 H   0  0  0

+    0.1898    4.3152    0.0000 H   0  0  0

+    3.2824    1.4373    0.0000 H   0  0  0

+   -2.8086   -3.4237    0.0000 H   0  0  0

+   -5.6792    0.5051    0.0000 H   0  0  0

+    3.3302   -1.2452    0.0000 H   0  0  0

+    4.7025   -1.4314    0.0000 H   0  0  0

+   -5.2194   -3.6582    0.0000 H   0  0  0

+   -6.6167   -1.6911    0.0000 H   0  0  0

+    6.2678    0.8092    0.0000 H   0  0  0

+    4.8956    0.9954    0.0000 H   0  0  0

+    5.4223   -1.6387    0.0000 H   0  0  0

+    6.3489   -2.7843    0.0000 H   0  0  0

+    7.4945   -1.8577    0.0000 H   0  0  0

+    8.3406   -1.0315    0.0000 H   0  0  0

+    8.7221    0.3916    0.0000 H   0  0  0

+    7.2990    0.7731    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  2  0

+  8 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  1  0

+ 13 17  1  0

+ 15 18  2  0

+ 16 19  2  0

+ 17 20  1  0

+ 20 21  1  0

+ 21 22  1  0

+ 21 23  1  0

+  7 12  1  0

+  9 10  2  0

+ 18 19  1  0

+  6 24  1  0

+  7 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 23 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+144-62-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.7412   -0.0942   -0.0016 C   0  0  0

+   -0.7412    0.0942   -0.0003 C   0  0  0

+    1.5554    0.9769   -0.0008 O   0  0  0

+    1.2102   -1.2123    0.0018 O   0  0  0

+   -1.5554   -0.9769   -0.0010 O   0  0  0

+   -1.2102    1.2123    0.0015 O   0  0  0

+    2.1660    1.7802    0.0000 H   0  0  0

+   -2.1660   -1.7802    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  5  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+142713-63-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    1.6397   -1.1459    0.0102 C   0  0  0

+    0.3429   -1.8977   -0.1447 C   0  0  0

+    2.1543   -0.9103    1.2714 C   0  0  0

+    2.3159   -0.6979   -1.1098 C   0  0  0

+   -0.7749   -0.9507   -0.1327 N   0  0  0

+    3.3434   -0.2217    1.4161 C   0  0  0

+    3.5050   -0.0091   -0.9706 C   0  0  0

+   -2.0396   -1.3995   -0.2579 C   0  0  0

+    4.0209    0.2333    0.2945 C   0  0  0

+   -3.1894   -0.4254   -0.2455 C   0  0  0

+   -2.2523   -2.5872   -0.3804 O   0  0  0

+    5.1905    0.9112    0.4342 O   0  0  0

+   -4.1249   -0.7554    0.9193 C   0  0  0

+   -2.4975    1.4025   -0.0326 Br  0  0  0

+    5.6366    1.2408   -0.8828 C   0  0  0

+   -0.3910   -2.5865    0.0000 H   0  0  0

+    0.9436   -2.7053    0.0000 H   0  0  0

+    2.6165   -1.8044    0.0000 H   0  0  0

+    1.7855    0.1575    0.0000 H   0  0  0

+   -0.5938    0.0393    0.0000 H   0  0  0

+    3.8765   -1.0754    0.0000 H   0  0  0

+    3.0383    0.8826    0.0000 H   0  0  0

+   -3.8930    0.2943    0.0000 H   0  0  0

+   -4.4597    0.1938    0.0000 H   0  0  0

+   -5.0741   -1.0902    0.0000 H   0  0  0

+   -3.7901   -1.7046    0.0000 H   0  0  0

+    6.2347    0.4313    0.0000 H   0  0  0

+    6.4461    1.8389    0.0000 H   0  0  0

+    5.0385    2.0503    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  1  0

+ 12 15  1  0

+  7  9  1  0

+  2 16  1  0

+  2 17  1  0

+  3 18  1  0

+  4 19  1  0

+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120209-97-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.0400    0.8819   -0.0028 C   0  0  0

+   -1.2366   -0.5729   -0.0011 C   0  0  0

+    0.1874    1.3904   -0.0027 N   0  0  0

+   -2.1752    1.7224    0.0015 C   0  0  0

+   -0.1873   -1.3904    0.0005 N   0  0  0

+   -2.5509   -1.0797   -0.0007 C   0  0  0

+    1.2366    0.5731   -0.0011 C   0  0  0

+   -3.4155    1.1754    0.0070 C   0  0  0

+    1.0400   -0.8820    0.0005 C   0  0  0

+   -3.6063   -0.2145   -0.0019 C   0  0  0

+    2.5510    1.0798   -0.0010 C   0  0  0

+    2.1752   -1.7225    0.0017 C   0  0  0

+   -4.9037   -0.7235   -0.0015 N   0  0  0

+    3.6062    0.2145    0.0006 C   0  0  0

+    3.4155   -1.1755    0.0013 C   0  0  0

+    4.9037    0.7234    0.0003 N   0  0  0

+   -2.0594    2.7612    0.0000 H   0  0  0

+   -2.7167   -2.1117    0.0000 H   0  0  0

+   -4.2502    1.8046    0.0000 H   0  0  0

+    2.7170    2.1118    0.0000 H   0  0  0

+    2.0594   -2.7613    0.0000 H   0  0  0

+   -5.7208   -0.0717    0.0000 H   0  0  0

+   -5.0596   -1.7571    0.0000 H   0  0  0

+    4.2502   -1.8047    0.0000 H   0  0  0

+    5.7208    0.0715    0.0000 H   0  0  0

+    5.0597    1.7570    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  2  0

+ 12 15  2  0

+ 14 16  1  0

+  7  9  1  0

+  8 10  1  0

+ 14 15  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67-72-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.7650    0.0000    0.0000 C   0  0  0

+   -0.7650    0.0000    0.0000 C   0  0  0

+    1.3660   -0.0161    1.6998 Cl  0  0  0

+    1.3660   -1.4640   -0.8639 Cl  0  0  0

+    1.3660    1.4801   -0.8360 Cl  0  0  0

+   -1.3660   -1.4801    0.8360 Cl  0  0  0

+   -1.3660    1.4640    0.8639 Cl  0  0  0

+   -1.3660    0.0161   -1.6998 Cl  0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5447-11-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+    0.7797    1.2448   -0.4684 O   0  0  0

+   -0.1704    0.3680    0.1403 C   0  0  0

+    2.0021    0.6717   -0.3084 C   0  0  0

+   -1.5536    0.9486   -0.0031 C   0  0  0

+    3.1352    1.3019   -0.8040 C   0  0  0

+    2.1190   -0.5404    0.3552 C   0  0  0

+   -2.6165    0.2897    0.4994 N   0  0  0

+   -1.7103    2.0089   -0.5707 O   0  0  0

+    2.9924    2.8222   -1.6298 Cl  0  0  0

+    4.3776    0.7178   -0.6399 C   0  0  0

+    3.3631   -1.1215    0.5174 C   0  0  0

+   -3.9612    0.8542    0.3600 C   0  0  0

+    4.4919   -0.4938    0.0176 C   0  0  0

+    3.5102   -2.6385    1.3484 Cl  0  0  0

+   -4.9858   -0.2800    0.2911 C   0  0  0

+   -4.2629    1.7322    1.5470 C   0  0  0

+    6.0529   -1.2252    0.2224 Cl  0  0  0

+   -4.6794   -1.1715   -0.9140 C   0  0  0

+   -5.0028    2.6797    1.4251 O   0  0  0

+   -3.7098    1.4618    2.7397 O   0  0  0

+   -5.8941   -2.5163   -0.9957 S   0  0  0

+   -5.3027   -3.3857   -2.4739 C   0  0  0

+   -0.6697   -0.4648    0.0000 H   0  0  0

+    0.5829   -0.2447    0.0000 H   0  0  0

+    1.3259   -1.1006    0.0000 H   0  0  0

+   -2.5401   -0.6783    0.0000 H   0  0  0

+    5.1720    1.2762    0.0000 H   0  0  0

+   -3.2521    1.5176    0.0000 H   0  0  0

+   -5.5871    0.4825    0.0000 H   0  0  0

+   -5.8382   -0.7450    0.0000 H   0  0  0

+   -4.0781   -1.9339    0.0000 H   0  0  0

+   -3.8270   -0.7065    0.0000 H   0  0  0

+   -2.8374    1.0353    0.0000 H   0  0  0

+   -6.1056   -3.9319    0.0000 H   0  0  0

+   -4.7565   -4.1886    0.0000 H   0  0  0

+   -4.4998   -2.8395    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  4  2  0

+  9  5  1  0

+ 10  5  1  0

+ 11  6  2  0

+ 12  7  1  0

+ 13 10  2  0

+ 14 11  1  0

+ 15 12  1  0

+ 16 12  1  0

+ 17 13  1  0

+ 18 15  1  0

+ 19 16  2  0

+ 20 16  1  0

+ 21 18  1  0

+ 22 21  1  0

+ 11 13  1  0

+  2 23  1  0

+  2 24  1  0

+  6 25  1  0

+  7 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 20 33  1  0

+ 22 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120302-30-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.7090   -0.0822    0.2789 C   0  0  0

+   -0.0989   -1.1964   -0.0125 C   0  0  0

+    2.0831   -0.5854    0.3468 C   0  0  0

+    0.1284    1.1783    0.4320 C   0  0  0

+   -1.4738   -1.0265   -0.1403 C   0  0  0

+    0.7347   -2.2878   -0.1115 N   0  0  0

+    2.0303   -1.9048    0.1054 C   0  0  0

+    3.3212    0.2248    0.6328 C   0  0  0

+   -1.2235    1.3232    0.2977 C   0  0  0

+   -2.0262    0.2252    0.0192 C   0  0  0

+    3.9019    0.7501   -0.6816 C   0  0  0

+   -3.4891    0.4032   -0.1178 N   0  3  0

+    5.0759    1.5182   -0.4104 O   0  0  0

+   -3.9841    1.5073    0.0219 O   0  0  0

+   -4.1981   -0.5545   -0.3703 O   0  5  0

+    0.7282    2.0132    0.0000 H   0  0  0

+   -2.0870   -1.8517    0.0000 H   0  0  0

+    0.4157   -3.2651    0.0000 H   0  0  0

+    2.8414   -2.5365    0.0000 H   0  0  0

+    3.4318   -0.7973    0.0000 H   0  0  0

+    4.2820   -0.1410    0.0000 H   0  0  0

+   -1.6393    2.2634    0.0000 H   0  0  0

+    3.7913    1.7722    0.0000 H   0  0  0

+    2.9411    1.1160    0.0000 H   0  0  0

+    5.9362    2.0811    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  8 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 12 14  2  0

+ 12 15  1  0

+  6  7  1  0

+  9 10  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97-56-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    2.3205   -0.0144   -0.0014 C   0  0  0

+    1.0013    0.3446   -0.0014 N   0  0  0

+    3.3151    0.9669   -0.0014 C   0  0  0

+    2.6807   -1.3649    0.0043 C   0  0  0

+    0.0856   -0.5640   -0.0015 N   0  0  0

+    4.6440    0.5972   -0.0014 C   0  0  0

+    2.9369    2.4257   -0.0018 C   0  0  0

+    4.0133   -1.7194    0.0042 C   0  0  0

+   -1.2309   -0.2057   -0.0015 C   0  0  0

+    4.9930   -0.7418   -0.0015 C   0  0  0

+   -2.2255   -1.1896   -0.0015 C   0  0  0

+   -1.5898    1.1469    0.0044 C   0  0  0

+   -3.5526   -0.8241   -0.0011 C   0  0  0

+   -2.9188    1.5042    0.0049 C   0  0  0

+   -3.9055    0.5222   -0.0005 C   0  0  0

+   -4.6248   -1.8831   -0.0016 C   0  0  0

+   -5.2491    0.8879   -0.0005 N   0  0  0

+    1.9449   -2.1012    0.0000 H   0  0  0

+    5.3860    1.3272    0.0000 H   0  0  0

+    3.9445    2.6869    0.0000 H   0  0  0

+    2.6757    3.4333    0.0000 H   0  0  0

+    1.9293    2.1645    0.0000 H   0  0  0

+    4.2831   -2.7248    0.0000 H   0  0  0

+    5.9974   -1.0152    0.0000 H   0  0  0

+   -1.9623   -2.1967    0.0000 H   0  0  0

+   -0.8525    1.8817    0.0000 H   0  0  0

+   -3.1866    2.5101    0.0000 H   0  0  0

+   -5.3563   -1.1425    0.0000 H   0  0  0

+   -5.3654   -2.6146    0.0000 H   0  0  0

+   -3.8933   -2.6237    0.0000 H   0  0  0

+   -5.5145    1.8944    0.0000 H   0  0  0

+   -5.9880    0.1548    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  9 11  2  0

+  9 12  1  0

+ 11 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+ 13 16  1  0

+ 15 17  1  0

+  8 10  1  0

+ 14 15  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+82-28-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -0.9213    0.2935    0.0779 C   0  0  0

+   -0.6671   -1.0925    0.0561 C   0  0  0

+    0.1992    1.2403    0.2181 C   0  0  0

+   -2.2360    0.7574   -0.0395 C   0  0  0

+    0.7234   -1.5828    0.1736 C   0  0  0

+   -1.7225   -1.9854   -0.0765 C   0  0  0

+    1.5841    0.7550    0.0276 C   0  0  0

+   -0.0118    2.4071    0.4868 O   0  0  0

+   -3.2802   -0.1589   -0.1770 C   0  0  0

+   -2.5000    2.1180   -0.0190 N   0  0  0

+    1.8408   -0.6282    0.0061 C   0  0  0

+    0.9449   -2.7549    0.4054 O   0  0  0

+   -3.0224   -1.5125   -0.1876 C   0  0  0

+    2.6335    1.6537   -0.1305 C   0  0  0

+   -4.6983    0.3348   -0.3044 C   0  0  0

+    3.1422   -1.0858   -0.1733 C   0  0  0

+    3.9227    1.1818   -0.3076 C   0  0  0

+    4.1751   -0.1778   -0.3295 C   0  0  0

+   -1.5400   -3.0077    0.0000 H   0  0  0

+   -1.7160    2.7990    0.0000 H   0  0  0

+   -3.4818    2.4564    0.0000 H   0  0  0

+   -3.8133   -2.1855    0.0000 H   0  0  0

+    2.4490    2.6756    0.0000 H   0  0  0

+   -4.3569    1.3155    0.0000 H   0  0  0

+   -5.6790    0.6762    0.0000 H   0  0  0

+   -5.0397   -0.6459    0.0000 H   0  0  0

+    3.3399   -2.1053    0.0000 H   0  0  0

+    4.7158    1.8522    0.0000 H   0  0  0

+    5.1565   -0.5173    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 14 17  2  0

+ 16 18  2  0

+  7 11  2  0

+  9 13  2  0

+ 17 18  1  0

+  6 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112-92-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 56                          1 V2000

+   -0.1879   -0.4679   -0.0051 C   0  0  0

+   -1.4365    0.4162    0.0045 C   0  0  0

+    1.0620    0.4145    0.0045 C   0  0  0

+   -2.6863   -0.4662   -0.0051 C   0  0  0

+    2.3106   -0.4697   -0.0051 C   0  0  0

+   -3.9349    0.4180    0.0046 C   0  0  0

+    3.5604    0.4128    0.0045 C   0  0  0

+   -5.1848   -0.4645   -0.0051 C   0  0  0

+    4.8091   -0.4714   -0.0051 C   0  0  0

+   -6.4334    0.4197    0.0046 C   0  0  0

+    6.0589    0.4111    0.0045 C   0  0  0

+   -7.6832   -0.4628   -0.0050 C   0  0  0

+    7.3075   -0.4731   -0.0052 C   0  0  0

+   -8.9319    0.4214    0.0046 C   0  0  0

+    8.5574    0.4093    0.0045 C   0  0  0

+  -10.1817   -0.4610   -0.0050 C   0  0  0

+    9.8060   -0.4748   -0.0052 C   0  0  0

+  -11.4303    0.4231    0.0046 C   0  0  0

+   10.9733    0.3494    0.0038 O   0  0  0

+   -0.9526   -1.3234    0.0000 H   0  0  0

+    0.5756   -1.3245    0.0000 H   0  0  0

+   -0.6718    1.2717    0.0000 H   0  0  0

+   -2.2001    1.2727    0.0000 H   0  0  0

+    1.8268    1.2700    0.0000 H   0  0  0

+    0.2985    1.2711    0.0000 H   0  0  0

+   -3.4511   -1.3217    0.0000 H   0  0  0

+   -1.9228   -1.3228    0.0000 H   0  0  0

+    1.5459   -1.3252    0.0000 H   0  0  0

+    3.0742   -1.3262    0.0000 H   0  0  0

+   -3.1701    1.2735    0.0000 H   0  0  0

+   -4.6985    1.2746    0.0000 H   0  0  0

+    4.3251    1.2683    0.0000 H   0  0  0

+    2.7968    1.2693    0.0000 H   0  0  0

+   -5.9496   -1.3200    0.0000 H   0  0  0

+   -4.4212   -1.3211    0.0000 H   0  0  0

+    4.0444   -1.3269    0.0000 H   0  0  0

+    5.5727   -1.3279    0.0000 H   0  0  0

+   -5.6687    1.2752    0.0000 H   0  0  0

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+    6.8236    1.2666    0.0000 H   0  0  0

+    5.2953    1.2676    0.0000 H   0  0  0

+   -8.4479   -1.3183    0.0000 H   0  0  0

+   -6.9196   -1.3193    0.0000 H   0  0  0

+    6.5427   -1.3286    0.0000 H   0  0  0

+    8.0710   -1.3297    0.0000 H   0  0  0

+   -8.1672    1.2769    0.0000 H   0  0  0

+   -9.6955    1.2780    0.0000 H   0  0  0

+    9.3221    1.2648    0.0000 H   0  0  0

+    7.7939    1.2659    0.0000 H   0  0  0

+  -10.9464   -1.3165    0.0000 H   0  0  0

+   -9.4181   -1.3175    0.0000 H   0  0  0

+    9.0413   -1.3303    0.0000 H   0  0  0

+   10.5696   -1.3313    0.0000 H   0  0  0

+  -10.7672    1.3596    0.0000 H   0  0  0

+  -12.3668    1.0862    0.0000 H   0  0  0

+  -12.0934   -0.5134    0.0000 H   0  0  0

+   11.9107    1.0113    0.0000 H   0  0  0

+  1  2  1  0

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+  1 20  1  0

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+  2 22  1  0

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+  3 24  1  0

+  3 25  1  0

+  4 26  1  0

+  4 27  1  0

+  5 28  1  0

+  5 29  1  0

+  6 30  1  0

+  6 31  1  0

+  7 32  1  0

+  7 33  1  0

+  8 34  1  0

+  8 35  1  0

+  9 36  1  0

+  9 37  1  0

+ 10 38  1  0

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+ 17 53  1  0

+ 18 54  1  0

+ 18 55  1  0

+ 18 56  1  0

+ 19 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+159092-72-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    1.4992    0.1709   -0.0031 C   0  0  0

+    0.1525    0.7498   -0.0012 C   0  0  0

+    2.6121    1.0416   -0.0019 C   0  0  0

+    1.7013   -1.2105   -0.0003 C   0  0  0

+    0.0186    2.1569    0.0018 C   0  0  0

+   -0.9888   -0.0537   -0.0027 C   0  0  0

+    2.4113    2.4417    0.0016 C   0  0  0

+    3.9048    0.4986   -0.0037 C   0  0  0

+    2.9730   -1.7085   -0.0017 C   0  0  0

+    0.5424   -2.1313    0.0048 N   0  3  0

+    1.1728    2.9744    0.0024 C   0  0  0

+   -1.2645    2.7212    0.0036 C   0  0  0

+   -2.2255    0.5268   -0.0013 C   0  0  0

+    4.0703   -0.8553   -0.0066 C   0  0  0

+    0.0666   -2.5057    1.0616 O   0  0  0

+    0.0645   -2.5146   -1.0480 O   0  5  0

+   -2.3613    1.9096    0.0025 C   0  0  0

+   -3.4346   -0.3271   -0.0030 N   0  3  0

+   -4.5405    0.1831   -0.0018 O   0  0  0

+   -3.3235   -1.5401   -0.0056 O   0  5  0

+   -0.8977   -1.0944    0.0000 H   0  0  0

+    3.2407    3.0768    0.0000 H   0  0  0

+    4.7381    1.1286    0.0000 H   0  0  0

+    3.1227   -2.7424    0.0000 H   0  0  0

+    1.0633    4.0133    0.0000 H   0  0  0

+   -1.3806    3.7594    0.0000 H   0  0  0

+    5.0349   -1.2565    0.0000 H   0  0  0

+   -3.3160    2.3336    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  8 14  2  0

+ 10 15  2  0

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+ 12 17  1  0

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+ 18 19  2  0

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+  7 11  2  0

+  9 14  1  0

+ 13 17  2  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91-19-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+    0.0059    0.7089   -0.0028 C   0  0  0

+    0.0059   -0.7090   -0.0009 C   0  0  0

+    1.2318    1.3973   -0.0022 C   0  0  0

+   -1.1570    1.3691    0.0004 N   0  0  0

+    1.2319   -1.3973    0.0016 C   0  0  0

+   -1.1571   -1.3691   -0.0010 N   0  0  0

+    2.3984    0.6971    0.0002 C   0  0  0

+   -2.2864    0.6982    0.0053 C   0  0  0

+    2.3984   -0.6970    0.0021 C   0  0  0

+   -2.2864   -0.6981   -0.0028 C   0  0  0

+    1.2465    2.4176    0.0000 H   0  0  0

+    1.2467   -2.4176    0.0000 H   0  0  0

+    3.2864    1.1998    0.0000 H   0  0  0

+   -3.1733    1.2029    0.0000 H   0  0  0

+    3.2865   -1.1997    0.0000 H   0  0  0

+   -3.1733   -1.2028    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

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+  7  9  1  0

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+  3 11  1  0

+  5 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-14-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.4697    0.0001    0.0872 C   0  0  0

+   -0.7912   -1.1971    0.2207 C   0  0  0

+   -0.7914    1.1972    0.2179 C   0  0  0

+   -2.9214   -0.0002   -0.2017 N   0  3  0

+    0.5655   -1.1968    0.4848 C   0  0  0

+    0.5657    1.1975    0.4821 C   0  0  0

+   -3.5192    1.0545   -0.3193 O   0  0  0

+   -3.5182   -1.0551   -0.3219 O   0  5  0

+    1.2440    0.0007    0.6155 C   0  0  0

+    2.7234    0.0010    0.9030 C   0  0  0

+    3.6376   -0.0005   -0.6510 Cl  0  0  0

+   -1.3105   -2.0886    0.0000 H   0  0  0

+   -1.3110    2.0886    0.0000 H   0  0  0

+    1.0851   -2.0882    0.0000 H   0  0  0

+    1.0850    2.0890    0.0000 H   0  0  0

+    3.2402    0.8940    0.0000 H   0  0  0

+    2.2079    0.8947    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

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+  6  9  2  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64894-89-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 43                          1 V2000

+    1.4939    0.1581   -0.4743 C   0  0  0

+    0.4491    1.0242   -0.8276 C   0  0  0

+    2.5829    0.6526    0.3719 C   0  0  0

+    1.4950   -1.1823   -0.9248 C   0  0  0

+    0.4989    2.3506   -0.3431 C   0  0  0

+   -0.5944    0.5948   -1.6238 N   0  0  0

+    2.5909    1.9140    0.8088 N   0  0  0

+    3.6256   -0.2178    0.7225 C   0  0  0

+    2.4995   -2.0169   -0.5857 C   0  0  0

+    1.6223    2.7685    0.4983 C   0  0  0

+   -0.5061    3.2778   -0.6503 C   0  0  0

+   -1.7311    0.0421   -1.0425 C   0  0  0

+    3.6041   -1.5504    0.2534 C   0  0  0

+    1.6499    4.0986    0.9709 C   0  0  0

+   -0.4214    4.5485   -0.1625 C   0  0  0

+   -2.7825   -0.3903   -1.8468 C   0  0  0

+   -1.8126   -0.0826    0.3416 C   0  0  0

+    4.5831   -2.3808    0.5781 N   0  0  0

+    0.6442    4.9511    0.6377 C   0  0  0

+   -3.9078   -0.9377   -1.2751 C   0  0  0

+   -2.9355   -0.6292    0.9199 C   0  0  0

+    4.5674   -3.4412    0.2057 N   0  3  0

+   -3.9951   -1.0596    0.1155 C   0  0  0

+    4.5516   -4.5016   -0.1667 N   0  5  0

+   -5.1994   -1.6456    0.7314 C   0  0  0

+   -5.2820   -1.7624    2.0714 O   0  0  0

+   -6.1176   -2.0234    0.0309 O   0  0  0

+    0.6421   -1.5830    0.0000 H   0  0  0

+   -0.9799    1.4546    0.0000 H   0  0  0

+    4.4823    0.1746    0.0000 H   0  0  0

+    2.3616   -2.9491    0.0000 H   0  0  0

+   -1.3813    2.9287    0.0000 H   0  0  0

+    2.5090    4.4858    0.0000 H   0  0  0

+   -1.1783    5.1098    0.0000 H   0  0  0

+   -3.1680    0.4695    0.0000 H   0  0  0

+   -1.1895   -0.7895    0.0000 H   0  0  0

+    0.8045    5.8797    0.0000 H   0  0  0

+   -4.5156   -0.2176    0.0000 H   0  0  0

+   -2.5518   -1.4898    0.0000 H   0  0  0

+   -5.8261   -2.5318    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 25 27  2  0

+  7 10  1  0

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+ 15 19  1  0

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+  4 28  1  0

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+ 11 32  1  0

+ 14 33  1  0

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+ 16 35  1  0

+ 17 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 26 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35142-05-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.2530   -0.4612    0.0379 C   0  0  0

+   -1.2056   -0.6063    0.0215 C   0  0  0

+    0.8046    0.8368    0.0203 C   0  0  0

+    1.0953   -1.5812    0.0645 C   0  0  0

+   -2.0027    0.5597   -0.0153 C   0  0  0

+   -1.8132   -1.8633    0.0420 C   0  0  0

+    2.2124    0.9900    0.0401 C   0  0  0

+   -0.0440    1.9619   -0.0170 C   0  0  0

+    2.4754   -1.4107    0.0829 C   0  0  0

+    0.8191   -2.9157    0.0773 O   0  0  0

+   -3.4041    0.4316   -0.0319 C   0  0  0

+   -1.3885    1.8307   -0.0345 C   0  0  0

+   -3.1754   -1.9627    0.0257 C   0  0  0

+    3.0272   -0.1383    0.0737 C   0  0  0

+    2.8101    2.3332    0.0248 C   0  0  0

+    3.0658   -2.6433    0.1076 O   0  0  0

+    2.0433   -3.5665   -0.3101 C   0  0  0

+   -3.9719   -0.8255   -0.0110 C   0  0  0

+   -4.1917    1.5372   -0.0688 O   0  0  0

+    3.5190    2.7435   -1.0461 O   0  0  0

+    2.6650    3.0739    0.9778 O   0  0  0

+   -5.5455    1.0799   -0.0770 C   0  0  0

+   -1.2272   -2.7260    0.0000 H   0  0  0

+    0.3752    2.9169    0.0000 H   0  0  0

+   -1.9851    2.6862    0.0000 H   0  0  0

+   -3.6229   -2.9048    0.0000 H   0  0  0

+    4.0641   -0.0258    0.0000 H   0  0  0

+    1.4505   -4.4246    0.0000 H   0  0  0

+    2.8271   -4.2546    0.0000 H   0  0  0

+   -5.0103   -0.9227    0.0000 H   0  0  0

+    4.4217    3.2659    0.0000 H   0  0  0

+   -5.8793    2.0680    0.0000 H   0  0  0

+   -6.5336    0.7461    0.0000 H   0  0  0

+   -5.2117    0.0918    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 20 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+18662-53-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 23                          1 V2000

+   -8.7047    0.0081   -0.2847 N   0  0  0

+   -9.1448   -1.3504   -0.6293 C   0  0  0

+   -8.0007    0.5349   -1.4615 C   0  0  0

+   -9.9200    0.8171   -0.1226 C   0  0  0

+   -9.3303   -2.1535    0.6324 C   0  0  0

+   -6.5308    0.2220   -1.3493 C   0  0  0

+   -9.6399    1.9618    0.8167 C   0  0  0

+   -9.7853   -3.2876    0.5743 O   0  0  0

+   -9.0258   -1.6712    1.7148 O   0  0  0

+   -6.0850   -0.2597   -0.3168 O   0  0  0

+   -5.7833    0.4496   -2.2907 O   0  0  0

+   -8.5717    2.0184    1.4105 O   0  0  0

+  -10.4806    2.8345    0.9855 O   0  0  0

+    4.1849   -0.1185   -0.6679 O   0  0  0

+   12.8364   -0.0588   -0.2845 Na  0  3  0

+   21.4880    0.0008    0.0988 Na  0  3  0

+   30.1395    0.0604    0.4822 Na  0  3  0

+   -9.7272   -0.7409    0.0000 H   0  0  0

+   -9.9578   -1.5735    0.0000 H   0  0  0

+   -7.6345    1.2943    0.0000 H   0  0  0

+   -8.6515    1.0708    0.0000 H   0  0  0

+  -10.7103    1.1107    0.0000 H   0  0  0

+  -10.3030    0.0660    0.0000 H   0  0  0

+    3.3418   -0.1185    0.0000 H   0  0  0

+    5.0280   -0.1185    0.0000 H   0  0  0

+   -8.5757   -0.9583    0.0000 H   0  0  0

+   -4.9768    0.6952    0.0000 H   0  0  0

+  -11.0655    3.4417    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  2  0

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+  7 12  2  0

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+  2 18  1  0

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+  3 20  1  0

+  3 21  1  0

+  4 22  1  0

+  4 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 13 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23696-28-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -1.6271    0.9114    0.1635 C   0  0  0

+   -2.3350   -0.2438   -0.2357 C   0  0  0

+   -0.3233    0.8203    0.4701 N   0  3  0

+   -2.3021    2.1409    0.2393 C   0  0  0

+   -1.6803   -1.4452   -0.3055 N   0  3  0

+   -3.6889   -0.1449   -0.5523 C   0  0  0

+    0.3003   -0.3555    0.3980 C   0  0  0

+    0.2911    1.8140    0.8144 O   0  5  0

+   -3.6276    2.2034   -0.0724 C   0  0  0

+   -0.3834   -1.5034    0.0053 C   0  0  0

+   -2.3728   -2.6143   -0.7040 O   0  5  0

+   -4.3185    1.0647   -0.4742 C   0  0  0

+    1.7349   -0.4418    0.7375 C   0  0  0

+    0.3455   -2.8204   -0.0678 C   0  0  0

+    2.6653   -0.1019   -0.1763 N   0  0  0

+    2.0767   -0.8195    1.8415 O   0  0  0

+    4.0885   -0.1875    0.1605 C   0  0  0

+    4.9248    0.2515   -1.0432 C   0  0  0

+    4.5964    1.5996   -1.3851 O   0  0  0

+   -1.7679    2.9970    0.0000 H   0  0  0

+   -4.2435   -0.9879    0.0000 H   0  0  0

+   -4.1018    3.0942    0.0000 H   0  0  0

+   -5.3271    1.0977    0.0000 H   0  0  0

+   -0.5374   -3.3090    0.0000 H   0  0  0

+    0.8341   -3.7033    0.0000 H   0  0  0

+    1.2284   -2.3318    0.0000 H   0  0  0

+    2.5194    0.8966    0.0000 H   0  0  0

+    3.6932   -1.1159    0.0000 H   0  0  0

+    4.8303   -0.8716    0.0000 H   0  0  0

+    5.3195   -0.6772    0.0000 H   0  0  0

+    5.8825    0.5693    0.0000 H   0  0  0

+    4.3576    2.5800    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+ 10 14  1  0

+ 13 15  1  0

+ 13 16  2  0

+ 15 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+  7 10  1  0

+  9 12  1  0

+  4 20  1  0

+  6 21  1  0

+  9 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+759-94-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 30                          1 V2000

+    0.9793    0.2406    0.0566 N   0  0  0

+   -0.0201   -0.6425    0.2516 C   0  0  0

+    0.6916    1.5575   -0.5171 C   0  0  0

+    2.3524   -0.1143    0.4240 C   0  0  0

+   -1.6726   -0.2130   -0.1836 S   0  0  0

+    0.2187   -1.7357    0.7278 O   0  0  0

+    0.1517    2.4828    0.5753 C   0  0  0

+    2.9612   -0.9953   -0.6688 C   0  0  0

+   -3.0147   -1.3988    0.0783 C   0  0  0

+   -0.1487    3.8581   -0.0239 C   0  0  0

+    4.3952   -1.3659   -0.2851 C   0  0  0

+   -4.3375   -0.7813   -0.3798 C   0  0  0

+    1.7255    1.3435    0.0000 H   0  0  0

+    1.3080    2.4147    0.0000 H   0  0  0

+    3.3550    0.2166    0.0000 H   0  0  0

+    2.3176    0.9409    0.0000 H   0  0  0

+   -0.8822    2.6969    0.0000 H   0  0  0

+   -0.4647    1.6256    0.0000 H   0  0  0

+    1.9586   -1.3262    0.0000 H   0  0  0

+    2.9960   -2.0505    0.0000 H   0  0  0

+   -3.5876   -2.2856    0.0000 H   0  0  0

+   -2.2143   -2.0873    0.0000 H   0  0  0

+    0.8828    4.0834    0.0000 H   0  0  0

+   -0.3740    4.8896    0.0000 H   0  0  0

+   -1.1802    3.6328    0.0000 H   0  0  0

+    4.1310   -2.3881    0.0000 H   0  0  0

+    5.4174   -1.6301    0.0000 H   0  0  0

+    4.6594   -0.3437    0.0000 H   0  0  0

+   -3.8909    0.1754    0.0000 H   0  0  0

+   -5.2942   -0.3347    0.0000 H   0  0  0

+   -4.7841   -1.7380    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

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+ 11 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3602-55-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+    1.7860    0.6418   -0.0004 C   0  0  0

+    0.3572    0.1626   -0.0019 C   0  0  0

+    1.8392    2.0882   -0.4963 C   0  0  0

+    2.3468    0.5691    1.4212 C   0  0  0

+    2.6224   -0.2453   -0.9247 C   0  0  0

+    0.0637   -1.2851    0.0003 C   0  0  0

+   -0.6471    1.0499    0.0005 C   0  0  0

+   -1.3367   -1.7548   -0.0007 C   0  0  0

+    0.9739   -2.0891    0.0024 O   0  0  0

+   -2.0476    0.5801   -0.0004 C   0  0  0

+   -2.3410   -0.8675   -0.0034 C   0  0  0

+   -2.9577    1.3842    0.0022 O   0  0  0

+    2.8838    2.0498    0.0000 H   0  0  0

+    1.8776    3.1328    0.0000 H   0  0  0

+    0.7946    2.1266    0.0000 H   0  0  0

+    2.2124   -0.4675    0.0000 H   0  0  0

+    3.3834    0.4347    0.0000 H   0  0  0

+    2.4812    1.6057    0.0000 H   0  0  0

+    1.8618   -0.9624    0.0000 H   0  0  0

+    3.3395   -1.0059    0.0000 H   0  0  0

+    3.3830    0.4718    0.0000 H   0  0  0

+   -0.4394    2.0744    0.0000 H   0  0  0

+   -1.5444   -2.7793    0.0000 H   0  0  0

+   -3.3321   -1.1999    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  6  8  1  0

+  6  9  2  0

+  7 10  1  0

+  8 11  2  0

+ 10 12  2  0

+ 10 11  1  0

+  3 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  4 18  1  0

+  5 19  1  0

+  5 20  1  0

+  5 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6237-22-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    1.2776    0.0835   -0.1686 C   0  0  0

+    0.1641    0.8729   -0.5189 C   0  0  0

+    2.4281    0.7060    0.3832 C   0  0  0

+    1.2624   -1.3097   -0.3524 C   0  0  0

+    0.2498    2.2620   -0.3006 C   0  0  0

+   -0.9704    0.3051   -1.0574 N   0  0  0

+    2.4644    2.0241    0.5724 N   0  0  0

+    3.5355   -0.0950    0.7295 C   0  0  0

+    2.3518   -2.0472   -0.0052 C   0  0  0

+    1.4362    2.8089    0.2559 C   0  0  0

+   -0.8210    3.1123   -0.6259 C   0  0  0

+   -1.8467   -0.0384    0.0705 C   0  0  0

+    3.4862   -1.4388    0.5320 C   0  0  0

+    2.3328   -3.5147   -0.2000 N   0  3  0

+    1.5091    4.2008    0.4694 C   0  0  0

+   -0.7104    4.4502   -0.4046 C   0  0  0

+   -3.1324   -0.6769   -0.4587 C   0  0  0

+    3.3038   -4.1825    0.1080 O   0  0  0

+    1.3463   -4.0541   -0.6683 O   0  5  0

+    0.4529    4.9913    0.1426 C   0  0  0

+   -4.0451   -1.0347    0.7160 C   0  0  0

+   -5.2796   -1.6477    0.2079 N   0  0  0

+   -6.1065   -1.9652    1.3798 C   0  0  0

+   -5.9920   -0.6040   -0.5411 C   0  0  0

+    0.3873   -1.7679    0.0000 H   0  0  0

+   -0.5687   -0.5973    0.0000 H   0  0  0

+    4.4233    0.3382    0.0000 H   0  0  0

+   -1.7275    2.7198    0.0000 H   0  0  0

+   -1.7276    0.9422    0.0000 H   0  0  0

+   -2.6533    0.5318    0.0000 H   0  0  0

+    4.3244   -1.9615    0.0000 H   0  0  0

+    2.4037    4.6197    0.0000 H   0  0  0

+   -1.5206    5.0152    0.0000 H   0  0  0

+   -3.2515   -1.6575    0.0000 H   0  0  0

+   -2.3258   -1.2471    0.0000 H   0  0  0

+    0.5550    5.9738    0.0000 H   0  0  0

+   -3.9260   -0.0541    0.0000 H   0  0  0

+   -4.8517   -0.4645    0.0000 H   0  0  0

+   -6.4606   -1.0430    0.0000 H   0  0  0

+   -7.0287   -2.3193    0.0000 H   0  0  0

+   -5.7524   -2.8874    0.0000 H   0  0  0

+   -5.1761   -0.0471    0.0000 H   0  0  0

+   -6.5489    0.2119    0.0000 H   0  0  0

+   -6.8079   -1.1609    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  8 13  2  0

+  9 14  1  0

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+ 12 17  1  0

+ 14 18  2  0

+ 14 19  1  0

+ 15 20  2  0

+ 17 21  1  0

+ 21 22  1  0

+ 22 23  1  0

+ 22 24  1  0

+  7 10  2  0

+  9 13  1  0

+ 16 20  1  0

+  4 25  1  0

+  6 26  1  0

+  8 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 12 30  1  0

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+ 15 32  1  0

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+ 17 35  1  0

+ 20 36  1  0

+ 21 37  1  0

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+ 23 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+114882-46-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+    0.3275   -0.4819   -0.0017 C   0  0  0

+   -1.0780   -0.5124   -0.0016 C   0  0  0

+    1.0018    0.7521   -0.0002 C   0  0  0

+    1.0721   -1.7414    0.0027 C   0  0  0

+   -1.7949    0.7016   -0.0004 C   0  0  0

+   -1.7552   -1.7554   -0.0022 C   0  0  0

+    2.4667    0.7422   -0.0003 C   0  0  0

+    0.2631    1.9433    0.0019 C   0  0  0

+    2.4611   -1.7158    0.0021 C   0  0  0

+    0.3443   -2.9560    0.0069 C   0  0  0

+   -3.2647    0.6390   -0.0003 C   0  0  0

+   -1.1032    1.9161    0.0002 C   0  0  0

+   -1.0122   -2.9531   -0.0024 C   0  0  0

+   -3.1638   -1.7768   -0.0021 C   0  0  0

+    3.1580   -0.4956   -0.0020 C   0  0  0

+    3.1907    1.9376    0.0006 C   0  0  0

+   -3.8904   -0.6334   -0.0014 C   0  0  0

+   -3.9881    1.7476    0.0012 N   0  0  0

+    4.5673   -0.4890   -0.0021 C   0  0  0

+    4.5555    1.9063    0.0000 C   0  0  0

+   -5.2043    1.6811    0.0012 O   0  0  0

+    5.2399    0.6945   -0.0007 C   0  0  0

+    0.7665    2.8694    0.0000 H   0  0  0

+    2.9987   -2.6226    0.0000 H   0  0  0

+    0.8630   -3.8737    0.0000 H   0  0  0

+   -1.6420    2.8221    0.0000 H   0  0  0

+   -1.5257   -3.8737    0.0000 H   0  0  0

+   -3.6643   -2.7045    0.0000 H   0  0  0

+    2.6838    2.8619    0.0000 H   0  0  0

+   -4.9430   -0.6909    0.0000 H   0  0  0

+    5.0996   -1.3989    0.0000 H   0  0  0

+    5.0973    2.8105    0.0000 H   0  0  0

+    6.2940    0.6931    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

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+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

+  7 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 18 21  2  0

+ 19 22  2  0

+  8 12  2  0

+  9 15  1  0

+ 10 13  2  0

+ 14 17  2  0

+ 20 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 22 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55302-96-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.2728   -0.0045   -0.1385 C   0  0  0

+    0.6594   -1.0332   -0.1598 C   0  0  0

+    0.1503    1.3109    0.0061 C   0  0  0

+   -1.6336   -0.2912   -0.2682 N   0  0  0

+    2.0090   -0.7441   -0.0366 C   0  0  0

+    1.4969    1.5946    0.1286 C   0  0  0

+   -2.6164    0.7950   -0.2456 C   0  0  0

+    2.4259    0.5720    0.1076 C   0  0  0

+    2.9240   -1.7488   -0.0566 O   0  0  0

+   -4.0226    0.2138   -0.4052 C   0  0  0

+    3.8937    0.8861    0.2416 C   0  0  0

+   -4.2885   -0.6915    0.6681 O   0  0  0

+    0.3415   -2.0195    0.0000 H   0  0  0

+   -0.5435    2.0806    0.0000 H   0  0  0

+   -1.9535   -1.2768    0.0000 H   0  0  0

+    1.8158    2.5806    0.0000 H   0  0  0

+   -1.7736    1.3979    0.0000 H   0  0  0

+   -3.1191    1.7012    0.0000 H   0  0  0

+    3.6217   -2.5149    0.0000 H   0  0  0

+   -4.1939    1.2358    0.0000 H   0  0  0

+   -5.0570    0.2757    0.0000 H   0  0  0

+    4.1105   -0.1272    0.0000 H   0  0  0

+    4.9070    1.1029    0.0000 H   0  0  0

+    3.6769    1.8994    0.0000 H   0  0  0

+   -4.5805   -1.6858    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  7 10  1  0

+  8 11  1  0

+ 10 12  1  0

+  6  8  2  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2085-88-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    1.4439   -0.1455   -0.1878 C   0  0  0

+   -0.0577   -0.0634   -0.0912 C   0  0  0

+    2.2458    1.1315    0.0715 C   0  0  0

+    2.1999    0.0534    1.0084 O   0  0  0

+    1.9897   -1.1325   -1.2216 C   0  0  0

+   -0.7865   -1.1702    0.3013 C   0  0  0

+   -0.7060    1.1207   -0.3899 C   0  0  0

+   -2.1642   -1.0949    0.3899 C   0  0  0

+   -2.0832    1.1960   -0.3013 C   0  0  0

+   -2.8127    0.0871    0.0858 C   0  0  0

+    3.2093    1.4383    0.0000 H   0  0  0

+    1.6265    1.9308    0.0000 H   0  0  0

+    1.1048   -1.6218    0.0000 H   0  0  0

+    2.4790   -2.0174    0.0000 H   0  0  0

+    2.8746   -0.6432    0.0000 H   0  0  0

+   -0.3313   -2.0731    0.0000 H   0  0  0

+   -0.1670    1.9762    0.0000 H   0  0  0

+   -2.7029   -1.9506    0.0000 H   0  0  0

+   -2.5386    2.0988    0.0000 H   0  0  0

+   -3.8230    0.1276    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  7  9  2  0

+  8 10  2  0

+  3  4  1  0

+  9 10  1  0

+  3 11  1  0

+  3 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-07-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    0.0036   -0.4683    0.0000 C   0  0  0

+   -1.3472    0.1998    0.0000 C   0  0  0

+    1.0085    0.2015    0.0000 O   0  0  0

+    0.0690   -1.4842    0.0000 H   0  0  0

+   -0.8959    1.1123    0.0000 H   0  0  0

+   -2.2597    0.6511    0.0000 H   0  0  0

+   -1.7985   -0.7127    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+148193-31-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+    0.9742   -0.3499   -0.0025 C   0  0  0

+   -0.1445    0.5120   -0.0009 C   0  0  0

+    2.2717    0.1343   -0.0013 C   0  0  0

+    0.2315   -1.9588    0.0010 S   0  0  0

+   -1.4066   -0.2043   -0.0027 C   0  0  0

+    0.1171    1.9026    0.0017 C   0  0  0

+    2.4835    1.5040    0.0017 C   0  0  0

+    3.3554   -0.7485   -0.0025 N   0  0  0

+   -1.4150   -1.5030    0.0043 N   0  0  0

+   -2.9040    0.6740   -0.0011 Cl  0  0  0

+    1.3946    2.3670    0.0025 C   0  0  0

+   -0.6861    2.5847    0.0000 H   0  0  0

+    3.4646    1.8886    0.0000 H   0  0  0

+    3.1875   -1.7888    0.0000 H   0  0  0

+    4.3402   -0.3737    0.0000 H   0  0  0

+    1.5633    3.4072    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  5  9  2  0

+  7 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  8 15  1  0

+ 11 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2154-67-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -2.4440    1.1994   -0.0499 O   0  0  0

+   -1.4251    0.3424   -0.6564 N   0  0  0

+   -0.1102    0.9068   -0.2720 C   0  0  0

+   -1.4633   -0.9464    0.0737 C   0  0  0

+    0.4909    1.6918   -1.4397 C   0  0  0

+   -0.2600    1.8121    0.9523 C   0  0  0

+    0.7584   -0.2849    0.0594 C   0  0  0

+   -2.1397   -0.7647    1.4339 C   0  0  0

+   -2.2068   -1.9998   -0.7500 C   0  0  0

+   -0.0179   -1.3482    0.2578 C   0  0  0

+    2.2252   -0.2721    0.1481 C   0  0  0

+    2.7732    0.2956    1.0725 O   0  0  0

+    2.9629   -0.8900   -0.7959 O   0  0  0

+   -3.1841    1.8219    0.0000 H   0  0  0

+    1.2587    1.1039    0.0000 H   0  0  0

+    1.0788    2.4596    0.0000 H   0  0  0

+   -0.2769    2.2797    0.0000 H   0  0  0

+    0.6941    1.9700    0.0000 H   0  0  0

+   -0.4179    2.7662    0.0000 H   0  0  0

+   -1.2141    1.6542    0.0000 H   0  0  0

+   -1.8888    0.1692    0.0000 H   0  0  0

+   -3.0736   -0.5138    0.0000 H   0  0  0

+   -2.3906   -1.6986    0.0000 H   0  0  0

+   -2.9969   -1.4422    0.0000 H   0  0  0

+   -2.7644   -2.7899    0.0000 H   0  0  0

+   -1.4167   -2.5574    0.0000 H   0  0  0

+    0.2996   -2.2616    0.0000 H   0  0  0

+    3.7042   -1.5109    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  3  1  0

+  8  4  1  0

+  9  4  1  0

+ 10  4  1  0

+ 11  7  1  0

+ 12 11  2  0

+ 13 11  1  0

+  7 10  2  0

+  1 14  1  0

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+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 13 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+497-19-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+    0.0000   -0.0349    0.0014 C   0  0  0

+    0.0000   -1.2492   -0.0004 O   0  0  0

+    1.1651    0.6377   -0.0003 O   0  0  0

+   -1.1651    0.6378   -0.0003 O   0  0  0

+    2.0389    1.1422    0.0000 H   0  0  0

+   -2.0389    1.1423    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  3  5  1  0

+  4  6  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96563-06-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+    0.2309   -0.4423   -0.0243 C   0  0  0

+   -1.2446   -0.5999   -0.0196 C   0  0  0

+    0.5530    0.9019   -0.1881 C   0  0  0

+    1.2556   -1.3813    0.1080 C   0  0  0

+   -1.8445    0.6458   -0.1805 C   0  0  0

+   -2.0470   -1.7348    0.1133 C   0  0  0

+   -0.7417    1.6695   -0.2965 C   0  0  0

+    1.8725    1.3009   -0.2239 C   0  0  0

+    2.5725   -0.9734    0.0693 C   0  0  0

+   -3.2186    0.7570   -0.2081 C   0  0  0

+   -3.4206   -1.6141    0.0844 C   0  0  0

+   -0.8442    2.6631    0.8624 C   0  0  0

+    2.8830    0.3645   -0.0969 C   0  0  0

+    3.6773   -1.9883    0.2127 C   0  0  0

+   -4.0077   -0.3717   -0.0758 C   0  0  0

+    4.3242    0.8030   -0.1364 C   0  0  0

+    1.0289   -2.3916    0.0000 H   0  0  0

+   -1.6117   -2.6743    0.0000 H   0  0  0

+   -1.7108    2.0341    0.0000 H   0  0  0

+    2.1054    2.3098    0.0000 H   0  0  0

+   -3.6596    1.6938    0.0000 H   0  0  0

+   -4.0125   -2.4637    0.0000 H   0  0  0

+    0.1858    2.7694    0.0000 H   0  0  0

+   -0.9505    3.6931    0.0000 H   0  0  0

+   -1.8742    2.5568    0.0000 H   0  0  0

+    2.9768   -2.7508    0.0000 H   0  0  0

+    4.4398   -2.6888    0.0000 H   0  0  0

+    4.3778   -1.2258    0.0000 H   0  0  0

+   -5.0394   -0.2845    0.0000 H   0  0  0

+    4.6256   -0.1876    0.0000 H   0  0  0

+    5.3148    1.1044    0.0000 H   0  0  0

+    4.0228    1.7936    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86470-99-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.1889   -0.0023   -0.0261 C   0  0  0

+   -1.6582   -0.0955    0.0021 C   0  0  0

+    0.4292    1.3346   -0.0830 C   0  0  0

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+   -2.2463   -1.2671    0.0531 C   0  0  0

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+   -0.4314    2.5267   -0.1104 C   0  0  0

+    2.0119   -0.9730   -0.0244 C   0  0  0

+   -0.1114   -2.4072    0.0669 C   0  0  0

+   -1.7406    2.4436   -0.0853 C   0  0  0

+   -3.7553    1.0871   -0.0032 C   0  0  0

+   -1.4278   -2.4911    0.0825 C   0  0  0

+   -3.7171   -1.3367    0.0807 C   0  0  0

+    2.5710    0.2186   -0.0805 C   0  0  0

+   -4.4240   -0.2252    0.0538 C   0  0  0

+    4.0729    0.3384   -0.1105 C   0  0  0

+    4.6060    0.4293    1.3208 C   0  0  0

+    4.6296   -0.8097   -0.7540 O   0  0  0

+    2.2171    2.4298    0.0000 H   0  0  0

+    0.0392    3.5236    0.0000 H   0  0  0

+    2.6396   -1.8792    0.0000 H   0  0  0

+    0.4986   -3.3254    0.0000 H   0  0  0

+   -2.3339    3.3727    0.0000 H   0  0  0

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+   -1.9161   -3.4794    0.0000 H   0  0  0

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+    4.7913   -0.6574    0.0000 H   0  0  0

+    5.6927    0.6146    0.0000 H   0  0  0

+    4.4207    1.5160    0.0000 H   0  0  0

+    5.1106   -1.8016    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2984-50-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -2.5454    0.2034   -0.5273 C   0  0  0

+   -3.8064   -0.5658   -0.1283 C   0  0  0

+   -3.3840    0.6170    0.5533 O   0  0  0

+   -1.3134   -0.5135    0.0288 C   0  0  0

+   -0.0525    0.2557   -0.3702 C   0  0  0

+    1.1795   -0.4612    0.1859 C   0  0  0

+    2.4405    0.3080   -0.2131 C   0  0  0

+    3.6725   -0.4088    0.3430 C   0  0  0

+    4.9335    0.3604   -0.0560 C   0  0  0

+   -2.0398    1.1453    0.0000 H   0  0  0

+   -4.8743   -0.5165    0.0000 H   0  0  0

+   -3.5411   -1.6014    0.0000 H   0  0  0

+   -1.9958   -1.3364    0.0000 H   0  0  0

+   -0.6140   -1.3221    0.0000 H   0  0  0

+    0.6299    1.0786    0.0000 H   0  0  0

+   -0.7519    1.0643    0.0000 H   0  0  0

+    0.4971   -1.2841    0.0000 H   0  0  0

+    1.8788   -1.2698    0.0000 H   0  0  0

+    3.1229    1.1309    0.0000 H   0  0  0

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+    2.9901   -1.2317    0.0000 H   0  0  0

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+    5.4902   -0.5523    0.0000 H   0  0  0

+    5.8462    0.9171    0.0000 H   0  0  0

+    4.3768    1.2731    0.0000 H   0  0  0

+  1  2  1  0

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+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+  9 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146795-44-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -1.8474   -0.3773    0.0661 C   0  0  0

+   -2.8846    0.6231    0.0336 C   0  0  0

+   -0.4249   -0.0073    0.1387 C   0  0  0

+   -2.2477   -1.6971    0.0320 C   0  0  0

+   -4.1571    0.1850   -0.0326 C   0  0  0

+    0.5205   -0.9674    0.1675 N   0  0  0

+   -0.1023    1.1651    0.1726 O   0  0  0

+   -3.9742   -1.5866   -0.0417 S   0  0  0

+   -5.4038    0.9819   -0.0781 N   0  3  0

+    1.8735   -0.6188    0.1034 C   0  0  0

+   -6.4833    0.4210   -0.1372 O   0  0  0

+   -5.3500    2.1986   -0.0564 O   0  5  0

+    2.8426   -1.6077   -0.0025 C   0  0  0

+    2.2504    0.7177    0.1397 C   0  0  0

+    4.1779   -1.2601   -0.0662 C   0  0  0

+    3.5870    1.0585    0.0757 C   0  0  0

+    4.5501    0.0709   -0.0245 C   0  0  0

+    5.9819    0.4399   -0.0924 N   0  3  0

+    6.3112    1.6119   -0.0558 O   0  0  0

+    6.8309   -0.4286   -0.1849 O   0  5  0

+   -2.6609    1.6335    0.0000 H   0  0  0

+   -1.6581   -2.5476    0.0000 H   0  0  0

+    0.2440   -1.9646    0.0000 H   0  0  0

+    2.5662   -2.6049    0.0000 H   0  0  0

+    1.5279    1.4586    0.0000 H   0  0  0

+    4.9030   -1.9984    0.0000 H   0  0  0

+    3.8672    2.0547    0.0000 H   0  0  0

+  1  2  1  0

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+  5  8  1  0

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+  4 22  1  0

+  6 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+113779-16-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 39                          1 V2000

+    0.5812    0.2949   -0.0034 C   0  0  0

+    0.1501   -1.0482   -0.0019 C   0  0  0

+    1.9398    0.5376   -0.0015 C   0  0  0

+   -0.2958    1.4007   -0.0010 C   0  0  0

+   -1.2299   -1.3260   -0.0009 C   0  0  0

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+    2.5070   -1.8079   -0.0006 C   0  0  0

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+    4.2217    0.2336    0.0031 C   0  0  0

+    1.6348    2.8876   -0.0031 C   0  0  0

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+   -3.5649   -0.4651   -0.0008 C   0  0  0

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+   -4.4616    0.5798   -0.0066 C   0  0  0

+   -0.3740    3.5077    0.0000 H   0  0  0

+   -2.6626   -2.8872    0.0000 H   0  0  0

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+    1.3368   -4.2030    0.0000 H   0  0  0

+    5.1744   -0.1997    0.0000 H   0  0  0

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+   -1.0258   -4.6661    0.0000 H   0  0  0

+   -4.7077    2.6778    0.0000 H   0  0  0

+   -5.4893    0.3814    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+138542-40-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+    0.7373   -0.3507    0.0017 C   0  0  0

+   -0.6611   -0.1986    0.0015 C   0  0  0

+    1.5651    0.7978    0.0005 C   0  0  0

+    1.3012   -1.6475   -0.0028 C   0  0  0

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+   -1.4945   -1.3424    0.0026 C   0  0  0

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+    0.9898    2.0642   -0.0013 C   0  0  0

+    2.7553   -1.8048   -0.0021 C   0  0  0

+    0.4612   -2.7668   -0.0075 C   0  0  0

+   -2.6342    1.2343   -0.0001 C   0  0  0

+   -0.3888    2.2180   -0.0001 C   0  0  0

+   -2.9454   -1.1543    0.0024 C   0  0  0

+   -0.9216   -2.6161    0.0044 C   0  0  0

+    3.5878   -0.6759    0.0022 C   0  0  0

+    3.8693    1.7334   -0.0009 C   0  0  0

+   -3.4618    0.1226    0.0001 C   0  0  0

+    4.9893   -0.8275    0.0020 C   0  0  0

+    5.2486    1.5600   -0.0011 C   0  0  0

+   -4.9298    0.3113   -0.0006 N   0  3  0

+    5.7998    0.2900    0.0003 C   0  0  0

+   -5.6683   -0.6572   -0.0004 O   0  0  0

+   -5.4757    1.6179   -0.0015 O   0  5  0

+    1.6087    2.9170    0.0000 H   0  0  0

+    3.1790   -2.7696    0.0000 H   0  0  0

+    0.8805   -3.7335    0.0000 H   0  0  0

+   -3.0595    2.1984    0.0000 H   0  0  0

+   -0.8072    3.1851    0.0000 H   0  0  0

+   -3.5895   -1.9882    0.0000 H   0  0  0

+   -1.5410   -3.4686    0.0000 H   0  0  0

+    3.4604    2.7045    0.0000 H   0  0  0

+    5.4168   -1.7906    0.0000 H   0  0  0

+    5.8806    2.4032    0.0000 H   0  0  0

+    6.8473    0.1754    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

+  7 16  1  0

+ 11 17  1  0

+ 15 18  1  0

+ 16 19  2  0

+ 17 20  1  0

+ 18 21  2  0

+ 20 22  2  0

+ 20 23  1  0

+  8 12  2  0

+  9 15  1  0

+ 10 14  2  0

+ 13 17  2  0

+ 19 21  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-52-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.7443    0.1116    0.0036 C   0  0  0

+    0.0977   -0.9850    0.0033 C   0  0  0

+   -0.2188    1.3910    0.0017 C   0  0  0

+   -2.2114   -0.0839   -0.0003 N   0  3  0

+    1.4673   -0.8061    0.0012 C   0  0  0

+    1.1494    1.5770   -0.0004 C   0  0  0

+   -2.9544    0.8811   -0.0001 O   0  0  0

+   -2.6757   -1.2100   -0.0038 O   0  5  0

+    1.9984    0.4773   -0.0006 C   0  0  0

+    2.3843   -2.0019    0.0005 C   0  0  0

+    3.3829    0.6619   -0.0032 N   0  0  0

+   -0.2996   -1.9432    0.0000 H   0  0  0

+   -0.8532    2.2117    0.0000 H   0  0  0

+    1.5429    2.5368    0.0000 H   0  0  0

+    1.5611   -2.6331    0.0000 H   0  0  0

+    3.0155   -2.8251    0.0000 H   0  0  0

+    3.2075   -1.3707    0.0000 H   0  0  0

+    4.0157   -0.1600    0.0000 H   0  0  0

+    3.7783    1.6209    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  9 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84-24-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 66                          1 V2000

+   -3.7194   -0.3410   -0.5276 C   0  0  0

+   -4.6033   -0.5760    0.6989 C   0  0  0

+   -2.6563    0.6736   -0.1936 C   0  0  0

+   -5.6827   -1.6060    0.3598 C   0  0  0

+   -1.4320    0.2395    0.3206 C   0  0  0

+   -2.9106    2.0261   -0.4087 C   0  0  0

+   -6.5666   -1.8410    1.5863 C   0  0  0

+   -0.4642    1.1807    0.6164 C   0  0  0

+   -1.3422   -1.0922    0.4801 O   0  0  0

+   -4.2065    2.4591   -0.9556 C   0  0  0

+   -1.9224    2.9722   -0.0997 C   0  0  0

+   -7.6460   -2.8711    1.2472 C   0  0  0

+    0.7759    0.9015    1.1132 O   0  0  0

+   -0.7148    2.5392    0.4102 C   0  0  0

+   -0.2535   -1.6648   -0.0490 C   0  0  0

+   -5.1505    2.6391   -0.2115 O   0  0  0

+   -4.3465    2.6560   -2.2816 O   0  0  0

+   -2.1500    4.2949   -0.2996 O   0  0  0

+    1.1178   -0.3367    1.5168 C   0  0  0

+    0.9970   -1.4230    0.5297 C   0  0  0

+   -0.3436   -2.5130   -1.1408 C   0  0  0

+    1.5096   -0.5488    2.6475 O   0  0  0

+    2.1200   -2.1379    0.1108 C   0  0  0

+    0.7858   -3.1833   -1.5884 C   0  0  0

+    3.4424   -1.9533    0.8095 C   0  0  0

+    2.0094   -3.0140   -0.9464 C   0  0  0

+    0.6969   -4.0108   -2.6602 O   0  0  0

+    4.2134   -0.8445    0.1407 C   0  0  0

+    5.5775   -0.4601    0.6529 C   0  0  0

+    3.7381   -0.2642   -0.8056 O   0  0  0

+    6.1375    0.6830   -0.1960 C   0  0  0

+    7.5225    1.0733    0.3240 C   0  0  0

+    8.0824    2.2164   -0.5250 C   0  0  0

+    9.4674    2.6068   -0.0050 C   0  0  0

+   -3.8126   -1.3053    0.0000 H   0  0  0

+   -2.8481   -0.7646    0.0000 H   0  0  0

+   -4.5101    0.3883    0.0000 H   0  0  0

+   -5.4746   -0.1523    0.0000 H   0  0  0

+   -5.7759   -2.5703    0.0000 H   0  0  0

+   -4.8114   -2.0297    0.0000 H   0  0  0

+   -6.4734   -0.8767    0.0000 H   0  0  0

+   -7.4379   -1.4174    0.0000 H   0  0  0

+   -8.3149   -2.1702    0.0000 H   0  0  0

+   -8.3469   -3.5400    0.0000 H   0  0  0

+   -6.9771   -3.5720    0.0000 H   0  0  0

+    0.0234    3.1666    0.0000 H   0  0  0

+   -4.9079    3.4456    0.0000 H   0  0  0

+   -2.3143    5.2497    0.0000 H   0  0  0

+   -1.2097   -2.9472    0.0000 H   0  0  0

+    3.3360   -2.9163    0.0000 H   0  0  0

+    4.3495   -2.2935    0.0000 H   0  0  0

+    2.6985   -3.6950    0.0000 H   0  0  0

+    0.5934   -4.9741    0.0000 H   0  0  0

+    5.6078   -1.4284    0.0000 H   0  0  0

+    6.5246   -0.6641    0.0000 H   0  0  0

+    6.1072    1.6513    0.0000 H   0  0  0

+    5.1904    0.8870    0.0000 H   0  0  0

+    7.5528    0.1050    0.0000 H   0  0  0

+    8.4696    0.8694    0.0000 H   0  0  0

+    8.0520    3.1847    0.0000 H   0  0  0

+    7.1353    2.4203    0.0000 H   0  0  0

+    9.7302    1.6743    0.0000 H   0  0  0

+   10.3999    2.8696    0.0000 H   0  0  0

+    9.2046    3.5393    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  5  1  0

+  9  5  1  0

+ 10  6  1  0

+ 11  6  2  0

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+ 20 15  2  0

+ 21 15  1  0

+ 22 19  2  0

+ 23 20  1  0

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+ 25 23  1  0

+ 26 23  2  0

+ 27 24  1  0

+ 28 25  1  0

+ 29 28  1  0

+ 30 28  2  0

+ 31 29  1  0

+ 32 31  1  0

+ 33 32  1  0

+ 34 33  1  0

+ 11 14  1  0

+ 19 20  1  0

+ 24 26  1  0

+  1 35  1  0

+  1 36  1  0

+  2 37  1  0

+  2 38  1  0

+  4 39  1  0

+  4 40  1  0

+  7 41  1  0

+  7 42  1  0

+ 12 43  1  0

+ 12 44  1  0

+ 12 45  1  0

+ 14 46  1  0

+ 17 47  1  0

+ 18 48  1  0

+ 21 49  1  0

+ 25 50  1  0

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+ 27 53  1  0

+ 29 54  1  0

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+ 31 56  1  0

+ 31 57  1  0

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+ 32 59  1  0

+ 33 60  1  0

+ 33 61  1  0

+ 34 62  1  0

+ 34 63  1  0

+ 34 64  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104-91-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.9569   -0.2720    0.0023 C   0  0  0

+   -0.0908   -1.3882    0.0013 C   0  0  0

+   -0.4143    1.0321    0.0019 C   0  0  0

+   -2.2781   -0.4485   -0.0020 N   0  0  0

+    1.2575   -1.1981    0.0000 C   0  0  0

+    0.9370    1.2027    0.0007 C   0  0  0

+   -3.0214    0.5164   -0.0011 O   0  0  0

+    1.7845    0.0943   -0.0003 C   0  0  0

+    3.1267    0.2736   -0.0016 O   0  0  0

+   -0.4748   -2.3348    0.0000 H   0  0  0

+   -1.0334    1.8447    0.0000 H   0  0  0

+    1.8853   -2.0039    0.0000 H   0  0  0

+    1.3312    2.1451    0.0000 H   0  0  0

+    4.1392    0.4089    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  8  9  1  0

+  6  8  2  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53473-85-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+    0.3668    0.6534    0.0023 C   0  0  0

+    0.0870   -0.7325    0.0002 C   0  0  0

+    2.1390    0.6948    0.0012 S   0  0  0

+   -0.6325    1.6034   -0.0004 C   0  0  0

+   -1.2754   -1.1106    0.0000 C   0  0  0

+    1.2860   -1.5487   -0.0018 C   0  0  0

+    2.4547   -0.9841   -0.0017 N   0  0  0

+   -1.9434    1.2100   -0.0052 C   0  0  0

+   -2.2594   -0.1494    0.0018 C   0  0  0

+   -3.6027   -0.5420    0.0016 N   0  0  0

+   -0.3888    2.6243    0.0000 H   0  0  0

+   -1.5366   -2.1272    0.0000 H   0  0  0

+    1.2086   -2.5955    0.0000 H   0  0  0

+   -2.7087    1.9284    0.0000 H   0  0  0

+   -4.3614    0.1833    0.0000 H   0  0  0

+   -3.8514   -1.5617    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  9 10  1  0

+  6  7  2  0

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+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  8 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93-15-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+   -1.7790   -1.8213   -0.1788 O   0  0  0

+   -0.9811   -3.0022   -0.0750 C   0  0  0

+   -0.9468   -0.7654    0.0257 C   0  0  0

+   -1.4450    0.5333   -0.0155 C   0  0  0

+    0.3980   -0.9805    0.2811 C   0  0  0

+   -2.7652    0.7493   -0.2598 O   0  0  0

+   -0.5929    1.6059    0.1934 C   0  0  0

+    1.2427    0.0940    0.4887 C   0  0  0

+   -2.9631    2.1643   -0.2385 C   0  0  0

+    0.7488    1.3845    0.4421 C   0  0  0

+    2.7050   -0.1418    0.7663 C   0  0  0

+    3.4657   -0.1661   -0.5343 C   0  0  0

+    4.4227    0.7021   -0.7497 C   0  0  0

+   -1.8305   -3.5761    0.0000 H   0  0  0

+   -0.4072   -3.8516    0.0000 H   0  0  0

+   -0.1317   -2.4283    0.0000 H   0  0  0

+    0.7715   -1.9351    0.0000 H   0  0  0

+   -0.9616    2.5624    0.0000 H   0  0  0

+   -1.9479    2.3063    0.0000 H   0  0  0

+   -3.1051    3.1795    0.0000 H   0  0  0

+   -3.9783    2.0223    0.0000 H   0  0  0

+    1.3969    2.1787    0.0000 H   0  0  0

+    2.0921   -0.9635    0.0000 H   0  0  0

+    3.1500   -1.0653    0.0000 H   0  0  0

+    3.8195   -1.1282    0.0000 H   0  0  0

+    5.3988    0.3890    0.0000 H   0  0  0

+    4.2058    1.7040    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

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+  7  4  1  0

+  8  5  2  0

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+ 10  7  2  0

+ 11  8  1  0

+ 12 11  1  0

+ 13 12  2  0

+  8 10  1  0

+  2 14  1  0

+  2 15  1  0

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+  7 18  1  0

+  9 19  1  0

+  9 20  1  0

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+ 10 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+932-97-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.9646    0.0000    0.0032 C   0  0  0

+   -0.2894   -1.2163    0.0020 C   0  0  0

+   -0.2894    1.2163    0.0025 C   0  0  0

+   -2.2146    0.0000   -0.0004 N   0  3  0

+    1.0710   -1.2610    0.0002 C   0  0  0

+    1.0710    1.2610    0.0007 C   0  0  0

+   -3.3386    0.0000   -0.0037 N   0  5  0

+    1.8248    0.0000   -0.0005 C   0  0  0

+    3.0435    0.0000   -0.0026 O   0  0  0

+   -0.8216   -2.0874    0.0000 H   0  0  0

+   -0.8216    2.0874    0.0000 H   0  0  0

+    1.5600   -2.1571    0.0000 H   0  0  0

+    1.5600    2.1571    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  2  0

+  5  8  1  0

+  8  9  2  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26444-49-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+    0.2312   -1.1681    0.2030 P   0  0  0

+   -1.0426   -2.1432    0.3393 O   0  0  0

+    0.2563   -0.1414    1.4429 O   0  0  0

+    1.5812   -2.0454    0.2052 O   0  0  0

+    0.1381   -0.4092   -1.0642 O   0  0  0

+   -2.1490   -1.3637    0.2159 C   0  0  0

+    0.1296    1.1072    0.9216 C   0  0  0

+    2.6033   -1.1941   -0.0732 C   0  0  0

+   -2.5228   -0.8801   -1.0293 C   0  0  0

+   -2.9097   -1.0548    1.3345 C   0  0  0

+   -1.1192    1.7082    0.8530 C   0  0  0

+    1.2491    1.7853    0.4623 C   0  0  0

+    3.3702   -0.6685    0.9568 C   0  0  0

+    2.8852   -0.8535   -1.3880 C   0  0  0

+   -3.6480   -0.0878   -1.1521 C   0  0  0

+   -4.0337   -0.2623    1.2064 C   0  0  0

+   -1.2454    2.9773    0.3227 C   0  0  0

+    1.1176    3.0546   -0.0673 C   0  0  0

+    4.4084    0.1965    0.6712 C   0  0  0

+    3.9249    0.0122   -1.6684 C   0  0  0

+   -4.4008    0.2236   -0.0352 C   0  0  0

+   -4.0547    0.4379   -2.5046 C   0  0  0

+   -0.1285    3.6489   -0.1397 C   0  0  0

+    4.6838    0.5389   -0.6400 C   0  0  0

+   -1.8615   -0.1886    0.0000 H   0  0  0

+   -3.3683   -1.8945    0.0000 H   0  0  0

+   -1.9031    1.1595    0.0000 H   0  0  0

+    2.1058    1.3593    0.0000 H   0  0  0

+    3.9475   -1.4315    0.0000 H   0  0  0

+    2.2076   -0.1779    0.0000 H   0  0  0

+   -4.6990   -0.9499    0.0000 H   0  0  0

+   -2.1005    3.4065    0.0000 H   0  0  0

+    1.8994    3.6062    0.0000 H   0  0  0

+    5.0908   -0.4742    0.0000 H   0  0  0

+    3.3455    0.7736    0.0000 H   0  0  0

+   -5.1578    0.8087    0.0000 H   0  0  0

+   -3.2979    1.0234    0.0000 H   0  0  0

+   -4.6402    1.1947    0.0000 H   0  0  0

+   -4.8115   -0.1476    0.0000 H   0  0  0

+   -0.1746    4.6046    0.0000 H   0  0  0

+    5.3838    1.1911    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

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+ 19 24  1  0

+ 16 21  1  0

+ 18 23  2  0

+ 20 24  2  0

+  9 25  1  0

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+ 21 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+ 24 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6628-97-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.4330   -1.4512    0.9348 O   0  0  0

+    0.2835   -0.5226    0.6209 C   0  0  0

+    1.6869   -0.7660    0.2261 C   0  0  0

+   -0.2456    0.8634    0.6251 C   0  0  0

+    2.5008    0.3225   -0.1341 C   0  0  0

+    2.2083   -2.0551    0.2079 C   0  0  0

+   -1.5539    1.0930    0.9868 N   0  0  0

+    0.5468    1.9051    0.2758 C   0  0  0

+    1.9390    1.6922   -0.1118 C   0  0  0

+    3.8206    0.1021   -0.5057 C   0  0  0

+    3.5271   -2.2584   -0.1653 C   0  0  0

+   -2.5896    0.4639    0.2951 C   0  0  0

+    2.6357    2.6403   -0.4219 O   0  0  0

+    4.3267   -1.1885   -0.5193 C   0  0  0

+   -3.7239    0.0379    0.9758 C   0  0  0

+   -2.4920    0.2669   -1.0775 C   0  0  0

+   -4.7471   -0.5840    0.2878 C   0  0  0

+   -3.5190   -0.3555   -1.7586 C   0  0  0

+   -4.6442   -0.7830   -1.0768 C   0  0  0

+    1.5899   -2.8361    0.0000 H   0  0  0

+   -1.7382    2.0720    0.0000 H   0  0  0

+    0.1732    2.8286    0.0000 H   0  0  0

+    4.4480    0.8759    0.0000 H   0  0  0

+    3.9040   -3.1806    0.0000 H   0  0  0

+    5.3140   -1.3216    0.0000 H   0  0  0

+   -4.1596    0.9338    0.0000 H   0  0  0

+   -1.5354   -0.0113    0.0000 H   0  0  0

+   -5.7062   -0.3147    0.0000 H   0  0  0

+   -3.0821   -1.2508    0.0000 H   0  0  0

+   -5.0000   -1.7135    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  4  2  0

+  9  5  1  0

+ 10  5  1  0

+ 11  6  2  0

+ 12  7  1  0

+ 13  9  2  0

+ 14 10  2  0

+ 15 12  2  0

+ 16 12  1  0

+ 17 15  1  0

+ 18 16  2  0

+ 19 17  2  0

+  8  9  1  0

+ 11 14  1  0

+ 18 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1836-77-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    1.1152   -0.0143    0.9603 C   0  0  0

+    0.0773   -0.0282    1.8383 O   0  0  0

+    1.6450    1.1940    0.5295 C   0  0  0

+    1.6505   -1.2087    0.4977 C   0  0  0

+   -1.0627   -0.0178    1.0990 C   0  0  0

+    2.7009    1.2055   -0.3632 C   0  0  0

+    0.9821    2.6896    1.1104 Cl  0  0  0

+    2.7061   -1.1921   -0.3947 C   0  0  0

+    0.9951   -2.7221    1.0398 Cl  0  0  0

+   -2.2996   -0.0281    1.7285 C   0  0  0

+   -0.9924    0.0088   -0.2863 C   0  0  0

+    3.2292    0.0140   -0.8269 C   0  0  0

+   -3.4568   -0.0171    0.9747 C   0  0  0

+   -2.1530    0.0198   -1.0356 C   0  0  0

+    4.5549    0.0317   -1.9476 Cl  0  0  0

+   -3.3838    0.0042   -0.4062 C   0  0  0

+   -4.6257    0.0155   -1.2115 N   0  3  0

+   -4.5627    0.0342   -2.4278 O   0  0  0

+   -5.7106    0.0060   -0.6580 O   0  5  0

+    3.1858    1.9599    0.0000 H   0  0  0

+    3.2041   -1.9380    0.0000 H   0  0  0

+   -2.3001   -0.9249    0.0000 H   0  0  0

+   -0.1094    0.1659    0.0000 H   0  0  0

+   -4.3452   -0.1398    0.0000 H   0  0  0

+   -2.1544    0.9166    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  2  0

+ 10 13  2  0

+ 11 14  1  0

+ 12 15  1  0

+ 13 16  1  0

+ 16 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+  8 12  1  0

+ 14 16  2  0

+  6 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+523-50-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 22                          1 V2000

+    0.2705   -0.1024   -0.0023 C   0  0  0

+   -1.0714   -0.5000   -0.0015 C   0  0  0

+    0.5739    1.2677   -0.0006 C   0  0  0

+    1.2668   -1.0113    0.0008 O   0  0  0

+   -2.0904    0.4640    0.0012 C   0  0  0

+   -1.7559   -1.7976   -0.0027 C   0  0  0

+   -0.4597    2.2177    0.0016 C   0  0  0

+    1.9781    1.6831   -0.0015 C   0  0  0

+    2.5562   -0.6403    0.0004 C   0  0  0

+   -1.7622    1.8211    0.0022 C   0  0  0

+   -3.2652   -0.1968    0.0014 O   0  0  0

+   -3.0685   -1.5266   -0.0008 C   0  0  0

+    2.9340    0.7181   -0.0040 C   0  0  0

+    3.4213   -1.4978    0.0037 O   0  0  0

+   -1.3146   -2.7329    0.0000 H   0  0  0

+   -0.2301    3.2261    0.0000 H   0  0  0

+    2.2352    2.6848    0.0000 H   0  0  0

+   -2.5145    2.5307    0.0000 H   0  0  0

+   -3.8202   -2.2368    0.0000 H   0  0  0

+    3.9348    0.9787    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+  9 14  2  0

+  7 10  2  0

+  9 13  1  0

+ 11 12  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2478-38-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.8718    1.2116    0.0018 C   0  0  0

+   -1.5807    0.0120    0.0009 C   0  0  0

+    0.5091    1.1996    0.0017 C   0  0  0

+   -1.5407    2.3957   -0.0030 O   0  0  0

+   -0.8999   -1.2033    0.0000 C   0  0  0

+   -2.9390    0.0277    0.0015 O   0  0  0

+    1.1969   -0.0201    0.0007 C   0  0  0

+   -0.5528    3.4282   -0.0007 C   0  0  0

+    0.4813   -1.2232   -0.0001 C   0  0  0

+   -1.5960   -2.3717   -0.0004 O   0  0  0

+    2.6655   -0.0370    0.0001 C   0  0  0

+   -0.6322   -3.4267   -0.0014 C   0  0  0

+    3.4038   -1.3508   -0.0009 C   0  0  0

+    3.2840    1.0063    0.0004 O   0  0  0

+    1.0400    2.0996    0.0000 H   0  0  0

+   -3.9838    0.0398    0.0000 H   0  0  0

+    0.2022    2.7058    0.0000 H   0  0  0

+    0.1696    4.1832    0.0000 H   0  0  0

+   -1.3078    4.1506    0.0000 H   0  0  0

+    0.9913   -2.1352    0.0000 H   0  0  0

+   -1.4036   -4.1315    0.0000 H   0  0  0

+    0.0726   -4.1981    0.0000 H   0  0  0

+    0.1392   -2.7219    0.0000 H   0  0  0

+    2.4929   -1.8627    0.0000 H   0  0  0

+    3.9157   -2.2617    0.0000 H   0  0  0

+    4.3147   -0.8389    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 11 14  2  0

+  7  9  2  0

+  3 15  1  0

+  6 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109143-16-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -1.5312    0.0037   -0.2842 C   0  0  0

+   -1.9040    0.3644    1.0210 C   0  0  0

+   -0.1841   -0.1324   -0.6169 C   0  0  0

+   -2.7900   -0.1544   -1.0227 C   0  0  0

+   -3.2520    0.4200    1.0511 O   0  0  0

+   -0.9195    0.5839    1.9765 C   0  0  0

+    0.7825    0.0901    0.3474 C   0  0  0

+   -3.7714    0.1097   -0.1494 C   0  0  0

+    0.4096    0.4478    1.6416 C   0  0  0

+    2.1369   -0.0446    0.0228 N   0  0  0

+   -5.2176    0.0718   -0.4628 N   0  3  0

+    2.8581   -1.2680    0.3825 C   0  0  0

+    2.8337    1.0377   -0.6766 C   0  0  0

+   -6.0353    0.3286    0.4026 O   0  0  0

+   -5.5899   -0.2163   -1.5862 O   0  5  0

+    2.3916   -2.4171   -0.5135 C   0  0  0

+    3.2967    2.0854    0.3377 C   0  0  0

+    3.2792   -3.9228   -0.0709 Cl  0  0  0

+    4.1543    3.4174   -0.5232 Cl  0  0  0

+   -0.1251   -1.0714    0.0000 H   0  0  0

+   -2.8548   -1.0930    0.0000 H   0  0  0

+   -0.9747    1.5231    0.0000 H   0  0  0

+    0.8046    1.3017    0.0000 H   0  0  0

+    3.6329   -1.8017    0.0000 H   0  0  0

+    3.5464   -0.6266    0.0000 H   0  0  0

+    3.3070    0.2246    0.0000 H   0  0  0

+    3.7731    1.0899    0.0000 H   0  0  0

+    1.6168   -1.8834    0.0000 H   0  0  0

+    1.7033   -3.0585    0.0000 H   0  0  0

+    2.8234    2.8985    0.0000 H   0  0  0

+    2.3573    2.0332    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  6  9  2  0

+  7 10  1  0

+  8 11  1  0

+ 10 12  1  0

+ 10 13  1  0

+ 11 14  2  0

+ 11 15  1  0

+ 12 16  1  0

+ 13 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+  5  8  1  0

+  7  9  1  0

+  3 20  1  0

+  4 21  1  0

+  6 22  1  0

+  9 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+488-11-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.5742    0.2651   -0.0032 C   0  0  0

+   -0.4864   -0.5684   -0.0020 C   0  0  0

+    0.3648    1.7258   -0.0019 C   0  0  0

+    2.3295   -0.4385    0.0013 Br  0  0  0

+   -0.2780   -2.0221   -0.0034 C   0  0  0

+   -2.2417    0.1351    0.0013 Br  0  0  0

+   -0.7625    2.1776    0.0002 O   0  0  0

+    1.4245    2.5584   -0.0031 O   0  0  0

+   -1.2315   -2.7712   -0.0023 O   0  0  0

+    0.7027   -2.4152    0.0000 H   0  0  0

+    2.2553    3.2112    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  2  1  0

+  7  3  2  0

+  8  3  1  0

+  9  5  2  0

+  5 10  1  0

+  8 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13395-02-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+   -0.4312    0.5094    0.0324 C   0  0  0

+   -0.7889   -0.8347    0.0127 C   0  0  0

+    1.0029    0.8013    0.0273 C   0  0  0

+   -1.4605    1.4570    0.0496 C   0  0  0

+    0.1043   -1.9127   -0.0137 C   0  0  0

+   -2.1118   -1.2948    0.0167 C   0  0  0

+    1.9015   -0.2961   -0.0006 C   0  0  0

+    1.4922    2.1060    0.0491 C   0  0  0

+   -2.7862    1.0179    0.0489 C   0  0  0

+   -1.4484    2.8173    0.0678 O   0  0  0

+    1.4383   -1.6325   -0.0211 C   0  0  0

+   -0.6699   -3.0706   -0.0259 N   0  0  0

+   -3.1168   -0.3357    0.0405 C   0  0  0

+   -1.9901   -2.7549   -0.0083 C   0  0  0

+    3.2868   -0.0323   -0.0073 C   0  0  0

+    2.8397    2.3317    0.0430 C   0  0  0

+   -3.6003    2.1173    0.0682 O   0  0  0

+   -2.7697    3.2204   -0.3368 C   0  0  0

+   -2.9136   -3.5480   -0.0125 O   0  0  0

+    3.7355    1.2703    0.0147 C   0  0  0

+    4.1757   -1.0586   -0.0351 O   0  0  0

+    5.4802   -0.4754   -0.0349 C   0  0  0

+    0.8285    2.9118    0.0000 H   0  0  0

+    2.1283   -2.4159    0.0000 H   0  0  0

+   -0.2891   -4.0426    0.0000 H   0  0  0

+   -4.1187   -0.6288    0.0000 H   0  0  0

+    3.1995    3.3116    0.0000 H   0  0  0

+   -2.3512    4.1767    0.0000 H   0  0  0

+   -3.6709    3.7472    0.0000 H   0  0  0

+    4.7617    1.4619    0.0000 H   0  0  0

+    5.9063   -1.4284    0.0000 H   0  0  0

+    6.4332   -0.0493    0.0000 H   0  0  0

+    5.0541    0.4776    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  5 11  2  0

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+  7 11  1  0

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+ 16 27  1  0

+ 18 28  1  0

+ 18 29  1  0

+ 20 30  1  0

+ 22 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21362-69-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 73                          1 V2000

+   -0.8763    1.2894    0.0224 C   0  0  2

+   -1.4793   -0.1042    0.2415 C   0  0  1

+    0.4975    1.2976    0.6662 C   0  0  1

+   -1.7834    2.3204    0.7001 C   0  0  0

+   -2.8673   -0.1816   -0.4011 C   0  0  2

+   -0.5870   -1.2016   -0.3298 C   0  0  0

+    1.3663    0.2767   -0.1177 C   0  0  2

+    1.3050    2.5885    0.4913 C   0  0  0

+   -3.1574    2.2770    0.0347 C   0  0  0

+   -3.7867    0.8902    0.1974 C   0  0  1

+   -3.4639   -1.5479   -0.0646 C   0  0  0

+   -2.7572    0.0054   -1.9157 C   0  0  0

+    0.8455   -1.1062    0.2209 C   0  0  0

+    2.7845    0.5991    0.3407 C   0  0  2

+    1.2357    0.5288   -1.6211 C   0  0  0

+    2.7703    2.1101    0.6824 C   0  0  0

+   -5.0954    0.8745   -0.5920 C   0  0  0

+   -4.9073   -1.6947   -0.4514 C   0  0  2

+    3.6975    0.3620   -0.7327 O   0  0  0

+   -5.7330   -0.4780   -0.6942 C   0  0  1

+   -5.9794   -1.2241    0.9377 S   0  0  0

+    4.7431   -0.4608   -0.2115 C   0  0  0

+    5.4589    0.2641    0.9417 C   0  0  0

+    4.1506   -1.7555    0.3821 C   0  0  0

+    5.6774   -0.7779   -1.2452 O   0  0  0

+    5.2764   -0.6155    2.1959 C   0  0  0

+    5.0235   -2.0352    1.6306 C   0  0  0

+    5.0064   -0.5629   -2.4885 C   0  0  0

+   -0.4496    2.2407    0.0000 H   0  0  0

+   -1.9008   -1.0578    0.0000 H   0  0  0

+    0.0630    0.3498    0.0000 H   0  0  0

+   -0.8642    2.8125    0.0000 H   0  0  0

+   -2.0530    3.3276    0.0000 H   0  0  0

+   -1.5131   -1.6805    0.0000 H   0  0  0

+   -0.3070   -2.2059    0.0000 H   0  0  0

+    1.7079    3.5501    0.0000 H   0  0  0

+    0.3792    3.0680    0.0000 H   0  0  0

+   -3.0316    3.3120    0.0000 H   0  0  0

+   -4.1613    2.5586    0.0000 H   0  0  0

+   -4.2165   -0.0597    0.0000 H   0  0  0

+   -3.5365   -2.5880    0.0000 H   0  0  0

+   -2.4513   -1.7964    0.0000 H   0  0  0

+   -1.8587   -0.5236    0.0000 H   0  0  0

+   -2.2282    0.9039    0.0000 H   0  0  0

+   -3.6557    0.5344    0.0000 H   0  0  0

+    0.7666   -2.1458    0.0000 H   0  0  0

+    1.8635   -1.3316    0.0000 H   0  0  0

+    2.7686   -0.4434    0.0000 H   0  0  0

+    2.1615    1.0084    0.0000 H   0  0  0

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+    4.0135   -0.2448    0.0000 H   0  0  0

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+ 28 67  1  0

+ 28 68  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7227-92-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -2.1408   -0.0135    0.0037 C   0  0  0

+   -1.6286   -1.2984    0.0031 C   0  0  0

+   -1.2893    1.0772    0.0030 C   0  0  0

+   -3.6061    0.1957   -0.0011 N   0  3  0

+   -0.2635   -1.5002    0.0018 C   0  0  0

+    0.0773    0.8891    0.0018 C   0  0  0

+   -4.0599    1.3259   -0.0007 O   0  0  0

+   -4.3580   -0.7625   -0.0056 O   0  5  0

+    0.6005   -0.4047    0.0011 C   0  0  0

+    1.9588   -0.5986    0.0003 N   0  0  0

+    2.7552    0.4163   -0.0004 N   0  0  0

+    4.1421    0.2183   -0.0012 N   0  0  0

+    4.6880   -1.1412   -0.0013 C   0  0  0

+    5.0465    1.3708   -0.0020 C   0  0  0

+   -2.2722   -2.1123    0.0000 H   0  0  0

+   -1.6795    2.0386    0.0000 H   0  0  0

+    0.1196   -2.4645    0.0000 H   0  0  0

+    0.7148    1.7078    0.0000 H   0  0  0

+    3.7251   -1.5278    0.0000 H   0  0  0

+    5.0746   -2.1041    0.0000 H   0  0  0

+    5.6509   -0.7546    0.0000 H   0  0  0

+    5.8628    0.7302    0.0000 H   0  0  0

+    5.6871    2.1871    0.0000 H   0  0  0

+    4.2302    2.0114    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+194-69-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    1.0497   -0.4982    0.0021 C   0  0  0

+   -0.2559    0.0457    0.0014 C   0  0  0

+    2.2324    0.3603    0.0009 C   0  0  0

+    1.2220   -1.8957   -0.0019 C   0  0  0

+   -1.3607   -0.8297    0.0020 C   0  0  0

+   -0.4609    1.4403   -0.0005 C   0  0  0

+    3.5115   -0.2438    0.0012 C   0  0  0

+    2.1248    1.7544   -0.0001 C   0  0  0

+    0.0929   -2.7392   -0.0067 C   0  0  0

+    2.5259   -2.4408   -0.0017 C   0  0  0

+   -2.7088   -0.2569    0.0012 C   0  0  0

+   -1.1602   -2.2187    0.0030 C   0  0  0

+   -1.7028    1.9716   -0.0017 C   0  0  0

+    3.6210   -1.6519    0.0031 C   0  0  0

+    4.6525    0.5718    0.0001 C   0  0  0

+    3.2550    2.5192   -0.0007 C   0  0  0

+   -2.8513    1.1497   -0.0002 C   0  0  0

+   -3.8469   -1.0678    0.0013 C   0  0  0

+    4.5140    1.9282   -0.0013 C   0  0  0

+   -4.1388    1.7070   -0.0010 C   0  0  0

+   -5.0857   -0.4942    0.0000 C   0  0  0

+   -5.2297    0.8889   -0.0005 C   0  0  0

+    0.3729    2.0824    0.0000 H   0  0  0

+    1.1769    2.2116    0.0000 H   0  0  0

+    0.2230   -3.7835    0.0000 H   0  0  0

+    2.6458   -3.4863    0.0000 H   0  0  0

+   -1.9914   -2.8641    0.0000 H   0  0  0

+   -1.8167    3.0178    0.0000 H   0  0  0

+    4.5756   -2.0949    0.0000 H   0  0  0

+    5.6116    0.1386    0.0000 H   0  0  0

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+   -3.7495   -2.1157    0.0000 H   0  0  0

+    5.3724    2.5370    0.0000 H   0  0  0

+   -4.2621    2.7521    0.0000 H   0  0  0

+   -5.9419   -1.1061    0.0000 H   0  0  0

+   -6.1941    1.3101    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1319-69-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 18                          1 V2000

+   -3.7727   -1.1259   -0.0614 P   0  0  0

+   -4.7452   -0.0074    0.5672 O   0  0  0

+   -2.6502   -1.3827    0.8684 O   0  0  0

+   -4.5999   -2.4876   -0.2930 O   0  0  0

+   -3.1939   -0.6035   -1.4700 O   0  0  0

+   -5.8030    0.1952   -0.3720 C   0  0  0

+   -6.7683    1.2526    0.1674 C   0  0  0

+   -7.9009    1.4696   -0.8382 C   0  0  0

+   -7.3143    0.8089    1.4112 O   0  0  0

+   -8.8025    2.4572   -0.3344 O   0  0  0

+    6.7202    0.0155    0.1040 K   0  3  0

+   15.3669    0.4775   -0.0417 K   0  3  0

+   -6.5891   -0.1655    0.0000 H   0  0  0

+   -5.6991   -0.6634    0.0000 H   0  0  0

+   -6.3460    2.0074    0.0000 H   0  0  0

+   -8.6870    1.1089    0.0000 H   0  0  0

+   -7.7970    0.6110    0.0000 H   0  0  0

+   -7.9855    0.2634    0.0000 H   0  0  0

+   -9.3856    3.0960    0.0000 H   0  0  0

+   -5.0489   -3.2268    0.0000 H   0  0  0

+   -2.5518   -0.0240    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+  4 20  1  0

+  5 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+143-16-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 39                          1 V2000

+    0.0000   -0.4655   -0.0051 N   0  0  0

+   -1.1786    0.4113    0.0045 C   0  0  0

+    1.1786    0.4113    0.0045 C   0  0  0

+   -2.4488   -0.4416   -0.0048 C   0  0  0

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+   -3.6763    0.4717    0.0051 C   0  0  0

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+   -4.9465   -0.3812   -0.0041 C   0  0  0

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+   -6.1740    0.5321    0.0058 C   0  0  0

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+   -7.4443   -0.3208   -0.0035 C   0  0  0

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+    0.0000   -1.6130    0.0000 H   0  0  0

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+   -1.7055   -1.3158    0.0000 H   0  0  0

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+   -4.2032   -1.2554    0.0000 H   0  0  0

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+    5.7311   -1.2185    0.0000 H   0  0  0

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+   -6.9172    1.4064    0.0000 H   0  0  0

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+    5.3894    1.3694    0.0000 H   0  0  0

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+   -8.3970   -0.9604    0.0000 H   0  0  0

+   -6.8047   -1.2735    0.0000 H   0  0  0

+    6.8047   -1.2735    0.0000 H   0  0  0

+    8.3970   -0.9604    0.0000 H   0  0  0

+    8.0839    0.6319    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 37  1  0

+ 13 38  1  0

+ 13 39  1  0

+ 13 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2872-48-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -0.4706    0.5634    0.1111 C   0  0  0

+   -0.3376   -0.8448    0.0973 C   0  0  0

+    0.7300    1.4081    0.2243 C   0  0  0

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+    0.6279    2.5915    0.4858 O   0  0  0

+   -2.8711    0.3149   -0.1018 C   0  0  0

+   -1.8778    2.5186    0.0252 N   0  0  0

+    2.1926   -0.6012    0.0017 C   0  0  0

+    1.1181   -2.6374    0.4353 O   0  0  0

+   -2.7391   -1.0576   -0.1046 C   0  0  0

+   -1.3555   -3.0293   -0.0250 N   0  0  0

+    3.1853    1.5996   -0.1684 C   0  0  0

+   -4.1041    0.8740   -0.1993 O   0  0  0

+    3.4447   -1.1749   -0.1950 C   0  0  0

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+   -5.0388   -0.2022   -0.3000 C   0  0  0

+    4.5514   -0.3649   -0.3758 C   0  0  0

+   -1.0331    3.1282    0.0000 H   0  0  0

+   -2.8281    2.9453    0.0000 H   0  0  0

+   -3.5904   -1.6580    0.0000 H   0  0  0

+   -2.2081   -3.6278    0.0000 H   0  0  0

+   -0.4109   -3.4684    0.0000 H   0  0  0

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+    3.5498   -2.2113    0.0000 H   0  0  0

+    5.2760    1.6098    0.0000 H   0  0  0

+   -5.8253    0.4809    0.0000 H   0  0  0

+   -5.7219   -0.9887    0.0000 H   0  0  0

+   -4.2523   -0.8853    0.0000 H   0  0  0

+    5.5014   -0.7924    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6264-66-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -2.5692   -0.3494    0.8037 C   0  0  0

+   -3.1051   -0.3989   -0.4831 C   0  0  0

+   -1.4159    0.3810    1.0434 C   0  0  0

+   -3.1982   -1.0314    1.8522 N   0  0  0

+   -2.4833    0.2820   -1.5177 C   0  0  0

+   -4.2719   -1.1373   -0.7299 N   0  0  0

+   -0.7978    1.0606    0.0037 C   0  0  0

+   -1.3326    1.0098   -1.2748 C   0  0  0

+    0.3334    1.7775    0.2386 O   0  0  0

+    1.3771    0.9135    0.1245 C   0  0  0

+    2.6585    1.3264    0.4586 C   0  0  0

+    1.1590   -0.3824   -0.3206 C   0  0  0

+    3.7192    0.4493    0.3430 C   0  0  0

+    2.2184   -1.2604   -0.4367 C   0  0  0

+    3.5026   -0.8460   -0.1078 C   0  0  0

+    4.5767   -1.7349   -0.2256 N   0  0  0

+   -0.7665   -0.3921    0.0000 H   0  0  0

+   -4.1833   -0.8097    0.0000 H   0  0  0

+   -2.8977   -1.9954    0.0000 H   0  0  0

+   -3.1317    1.0560    0.0000 H   0  0  0

+   -5.1661   -0.6684    0.0000 H   0  0  0

+   -4.2309   -2.1462    0.0000 H   0  0  0

+   -1.6592    1.9652    0.0000 H   0  0  0

+    2.8488    2.3180    0.0000 H   0  0  0

+    0.2126   -0.7343    0.0000 H   0  0  0

+    4.6652    0.8022    0.0000 H   0  0  0

+    2.0278   -2.2520    0.0000 H   0  0  0

+    4.4081   -2.7304    0.0000 H   0  0  0

+    5.5231   -1.3831    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3268-49-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    1.0191   -0.5402   -0.2113 C   0  0  0

+   -0.1510    0.4451   -0.1783 C   0  0  0

+    2.3060    0.2151   -0.4222 C   0  0  0

+   -1.7000   -0.4640    0.0756 S   0  0  0

+    3.1848    0.1530    0.4037 O   0  0  0

+   -2.8787    0.9148    0.0722 C   0  0  0

+    0.1856   -1.3285    0.0000 H   0  0  0

+    1.7080   -1.4576    0.0000 H   0  0  0

+    0.6825    1.2334    0.0000 H   0  0  0

+   -0.8399    1.3625    0.0000 H   0  0  0

+    2.0443    1.3321    0.0000 H   0  0  0

+   -2.0067    1.6603    0.0000 H   0  0  0

+   -3.6242    1.7868    0.0000 H   0  0  0

+   -3.7507    0.1693    0.0000 H   0  0  0

+  1  2  1  0

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+  2 10  1  0

+  3 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94740-40-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+   -1.2764    0.8094   -0.2379 C   0  0  2

+   -2.2523   -0.2816   -0.1007 N   0  0  0

+   -0.0469    0.4883    0.5721 C   0  0  0

+   -1.9382    2.0885    0.3166 C   0  0  0

+   -3.4720    0.2519    0.5327 C   0  0  0

+   -2.0635   -1.5580   -0.4903 C   0  0  0

+    1.1650    0.8997    0.1494 N   0  0  0

+   -0.1475   -0.1378    1.6005 O   0  0  0

+   -3.4529    1.7680    0.2153 C   0  0  0

+   -3.1552   -2.5770   -0.2876 C   0  0  0

+   -1.0151   -1.8865   -1.0039 O   0  0  0

+    2.3726    0.4719    0.8598 C   0  0  0

+    1.2614    1.6701   -0.8807 N   0  0  0

+    2.8793   -0.8144    0.2599 C   0  0  0

+    2.3566    2.0418   -1.2628 O   0  0  0

+    3.9831   -1.3965    0.7542 O   0  0  0

+    2.2918   -1.3216   -0.6661 O   0  0  0

+   -0.6764    1.5599    0.0000 H   0  0  0

+   -1.0487    2.4519    0.0000 H   0  0  0

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+   -2.4996   -3.2794    0.0000 H   0  0  0

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+    2.4703    1.4278    0.0000 H   0  0  0

+    4.8330   -1.8447    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 28  1  0

+ 12 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+514-78-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 94 95                          1 V2000

+   11.4339    0.2137   -0.1905 C   0  0  0

+   12.1183    1.2977    0.5997 C   0  0  0

+   12.0193   -1.0222   -0.3473 C   0  0  0

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+  1  2  1  0

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+ 41 93  1  0

+ 41 94  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+53940-49-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -0.5580   -0.5564    0.4657 C   0  0  0

+   -2.0210   -0.4410    0.8083 C   0  0  0

+    0.2188    0.5832    0.3643 C   0  0  0

+    0.0057   -1.8013    0.2591 C   0  0  0

+   -2.8373   -0.3079   -0.4789 C   0  0  0

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+   -4.3226   -0.1908   -0.1310 C   0  0  0

+   -3.5265    0.9439   -0.4784 O   0  0  0

+    2.1301   -0.7745   -0.1643 C   0  0  0

+    2.3289    1.5987   -0.0511 O   0  0  0

+    3.4500   -0.8820   -0.4737 O   0  0  0

+    1.4721    2.7100    0.2192 C   0  0  0

+   -2.6524   -1.2586    0.0000 H   0  0  0

+   -1.6024   -1.3854    0.0000 H   0  0  0

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+   -4.5845   -1.1900    0.0000 H   0  0  0

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+    2.2902    3.3407    0.0000 H   0  0  0

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+  1  2  1  0

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+  8 20  1  0

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+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13365-37-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+    0.6010    0.0188   -0.5621 C   0  0  0

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+    1.3419    1.1851   -0.2874 C   0  0  0

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+ 21 40  1  0

+ 21 41  1  0

+ 21 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+56600-58-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+    0.3621   -0.1356    0.0845 C   0  0  0

+   -0.1398   -1.4492    0.0855 C   0  0  0

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+    2.4508    2.0418    1.1908 O   0  0  0

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+   -2.9075    1.8512   -0.1045 C   0  0  0

+   -3.9022   -0.7497   -0.0821 C   0  0  0

+    4.6518   -0.7154   -1.1699 C   0  0  0

+   -4.2711    1.6218   -0.1640 C   0  0  0

+   -4.7658    0.3305   -0.1355 C   0  0  0

+    0.3770   -3.5009    0.0000 H   0  0  0

+    2.7675   -3.1018    0.0000 H   0  0  0

+    4.5011    0.1875    0.0000 H   0  0  0

+    3.4489    0.0542    0.0000 H   0  0  0

+   -2.5417    2.8279    0.0000 H   0  0  0

+   -4.2807   -1.7215    0.0000 H   0  0  0

+    4.7525   -1.7535    0.0000 H   0  0  0

+    5.6899   -0.6147    0.0000 H   0  0  0

+    4.5511    0.3227    0.0000 H   0  0  0

+   -4.9316    2.4290    0.0000 H   0  0  0

+   -5.7964    0.1702    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  2  0

+  7 14  1  0

+  8 15  2  0

+  8 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 14 19  1  0

+ 17 20  2  0

+ 18 21  2  0

+  7 13  1  0

+  9 11  2  0

+ 20 21  1  0

+  6 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+ 19 28  1  0

+ 19 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-46-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.0000    0.0629    0.0000 O   0  0  0

+   -1.1088    0.9149   -0.2945 C   0  0  0

+    1.1088    0.9149    0.2945 C   0  0  0

+   -2.3357    0.0609   -0.6204 C   0  0  0

+    2.3357    0.0609    0.6204 C   0  0  0

+   -2.6538   -0.7639    0.5024 O   0  0  0

+    2.6538   -0.7639   -0.5024 O   0  0  0

+   -0.3881    1.6767    0.0000 H   0  0  0

+   -1.7929    1.7098    0.0000 H   0  0  0

+    1.7929    1.7098    0.0000 H   0  0  0

+    0.3881    1.6767    0.0000 H   0  0  0

+   -2.6282    1.0680    0.0000 H   0  0  0

+   -3.3835    0.1057    0.0000 H   0  0  0

+    3.3835    0.1057    0.0000 H   0  0  0

+    2.6282    1.0680    0.0000 H   0  0  0

+   -3.0312   -1.7424    0.0000 H   0  0  0

+    3.0312   -1.7424    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+151378-32-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 42                          1 V2000

+   -0.9523    0.9727    0.1805 C   0  0  1

+   -1.1432   -0.5159    0.1697 C   0  0  0

+    0.5072    1.1637   -0.0353 C   0  0  0

+   -2.1626    1.7969   -0.1917 C   0  0  2

+   -1.5980    1.8268    1.1348 O   0  0  0

+    0.1050   -1.1256    0.2968 C   0  0  0

+   -2.3161   -1.1853   -0.0917 C   0  0  0

+    1.1223   -0.0926    0.1268 C   0  0  0

+    1.2429    2.3040   -0.3412 C   0  0  0

+   -3.4986    1.0480   -0.1024 C   0  0  1

+    0.1483   -2.5166    0.4287 C   0  0  0

+   -3.4910   -0.3928   -0.5638 C   0  0  1

+   -2.2658   -2.5589    0.0512 C   0  0  0

+    2.5318   -0.1992    0.0495 C   0  0  0

+    2.6018    2.2014   -0.4494 C   0  0  0

+   -3.9947    1.1168    1.2360 O   0  0  0

+   -1.0620   -3.1922    0.3269 C   0  0  0

+   -3.5525   -0.4362   -1.9908 O   0  0  0

+    3.2655    0.9797   -0.2472 C   0  0  0

+    3.2037   -1.4080    0.2543 C   0  0  0

+    4.6680    0.8987   -0.3319 C   0  0  0

+    4.5635   -1.4458    0.1656 C   0  0  0

+    5.2901   -0.2936   -0.1272 C   0  0  0

+   -2.4521    2.7963    0.0000 H   0  0  0

+    0.7798    3.2358    0.0000 H   0  0  0

+   -3.6916    2.0704    0.0000 H   0  0  0

+    1.0537   -3.0293    0.0000 H   0  0  0

+   -4.4161    0.0835    0.0000 H   0  0  0

+   -3.1465   -3.1130    0.0000 H   0  0  0

+    3.1670    3.0750    0.0000 H   0  0  0

+   -5.0253    1.2597    0.0000 H   0  0  0

+   -1.0491   -4.2326    0.0000 H   0  0  0

+   -4.4026   -1.0361    0.0000 H   0  0  0

+    2.6637   -2.2974    0.0000 H   0  0  0

+    5.2328    1.7726    0.0000 H   0  0  0

+    5.0534   -2.3638    0.0000 H   0  0  0

+    6.3297   -0.3361    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

+  3  9  1  0

+  4 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  2  0

+  8 14  1  0

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+ 10 16  1  0

+ 11 17  2  0

+ 12 18  1  0

+ 14 19  2  0

+ 14 20  1  0

+ 19 21  1  0

+ 20 22  2  0

+ 21 23  2  0

+  4  5  1  0

+  6  8  1  0

+ 10 12  1  0

+ 13 17  1  0

+ 15 19  1  0

+ 22 23  1  0

+  4 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+133502-50-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 53                          1 V2000

+    0.0003   -0.4991   -0.0042 C   0  0  0

+   -1.2717    0.2366   -0.0013 C   0  0  0

+    1.2734    0.2346   -0.0039 C   0  0  0

+   -0.0008   -1.9070   -0.0013 C   0  0  0

+   -1.8558    0.6356   -1.2115 C   0  0  0

+   -1.9075    0.5364    1.2112 C   0  0  0

+    1.9114    0.5359   -1.2153 C   0  0  0

+    1.8505    0.6403    1.2070 C   0  0  0

+   -1.2171   -2.6117   -0.1432 C   0  0  0

+    1.2150   -2.6131    0.1376 C   0  0  0

+   -3.0379    1.3186   -1.2041 C   0  0  0

+   -3.0897    1.2199    1.2092 C   0  0  0

+    3.0939    1.2182   -1.2103 C   0  0  0

+    3.0336    1.3224    1.2025 C   0  0  0

+   -1.2205   -3.9652   -0.1408 C   0  0  0

+    1.2163   -3.9666    0.1406 C   0  0  0

+   -3.6639    1.6191    0.0042 C   0  0  0

+    3.6668    1.6150   -0.0035 C   0  0  0

+   -0.0030   -4.6754    0.0043 C   0  0  0

+   -4.8670    2.3144    0.0069 N   0  0  0

+    4.8705    2.3093   -0.0033 N   0  0  0

+   -0.0040   -6.0013    0.0070 N   0  0  0

+   -5.5269    2.6315    1.2759 C   0  0  0

+   -5.4755    2.7304   -1.2591 C   0  0  0

+    5.4747    2.7275    1.2641 C   0  0  0

+    5.5354    2.6231   -1.2704 C   0  0  0

+   -1.3152    1.4948    0.0000 H   0  0  0

+   -2.3784   -0.3629    0.0000 H   0  0  0

+    2.3822   -0.3634    0.0000 H   0  0  0

+    1.3045    1.4961    0.0000 H   0  0  0

+   -2.0960   -2.1037    0.0000 H   0  0  0

+    2.0945   -2.1062    0.0000 H   0  0  0

+   -2.5640    2.2163    0.0000 H   0  0  0

+   -3.6340    0.3630    0.0000 H   0  0  0

+    3.6370    0.3606    0.0000 H   0  0  0

+    2.5667    2.2238    0.0000 H   0  0  0

+   -2.1014   -4.4697    0.0000 H   0  0  0

+    2.0964   -4.4724    0.0000 H   0  0  0

+   -0.0048   -7.0164    0.0000 H   0  0  0

+   -5.0872    3.5465    0.0000 H   0  0  0

+   -6.4419    3.0712    0.0000 H   0  0  0

+   -5.9666    1.7165    0.0000 H   0  0  0

+   -4.9026    3.5684    0.0000 H   0  0  0

+   -6.3135    3.3033    0.0000 H   0  0  0

+   -6.0484    1.8924    0.0000 H   0  0  0

+    6.0524    1.8928    0.0000 H   0  0  0

+    6.3094    3.3052    0.0000 H   0  0  0

+    4.8970    3.5622    0.0000 H   0  0  0

+    5.9687    1.7051    0.0000 H   0  0  0

+    6.4534    3.0564    0.0000 H   0  0  0

+    5.1021    3.5411    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  2  0

+  8 14  1  0

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+ 10 16  2  0

+ 11 17  1  0

+ 13 18  1  0

+ 15 19  1  0

+ 17 20  1  0

+ 18 21  1  0

+ 19 22  2  0

+ 20 23  1  0

+ 20 24  1  0

+ 21 25  1  0

+ 21 26  1  0

+ 12 17  2  0

+ 14 18  2  0

+ 16 19  1  0

+  5 27  1  0

+  6 28  1  0

+  7 29  1  0

+  8 30  1  0

+  9 31  1  0

+ 10 32  1  0

+ 11 33  1  0

+ 12 34  1  0

+ 13 35  1  0

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+ 16 38  1  0

+ 22 39  1  0

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+ 24 43  1  0

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+ 25 46  1  0

+ 25 47  1  0

+ 25 48  1  0

+ 26 49  1  0

+ 26 50  1  0

+ 26 51  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115453-72-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    2.5219    0.2808   -0.0590 C   0  0  0

+    1.3266   -0.6218    0.1071 C   0  0  0

+    2.6172    1.4152    1.3392 Cl  0  0  0

+    4.0228   -0.7160   -0.1276 Cl  0  0  0

+    2.3558    1.2230   -1.5872 Cl  0  0  0

+    0.1059   -0.1116    0.0971 C   0  0  0

+    1.5513   -2.3311    0.3115 Cl  0  0  0

+   -1.2955   -1.1790    0.1369 S   0  0  0

+   -0.1152    1.6095    0.0448 Cl  0  0  0

+   -2.6289    0.0504    0.1052 C   0  0  0

+   -3.9817   -0.6636    0.1338 C   0  0  1

+   -5.0895    0.3577    0.1075 C   0  0  0

+   -4.0970   -1.5414   -1.0385 N   0  0  0

+   -5.5773    0.8486    1.2576 O   0  0  0

+   -5.5386    0.7348   -0.9490 O   0  0  0

+   -1.7763    0.7870    0.0000 H   0  0  0

+   -3.2642    0.9809    0.0000 H   0  0  0

+   -3.0568   -1.3071    0.0000 H   0  0  0

+   -5.1378   -1.9729    0.0000 H   0  0  0

+   -3.2029   -2.2270    0.0000 H   0  0  0

+   -6.3715    1.6478    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  6  9  1  0

+  8 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 12 15  2  0

+ 10 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 13 19  1  0

+ 13 20  1  0

+ 14 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85-40-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.2890    0.6862    0.1456 C   0  0  0

+   -0.2174   -0.7078   -0.5039 C   0  0  0

+    1.1084    1.1629    0.0924 C   0  0  0

+   -1.4827    1.4461   -0.3021 C   0  0  0

+    1.1807   -1.1054   -0.0894 C   0  0  0

+   -1.3515   -1.5348    0.0644 C   0  0  0

+    1.8799    0.0427    0.0845 N   0  0  0

+    1.4886    2.3136    0.0622 O   0  0  0

+   -2.6796    0.5885    0.0661 C   0  0  0

+    1.5965   -2.2343    0.0597 O   0  0  0

+   -2.5720   -0.6911    0.2659 C   0  0  0

+   -0.1643    1.7286    0.0000 H   0  0  0

+   -0.0331   -1.7413    0.0000 H   0  0  0

+   -0.8110    2.2529    0.0000 H   0  0  0

+   -2.1976    2.2149    0.0000 H   0  0  0

+   -2.0412   -2.3262    0.0000 H   0  0  0

+   -0.6421   -2.3086    0.0000 H   0  0  0

+    2.9293    0.0721    0.0000 H   0  0  0

+   -3.6327    1.0286    0.0000 H   0  0  0

+   -3.4805   -1.2172    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  5  7  1  0

+  9 11  2  0

+  1 12  1  0

+  2 13  1  0

+  4 14  1  0

+  4 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+872-50-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.3598    0.6389   -0.0283 C   0  0  0

+   -0.3183   -0.7046   -0.0325 N   0  0  0

+    1.0403    1.2029   -0.1303 C   0  0  0

+   -1.3726    1.3024    0.0417 O   0  0  0

+    1.0604   -1.1952   -0.1435 C   0  0  0

+   -1.4979   -1.5683    0.0622 C   0  0  0

+    1.9569    0.0085    0.2223 C   0  0  0

+    1.9678    1.7896    0.0000 H   0  0  0

+    0.5398    2.1797    0.0000 H   0  0  0

+    0.5916   -2.1876    0.0000 H   0  0  0

+    2.0014   -1.7602    0.0000 H   0  0  0

+   -2.1463   -0.6828    0.0000 H   0  0  0

+   -2.3834   -2.2167    0.0000 H   0  0  0

+   -0.8495   -2.4538    0.0000 H   0  0  0

+    2.7732   -0.7252    0.0000 H   0  0  0

+    2.7625    0.7539    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  3  7  1  0

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+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61166-04-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.5252   -0.4293   -0.0018 C   0  0  0

+   -0.9218   -0.7134   -0.0008 C   0  0  0

+    0.6570    0.9668   -0.0009 C   0  0  0

+    1.6595   -1.2381    0.0019 C   0  0  0

+   -1.5722    0.5294    0.0005 C   0  0  0

+   -1.6670   -1.8903   -0.0017 C   0  0  0

+   -0.6119    1.5248    0.0004 N   0  0  0

+    1.9277    1.5341   -0.0015 C   0  0  0

+    2.9161   -0.6580   -0.0003 C   0  0  0

+   -2.9635    0.5706    0.0016 C   0  0  0

+   -3.0437   -1.8290   -0.0013 C   0  0  0

+   -0.8950    2.9621    0.0016 C   0  0  0

+    3.0450    0.7283   -0.0029 C   0  0  0

+    4.0590   -1.4662    0.0033 N   0  0  0

+   -3.6883   -0.6014    0.0014 C   0  0  0

+    1.5621   -2.2775    0.0000 H   0  0  0

+   -1.1841   -2.8158    0.0000 H   0  0  0

+    2.0345    2.5726    0.0000 H   0  0  0

+   -3.4582    1.4899    0.0000 H   0  0  0

+   -3.6034   -2.7102    0.0000 H   0  0  0

+    0.1293    3.1638    0.0000 H   0  0  0

+   -1.0967    3.9864    0.0000 H   0  0  0

+   -1.9193    2.7604    0.0000 H   0  0  0

+    3.9954    1.1603    0.0000 H   0  0  0

+    3.9632   -2.5057    0.0000 H   0  0  0

+    5.0072   -1.0294    0.0000 H   0  0  0

+   -4.7316   -0.5647    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  8 13  2  0

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+  5  7  1  0

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+ 11 15  1  0

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+  8 18  1  0

+ 10 19  1  0

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+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-69-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.5177   -0.2787    0.0023 C   0  0  0

+    0.4185   -1.3134    0.0012 C   0  0  0

+   -0.1216    0.9889    0.0015 N   0  0  0

+   -1.9609   -0.5958   -0.0018 C   0  0  0

+    1.7660   -1.0001   -0.0007 C   0  0  0

+    1.1553    1.3130   -0.0003 C   0  0  0

+   -2.8549    0.3835   -0.0008 C   0  0  0

+    2.1356    0.3379   -0.0015 C   0  0  0

+    0.1085   -2.3033    0.0000 H   0  0  0

+   -2.2747   -1.5845    0.0000 H   0  0  0

+    2.4843   -1.7485    0.0000 H   0  0  0

+    1.4291    2.3135    0.0000 H   0  0  0

+   -2.5411    1.3722    0.0000 H   0  0  0

+   -3.8680    0.1609    0.0000 H   0  0  0

+    3.1382    0.6038    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  8  2  0

+  2  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14861-17-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.4413    0.4614    1.0503 C   0  0  0

+   -0.7463    0.9056    1.5399 O   0  0  0

+    0.9132    0.9364   -0.1664 C   0  0  0

+    1.1864   -0.4625    1.7677 C   0  0  0

+   -1.7228    0.2539    0.8537 C   0  0  0

+    2.1213    0.4835   -0.6618 C   0  0  0

+   -0.0138    2.0974   -1.0645 Cl  0  0  0

+    2.3937   -0.9125    1.2686 C   0  0  0

+   -3.0526    0.6030    1.0405 C   0  0  0

+   -1.3885   -0.7554   -0.0370 C   0  0  0

+    2.8600   -0.4424    0.0539 C   0  0  0

+   -4.0447   -0.0579    0.3437 C   0  0  0

+   -2.3797   -1.4175   -0.7348 C   0  0  0

+    4.3770   -1.0103   -0.5706 Cl  0  0  0

+   -3.7111   -1.0724   -0.5444 C   0  0  0

+   -4.7158   -1.7426   -1.2509 N   0  0  0

+    0.6637   -1.1878    0.0000 H   0  0  0

+    2.6466    1.2070    0.0000 H   0  0  0

+    2.5856   -1.7857    0.0000 H   0  0  0

+   -3.1999    1.4848    0.0000 H   0  0  0

+   -0.5430   -1.0460    0.0000 H   0  0  0

+   -4.8897    0.2341    0.0000 H   0  0  0

+   -2.2305   -2.2990    0.0000 H   0  0  0

+   -5.5174   -1.3466    0.0000 H   0  0  0

+   -4.6580   -2.6348    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  1  0

+ 12 15  1  0

+ 15 16  1  0

+  8 11  2  0

+ 13 15  2  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 16 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53-70-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -1.3876   -0.1649   -0.0019 C   0  0  0

+   -2.8497   -0.3049   -0.0016 C   0  0  0

+   -0.8203    1.1346    0.0000 C   0  0  0

+   -0.5684   -1.2866    0.0018 C   0  0  0

+   -3.6543    0.8547    0.0006 C   0  0  0

+   -3.4528   -1.5643   -0.0030 C   0  0  0

+    0.5673    1.2868   -0.0003 C   0  0  0

+   -1.6900    2.3071    0.0026 C   0  0  0

+    0.8188   -1.1343    0.0015 C   0  0  0

+   -3.0321    2.1742    0.0029 C   0  0  0

+   -5.0495    0.7203    0.0009 C   0  0  0

+   -4.8154   -1.6633   -0.0022 C   0  0  0

+    1.3861    0.1653   -0.0022 C   0  0  0

+    1.6891   -2.3068    0.0055 C   0  0  0

+   -5.6102   -0.5239   -0.0009 C   0  0  0

+    2.8486    0.3055   -0.0020 C   0  0  0

+    3.0308   -2.1738    0.0053 C   0  0  0

+    3.6535   -0.8538   -0.0034 C   0  0  0

+    3.4506    1.5651    0.0002 C   0  0  0

+    5.0483   -0.7212   -0.0031 C   0  0  0

+    4.8236    1.6632    0.0009 C   0  0  0

+    5.6138    0.5209   -0.0014 C   0  0  0

+   -0.9909   -2.2447    0.0000 H   0  0  0

+   -2.8629   -2.4295    0.0000 H   0  0  0

+    0.9899    2.2449    0.0000 H   0  0  0

+   -1.2659    3.2645    0.0000 H   0  0  0

+   -3.6358    3.0298    0.0000 H   0  0  0

+   -5.6594    1.5715    0.0000 H   0  0  0

+   -5.2658   -2.6087    0.0000 H   0  0  0

+    1.2652   -3.2643    0.0000 H   0  0  0

+   -6.6528   -0.6210    0.0000 H   0  0  0

+    3.6345   -3.0294    0.0000 H   0  0  0

+    2.8609    2.4305    0.0000 H   0  0  0

+    5.6560   -1.5740    0.0000 H   0  0  0

+    5.2764    2.6074    0.0000 H   0  0  0

+    6.6568    0.6139    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+ 14 17  2  0

+ 16 18  1  0

+ 16 19  2  0

+ 18 20  2  0

+ 19 21  1  0

+ 20 22  1  0

+  8 10  1  0

+  9 13  1  0

+ 12 15  1  0

+ 17 18  1  0

+ 21 22  2  0

+  4 23  1  0

+  6 24  1  0

+  7 25  1  0

+  8 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1241-94-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 53                          1 V2000

+   -0.5108   -0.8667    0.1313 P   0  0  0

+   -1.5549   -2.0680   -0.1113 O   0  0  0

+   -0.9364   -0.0432    1.4476 O   0  0  0

+    0.9673   -1.4726    0.3319 O   0  0  0

+   -0.5184    0.0376   -1.0403 O   0  0  0

+   -2.7417   -1.4957   -0.4440 C   0  0  0

+   -1.0862    1.2533    1.0686 C   0  0  0

+    1.8705   -0.3652    0.3366 C   0  0  0

+   -2.9768   -1.0928   -1.7508 C   0  0  0

+   -3.7223   -1.3184    0.5209 C   0  0  0

+   -2.2331    1.6532    0.3988 C   0  0  0

+   -0.0945    2.1802    1.3561 C   0  0  0

+    3.3095   -0.8811    0.4005 C   0  0  0

+   -4.1839   -0.5113   -2.0865 C   0  0  0

+   -4.9281   -0.7363    0.1801 C   0  0  0

+   -2.3828    2.9719    0.0145 C   0  0  0

+   -0.2490    3.4973    0.9697 C   0  0  0

+    4.2791    0.2890    0.2230 C   0  0  0

+    3.5537   -1.5444    1.7575 C   0  0  0

+   -5.1577   -0.3306   -1.1214 C   0  0  0

+   -1.3909    3.8924    0.2970 C   0  0  0

+    5.0421    0.1239   -1.0928 C   0  0  0

+    4.1843   -2.9222    1.5455 C   0  0  0

+    6.0915    1.2305   -1.2162 C   0  0  0

+    6.8545    1.0654   -2.5320 C   0  0  0

+    2.3085    0.5242    0.0000 H   0  0  0

+    1.0363    0.1705    0.0000 H   0  0  0

+   -2.3041   -0.3645    0.0000 H   0  0  0

+   -4.0288   -2.2612    0.0000 H   0  0  0

+   -3.0076    1.0343    0.0000 H   0  0  0

+    0.8364    1.8391    0.0000 H   0  0  0

+    2.6115   -1.5851    0.0000 H   0  0  0

+   -3.8756    0.4309    0.0000 H   0  0  0

+   -5.6059   -1.4598    0.0000 H   0  0  0

+   -3.3124    3.3163    0.0000 H   0  0  0

+    0.5236    4.1185    0.0000 H   0  0  0

+    4.6401    1.2123    0.0000 H   0  0  0

+    3.4249    0.7922    0.0000 H   0  0  0

+    2.5728   -1.4008    0.0000 H   0  0  0

+    2.9589   -2.3375    0.0000 H   0  0  0

+   -5.9648    0.2451    0.0000 H   0  0  0

+   -1.5951    4.8625    0.0000 H   0  0  0

+    4.6606   -0.7911    0.0000 H   0  0  0

+    5.8730   -0.4169    0.0000 H   0  0  0

+    3.2828   -3.3348    0.0000 H   0  0  0

+    4.5969   -3.8237    0.0000 H   0  0  0

+    5.0858   -2.5096    0.0000 H   0  0  0

+    6.4730    2.1455    0.0000 H   0  0  0

+    5.2606    1.7713    0.0000 H   0  0  0

+    6.6448    0.0964    0.0000 H   0  0  0

+    7.8235    0.8557    0.0000 H   0  0  0

+    7.0642    2.0344    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  6 10  2  0

+  7 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  2  0

+ 10 15  1  0

+ 11 16  1  0

+ 12 17  2  0

+ 13 18  1  0

+ 13 19  1  0

+ 14 20  1  0

+ 16 21  2  0

+ 18 22  1  0

+ 19 23  1  0

+ 22 24  1  0

+ 24 25  1  0

+ 15 20  2  0

+ 17 21  1  0

+  8 26  1  0

+  8 27  1  0

+  9 28  1  0

+ 10 29  1  0

+ 11 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 14 33  1  0

+ 15 34  1  0

+ 16 35  1  0

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+ 23 45  1  0

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+ 23 47  1  0

+ 24 48  1  0

+ 24 49  1  0

+ 25 50  1  0

+ 25 51  1  0

+ 25 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-60-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.1505    0.8947    0.0803 C   0  0  0

+   -1.3691   -0.4967    0.0795 C   0  0  0

+    0.2216    1.4186    0.2351 C   0  0  0

+   -2.2273    1.7653   -0.0703 C   0  0  0

+   -0.2216   -1.4190    0.2332 C   0  0  0

+   -2.6579   -0.9921   -0.0663 C   0  0  0

+    1.3690    0.4967    0.0788 C   0  0  0

+    0.4065    2.5930    0.4873 O   0  0  0

+   -3.5046    1.2612   -0.2199 C   0  0  0

+    1.1504   -0.8950    0.0781 C   0  0  0

+   -0.4064   -2.5938    0.4837 O   0  0  0

+   -3.7246   -0.1101   -0.2113 C   0  0  0

+    2.6572    0.9923   -0.0674 C   0  0  0

+    2.2276   -1.7652   -0.0689 C   0  0  0

+   -4.9849   -0.5927   -0.3546 O   0  0  0

+    3.7244    0.1104   -0.2134 C   0  0  0

+    3.5057   -1.2608   -0.2138 C   0  0  0

+    4.9846    0.5932   -0.3565 O   0  0  0

+   -2.0701    2.7918    0.0000 H   0  0  0

+   -2.8254   -2.0169    0.0000 H   0  0  0

+   -4.3140    1.9117    0.0000 H   0  0  0

+    2.8244    2.0172    0.0000 H   0  0  0

+    2.0706   -2.7917    0.0000 H   0  0  0

+   -5.9547   -0.9640    0.0000 H   0  0  0

+    4.3154   -1.9110    0.0000 H   0  0  0

+    5.9543    0.9647    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  2  0

+  7 13  2  0

+ 10 14  2  0

+ 12 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+ 16 18  1  0

+  7 10  1  0

+  9 12  1  0

+ 16 17  2  0

+  4 19  1  0

+  6 20  1  0

+  9 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103302-38-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.6797   -0.8165    0.3490 C   0  0  2

+   -0.6798   -0.8165   -0.3490 C   0  0  2

+    0.8638    0.4679    1.1131 C   0  0  0

+    1.7161   -0.9430   -0.6267 O   0  0  0

+   -0.8638    0.4679   -1.1131 C   0  0  0

+   -1.7161   -0.9429    0.6267 O   0  0  0

+    0.3670    1.6048    0.6378 C   0  0  0

+   -0.3669    1.6048   -0.6378 C   0  0  0

+    0.6232   -1.7453    0.0000 H   0  0  0

+   -0.6234   -1.7453    0.0000 H   0  0  0

+    1.7859    0.5930    0.0000 H   0  0  0

+    2.6398   -1.0557    0.0000 H   0  0  0

+   -1.7859    0.5930    0.0000 H   0  0  0

+   -2.6398   -1.0556    0.0000 H   0  0  0

+    0.8765    2.3835    0.0000 H   0  0  0

+   -0.8764    2.3835    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  8  1  0

+  1  9  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98114-60-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 10                          1 V2000

+   -4.2371   -0.2758   -0.2729 N   0  0  0

+   -5.1921    0.5836    0.4311 C   0  0  0

+   -3.2182   -0.7573    0.3548 N   0  0  0

+   -5.2404    1.9544   -0.2467 C   0  0  0

+   -2.4243   -1.4718   -0.2305 O   0  0  0

+    6.8678    0.1929    0.0083 K   0  3  0

+   -6.0745    0.7816    0.0000 H   0  0  0

+   -5.6071   -0.2199    0.0000 H   0  0  0

+   -4.3366    1.9862    0.0000 H   0  0  0

+   -5.2722    2.8582    0.0000 H   0  0  0

+   -6.1442    1.9226    0.0000 H   0  0  0

+   -1.7521   -2.0768    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  3  5  1  0

+  2  7  1  0

+  2  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+239-35-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 30                          1 V2000

+    0.4168    0.3655    0.0038 C   0  0  0

+   -0.3789   -0.7795    0.0021 C   0  0  0

+    1.8178    0.2947    0.0017 C   0  0  0

+   -0.7340    1.7157    0.0012 S   0  0  0

+   -1.8411   -0.5490    0.0037 C   0  0  0

+    0.2850   -2.0382   -0.0004 C   0  0  0

+    2.4402   -0.9792   -0.0020 C   0  0  0

+    2.6169    1.4477    0.0029 C   0  0  0

+   -2.2497    0.7937   -0.0021 C   0  0  0

+   -2.8602   -1.5261    0.0025 C   0  0  0

+    1.6321   -2.1322   -0.0013 C   0  0  0

+    3.8402   -1.0628   -0.0040 C   0  0  0

+    3.9741    1.3298    0.0003 C   0  0  0

+   -3.5812    1.1568   -0.0051 C   0  0  0

+   -4.1814   -1.1575    0.0043 C   0  0  0

+    4.5846    0.0784   -0.0024 C   0  0  0

+   -4.5558    0.1779   -0.0072 C   0  0  0

+   -0.2894   -2.9196    0.0000 H   0  0  0

+    2.1697    2.3999    0.0000 H   0  0  0

+   -2.6039   -2.5464    0.0000 H   0  0  0

+    2.0848   -3.0818    0.0000 H   0  0  0

+    4.3134   -2.0023    0.0000 H   0  0  0

+    4.5696    2.1970    0.0000 H   0  0  0

+   -3.8523    2.1732    0.0000 H   0  0  0

+   -4.9248   -1.9018    0.0000 H   0  0  0

+    5.6346    0.0132    0.0000 H   0  0  0

+   -5.5738    0.4432    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  2  1  0

+  7  3  2  0

+  8  3  1  0

+  9  4  1  0

+ 10  5  2  0

+ 11  6  2  0

+ 12  7  1  0

+ 13  8  2  0

+ 14  9  2  0

+ 15 10  1  0

+ 16 12  2  0

+ 17 14  1  0

+  5  9  1  0

+  7 11  1  0

+ 13 16  1  0

+ 15 17  2  0

+  6 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63521-85-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 71                          1 V2000

+   -0.4088    1.8240    0.7074 C   0  0  0

+   -0.7193    0.5932    0.1862 C   0  0  0

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+ 38 67  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+37797-31-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+    1.6973    0.5348   -0.5001 C   0  0  0

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+ 23 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16234-96-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 53                          1 V2000

+   -3.0853    1.6418    0.6774 C   0  0  0

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+    5.5600   -2.6419    0.0000 H   0  0  0

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+ 30 50  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98151-91-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+    0.0678   -0.1052   -0.0945 C   0  0  0

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+ 20 35  1  0

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+ 24 37  1  0

+ 25 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17455-23-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 78                          1 V2000

+    5.1942    0.7614    0.4845 C   0  0  0

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+ 32 76  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+830-07-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.0921    0.1108   -0.0035 C   0  0  0

+   -1.0336   -0.6298   -0.0028 O   0  0  0

+   -0.2662    1.4251   -0.0010 C   0  0  0

+    1.4678   -0.4093   -0.0009 C   0  0  0

+   -2.1026    0.1833    0.0001 C   0  0  0

+   -1.6740    1.4612    0.0013 C   0  0  0

+    2.4971    0.4329   -0.0019 C   0  0  0

+   -3.5182   -0.2523    0.0009 N   0  3  0

+    3.8825   -0.0908    0.0007 N   0  3  0

+   -4.4104    0.5768    0.0036 O   0  0  0

+   -3.7900   -1.4395   -0.0011 O   0  5  0

+    4.8252    0.6806   -0.0002 O   0  0  0

+    4.0792   -1.2928    0.0037 O   0  5  0

+    0.3575    2.2203    0.0000 H   0  0  0

+    1.6310   -1.4066    0.0000 H   0  0  0

+   -2.2536    2.2891    0.0000 H   0  0  0

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+  5  6  2  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52-90-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+   -0.1633   -0.1212   -0.4458 C   0  0  0

+   -1.5871    0.1115   -0.0100 C   0  0  0

+    0.7905    0.5155    0.5669 C   0  0  0

+    0.0957   -1.5652   -0.5216 N   0  0  0

+   -2.2435    1.2084   -0.4194 O   0  0  0

+   -2.1377   -0.6893    0.7078 O   0  0  0

+    2.5043    0.2354    0.0424 S   0  0  0

+   -0.3793    0.8760    0.0000 H   0  0  0

+    1.2209    1.4407    0.0000 H   0  0  0

+    0.0159    1.1797    0.0000 H   0  0  0

+   -0.6840   -2.2234    0.0000 H   0  0  0

+    1.0556   -1.9114    0.0000 H   0  0  0

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+  1  2  1  0

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+  3 10  1  0

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+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63449-41-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 67                          1 V2000

+    4.4803   -5.1849    0.1330 C   0  0  0

+    2.9816   -5.2740    0.2638 C   0  0  0

+    5.2582   -4.9390    1.2491 C   0  0  0

+    5.0774   -5.3546   -1.1019 C   0  0  0

+    2.3843   -3.9691   -0.0499 N   0  3  0

+    6.6327   -4.8572    1.1291 C   0  0  0

+    6.4524   -5.2729   -1.2219 C   0  0  0

+    0.9460   -4.0049    0.2468 C   0  0  0

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+ 24 67  1  0

+ 25 68  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7097-60-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 35                          1 V2000

+   -9.4247   -0.5182    0.0491 I   0  0  0

+  -10.8618    0.6504    0.6901 O   0  0  0

+   -8.0554   -0.3333    1.0455 O   0  0  0

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+  1  2  1  0

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+ 19 35  1  0

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+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+835-64-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -1.7442   -2.1080   -0.0005 O   0  0  0

+   -2.3598   -0.8981    0.0008 C   0  0  0

+   -1.5991    0.2781    0.0009 C   0  0  0

+   -3.7438   -0.8214   -0.0037 C   0  0  0

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+   -4.3691    0.4104   -0.0029 C   0  0  0

+    0.6764    1.2446   -0.0005 N   0  0  0

+    0.5947   -0.9303    0.0041 O   0  0  0

+   -3.6207    1.5755    0.0025 C   0  0  0

+    1.9608    0.8036   -0.0019 C   0  0  0

+    1.9055   -0.5999    0.0011 C   0  0  0

+    3.2009    1.4462   -0.0021 C   0  0  0

+    3.0798   -1.3356    0.0036 C   0  0  0

+    4.3575    0.6985   -0.0031 C   0  0  0

+    4.2980   -0.6869   -0.0004 C   0  0  0

+   -1.2738   -3.0325    0.0000 H   0  0  0

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+  2  1  1  0

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+ 10 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-38-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+    0.0000   -0.1066   -0.1977 P   0  0  0

+   -1.3146    0.1659    0.6910 O   0  0  0

+    1.3146    0.1659    0.6910 O   0  0  0

+    0.0000   -1.8383   -0.7676 C   0  0  0

+    0.0000    0.7982   -1.3689 O   0  0  0

+   -2.3037    0.7039   -0.1888 C   0  0  0

+    2.3037    0.7039   -0.1889 C   0  0  0

+    0.0000   -2.7736    0.4432 C   0  0  0

+   -3.5856    0.9869    0.5971 C   0  0  0

+    3.5856    0.9869    0.5970 C   0  0  0

+   -0.8527   -1.3460    0.0000 H   0  0  0

+   -0.8527   -2.3306    0.0000 H   0  0  0

+   -1.5155    1.2940    0.0000 H   0  0  0

+   -2.5115    1.6663    0.0000 H   0  0  0

+    2.5115    1.6663    0.0000 H   0  0  0

+    1.5155    1.2940    0.0000 H   0  0  0

+   -0.9846   -2.7736    0.0000 H   0  0  0

+    0.0000   -3.7582    0.0000 H   0  0  0

+    0.9846   -2.7736    0.0000 H   0  0  0

+   -3.3733    1.9483    0.0000 H   0  0  0

+   -4.5470    1.1991    0.0000 H   0  0  0

+   -3.7978    0.0255    0.0000 H   0  0  0

+    3.7978    0.0255    0.0000 H   0  0  0

+    4.5470    1.1991    0.0000 H   0  0  0

+    3.3733    1.9483    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  7 10  1  0

+  4 11  1  0

+  4 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-79-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -1.3138    0.9232    0.2169 C   0  0  0

+   -2.0674   -0.2079   -0.1490 C   0  0  0

+    0.0629    0.7351    0.7299 C   0  0  0

+   -1.8646    2.1898    0.0876 C   0  0  0

+   -1.4591   -1.5490   -0.0097 C   0  0  0

+   -3.3599   -0.0508   -0.6318 C   0  0  0

+    0.7203   -0.5675    0.5690 C   0  0  0

+    0.6432    1.6514    1.2797 O   0  0  0

+   -3.1552    2.3320   -0.4017 C   0  0  0

+    0.0035   -1.6575    0.2182 C   0  0  0

+   -2.1468   -2.5473   -0.0803 O   0  0  0

+   -3.8989    1.2216   -0.7503 C   0  0  0

+    2.2050   -0.6896    0.7968 C   0  0  0

+    0.6214   -2.8529    0.0739 O   0  0  0

+    2.9339   -0.4428   -0.4989 C   0  0  0

+    3.7933    0.5417   -0.5896 C   0  0  0

+    4.5223    0.7885   -1.8853 C   0  0  0

+    4.0530    1.4275    0.6016 C   0  0  0

+   -1.2699    2.9966    0.0000 H   0  0  0

+   -3.9629   -0.8514    0.0000 H   0  0  0

+   -3.5780    3.2408    0.0000 H   0  0  0

+   -4.8967    1.3164    0.0000 H   0  0  0

+    1.7515   -1.5835    0.0000 H   0  0  0

+    2.8613   -1.4472    0.0000 H   0  0  0

+    1.0817   -3.7433    0.0000 H   0  0  0

+    3.4914   -1.2758    0.0000 H   0  0  0

+    4.8437   -0.1609    0.0000 H   0  0  0

+    5.4717    1.1099    0.0000 H   0  0  0

+    4.2009    1.7379    0.0000 H   0  0  0

+    5.0148    1.1455    0.0000 H   0  0  0

+    4.3350    2.3893    0.0000 H   0  0  0

+    3.0912    1.7095    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  1  0

+ 10 14  1  0

+ 13 15  1  0

+ 15 16  2  0

+ 16 17  1  0

+ 16 18  1  0

+  7 10  2  0

+  9 12  2  0

+  4 19  1  0

+  6 20  1  0

+  9 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+589-15-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -2.4304    0.0121   -1.2356 C   0  0  0

+   -3.5176   -0.0039    0.4023 Br  0  0  0

+   -0.9688    0.0085   -0.8685 C   0  0  0

+   -0.2988   -1.1902   -0.7119 C   0  0  0

+   -0.2971    1.2043   -0.6940 C   0  0  0

+    1.0421   -1.1941   -0.3756 C   0  0  0

+    1.0433    1.2015   -0.3577 C   0  0  0

+    1.7131    0.0019   -0.1957 C   0  0  0

+    3.5471   -0.0027    0.2649 Br  0  0  0

+   -1.9190    0.9046    0.0000 H   0  0  0

+   -2.9527    0.8983    0.0000 H   0  0  0

+   -0.8206   -2.0767    0.0000 H   0  0  0

+   -0.8157    2.0926    0.0000 H   0  0  0

+    1.5606   -2.0825    0.0000 H   0  0  0

+    1.5649    2.0881    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

+  9  8  1  0

+  7  8  1  0

+  1 10  1  0

+  1 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119613-62-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 45                          1 V2000

+    1.0828   -0.0650    0.3163 C   0  0  0

+   -0.3023    0.1632    0.2476 C   0  0  0

+    2.0040    1.0841    0.6046 C   0  0  1

+    1.5639   -1.3262    0.1286 C   0  0  0

+   -1.1721   -0.9206   -0.0013 C   0  0  0

+   -0.8297    1.4639    0.4245 C   0  0  0

+    3.4455    0.9056    0.1684 C   0  0  2

+    2.5195    1.6984   -0.5778 O   0  0  0

+    0.7026   -2.3916   -0.1155 C   0  0  0

+    3.0503   -1.5721    0.1740 C   0  0  1

+   -2.6145   -0.6669   -0.0639 C   0  0  0

+   -0.6474   -2.2018   -0.1811 C   0  0  0

+   -2.1563    1.6978    0.3664 C   0  0  0

+    0.1111    2.6122    0.6839 C   0  0  0

+    3.7778   -0.4160   -0.5038 C   0  0  1

+    3.4755   -1.6703    1.5347 O   0  0  0

+   -3.0797    0.6539    0.1255 C   0  0  0

+   -3.5278   -1.6949   -0.3050 C   0  0  0

+    0.2167    3.4788   -0.5725 C   0  0  0

+    3.4009   -0.3579   -1.8810 O   0  0  0

+   -4.4576    0.9072    0.0706 C   0  0  0

+   -4.8637   -1.4153   -0.3544 C   0  0  0

+   -5.3258   -0.1181   -0.1653 C   0  0  0

+    1.2066    1.7382    0.0000 H   0  0  0

+    4.3223    1.4486    0.0000 H   0  0  0

+    1.0810   -3.3510    0.0000 H   0  0  0

+    2.8500   -2.5838    0.0000 H   0  0  0

+   -1.2804   -3.0160    0.0000 H   0  0  0

+   -2.4964    2.6714    0.0000 H   0  0  0

+    0.6494    1.7325    0.0000 H   0  0  0

+    1.1189    2.8312    0.0000 H   0  0  0

+    4.7963   -0.5779    0.0000 H   0  0  0

+    4.4804   -1.9024    0.0000 H   0  0  0

+   -3.2043   -2.6742    0.0000 H   0  0  0

+    1.2405    3.3541    0.0000 H   0  0  0

+    0.3414    4.5026    0.0000 H   0  0  0

+   -0.8071    3.6035    0.0000 H   0  0  0

+    2.3816   -0.2008    0.0000 H   0  0  0

+   -4.8046    1.8784    0.0000 H   0  0  0

+   -5.5418   -2.1924    0.0000 H   0  0  0

+   -6.3404    0.0667    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  6 14  1  0

+  7 15  1  0

+ 10 16  1  0

+ 11 17  2  0

+ 11 18  1  0

+ 14 19  1  0

+ 15 20  1  0

+ 17 21  1  0

+ 18 22  2  0

+ 21 23  2  0

+  7  8  1  0

+  9 12  2  0

+ 10 15  1  0

+ 13 17  1  0

+ 22 23  1  0

+  3 24  1  0

+  7 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4424-06-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 51                          1 V2000

+    0.6964   -0.0791   -0.0011 C   0  0  0

+   -0.6961    0.0823   -0.0007 C   0  0  0

+    1.5376    1.0580    0.0001 C   0  0  0

+    1.2547   -1.3784    0.0032 C   0  0  0

+   -1.5367   -1.0551   -0.0015 C   0  0  0

+   -1.2555    1.3812    0.0009 C   0  0  0

+    2.9991    0.8549   -0.0004 C   0  0  0

+    0.9691    2.3243    0.0008 C   0  0  0

+    2.7190   -1.5131    0.0026 C   0  0  0

+    0.4104   -2.4819    0.0073 C   0  0  0

+   -2.9983   -0.8528   -0.0012 C   0  0  0

+   -0.9689   -2.3216   -0.0030 C   0  0  0

+   -2.7200    1.5147    0.0013 C   0  0  0

+   -0.4105    2.4840    0.0017 C   0  0  0

+    3.5107   -0.4216   -0.0020 N   0  0  0

+    3.9864    1.7231    0.0004 N   0  0  0

+    3.2211   -2.6203    0.0063 O   0  0  0

+   -3.5115    0.4229    0.0000 N   0  0  0

+   -3.9841   -1.7227   -0.0022 N   0  0  0

+   -3.2226    2.6217    0.0027 O   0  0  0

+    4.8935   -0.3045   -0.0022 C   0  0  0

+    5.1728    1.0732   -0.0006 C   0  0  0

+   -4.8941    0.3037   -0.0004 C   0  0  0

+   -5.1713   -1.0745   -0.0018 C   0  0  0

+    5.9335   -1.2212   -0.0035 C   0  0  0

+    6.5050    1.5036   -0.0004 C   0  0  0

+   -5.9360    1.2184    0.0007 C   0  0  0

+   -6.5025   -1.5077   -0.0026 C   0  0  0

+    7.2391   -0.7742   -0.0033 C   0  0  0

+    7.5163    0.5854   -0.0017 C   0  0  0

+   -7.2405    0.7683    0.0003 C   0  0  0

+   -7.5158   -0.5917   -0.0019 C   0  0  0

+    1.5840    3.1641    0.0000 H   0  0  0

+    0.8167   -3.4401    0.0000 H   0  0  0

+   -1.5842   -3.1611    0.0000 H   0  0  0

+   -0.8166    3.4423    0.0000 H   0  0  0

+    5.7305   -2.2420    0.0000 H   0  0  0

+    6.7244    2.5210    0.0000 H   0  0  0

+   -5.7352    2.2397    0.0000 H   0  0  0

+   -6.7197   -2.5256    0.0000 H   0  0  0

+    8.0209   -1.4613    0.0000 H   0  0  0

+    8.5055    0.9091    0.0000 H   0  0  0

+   -8.0236    1.4539    0.0000 H   0  0  0

+   -8.5044   -0.9172    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  2  0

+  7 15  1  0

+  7 16  2  0

+  9 17  2  0

+ 11 18  1  0

+ 11 19  2  0

+ 13 20  2  0

+ 15 21  1  0

+ 16 22  1  0

+ 18 23  1  0

+ 19 24  1  0

+ 21 25  1  0

+ 22 26  1  0

+ 23 27  1  0

+ 24 28  1  0

+ 25 29  2  0

+ 26 30  2  0

+ 27 31  2  0

+ 28 32  2  0

+  8 14  1  0

+  9 15  1  0

+ 10 12  1  0

+ 13 18  1  0

+ 21 22  2  0

+ 23 24  2  0

+ 29 30  1  0

+ 31 32  1  0

+  8 33  1  0

+ 10 34  1  0

+ 12 35  1  0

+ 14 36  1  0

+ 25 37  1  0

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+ 27 39  1  0

+ 28 40  1  0

+ 29 41  1  0

+ 30 42  1  0

+ 31 43  1  0

+ 32 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+627-30-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+   -0.6429   -0.2436    0.0000 C   0  0  0

+   -1.9612    0.5331   -0.0001 C   0  0  0

+    0.5287    0.7405    0.0000 C   0  0  0

+   -3.0554   -0.3860   -0.0002 O   0  0  0

+    2.0821   -0.1747    0.0002 Cl  0  0  0

+   -1.3334   -1.1602    0.0000 H   0  0  0

+    0.1898   -1.0333    0.0000 H   0  0  0

+   -1.2707    1.4497    0.0000 H   0  0  0

+   -2.7939    1.3228    0.0000 H   0  0  0

+    1.2192    1.6571    0.0000 H   0  0  0

+   -0.3040    1.5302    0.0000 H   0  0  0

+   -3.9341   -1.1241    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+527-61-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.1416    0.0000    0.0013 C   0  0  0

+   -0.4031   -1.2792    0.0007 C   0  0  0

+   -0.4031    1.2792    0.0007 C   0  0  0

+   -2.3560    0.0000   -0.0029 O   0  0  0

+    0.9370   -1.2792    0.0000 C   0  0  0

+   -1.1566   -2.5843    0.0013 C   0  0  0

+    0.9370    1.2792    0.0001 C   0  0  0

+   -1.1566    2.5843    0.0014 C   0  0  0

+    1.6756    0.0000   -0.0006 C   0  0  0

+    2.8900    0.0000   -0.0007 O   0  0  0

+    1.4909   -2.2386    0.0000 H   0  0  0

+   -2.1160   -2.0304    0.0000 H   0  0  0

+   -1.7105   -3.5437    0.0000 H   0  0  0

+   -0.1972   -3.1382    0.0000 H   0  0  0

+    1.4909    2.2386    0.0000 H   0  0  0

+   -0.1972    3.1382    0.0000 H   0  0  0

+   -1.7105    3.5437    0.0000 H   0  0  0

+   -2.1160    2.0304    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  1  0

+  9 10  2  0

+  7  9  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1083-57-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+    0.2110    0.5987   -0.4439 C   0  0  0

+    0.5251   -0.7014   -0.8158 C   0  0  0

+    1.1998    1.4351    0.0570 C   0  0  0

+   -1.1020    1.0686   -0.5795 N   0  0  0

+    1.8208   -1.1621   -0.6872 C   0  0  0

+    2.4947    0.9733    0.1850 C   0  0  0

+   -2.1203    0.3981   -0.0051 C   0  0  0

+    2.8079   -0.3262   -0.1868 C   0  0  0

+   -3.5426    0.8287   -0.2559 C   0  0  0

+   -1.8921   -0.5519    0.7136 O   0  0  0

+    4.0832   -0.7806   -0.0601 O   0  0  0

+   -4.4964   -0.0922    0.5077 C   0  0  0

+    4.8544    0.2971    0.4747 C   0  0  0

+   -5.9403    0.3451    0.2531 C   0  0  0

+   -4.3201   -1.4376    0.0596 O   0  0  0

+    6.3078   -0.1503    0.6430 C   0  0  0

+   -0.2249   -1.3768    0.0000 H   0  0  0

+    1.0193    2.4281    0.0000 H   0  0  0

+   -1.2221    2.0707    0.0000 H   0  0  0

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+   -6.2328   -0.6208    0.0000 H   0  0  0

+   -4.1890   -2.4383    0.0000 H   0  0  0

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+  1  2  2  0

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+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+22603-58-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.0250   -1.2306    0.0025 C   0  0  0

+   -1.1924   -0.5793   -0.0191 C   0  0  0

+    1.2039   -0.4957    0.0198 C   0  0  0

+    0.0738   -2.7100    0.0133 N   0  3  0

+   -1.2390    0.8030   -0.0239 C   0  0  0

+   -2.4718   -1.3756   -0.0379 C   0  0  0

+    1.1535    0.8922    0.0154 C   0  0  0

+    2.4371   -1.1513    0.0412 N   0  0  0

+    0.1086   -3.3259   -1.0369 O   0  0  0

+    0.0790   -3.3114    1.0725 O   0  5  0

+   -0.0677    1.5373   -0.0071 C   0  0  0

+   -2.5459    1.4977   -0.0475 N   0  3  0

+    2.4070    1.6793    0.0333 N   0  3  0

+   -2.8816    2.1302   -1.0328 O   0  0  0

+   -3.2855    1.4369    0.9183 O   0  5  0

+    2.5881    2.5165    0.8992 O   0  0  0

+    3.2574    1.4896   -0.8178 O   0  5  0

+   -3.0197   -0.4953    0.0000 H   0  0  0

+   -3.3521   -1.9235    0.0000 H   0  0  0

+   -1.9239   -2.2559    0.0000 H   0  0  0

+    2.4734   -2.1875    0.0000 H   0  0  0

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+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-89-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -0.8726   -0.0682   -0.5098 C   0  0  0

+   -2.2359   -0.6111   -0.0765 C   0  0  0

+   -1.8266    0.7314    0.1920 O   0  0  0

+    0.2025   -0.5526    0.4651 C   0  0  0

+    1.8090    0.0872   -0.0456 Cl  0  0  0

+   -0.3131    0.8234    0.0000 H   0  0  0

+   -3.2859   -0.5365    0.0000 H   0  0  0

+   -2.0744   -1.6513    0.0000 H   0  0  0

+   -0.4590   -1.3714    0.0000 H   0  0  0

+    0.8270   -1.3999    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  4  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+584-79-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 49                          1 V2000

+    2.4939   -0.2496    0.0717 C   0  0  0

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+ 22 47  1  0

+ 22 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52671-42-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.1322   -1.0237   -0.0823 C   0  0  0

+   -1.1006   -1.5561   -0.2543 O   0  0  0

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+   -2.4426    1.8063    0.1048 C   0  0  0

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+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58152-03-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 82 84                          1 V2000

+   -0.6389   -0.1122    0.1402 C   0  0  1

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+ 39 82  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+134998-77-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.1631    0.4201   -0.0030 C   0  0  0

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+  1  2  1  0

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+  1  4  1  0

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+  3  7  1  0

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+  7 11  2  0

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+ 15 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122367-97-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 52                          1 V2000

+   -0.0382    0.7184   -0.4921 C   0  0  0

+   -0.8459   -0.4183   -0.4197 C   0  0  0

+    1.3592    0.7427   -0.4143 C   0  0  0

+   -0.5127    2.0925   -0.6564 C   0  0  0

+   -2.3247   -0.2001   -0.5369 C   0  0  2

+   -0.1825   -1.5928   -0.2529 C   0  0  0

+    1.7086    2.0536   -0.5353 N   0  0  0

+    2.0107   -0.4777   -0.2445 C   0  0  0

+    0.5774    2.8438   -0.6771 C   0  0  0

+   -1.9967    2.3363   -0.7524 C   0  0  0

+   -2.7179    1.1879   -0.0306 C   0  0  1

+   -3.0566   -1.2682    0.2841 C   0  0  0

+    1.2097   -1.6102   -0.1685 C   0  0  0

+    3.0841    2.5576   -0.5179 C   0  0  0

+   -4.1662    1.3809   -0.1770 N   0  0  0

+   -4.5628   -0.9998    0.2303 C   0  0  2

+    2.0614   -3.2825    0.0640 Br  0  0  0

+    3.4892    2.8848    0.9207 C   0  0  0

+   -4.8320    0.4268    0.7149 C   0  0  0

+   -4.4677    2.7226    0.3396 C   0  0  0

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+   -2.1191   -1.7318    0.0000 H   0  0  0

+    3.0183    1.5138    0.0000 H   0  0  0

+    4.0131    2.0773    0.0000 H   0  0  0

+   -5.5827   -0.7686    0.0000 H   0  0  0

+    4.0046    1.9748    0.0000 H   0  0  0

+   -5.5083    1.2245    0.0000 H   0  0  0

+   -5.7760   -0.0232    0.0000 H   0  0  0

+   -3.4473    2.9519    0.0000 H   0  0  0

+   -4.6970    3.7430    0.0000 H   0  0  0

+   -5.4881    2.4933    0.0000 H   0  0  0

+   -6.1341   -1.3746    0.0000 H   0  0  0

+   -5.9087   -2.8364    0.0000 H   0  0  0

+   -4.4469   -2.6110    0.0000 H   0  0  0

+    5.4513    2.5071    0.0000 H   0  0  0

+    5.7243    4.0865    0.0000 H   0  0  0

+    4.2718    5.2942    0.0000 H   0  0  0

+    2.7685    4.7421    0.0000 H   0  0  0

+  1  2  2  0

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+  7  9  1  0

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+ 22 45  1  0

+ 22 46  1  0

+ 23 47  1  0

+ 23 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2303-17-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    3.2304   -0.0901    0.1838 N   0  0  0

+    2.1554    0.4604   -0.4144 C   0  0  0

+    4.5436    0.5476    0.0612 C   0  0  0

+    3.0846   -1.3230    0.9616 C   0  0  0

+    0.5490   -0.2019   -0.1221 S   0  0  0

+    2.2942    1.4143   -1.1559 O   0  0  0

+    4.9945    0.5096   -1.4004 C   0  0  0

+    4.4501    2.0016    0.5283 C   0  0  0

+    3.9052   -2.4375    0.3095 C   0  0  0

+    3.5859   -1.0883    2.3880 C   0  0  0

+   -0.8947    0.5374   -0.9254 C   0  0  0

+   -2.1367   -0.2092   -0.5121 C   0  0  0

+   -3.1068    0.4226    0.1102 C   0  0  0

+   -2.2863   -1.9039   -0.8579 Cl  0  0  0

+   -2.9573    2.1173    0.4561 Cl  0  0  0

+   -4.5377   -0.4374    0.5864 Cl  0  0  0

+    4.7424   -0.5209    0.0000 H   0  0  0

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+    3.0300   -3.0819    0.0000 H   0  0  0

+    4.5496   -3.3127    0.0000 H   0  0  0

+    4.7804   -1.7931    0.0000 H   0  0  0

+    4.0467   -2.0726    0.0000 H   0  0  0

+    4.5702   -0.6275    0.0000 H   0  0  0

+    3.1251   -0.1040    0.0000 H   0  0  0

+   -0.2295    1.3969    0.0000 H   0  0  0

+   -1.6168    1.3497    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 10 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+ 11 31  1  0

+ 11 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-16-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 41                          1 V2000

+   -3.8682    0.1124   -0.5367 O   0  0  0

+   -4.7538   -0.8843   -0.3383 C   0  0  0

+   -3.0542    0.1317   -1.7389 C   0  0  0

+   -5.5777   -0.9039    0.8784 C   0  0  0

+   -4.8709   -1.7668   -1.1658 O   0  0  0

+   -2.1409    1.3591   -1.7166 C   0  0  0

+   -5.4325    0.1902    1.9044 C   0  0  0

+   -6.4520   -1.8880    1.0742 C   0  0  0

+   -1.2928    1.3009   -0.5680 O   0  0  0

+   -0.4686    2.4677   -0.6036 C   0  0  0

+    0.4686    2.4672    0.6057 C   0  0  0

+    1.2928    1.3004    0.5691 O   0  0  0

+    2.1409    1.3576    1.7178 C   0  0  0

+    3.0542    0.1302    1.7390 C   0  0  0

+    3.8682    0.1119    0.5368 O   0  0  0

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+    5.5777   -0.9032   -0.8791 C   0  0  0

+    4.8709   -1.7678    1.1642 O   0  0  0

+    5.4325    0.1919   -1.9042 C   0  0  0

+    6.4520   -1.8871   -1.0758 C   0  0  0

+   -3.2166   -0.6800    0.0000 H   0  0  0

+   -2.2979   -0.2048    0.0000 H   0  0  0

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+   -2.8865    1.7186    0.0000 H   0  0  0

+   -4.6119    0.0813    0.0000 H   0  0  0

+   -5.3236    1.0108    0.0000 H   0  0  0

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+   -7.2628   -1.7213    0.0000 H   0  0  0

+   -6.1910   -2.6735    0.0000 H   0  0  0

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+   -1.2277    2.7978    0.0000 H   0  0  0

+    1.2278    2.7970    0.0000 H   0  0  0

+    0.3004    3.2777    0.0000 H   0  0  0

+    2.8867    1.7168    0.0000 H   0  0  0

+    1.9296    2.1579    0.0000 H   0  0  0

+    2.2980   -0.2066    0.0000 H   0  0  0

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+    5.3237    1.0125    0.0000 H   0  0  0

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+    6.1911   -2.6727    0.0000 H   0  0  0

+    7.2628   -1.7203    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+ 20 41  1  0

+ 20 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+55566-30-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 26                          1 V2000

+   -5.6607    0.0087    0.0257 P   0  3  0

+   -6.7516    1.4058   -0.4004 C   0  0  0

+   -4.2696    0.6110    1.0384 C   0  0  0

+   -6.6047   -1.2341    0.9678 C   0  0  0

+   -5.0168   -0.7477   -1.5029 C   0  0  0

+   -6.0115    2.3799   -1.1389 O   0  0  0

+   -4.7743    1.2039    2.2366 O   0  0  0

+   -5.7495   -2.3291    1.3018 O   0  0  0

+   -6.1073   -1.2197   -2.2966 O   0  0  0

+    8.4392   -0.0448    0.0374 S   0  0  0

+    7.5284    1.1216   -0.3183 O   0  0  0

+    9.4877    0.5091    0.8204 O   0  0  0

+    7.5766   -1.0979    0.4449 O   0  0  0

+    9.0930   -0.5212   -1.2518 O   0  0  0

+   -7.4701    2.0563    0.0000 H   0  0  0

+   -7.4615    0.7458    0.0000 H   0  0  0

+   -3.7986   -0.2361    0.0000 H   0  0  0

+   -3.4731    1.1633    0.0000 H   0  0  0

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+   -7.3145   -1.8941    0.0000 H   0  0  0

+   -4.5458   -1.5948    0.0000 H   0  0  0

+   -4.2203   -0.1954    0.0000 H   0  0  0

+   -5.4251    3.1517    0.0000 H   0  0  0

+   -5.4026    1.9420    0.0000 H   0  0  0

+   -5.1529   -3.0930    0.0000 H   0  0  0

+   -6.9968   -1.6047    0.0000 H   0  0  0

+    6.9319    1.8855    0.0000 H   0  0  0

+    9.8763   -1.0920    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13684-63-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+    1.9411    0.2639   -0.1055 C   0  0  0

+    0.9571    1.1010   -0.6082 C   0  0  0

+    3.0720    0.8055    0.4884 C   0  0  0

+   -0.1523    0.5735   -1.1903 O   0  0  0

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+    3.2149    2.1845    0.5775 C   0  0  0

+    4.0674   -0.0364    0.9975 N   0  0  0

+   -1.2291    0.2737   -0.4388 C   0  0  0

+    2.2324    3.0153    0.0754 C   0  0  0

+    4.6242   -0.9759    0.2078 C   0  0  0

+   -2.2810   -0.3620   -0.9920 N   0  0  0

+   -1.2523    0.5764    0.7378 O   0  0  0

+    5.4940   -1.8628    0.7272 O   0  0  0

+    4.3411   -1.0227   -0.9730 O   0  0  0

+   -3.5463   -0.2651   -0.4021 C   0  0  0

+    6.0939   -2.8750   -0.1236 C   0  0  0

+   -4.3822   -1.3730   -0.3625 C   0  0  0

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+   -6.0477   -0.0737    0.7650 C   0  0  0

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+    1.8200   -0.6687    0.0000 H   0  0  0

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+   -2.0633   -1.2769    0.0000 H   0  0  0

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+    6.5734   -3.6840    0.0000 H   0  0  0

+    6.9029   -2.3955    0.0000 H   0  0  0

+   -3.9964   -2.2306    0.0000 H   0  0  0

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+   -7.2888   -1.9094    0.0000 H   0  0  0

+   -7.1052   -3.2266    0.0000 H   0  0  0

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+  1  2  1  0

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+ 18 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+129286-36-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+    0.9187   -0.0180   -0.0042 C   0  0  0

+   -0.2443   -0.9194   -0.0037 C   0  0  0

+    0.4439    1.3076   -0.0020 C   0  0  0

+    2.3137   -0.2496   -0.0013 C   0  0  0

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+   -0.4673   -2.2886   -0.0045 C   0  0  0

+   -1.0310    1.2587   -0.0001 C   0  0  0

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+    2.8309   -1.5536    0.0037 C   0  0  0

+   -2.6903   -0.5723   -0.0003 C   0  0  0

+   -1.7711   -2.7775   -0.0029 C   0  0  0

+   -2.0728    2.1734    0.0027 C   0  0  0

+    2.6925    2.1629   -0.0040 C   0  0  0

+    4.5892    0.6154    0.0003 C   0  0  0

+    4.1796   -1.7457    0.0069 C   0  0  0

+   -3.7246    0.3837    0.0023 C   0  0  0

+   -2.8728   -1.9641   -0.0014 C   0  0  0

+   -3.3905    1.7240    0.0042 C   0  0  0

+    5.0565   -0.6637    0.0051 C   0  0  0

+   -5.0191   -0.0029    0.0032 F   0  0  0

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+   -1.9160   -3.8161    0.0000 H   0  0  0

+   -1.8687    3.2020    0.0000 H   0  0  0

+    3.3506    2.9793    0.0000 H   0  0  0

+    5.2604    1.4211    0.0000 H   0  0  0

+    4.5628   -2.7218    0.0000 H   0  0  0

+   -3.8377   -2.3746    0.0000 H   0  0  0

+   -4.1626    2.4336    0.0000 H   0  0  0

+    6.0908   -0.8364    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  2  0

+ 11 17  1  0

+ 11 18  2  0

+ 13 19  1  0

+ 15 20  2  0

+ 17 21  1  0

+  5  7  1  0

+  9 14  1  0

+ 12 18  1  0

+ 16 20  1  0

+ 17 19  2  0

+  6 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 12 25  1  0

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+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+28920-43-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -0.4149   -0.4202   -0.8014 C   0  0  0

+   -1.7324   -1.0627   -0.4426 C   0  0  0

+   -0.5470    1.0367   -0.4310 C   0  0  0

+    0.7046   -1.0569    0.0245 C   0  0  0

+   -2.5526   -0.0699    0.0869 C   0  0  0

+   -2.1911   -2.3580   -0.5533 C   0  0  0

+   -1.8229    1.2221    0.0939 C   0  0  0

+    0.3261    2.0996   -0.5288 C   0  0  0

+    1.9723   -0.4387   -0.3207 O   0  0  0

+   -3.8432   -0.3993    0.5043 C   0  0  0

+   -3.4718   -2.6773   -0.1374 C   0  0  0

+   -2.2095    2.4943    0.5196 C   0  0  0

+   -0.0636    3.3574   -0.1043 C   0  0  0

+    3.1023   -0.8412    0.2834 C   0  0  0

+   -4.2940   -1.6981    0.3899 C   0  0  0

+   -1.3300    3.5518    0.4175 C   0  0  0

+    3.0639   -1.7209    1.1170 O   0  0  0

+    4.6179   -0.1021   -0.1294 Cl  0  0  0

+    0.4243    0.1201    0.0000 H   0  0  0

+    0.0486   -1.8092    0.0000 H   0  0  0

+    1.3116   -1.8492    0.0000 H   0  0  0

+   -1.5200   -3.0968    0.0000 H   0  0  0

+    1.3056    1.9076    0.0000 H   0  0  0

+   -4.5186    0.3355    0.0000 H   0  0  0

+   -3.7801   -3.6266    0.0000 H   0  0  0

+   -3.1878    2.6920    0.0000 H   0  0  0

+    0.5880    4.1135    0.0000 H   0  0  0

+   -5.2756   -1.8789    0.0000 H   0  0  0

+   -1.6838    4.4851    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

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+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

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+  9 14  1  0

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+ 14 18  1  0

+  5  7  1  0

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+  1 19  1  0

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+  6 22  1  0

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+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+842-19-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+   -3.1844    0.9175    0.2068 C   0  0  0

+   -4.0130   -0.1640    0.5980 C   0  0  0

+   -1.8948    0.6542   -0.2868 C   0  0  0

+   -3.6647    2.2321    0.3249 C   0  0  0

+   -3.5288   -1.4783    0.4846 C   0  0  0

+   -5.3029    0.0974    1.0923 C   0  0  0

+   -1.4599   -0.6317   -0.3824 C   0  0  0

+   -0.8471    1.9824   -0.7797 S   0  0  0

+   -4.9210    2.4505    0.8140 C   0  0  0

+   -2.2747   -1.6951    0.0023 C   0  0  0

+   -5.7405    1.3812    1.1896 C   0  0  0

+   -1.2326    2.3054   -2.1087 O   0  0  0

+   -0.8308    2.8881    0.3152 O   0  0  0

+    0.5681    1.4317   -0.8819 O   0  0  0

+   -5.3845    3.7227    0.9278 O   0  0  0

+   -1.6719   -3.3449   -0.1375 S   0  0  0

+   -2.0413   -3.7820   -1.4381 O   0  0  0

+   -0.3469   -3.3165    0.3753 O   0  0  0

+   -2.4715   -4.2050    0.8306 O   0  0  0

+   10.9288    0.2209   -0.1175 Na  0  3  0

+   19.5525    0.3780    0.6620 Na  0  3  0

+   -3.0184    3.0051    0.0000 H   0  0  0

+   -4.1737   -2.2525    0.0000 H   0  0  0

+   -5.9681   -0.6594    0.0000 H   0  0  0

+   -0.4658   -0.7960    0.0000 H   0  0  0

+   -6.7348    1.5444    0.0000 H   0  0  0

+   -5.7294    4.6694    0.0000 H   0  0  0

+    1.5071    1.0663    0.0000 H   0  0  0

+   -3.1575   -4.9429    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

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+  7 10  1  0

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+  4 22  1  0

+  5 23  1  0

+  6 24  1  0

+  7 25  1  0

+ 11 26  1  0

+ 15 27  1  0

+ 14 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+114656-95-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.6112   -0.3733   -0.0011 C   0  0  0

+   -0.7668   -0.1151   -0.0009 C   0  0  0

+    1.4858    0.7360   -0.0007 C   0  0  0

+    1.3616   -1.5186    0.0037 N   0  0  0

+   -1.2126    1.2154   -0.0002 C   0  0  0

+   -1.7476   -1.2147   -0.0008 C   0  0  0

+    2.8504    0.1847   -0.0011 C   0  0  0

+    0.9572    2.0216    0.0000 C   0  0  0

+    2.7124   -1.2125    0.0007 C   0  0  0

+   -0.3454    2.2191   -0.0002 N   0  0  0

+   -2.6717    1.4873    0.0001 C   0  0  0

+   -3.1980   -0.9045   -0.0001 C   0  0  0

+   -1.3703   -2.3693   -0.0018 O   0  0  0

+    4.1196    0.7604   -0.0011 C   0  0  0

+    1.8879    3.2069    0.0010 C   0  0  0

+    3.8528   -2.0086    0.0033 C   0  0  0

+   -3.6249    0.3755   -0.0004 C   0  0  0

+   -3.0760    2.6339    0.0011 O   0  0  0

+   -4.1001   -1.9129   -0.0001 O   0  0  0

+    5.2372   -0.0459   -0.0017 C   0  0  0

+    5.1024   -1.4259   -0.0009 C   0  0  0

+   -5.3951   -1.3086    0.0007 C   0  0  0

+    0.9709   -2.4857    0.0000 H   0  0  0

+    4.2233    1.7983    0.0000 H   0  0  0

+    2.7083    2.5627    0.0000 H   0  0  0

+    2.5321    4.0273    0.0000 H   0  0  0

+    1.0675    3.8511    0.0000 H   0  0  0

+    3.7626   -3.0478    0.0000 H   0  0  0

+   -4.6485    0.5760    0.0000 H   0  0  0

+    6.1878    0.3834    0.0000 H   0  0  0

+    5.9538   -2.0285    0.0000 H   0  0  0

+   -4.9540   -0.3634    0.0000 H   0  0  0

+   -6.3403   -0.8675    0.0000 H   0  0  0

+   -5.8362   -2.2538    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  7  9  2  0

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+ 17 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2835-98-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.6185   -1.6960    0.0010 O   0  0  0

+    0.6651   -0.7260    0.0020 C   0  0  0

+    1.0354    0.6171    0.0000 C   0  0  0

+   -0.6763   -1.0710   -0.0006 C   0  0  0

+    2.3893    0.9717   -0.0031 N   0  0  0

+    0.0585    1.6021    0.0006 C   0  0  0

+   -1.6446   -0.0837    0.0000 C   0  0  0

+   -1.2780    1.2494    0.0033 C   0  0  0

+   -3.1034   -0.4619   -0.0029 C   0  0  0

+    2.3467   -2.4368    0.0000 H   0  0  0

+   -0.9551   -2.0717    0.0000 H   0  0  0

+    3.1197    0.2330    0.0000 H   0  0  0

+    2.6638    1.9736    0.0000 H   0  0  0

+    0.3313    2.6044    0.0000 H   0  0  0

+   -2.0087    1.9877    0.0000 H   0  0  0

+   -3.3641    0.5436    0.0000 H   0  0  0

+   -4.1089   -0.7226    0.0000 H   0  0  0

+   -2.8427   -1.4674    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  2  0

+  8  6  2  0

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+  1 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42509-80-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 35                          1 V2000

+    1.8239   -0.0838   -0.3092 P   0  0  0

+    0.7453   -1.0373   -1.0300 O   0  0  0

+    1.6541   -0.1930    1.2881 O   0  0  0

+    3.3097   -0.5451   -0.7237 O   0  0  0

+    1.5492    1.6801   -0.8439 S   0  0  0

+   -0.4828   -0.6023   -0.6448 C   0  0  0

+    1.7079   -1.5831    1.6151 C   0  0  0

+    4.2078    0.4349   -0.1992 C   0  0  0

+   -1.6269   -1.1206   -1.0184 N   0  0  0

+   -0.7213    0.4200    0.1812 N   0  0  0

+    1.5517   -1.7577    3.1270 C   0  0  0

+    5.6452    0.0543   -0.5598 C   0  0  0

+   -2.6360   -0.3723   -0.3907 N   0  0  0

+   -2.0133    0.5688    0.3401 C   0  0  0

+   -4.0817   -0.5784   -0.5070 C   0  0  0

+   -2.7866    1.7697    1.3268 Cl  0  0  0

+   -4.5021   -0.4296   -1.9705 C   0  0  0

+   -4.4380   -1.9824   -0.0143 C   0  0  0

+    2.2435   -2.4122    0.0000 H   0  0  0

+    2.6491   -1.2856    0.0000 H   0  0  0

+    4.6101    1.3362    0.0000 H   0  0  0

+    3.3826    0.9765    0.0000 H   0  0  0

+    0.8161   -1.0996    0.0000 H   0  0  0

+    0.8936   -2.4933    0.0000 H   0  0  0

+    2.2873   -2.4158    0.0000 H   0  0  0

+    5.3926   -0.8999    0.0000 H   0  0  0

+    6.5994   -0.1983    0.0000 H   0  0  0

+    5.8978    1.0085    0.0000 H   0  0  0

+   -3.9839    0.4038    0.0000 H   0  0  0

+   -4.1728    0.5009    0.0000 H   0  0  0

+   -5.4326   -0.1003    0.0000 H   0  0  0

+   -4.8314   -1.3601    0.0000 H   0  0  0

+   -5.3947   -1.7396    0.0000 H   0  0  0

+   -4.6808   -2.9391    0.0000 H   0  0  0

+   -3.4813   -2.2252    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  2  0

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+ 17 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141511-28-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 46                          1 V2000

+    0.7666   -0.3557   -0.0299 C   0  0  0

+   -0.7033   -0.1723   -0.0231 C   0  0  0

+    1.5960    0.7498    0.0987 C   0  0  0

+    1.2950   -1.6333   -0.1815 C   0  0  0

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+    0.9967    2.1159    0.2920 C   0  0  0

+    2.6633   -1.7905   -0.1833 C   0  0  0

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+   -2.6045    1.2639   -0.1895 C   0  0  0

+   -0.3156    2.2611   -0.4708 C   0  0  0

+   -2.8956   -1.0962    0.1921 C   0  0  0

+   -0.9169   -2.6259    0.4339 C   0  0  0

+    3.5018   -0.6869   -0.0563 C   0  0  0

+    3.8311    1.8118    0.1894 C   0  0  0

+   -3.4275    0.1686    0.0071 C   0  0  0

+    4.9874   -0.9416   -0.0700 C   0  0  0

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+   -4.8963    0.3520    0.0203 N   0  3  0

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+   -5.6281   -0.6062    0.1926 O   0  0  0

+   -5.3730    1.4611   -0.1412 O   0  5  0

+    2.0038    2.3612    0.0000 H   0  0  0

+    0.9301    3.1503    0.0000 H   0  0  0

+    3.0701   -2.7439    0.0000 H   0  0  0

+    0.0503   -3.7916    0.0000 H   0  0  0

+    1.2855   -3.2949    0.0000 H   0  0  0

+   -3.0112    2.2173    0.0000 H   0  0  0

+   -0.0129    3.2525    0.0000 H   0  0  0

+   -1.2338    2.7420    0.0000 H   0  0  0

+   -3.5235   -1.9209    0.0000 H   0  0  0

+   -1.9247   -2.8684    0.0000 H   0  0  0

+   -0.8666   -3.6612    0.0000 H   0  0  0

+    4.2097    2.7767    0.0000 H   0  0  0

+    2.9172    2.3009    0.0000 H   0  0  0

+    4.6891   -1.9343    0.0000 H   0  0  0

+    5.9364   -1.3586    0.0000 H   0  0  0

+    6.2748    1.6408    0.0000 H   0  0  0

+    5.2890    2.4737    0.0000 H   0  0  0

+    6.5176   -0.3536    0.0000 H   0  0  0

+    6.5908    0.9538    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 35  1  0

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+ 18 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+ 21 41  1  0

+ 21 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105149-00-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 58                          1 V2000

+    3.2359    0.0619   -0.1624 C   0  0  1

+    1.8081   -0.4256   -0.3836 C   0  0  2

+    3.1938    1.5868   -0.4330 C   0  0  0

+    3.6492   -0.1952    1.2056 O   0  0  0

+    4.1743   -0.6143   -1.1284 C   0  0  0

+    0.9470    0.8122   -0.0110 C   0  0  1

+    1.3449   -1.5779    0.4847 C   0  0  0

+    1.6021   -0.7757   -1.8587 C   0  0  0

+    1.7080    1.9403   -0.7162 C   0  0  0

+    4.8756    0.1652    1.6152 C   0  0  0

+    4.8680   -1.8930   -0.7350 C   0  0  0

+    4.3703   -0.1315   -2.2178 O   0  0  0

+   -0.4528    0.5392   -0.5256 C   0  0  1

+   -0.1115   -1.8889    0.0977 C   0  0  0

+    5.3534   -0.2189    2.9919 C   0  0  0

+    5.5964    0.7977    0.8802 O   0  0  0

+   -0.9998   -0.6615    0.2635 C   0  0  2

+   -1.3424    1.7328   -0.3277 C   0  0  0

+   -2.4169   -0.9590   -0.2276 C   0  0  2

+   -2.6475    1.5989   -0.0888 C   0  0  0

+   -3.2590    0.2780    0.0007 C   0  0  0

+   -3.0337   -2.0965    0.5918 C   0  0  0

+   -2.3943   -1.3134   -1.7158 C   0  0  0

+   -3.6307    3.0146    0.1188 Cl  0  0  0

+   -4.5637    0.1150    0.3141 C   0  0  0

+   -4.3832   -2.2955    0.1749 O   0  0  0

+   -5.0972   -1.1909    0.4329 C   0  0  0

+   -6.2548   -1.3161    0.7851 O   0  0  0

+    4.2126    1.5262    0.0000 H   0  0  0

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+    1.3580   -2.5984    0.0000 H   0  0  0

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+    0.7225   -0.2581    0.0000 H   0  0  0

+    1.0845   -1.6553    0.0000 H   0  0  0

+    2.4817   -1.2933    0.0000 H   0  0  0

+    2.0613    2.8978    0.0000 H   0  0  0

+    0.7997    2.4057    0.0000 H   0  0  0

+    3.9709   -2.3797    0.0000 H   0  0  0

+    5.3547   -2.7901    0.0000 H   0  0  0

+    5.7651   -1.4063    0.0000 H   0  0  0

+    0.1793   -0.2620    0.0000 H   0  0  0

+   -1.0131   -2.3672    0.0000 H   0  0  0

+    0.2376   -2.8479    0.0000 H   0  0  0

+    4.7140   -1.0143    0.0000 H   0  0  0

+    6.1488   -0.8583    0.0000 H   0  0  0

+    5.9928    0.5765    0.0000 H   0  0  0

+   -1.6377    0.1352    0.0000 H   0  0  0

+   -0.9318    2.6672    0.0000 H   0  0  0

+   -3.1031   -3.1147    0.0000 H   0  0  0

+   -2.0536   -2.3809    0.0000 H   0  0  0

+   -3.4128   -1.3784    0.0000 H   0  0  0

+   -2.3293   -2.3319    0.0000 H   0  0  0

+   -1.3758   -1.2484    0.0000 H   0  0  0

+   -5.1843    0.9252    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

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+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  7 14  1  0

+ 10 15  1  0

+ 10 16  2  0

+ 13 17  1  0

+ 13 18  1  0

+ 17 19  1  0

+ 18 20  2  0

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+ 19 23  1  0

+ 20 24  1  0

+ 21 25  2  0

+ 22 26  1  0

+ 25 27  1  0

+ 27 28  2  0

+  6  9  1  0

+ 14 17  1  0

+ 20 21  1  0

+ 26 27  1  0

+  3 29  1  0

+  3 30  1  0

+  6 31  1  0

+  7 32  1  0

+  7 33  1  0

+  8 34  1  0

+  8 35  1  0

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+ 17 48  1  0

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+ 22 50  1  0

+ 22 51  1  0

+ 23 52  1  0

+ 23 53  1  0

+ 23 54  1  0

+ 25 55  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+52-24-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    0.0449    0.0574    0.0127 P   0  0  0

+    0.9059   -1.3437   -0.3454 N   0  0  0

+    1.0835    1.3809   -0.0319 N   0  0  0

+   -1.1809    0.2677   -1.1212 N   0  0  0

+   -0.7012   -0.0898    1.7140 S   0  0  0

+    0.0898   -2.4719    0.1227 C   0  0  0

+    0.1253   -2.0728   -1.3539 C   0  0  0

+    2.3067    0.9817    0.6768 C   0  0  0

+    2.2365    0.9853   -0.8516 C   0  0  0

+   -2.3926    0.6254   -0.3716 C   0  0  0

+   -1.5526    1.6884   -1.0825 C   0  0  0

+   -0.8269   -2.7116    0.0000 H   0  0  0

+    0.6249   -3.2539    0.0000 H   0  0  0

+   -0.3049   -1.2286    0.0000 H   0  0  0

+   -0.8050   -2.2530    0.0000 H   0  0  0

+    2.6619    0.1033    0.0000 H   0  0  0

+    2.9533    1.6744    0.0000 H   0  0  0

+    1.5830    0.2992    0.0000 H   0  0  0

+    2.5873    0.1051    0.0000 H   0  0  0

+   -3.2046    1.1138    0.0000 H   0  0  0

+   -2.7740   -0.2420    0.0000 H   0  0  0

+   -0.7083    2.1186    0.0000 H   0  0  0

+   -2.1533    2.4212    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6  7  1  0

+  8  9  1  0

+ 10 11  1  0

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+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+218-02-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.4527    0.5646    0.0022 C   0  0  0

+   -0.3714   -0.5777    0.0010 C   0  0  0

+    1.9047    0.3782    0.0015 C   0  0  0

+   -0.1171    1.8499   -0.0017 C   0  0  0

+   -1.8202   -0.3876    0.0011 C   0  0  0

+    0.2001   -1.8622   -0.0008 C   0  0  0

+    2.4232   -0.9375   -0.0001 C   0  0  0

+    2.7804    1.4678    0.0019 C   0  0  0

+   -1.4585    2.0305   -0.0071 C   0  0  0

+   -2.3395    0.9300    0.0027 C   0  0  0

+   -2.7180   -1.4607   -0.0007 C   0  0  0

+    1.5411   -2.0392   -0.0017 C   0  0  0

+    3.8142   -1.1242   -0.0010 C   0  0  0

+    4.1278    1.2517    0.0007 C   0  0  0

+   -3.7318    1.0979    0.0023 C   0  0  0

+   -4.0574   -1.1945   -0.0009 C   0  0  0

+    4.6417   -0.0410   -0.0001 C   0  0  0

+   -4.5195    0.0464    0.0006 N   0  0  0

+    0.5141    2.6912    0.0000 H   0  0  0

+   -0.4295   -2.7048    0.0000 H   0  0  0

+    2.4026    2.4494    0.0000 H   0  0  0

+   -1.8496    3.0069    0.0000 H   0  0  0

+   -2.3683   -2.4526    0.0000 H   0  0  0

+    1.9334   -3.0151    0.0000 H   0  0  0

+    4.2165   -2.0960    0.0000 H   0  0  0

+    4.7857    2.0724    0.0000 H   0  0  0

+   -4.1452    2.0650    0.0000 H   0  0  0

+   -4.7392   -1.9954    0.0000 H   0  0  0

+    5.6836   -0.1846    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112022-13-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+   -1.0873    0.6628    0.2234 C   0  0  0

+   -2.1215    1.5780    0.0516 C   0  0  0

+    0.2479    1.0606    0.1100 C   0  0  0

+   -1.4043   -0.6734    0.4861 N   0  0  0

+   -3.4216    1.2477    0.1810 O   0  0  0

+   -1.8002    2.8956   -0.2585 C   0  0  0

+    0.5460    2.3942   -0.1957 C   0  0  0

+    1.3336    0.0838    0.3103 C   0  0  0

+   -2.7216   -1.0540    0.1696 C   0  0  0

+   -3.6856   -0.0628    0.0151 C   0  0  0

+   -0.4802    3.2934   -0.3796 C   0  0  0

+    2.6116    0.4381    0.0701 N   0  0  0

+    1.0762   -1.0417    0.6922 O   0  0  0

+   -3.0423   -2.3902    0.0123 C   0  0  0

+   -4.9819   -0.4428   -0.3230 C   0  0  0

+    3.6906   -0.5327    0.2691 C   0  0  0

+   -4.3366   -2.7535   -0.3171 C   0  0  0

+   -5.2994   -1.7765   -0.4867 C   0  0  0

+    5.0323    0.1192   -0.0717 C   0  0  0

+    6.1142   -0.8542    0.1279 N   0  0  0

+    5.9227   -1.9099   -0.8756 C   0  0  0

+    7.3674   -0.1686   -0.2147 C   0  0  0

+   -0.6596   -1.3829    0.0000 H   0  0  0

+   -2.5467    3.6032    0.0000 H   0  0  0

+    1.5237    2.7135    0.0000 H   0  0  0

+   -0.2624    4.2986    0.0000 H   0  0  0

+    2.8472    1.4393    0.0000 H   0  0  0

+   -2.3013   -3.1035    0.0000 H   0  0  0

+   -5.7277    0.2656    0.0000 H   0  0  0

+    2.9102   -1.2028    0.0000 H   0  0  0

+    4.2551   -1.3926    0.0000 H   0  0  0

+   -4.6006   -3.7476    0.0000 H   0  0  0

+   -6.2901   -2.0530    0.0000 H   0  0  0

+    5.8127    0.7893    0.0000 H   0  0  0

+    4.4678    0.9791    0.0000 H   0  0  0

+    4.9106   -1.7263    0.0000 H   0  0  0

+    5.7391   -2.9220    0.0000 H   0  0  0

+    6.9348   -2.0935    0.0000 H   0  0  0

+    7.8611   -1.0710    0.0000 H   0  0  0

+    8.2698    0.3251    0.0000 H   0  0  0

+    6.8737    0.7338    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  7 11  1  0

+  9 10  2  0

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+  4 23  1  0

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+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111990-49-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.5220    0.1375    0.5526 C   0  0  0

+   -0.9095    0.2695    1.0047 C   0  0  0

+    1.2583    1.2675    0.2507 C   0  0  0

+    1.1005   -1.1136    0.4453 C   0  0  0

+   -1.8344    0.2348   -0.2137 C   0  0  0

+    2.5716    1.1464   -0.1641 C   0  0  0

+    2.4134   -1.2347    0.0307 C   0  0  0

+   -3.2877    0.3688    0.2453 C   0  0  0

+    3.1482   -0.1046   -0.2769 C   0  0  0

+   -4.2125    0.3340   -0.9731 C   0  0  0

+   -4.0155   -0.8025   -0.1295 O   0  0  0

+    4.5797   -0.2366   -0.7290 C   0  0  0

+   -0.3616    1.1198    0.0000 H   0  0  0

+   -1.4103    1.1484    0.0000 H   0  0  0

+    0.8177    2.1780    0.0000 H   0  0  0

+    0.5170   -1.9399    0.0000 H   0  0  0

+   -2.3823   -0.6155    0.0000 H   0  0  0

+   -1.3336   -0.6441    0.0000 H   0  0  0

+    3.1556    1.9723    0.0000 H   0  0  0

+    2.8544   -2.1450    0.0000 H   0  0  0

+   -3.2602    1.3800    0.0000 H   0  0  0

+   -4.2956    1.3421    0.0000 H   0  0  0

+   -5.2159    0.2059    0.0000 H   0  0  0

+    4.4868   -1.2439    0.0000 H   0  0  0

+    5.5870   -0.3295    0.0000 H   0  0  0

+    4.6726    0.7707    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

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+  7  9  1  0

+ 10 11  1  0

+  2 13  1  0

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+  4 16  1  0

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+  5 18  1  0

+  6 19  1  0

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+  8 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63019-39-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 34                          1 V2000

+    0.1113    0.4020    0.0020 C   0  0  0

+   -0.8255   -0.6485    0.0007 C   0  0  0

+    1.5370    0.0676    0.0012 C   0  0  0

+   -0.3233    1.7390   -0.0018 C   0  0  0

+   -2.2507   -0.3133    0.0009 C   0  0  0

+   -0.3895   -1.9850   -0.0004 C   0  0  0

+    1.9178   -1.2946   -0.0005 C   0  0  0

+    2.5179    1.0623    0.0018 C   0  0  0

+   -1.6388    2.0538   -0.0071 C   0  0  0

+   -2.6300    1.0492    0.0026 C   0  0  0

+   -3.2349   -1.3058   -0.0010 C   0  0  0

+    0.9264   -2.2990   -0.0004 C   0  0  0

+    3.2817   -1.6272   -0.0014 C   0  0  0

+    3.8501    0.7035    0.0005 C   0  0  0

+   -3.9941    1.3795    0.0027 C   0  0  0

+   -4.5526   -0.9508   -0.0013 C   0  0  0

+    4.2217   -0.6422   -0.0004 C   0  0  0

+    4.8078    1.6674    0.0006 O   0  0  0

+   -4.9296    0.3882    0.0012 C   0  0  0

+    0.3894    2.5107    0.0000 H   0  0  0

+   -1.1016   -2.7573    0.0000 H   0  0  0

+    2.2431    2.0762    0.0000 H   0  0  0

+   -1.9277    3.0638    0.0000 H   0  0  0

+   -2.9616   -2.3201    0.0000 H   0  0  0

+    1.2155   -3.3089    0.0000 H   0  0  0

+    3.5768   -2.6354    0.0000 H   0  0  0

+   -4.2929    2.3866    0.0000 H   0  0  0

+   -5.2912   -1.6978    0.0000 H   0  0  0

+    5.2405   -0.8983    0.0000 H   0  0  0

+    5.5482    2.4126    0.0000 H   0  0  0

+   -5.9497    0.6389    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 13 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4261-14-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    1.0198   -0.0965    0.5538 C   0  0  0

+    0.0314    0.8142    0.8297 N   0  0  0

+    2.0085    0.6075   -0.1538 C   0  0  0

+    1.1992   -1.3903    0.7999 N   0  0  0

+   -1.2133    0.5493    1.5553 C   0  0  0

+    0.4204    2.0108    0.3054 C   0  0  0

+    1.5806    1.8874   -0.2712 N   0  0  0

+    3.1540   -0.0937   -0.5682 C   0  0  0

+    2.2892   -2.0057    0.3931 C   0  0  0

+   -2.2837    0.1306    0.5806 C   0  0  0

+    3.2472   -1.3856   -0.2718 N   0  0  0

+    4.1611    0.5465   -1.2690 N   0  0  0

+   -2.4514   -1.2062    0.2701 C   0  0  0

+   -3.1014    1.0824    0.0013 C   0  0  0

+   -3.4330   -1.5902   -0.6239 C   0  0  0

+   -4.0834    0.6983   -0.8930 C   0  0  0

+   -4.2472   -0.6375   -1.2077 C   0  0  0

+   -0.9718    1.4589    0.0000 H   0  0  0

+   -1.9154    1.1760    0.0000 H   0  0  0

+   -0.0916    2.8004    0.0000 H   0  0  0

+    2.3177   -2.9464    0.0000 H   0  0  0

+    4.9954    0.1111    0.0000 H   0  0  0

+    4.1210    1.4868    0.0000 H   0  0  0

+   -1.7087   -1.7842    0.0000 H   0  0  0

+   -2.8740    1.9956    0.0000 H   0  0  0

+   -3.6616   -2.5031    0.0000 H   0  0  0

+   -4.8269    1.2753    0.0000 H   0  0  0

+   -5.1483   -0.9089    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+554-10-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+   -1.7680    0.0902   -0.1551 C   0  0  0

+   -3.1094    0.7303    0.2080 C   0  0  0

+   -0.6304    0.9023    0.4673 C   0  0  0

+   -1.7276   -1.2476    0.3457 O   0  0  0

+   -4.1719   -0.0282   -0.3732 O   0  0  0

+    1.2651   -0.0022   -0.0458 I   0  0  0

+   -0.8288   -0.3755    0.0000 H   0  0  0

+   -2.5056    1.5873    0.0000 H   0  0  0

+   -3.8530    1.4692    0.0000 H   0  0  0

+   -0.0266    1.7593    0.0000 H   0  0  0

+   -1.3740    1.6412    0.0000 H   0  0  0

+   -1.6960   -2.2954    0.0000 H   0  0  0

+   -5.0251   -0.6373    0.0000 H   0  0  0

+  1  2  1  0

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+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+193-40-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 41                          1 V2000

+    0.3874    0.0000   -0.0006 C   0  0  0

+   -0.9969   -0.0001   -0.0014 C   0  0  0

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+ 23 35  1  0

+ 24 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3198-41-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -1.0419    0.3534   -0.0065 C   0  0  0

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+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6756-41-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -0.1234    0.0897   -0.3512 N   0  0  0

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+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+114231-14-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 53 56                          1 V2000

+    0.6280   -0.9515    0.1567 N   0  0  0

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+ 31 52  1  0

+ 31 53  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115550-35-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 48                          1 V2000

+    0.8335   -0.4481   -0.0893 C   0  0  0

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+ 26 45  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4196-86-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 69 72                          1 V2000

+    1.5064   -0.2867    0.0000 C   0  0  0

+    0.8644   -0.9019   -0.8834 C   0  0  0

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+ 40 68  1  0

+ 41 69  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+553-30-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -5.1251    1.1841   -0.4883 C   0  0  0

+   -5.8929    0.2134    0.2985 C   0  0  0

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+   -1.9186   -4.2428    0.2687 N   0  0  0

+    9.8069    0.5773    0.0883 S   0  0  0

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+ 18 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25003-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -0.3638   -0.0741   -0.0022 C   0  0  0

+   -1.7994   -0.3907   -0.0015 C   0  0  0

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+   -4.5162   -0.9427   -0.0001 C   0  0  0

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+    4.6000   -0.0454   -0.0037 N   0  0  0

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+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+569-57-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 50                          1 V2000

+    0.7182    0.1534    0.1718 C   0  0  0

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+ 27 46  1  0

+ 27 47  1  0

+ 27 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+612-12-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.5558    0.4508    0.4078 C   0  0  0

+   -0.5579    0.4454   -0.4107 C   0  0  0

+    1.1065    1.6507    0.8180 C   0  0  0

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+    0.5433    2.8450    0.4096 C   0  0  0

+    2.4161   -1.3727   -0.3319 Cl  0  0  0

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+   -2.4038   -1.3910    0.3330 Cl  0  0  0

+    2.0970    1.6558    0.0000 H   0  0  0

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+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+522-40-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 51                          1 V2000

+    0.5318    0.3027   -0.5878 C   0  0  0

+   -0.4570   -0.5678   -0.3267 C   0  0  0

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+   -2.6790   -0.0515   -1.3207 C   0  0  0

+   -1.4532   -2.8288   -0.1157 C   0  0  0

+    3.7013   -0.5510    1.2279 C   0  0  0

+    4.1143   -0.6610   -1.1421 C   0  0  0

+   -3.6289    0.7785    1.1555 C   0  0  0

+   -3.9761    0.3963   -1.1967 C   0  0  0

+    4.5665   -0.7797    0.1660 C   0  0  0

+   -4.4554    0.8093    0.0399 C   0  0  0

+    5.8580   -1.1257    0.4072 O   0  0  0

+   -5.7354    1.2497    0.1574 O   0  0  0

+    6.7434    0.2016    0.1915 P   0  0  0

+   -6.6752   -0.0570    0.1976 P   0  0  0

+    6.6350    1.1372    1.4972 O   0  0  0

+    8.2811   -0.2119   -0.0463 O   0  0  0

+    6.2434    0.9417   -0.9886 O   0  0  0

+   -6.6432   -0.6957    1.6751 O   0  0  0

+   -8.1857    0.3567   -0.1756 O   0  0  0

+   -6.1799   -1.0512   -0.7805 O   0  0  0

+   -0.7035    2.0764    0.0000 H   0  0  0

+   -0.5649    1.0243    0.0000 H   0  0  0

+    0.2747   -2.9434    0.0000 H   0  0  0

+    0.8045   -1.7170    0.0000 H   0  0  0

+    2.1273   -1.1670    0.0000 H   0  0  0

+    2.5445   -1.2781    0.0000 H   0  0  0

+    1.1819    2.7205    0.0000 H   0  0  0

+    0.1504    3.6938    0.0000 H   0  0  0

+   -0.8229    2.6623    0.0000 H   0  0  0

+   -1.8287    1.2007    0.0000 H   0  0  0

+   -2.8676   -1.0364    0.0000 H   0  0  0

+   -1.9747   -1.9723    0.0000 H   0  0  0

+   -2.3097   -3.3503    0.0000 H   0  0  0

+   -0.9317   -3.6853    0.0000 H   0  0  0

+    3.4432   -1.5200    0.0000 H   0  0  0

+    3.8571   -1.6302    0.0000 H   0  0  0

+   -3.4453    1.7643    0.0000 H   0  0  0

+   -4.4760   -0.4730    0.0000 H   0  0  0

+    6.5196    2.1333    0.0000 H   0  0  0

+    9.2495   -0.4723    0.0000 H   0  0  0

+   -6.5930   -1.6972    0.0000 H   0  0  0

+   -9.1529    0.6216    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  1  0

+ 11 16  2  0

+ 13 17  2  0

+ 15 18  2  0

+ 17 19  1  0

+ 18 20  1  0

+ 19 21  1  0

+ 20 22  1  0

+ 21 23  1  0

+ 21 24  1  0

+ 21 25  2  0

+ 22 26  1  0

+ 22 27  1  0

+ 22 28  2  0

+ 14 17  1  0

+ 16 18  1  0

+  4 29  1  0

+  4 30  1  0

+  6 31  1  0

+  6 32  1  0

+  7 33  1  0

+  8 34  1  0

+  9 35  1  0

+  9 36  1  0

+  9 37  1  0

+ 10 38  1  0

+ 11 39  1  0

+ 12 40  1  0

+ 12 41  1  0

+ 12 42  1  0

+ 13 43  1  0

+ 14 44  1  0

+ 15 45  1  0

+ 16 46  1  0

+ 23 47  1  0

+ 24 48  1  0

+ 26 49  1  0

+ 27 50  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86831-65-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.7533   -0.0282   -0.3684 N   0  0  0

+   -0.6104    0.0432   -0.3362 N   0  0  0

+    1.2545    1.3065   -0.0146 C   0  0  0

+    1.1545   -0.9315    0.7183 C   0  0  0

+   -1.2135    0.3701    0.7562 N   0  0  0

+   -1.3620   -0.2415   -1.5020 O   0  0  0

+    2.7843    1.2979   -0.0315 C   0  0  0

+    1.1067   -2.3783    0.2228 C   0  0  0

+   -2.4295    0.4338    0.7849 O   0  0  0

+    1.3738    2.2678    0.0000 H   0  0  0

+    0.3139    1.5380    0.0000 H   0  0  0

+    2.0444   -1.3143    0.0000 H   0  0  0

+    1.8355   -0.2425    0.0000 H   0  0  0

+   -2.2679   -0.5846    0.0000 H   0  0  0

+    2.7789    0.3292    0.0000 H   0  0  0

+    3.7530    1.2925    0.0000 H   0  0  0

+    2.7897    2.2666    0.0000 H   0  0  0

+    0.1385   -2.3463    0.0000 H   0  0  0

+    1.0747   -3.3465    0.0000 H   0  0  0

+    2.0749   -2.4103    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  2  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83287-02-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+   -0.8320    0.9221   -0.0153 C   0  0  0

+   -0.8923   -0.4878   -0.0891 C   0  0  0

+    0.3995    1.6062    0.0373 C   0  0  0

+   -2.0336    1.6700    0.0006 C   0  0  0

+   -2.1361   -1.1189   -0.1391 C   0  0  0

+    0.3507   -1.2696   -0.1127 C   0  0  0

+    1.6647    0.8469    0.0149 C   0  0  0

+    0.4131    2.9295    0.1063 N   0  0  0

+   -3.2719    1.0048   -0.0578 C   0  0  0

+   -1.9412    3.0700    0.0747 C   0  0  0

+   -3.3161   -0.3576   -0.1163 C   0  0  0

+   -2.2055   -2.4695   -0.2104 O   0  0  0

+    1.6422   -0.5586   -0.0586 C   0  0  0

+    0.3159   -2.4851   -0.1755 O   0  0  0

+    2.8877    1.5154    0.0662 C   0  0  0

+   -0.6930    3.6501    0.1282 C   0  0  0

+   -4.5198   -0.9868   -0.1662 O   0  0  0

+   -2.4166   -2.9431    1.1212 C   0  0  0

+    2.8412   -1.2703   -0.0799 C   0  0  0

+    4.0650    0.7996    0.0448 C   0  0  0

+   -5.5206    0.0325   -0.1274 C   0  0  0

+    4.0455   -0.5895   -0.0290 C   0  0  0

+    5.2145   -1.2816   -0.0492 O   0  0  0

+    6.2668   -0.3169    0.0143 C   0  0  0

+   -4.1606    1.5560    0.0000 H   0  0  0

+   -2.8038    3.6612    0.0000 H   0  0  0

+    2.9118    2.5609    0.0000 H   0  0  0

+   -0.6186    4.6932    0.0000 H   0  0  0

+   -3.3717   -2.5174    0.0000 H   0  0  0

+   -2.8423   -3.8982    0.0000 H   0  0  0

+   -1.4615   -3.3688    0.0000 H   0  0  0

+    2.8301   -2.3160    0.0000 H   0  0  0

+    4.9801    1.3058    0.0000 H   0  0  0

+   -4.7744    0.7651    0.0000 H   0  0  0

+   -6.2532    0.7787    0.0000 H   0  0  0

+   -6.2668   -0.7001    0.0000 H   0  0  0

+    6.9735   -1.0877    0.0000 H   0  0  0

+    7.0376    0.3898    0.0000 H   0  0  0

+    5.5601    0.4539    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  1  0

+  8 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+ 15 20  2  0

+ 17 21  1  0

+ 19 22  2  0

+ 22 23  1  0

+ 23 24  1  0

+  7 13  2  0

+  9 11  2  0

+ 10 16  2  0

+ 20 22  1  0

+  9 25  1  0

+ 10 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+ 24 37  1  0

+ 24 38  1  0

+ 24 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.3875   -0.3668   -0.0013 C   0  0  0

+   -2.8632   -0.3668   -0.0011 C   0  0  0

+   -0.6886    0.8436   -0.0001 C   0  0  0

+   -0.6889   -1.5770    0.0032 C   0  0  0

+   -3.4696   -1.4171   -0.0021 O   0  0  0

+   -3.7312    1.1366    0.0005 Cl  0  0  0

+    0.6887    0.8436    0.0002 C   0  0  0

+    0.6889   -1.5770    0.0035 C   0  0  0

+    1.3875   -0.3668   -0.0006 C   0  0  0

+    2.8633   -0.3668   -0.0008 C   0  0  0

+    3.4696   -1.4171   -0.0015 O   0  0  0

+    3.7312    1.1366    0.0001 Cl  0  0  0

+   -1.2126    1.7513    0.0000 H   0  0  0

+   -1.2130   -2.4847    0.0000 H   0  0  0

+    1.2128    1.7513    0.0000 H   0  0  0

+    1.2130   -2.4847    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  7  9  1  0

+  9 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  8  9  2  0

+  3 13  1  0

+  4 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+153-78-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.3322   -0.4520   -0.0010 C   0  0  0

+   -1.1510   -0.4137   -0.0007 C   0  0  0

+    0.8294    0.8495    0.0000 C   0  0  0

+    1.2223   -1.5283    0.0030 C   0  0  0

+   -1.5811    0.9104    0.0006 C   0  0  0

+   -2.0966   -1.4413   -0.0014 C   0  0  0

+   -0.3530    1.7874    0.0011 C   0  0  0

+    2.1877    1.0753   -0.0001 C   0  0  0

+    2.5812   -1.3000    0.0016 C   0  0  0

+   -2.9285    1.2034    0.0008 C   0  0  0

+   -3.4421   -1.1387   -0.0008 C   0  0  0

+    3.0709    0.0009   -0.0013 C   0  0  0

+   -3.8599    0.1802   -0.0003 C   0  0  0

+    4.4479    0.2287   -0.0014 N   0  0  0

+    0.8579   -2.5062    0.0000 H   0  0  0

+   -1.7853   -2.4374    0.0000 H   0  0  0

+    0.3690    2.5410    0.0000 H   0  0  0

+   -1.0360    2.5765    0.0000 H   0  0  0

+    2.5544    2.0524    0.0000 H   0  0  0

+    3.2444   -2.1058    0.0000 H   0  0  0

+   -3.2460    2.1976    0.0000 H   0  0  0

+   -4.1478   -1.9075    0.0000 H   0  0  0

+   -4.8793    0.4037    0.0000 H   0  0  0

+    5.1102   -0.5778    0.0000 H   0  0  0

+    4.8152    1.2056    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+ 10 13  2  0

+ 12 14  1  0

+  5  7  1  0

+  9 12  2  0

+ 11 13  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5401-94-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -1.1815    0.6190   -0.0028 C   0  0  0

+   -1.6050   -0.7239   -0.0017 C   0  0  0

+    0.1866    0.9136   -0.0021 C   0  0  0

+   -2.3938    1.4313    0.0012 C   0  0  0

+   -0.6536   -1.7412    0.0001 C   0  0  0

+   -2.9753   -0.7055   -0.0022 N   0  0  0

+    1.0959   -0.1039   -0.0003 C   0  0  0

+   -3.4146    0.6224    0.0044 N   0  0  0

+    0.6760   -1.4286    0.0008 C   0  0  0

+    2.5432    0.2063    0.0004 N   0  3  0

+    3.3598   -0.6974    0.0020 O   0  0  0

+    2.9176    1.3654   -0.0006 O   0  5  0

+    0.5092    1.9047    0.0000 H   0  0  0

+   -2.4354    2.4727    0.0000 H   0  0  0

+   -0.9556   -2.7387    0.0000 H   0  0  0

+   -3.5913   -1.5462    0.0000 H   0  0  0

+    1.3844   -2.1931    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  8  1  0

+  7  9  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111955-14-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    1.4870   -0.3210    0.3005 C   0  0  2

+    0.4259   -0.7450   -0.6163 N   0  0  0

+    1.9951    0.9660   -0.1135 O   0  0  0

+    2.6912   -1.2802    0.1733 C   0  0  1

+   -0.9053   -0.4306   -0.3364 C   0  0  0

+    0.7215   -1.4088   -1.6821 N   0  0  0

+    3.3168    1.0562    0.4616 C   0  0  1

+    3.9226   -0.3534    0.2817 C   0  0  1

+    2.6874   -2.1974    1.2691 O   0  0  0

+   -1.6859   -1.3062    0.4083 C   0  0  0

+   -1.4512    0.7616   -0.7973 C   0  0  0

+   -0.1477   -1.6811   -2.4907 O   0  0  0

+    4.1470    2.0724   -0.3252 C   0  0  0

+    4.6781   -0.6991    1.4444 O   0  0  0

+   -3.0024   -0.9920    0.6832 C   0  0  0

+   -2.7680    1.0692   -0.5187 C   0  0  0

+    3.5360    3.3608   -0.2321 O   0  0  0

+   -3.5438    0.1924    0.2182 C   0  0  0

+   -4.9553    0.5255    0.5144 N   0  3  0

+   -5.4336    1.5683    0.1056 O   0  0  0

+   -5.6383   -0.2433    1.1670 O   0  5  0

+    0.7899    0.3732    0.0000 H   0  0  0

+    1.8041   -1.7055    0.0000 H   0  0  0

+    2.8652    1.9302    0.0000 H   0  0  0

+    4.6263    0.3341    0.0000 H   0  0  0

+    2.6833   -3.1812    0.0000 H   0  0  0

+   -1.3912   -2.2448    0.0000 H   0  0  0

+   -0.8284    1.5232    0.0000 H   0  0  0

+    4.8090    1.3447    0.0000 H   0  0  0

+    4.9642    2.6201    0.0000 H   0  0  0

+    5.5727   -1.1084    0.0000 H   0  0  0

+   -3.6272   -1.7519    0.0000 H   0  0  0

+   -3.0667    2.0066    0.0000 H   0  0  0

+    3.1145    4.2497    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  1  0

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+ 15 18  2  0

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+  7  8  1  0

+ 16 18  1  0

+  1 22  1  0

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+ 10 27  1  0

+ 11 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78865-83-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 48                          1 V2000

+   -4.1601    3.7544    0.4821 N   0  0  0

+   -5.0904    4.1639   -0.3761 C   0  0  0

+   -3.4135    4.8454    0.8586 C   0  0  0

+   -3.9684    2.3794    0.9499 C   0  0  0

+   -4.9572    5.4753   -0.5545 N   0  3  0

+   -3.9061    5.9090    0.2180 C   0  0  0

+   -2.8184    1.5185   -0.1578 S   0  0  0

+   -5.7875    6.3127   -1.4237 C   0  0  0

+   -2.7712   -0.1096    0.6406 C   0  0  0

+   -1.8360   -1.0342   -0.1414 C   0  0  0

+   -1.7962   -2.4074    0.5320 C   0  0  0

+   -0.8610   -3.3319   -0.2500 C   0  0  0

+   -0.8212   -4.7052    0.4234 C   0  0  0

+    0.1141   -5.6297   -0.3585 C   0  0  0

+    0.1539   -7.0030    0.3149 C   0  0  0

+    1.0891   -7.9275   -0.4671 C   0  0  0

+    1.1289   -9.3008    0.2063 C   0  0  0

+    2.0641  -10.2253   -0.5757 C   0  0  0

+   14.8594    4.4869   -0.0154 Cl  0  0  0

+   -5.9437    3.6669    0.0000 H   0  0  0

+   -2.4294    4.7633    0.0000 H   0  0  0

+   -4.9485    2.4994    0.0000 H   0  0  0

+   -4.3367    1.4632    0.0000 H   0  0  0

+   -3.5464    6.8286    0.0000 H   0  0  0

+   -5.0863    7.0080    0.0000 H   0  0  0

+   -6.4828    7.0139    0.0000 H   0  0  0

+   -6.4887    5.6174    0.0000 H   0  0  0

+   -3.7302    0.1257    0.0000 H   0  0  0

+   -3.2534   -0.9713    0.0000 H   0  0  0

+   -0.8770   -1.2695    0.0000 H   0  0  0

+   -1.3538   -0.1725    0.0000 H   0  0  0

+   -2.7552   -2.1721    0.0000 H   0  0  0

+   -2.2783   -3.2692    0.0000 H   0  0  0

+    0.0980   -3.5672    0.0000 H   0  0  0

+   -0.3789   -2.4701    0.0000 H   0  0  0

+   -1.7802   -4.4700    0.0000 H   0  0  0

+   -1.3033   -5.5670    0.0000 H   0  0  0

+    1.0731   -5.8649    0.0000 H   0  0  0

+    0.5962   -4.7679    0.0000 H   0  0  0

+   -0.8051   -6.7677    0.0000 H   0  0  0

+   -0.3282   -7.8648    0.0000 H   0  0  0

+    2.0481   -8.1628    0.0000 H   0  0  0

+    1.5712   -7.0657    0.0000 H   0  0  0

+    0.1699   -9.0655    0.0000 H   0  0  0

+    0.6468  -10.1626    0.0000 H   0  0  0

+    1.3699  -10.9276    0.0000 H   0  0  0

+    2.7664  -10.9195    0.0000 H   0  0  0

+    2.7583   -9.5230    0.0000 H   0  0  0

+   15.8469    4.4869    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+  5  6  1  0

+  2 20  1  0

+  3 21  1  0

+  4 22  1  0

+  4 23  1  0

+  6 24  1  0

+  8 25  1  0

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+ 17 44  1  0

+ 17 45  1  0

+ 18 46  1  0

+ 18 47  1  0

+ 18 48  1  0

+ 19 49  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64920-32-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    1.3842   -0.0519   -0.1890 C   0  0  0

+    0.0208   -0.3500   -0.1082 C   0  0  0

+    1.7973    1.2733   -0.2243 C   0  0  0

+    2.4107   -1.1517   -0.2444 C   0  0  2

+   -0.9155    0.7095   -0.0646 C   0  0  0

+   -0.4303   -1.6909   -0.0704 C   0  0  0

+    0.8576    2.3116   -0.1792 C   0  0  0

+    3.2432    1.5710   -0.3095 C   0  0  0

+    3.6749   -0.7187    0.4958 C   0  0  1

+    2.7309   -1.4360   -1.6078 O   0  0  0

+   -2.3419    0.3829    0.0180 C   0  0  0

+   -0.4748    2.0354   -0.1006 C   0  0  0

+   -1.7425   -1.9898    0.0055 C   0  0  0

+    4.1236    0.6389    0.0260 C   0  0  0

+    3.4129   -0.6740    1.8999 O   0  0  0

+   -2.7279   -0.9761    0.0514 C   0  0  0

+   -3.3176    1.3811    0.0634 C   0  0  0

+   -4.0903   -1.2978    0.1294 C   0  0  0

+   -4.6365    1.0350    0.1392 C   0  0  0

+   -5.0201   -0.3006    0.1723 C   0  0  0

+    1.6797   -1.9011    0.0000 H   0  0  0

+    0.2718   -2.4674    0.0000 H   0  0  0

+    1.1823    3.3068    0.0000 H   0  0  0

+    3.5580    2.5694    0.0000 H   0  0  0

+    4.4191   -1.4550    0.0000 H   0  0  0

+    3.5137   -2.1311    0.0000 H   0  0  0

+   -1.1707    2.8175    0.0000 H   0  0  0

+   -2.0396   -2.9936    0.0000 H   0  0  0

+    5.1455    0.8662    0.0000 H   0  0  0

+    2.3809   -0.4979    0.0000 H   0  0  0

+   -3.0383    2.3900    0.0000 H   0  0  0

+   -4.3939   -2.2997    0.0000 H   0  0  0

+   -5.3682    1.7837    0.0000 H   0  0  0

+   -6.0381   -0.5447    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  7 12  2  0

+  9 14  1  0

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+  6 22  1  0

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+ 12 27  1  0

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+ 14 29  1  0

+ 15 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+611-32-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.3393    0.9393   -0.0026 C   0  0  0

+   -0.0066   -0.4383   -0.0015 C   0  0  0

+    0.6846    1.9005   -0.0015 C   0  0  0

+   -1.6958    1.3136    0.0009 C   0  0  0

+    1.3483   -0.8141    0.0004 C   0  0  0

+   -0.9773   -1.3569   -0.0017 N   0  0  0

+    1.9851    1.4980    0.0007 C   0  0  0

+   -2.6375    0.3239    0.0054 C   0  0  0

+    2.3147    0.1439    0.0010 C   0  0  0

+    1.7288   -2.2722    0.0021 C   0  0  0

+   -2.2422   -1.0117   -0.0029 C   0  0  0

+    0.4496    2.9187    0.0000 H   0  0  0

+   -1.9750    2.3205    0.0000 H   0  0  0

+    2.7463    2.2139    0.0000 H   0  0  0

+   -3.6534    0.5686    0.0000 H   0  0  0

+    3.3202   -0.1404    0.0000 H   0  0  0

+    0.7177   -2.5360    0.0000 H   0  0  0

+    1.9926   -3.2833    0.0000 H   0  0  0

+    2.7399   -2.0084    0.0000 H   0  0  0

+   -2.9732   -1.7584    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

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+  3 12  1  0

+  4 13  1  0

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+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+81-54-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.7010    0.5453    0.0883 C   0  0  0

+   -0.5453   -0.8591    0.0748 C   0  0  0

+    0.4862    1.4102    0.2181 C   0  0  0

+   -1.9731    1.1004   -0.0269 C   0  0  0

+    0.7999   -1.4441    0.1903 C   0  0  0

+   -1.6691   -1.6803   -0.0490 C   0  0  0

+    1.8303    0.8233    0.0252 C   0  0  0

+    0.3619    2.5909    0.4800 O   0  0  0

+   -3.0895    0.2611   -0.1554 C   0  0  0

+   -2.1318    2.4474   -0.0143 O   0  0  0

+    1.9839   -0.5751    0.0116 C   0  0  0

+    0.9369   -2.6286    0.4303 O   0  0  0

+   -2.9352   -1.1117   -0.1588 C   0  0  0

+   -1.5268   -3.0287   -0.0625 O   0  0  0

+    2.9428    1.6415   -0.1432 C   0  0  0

+   -4.3300    0.8008   -0.2677 O   0  0  0

+    3.2471   -1.1282   -0.1700 C   0  0  0

+    4.1922    1.0748   -0.3226 C   0  0  0

+    4.3432   -0.3002   -0.3362 C   0  0  0

+   -2.2532    3.4777    0.0000 H   0  0  0

+   -3.7733   -1.7232    0.0000 H   0  0  0

+   -1.4179   -4.0604    0.0000 H   0  0  0

+    2.8349    2.6733    0.0000 H   0  0  0

+   -5.2813    1.2147    0.0000 H   0  0  0

+    3.3683   -2.1585    0.0000 H   0  0  0

+    5.0322    1.6836    0.0000 H   0  0  0

+    5.2958   -0.7111    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  3  7  1  0

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+  4  9  1  0

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+  5 12  2  0

+  6 13  1  0

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+ 11 17  1  0

+ 15 18  2  0

+ 17 19  2  0

+  7 11  2  0

+  9 13  2  0

+ 18 19  1  0

+ 10 20  1  0

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+ 14 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 19 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+127-69-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -1.4900   -0.4848    0.0533 C   0  0  0

+   -0.3301   -1.7955    0.2562 S   0  0  0

+   -2.3461   -0.4832   -1.0324 C   0  0  0

+   -1.5460    0.5372    0.9836 C   0  0  0

+    1.0607   -1.3511   -0.5252 N   0  0  0

+   -0.0065   -1.8140    1.6397 O   0  0  0

+   -0.8536   -2.8918   -0.4808 O   0  0  0

+   -3.2566    0.5428   -1.1944 C   0  0  0

+   -2.4538    1.5659    0.8277 C   0  0  0

+    1.7336   -0.2061   -0.1414 C   0  0  0

+   -3.3116    1.5736   -0.2652 C   0  0  0

+    2.8859    0.2894   -0.6845 C   0  0  0

+    1.3832    0.6453    0.8357 O   0  0  0

+   -4.2308    2.6128   -0.4263 N   0  0  0

+    3.1384    1.4560    0.0633 C   0  0  0

+    3.6977   -0.2803   -1.8191 C   0  0  0

+    2.1729    1.5556    0.9337 N   0  0  0

+    4.2957    2.4054   -0.1113 C   0  0  0

+   -2.7175   -1.3072    0.0000 H   0  0  0

+   -0.7097    0.8799    0.0000 H   0  0  0

+    1.6251   -2.0571    0.0000 H   0  0  0

+   -4.0927    0.1995    0.0000 H   0  0  0

+   -2.0784    2.3881    0.0000 H   0  0  0

+   -3.9439    3.4699    0.0000 H   0  0  0

+   -5.1165    2.4327    0.0000 H   0  0  0

+    3.1785   -1.0201    0.0000 H   0  0  0

+    4.4375   -0.7995    0.0000 H   0  0  0

+    4.2169    0.4595    0.0000 H   0  0  0

+    4.8689    1.7066    0.0000 H   0  0  0

+    4.9945    2.9786    0.0000 H   0  0  0

+    3.7225    3.1042    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

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+ 13 17  1  0

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+ 14 24  1  0

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+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+134-50-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -1.1646    0.8922    0.0028 C   0  0  0

+   -1.2063   -0.5271    0.0016 C   0  0  0

+    0.0000    1.5390    0.0023 N   0  0  0

+   -2.3787    1.6083   -0.0013 C   0  0  0

+    0.0001   -1.2553    0.0003 C   0  0  0

+   -2.4472   -1.1860    0.0012 C   0  0  0

+    1.1642    0.8922    0.0011 C   0  0  0

+   -3.5604    0.9362   -0.0064 C   0  0  0

+    1.2061   -0.5271    0.0003 C   0  0  0

+    0.0003   -2.6335   -0.0005 N   0  0  0

+   -3.5970   -0.4577    0.0020 C   0  0  0

+    2.3788    1.6085    0.0007 C   0  0  0

+    2.4475   -1.1860   -0.0015 C   0  0  0

+    3.5602    0.9366   -0.0010 C   0  0  0

+    3.5968   -0.4578   -0.0020 C   0  0  0

+   -2.3705    2.6544    0.0000 H   0  0  0

+   -2.4872   -2.2314    0.0000 H   0  0  0

+   -4.4577    1.4740    0.0000 H   0  0  0

+   -0.9056   -3.1567    0.0000 H   0  0  0

+    0.9064   -3.1564    0.0000 H   0  0  0

+   -4.5201   -0.9500    0.0000 H   0  0  0

+    2.3706    2.6546    0.0000 H   0  0  0

+    2.4877   -2.2314    0.0000 H   0  0  0

+    4.4575    1.4744    0.0000 H   0  0  0

+    4.5199   -0.9501    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  1  0

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+  4  8  1  0

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+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42397-65-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.6524   -0.8637   -0.0212 C   0  0  0

+   -0.6524   -0.8637   -0.0211 C   0  0  0

+    1.3952    0.4104    0.0077 C   0  0  0

+    1.4023   -2.1325   -0.0440 C   0  0  0

+   -1.3952    0.4104    0.0080 C   0  0  0

+   -1.4023   -2.1323   -0.0494 C   0  0  0

+    2.8671    0.3429    0.0067 C   0  0  0

+    0.7392    1.5460    0.0327 C   0  0  0

+    2.7142   -2.0975   -0.0429 C   0  0  0

+    0.6598   -3.4039   -0.0669 C   0  0  0

+   -2.8671    0.3429    0.0072 C   0  0  0

+   -0.7392    1.5460    0.0328 C   0  0  0

+   -2.7143   -2.0974   -0.0480 C   0  0  0

+   -0.6598   -3.4037   -0.0781 C   0  0  0

+    3.4589   -0.8321   -0.0196 C   0  0  0

+    3.6040    1.4797    0.0322 N   0  3  0

+   -3.4589   -0.8321   -0.0190 C   0  0  0

+   -3.6040    1.4797    0.0337 N   0  3  0

+    3.3614    2.3804   -0.7510 O   0  0  0

+    4.5090    1.6009    0.8383 O   0  5  0

+   -4.5084    1.6005    0.8405 O   0  0  0

+   -3.3620    2.3808   -0.7493 O   0  5  0

+    1.2471    2.4260    0.0000 H   0  0  0

+    3.2303   -2.9727    0.0000 H   0  0  0

+    1.1656   -4.2851    0.0000 H   0  0  0

+   -1.2471    2.4260    0.0000 H   0  0  0

+   -3.2304   -2.9727    0.0000 H   0  0  0

+   -1.1657   -4.2849    0.0000 H   0  0  0

+    4.4744   -0.8653    0.0000 H   0  0  0

+   -4.4744   -0.8653    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  8 23  1  0

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+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-39-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.8800    0.0024   -0.5886 C   0  0  0

+    1.5088   -1.1958   -0.3069 C   0  0  0

+    1.5115    1.1985   -0.3020 C   0  0  0

+   -0.4911    0.0050   -1.2138 C   0  0  0

+    2.7692   -1.1982    0.2614 C   0  0  0

+    2.7714    1.1961    0.2661 C   0  0  0

+   -1.8564   -0.0008    0.2008 Br  0  0  0

+    3.4004   -0.0025    0.5478 C   0  0  0

+    0.9830   -2.0636    0.0000 H   0  0  0

+    0.9885    2.0680    0.0000 H   0  0  0

+    0.0161    0.8838    0.0000 H   0  0  0

+   -1.0004    0.8826    0.0000 H   0  0  0

+    3.2923   -2.0676    0.0000 H   0  0  0

+    3.2972    2.0639    0.0000 H   0  0  0

+    4.4151   -0.0037    0.0000 H   0  0  0

+  1  2  2  0

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+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17564-64-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.5342   -2.2518   -0.4329 O   0  0  0

+   -0.1313   -1.1093   -0.3477 C   0  0  0

+    1.2607   -0.7047   -0.0583 C   0  0  0

+   -0.8758   -0.0002   -0.5067 N   0  0  0

+    1.2602    0.7048   -0.0565 C   0  0  0

+    2.4380   -1.3937    0.1847 C   0  0  0

+   -2.3086   -0.0003   -0.8121 C   0  0  0

+   -0.1312    1.1091   -0.3488 C   0  0  0

+    2.4372    1.3939    0.1881 C   0  0  0

+    3.6078   -0.6910    0.4280 C   0  0  0

+   -3.2507    0.0001    0.7252 Cl  0  0  0

+   -0.5342    2.2515   -0.4351 O   0  0  0

+    3.6074    0.6913    0.4293 C   0  0  0

+    2.4439   -2.4170    0.0000 H   0  0  0

+   -2.8205   -0.8863    0.0000 H   0  0  0

+   -1.7970   -0.8865    0.0000 H   0  0  0

+    2.4429    2.4172    0.0000 H   0  0  0

+    4.4985   -1.1948    0.0000 H   0  0  0

+    4.4979    1.1955    0.0000 H   0  0  0

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+ 10 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6358-85-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 73                          1 V2000

+    2.3704    3.7547   -1.2993 Cl  0  0  0

+    2.1199    2.1308   -0.7391 C   0  0  0

+    0.8525    1.5905   -0.7357 C   0  0  0

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+   -0.7119   -0.2950   -0.2819 C   0  0  0

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+   -1.8027    0.4894    0.0975 C   0  0  0

+    6.7770    1.7943    0.0806 C   0  0  0

+   -2.1714   -2.1667   -0.6496 C   0  0  0

+   -3.0696   -0.0475    0.1013 C   0  0  0

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+    7.1520    2.1770   -1.3279 C   0  0  0

+   -2.4106   -3.8233   -1.1101 Cl  0  0  0

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+ 43 69  1  0

+ 44 70  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7390-81-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 55                          1 V2000

+   -8.6673    0.4148   -0.2926 C   0  0  0

+   -9.9189   -0.4583   -0.1829 C   0  0  0

+   -9.4480    0.3435    0.9021 O   0  0  0

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+ 19 55  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21829-25-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+    0.0319   -0.3349   -0.3279 C   0  0  0

+   -0.0524    0.7474    0.7174 C   0  0  0

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+ 25 42  1  0

+ 25 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+838-95-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    0.6828    0.3814   -0.0013 C   0  0  0

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+ 13 26  1  0

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+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+215-62-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.2452    0.7529   -0.0039 C   0  0  0

+   -0.2922   -0.6620   -0.0031 C   0  0  0

+    1.0530    1.4504   -0.0020 C   0  0  0

+   -1.4282    1.4797   -0.0005 C   0  0  0

+    0.9672   -1.4314   -0.0010 C   0  0  0

+   -1.4503   -1.3013   -0.0034 N   0  0  0

+    2.2482    0.7104    0.0005 C   0  0  0

+    1.1055    2.8451   -0.0033 C   0  0  0

+   -2.6393    0.7705    0.0036 C   0  0  0

+    2.2032   -0.7627    0.0004 C   0  0  0

+    0.9367   -2.8272    0.0002 C   0  0  0

+   -2.6125   -0.6491   -0.0052 C   0  0  0

+    3.4734    1.3791    0.0017 C   0  0  0

+    2.3247    3.4864   -0.0020 C   0  0  0

+   -3.8750    1.4417    0.0077 C   0  0  0

+    3.3869   -1.5029    0.0029 C   0  0  0

+    2.1159   -3.5391    0.0027 C   0  0  0

+   -3.8320   -1.3537   -0.0050 C   0  0  0

+    3.5040    2.7563    0.0005 C   0  0  0

+   -5.0309    0.7240    0.0121 C   0  0  0

+    3.3360   -2.8794    0.0040 C   0  0  0

+   -5.0076   -0.6704   -0.0064 C   0  0  0

+   -1.4171    2.5265    0.0000 H   0  0  0

+    0.2198    3.4030    0.0000 H   0  0  0

+    0.0195   -3.3317    0.0000 H   0  0  0

+    4.3676    0.8349    0.0000 H   0  0  0

+    2.3614    4.5326    0.0000 H   0  0  0

+   -3.9054    2.4881    0.0000 H   0  0  0

+    4.3118   -1.0126    0.0000 H   0  0  0

+    2.0911   -4.5856    0.0000 H   0  0  0

+   -3.8334   -2.4005    0.0000 H   0  0  0

+    4.4241    3.2555    0.0000 H   0  0  0

+   -5.9500    1.2252    0.0000 H   0  0  0

+    4.2251   -3.4319    0.0000 H   0  0  0

+   -5.9105   -1.2000    0.0000 H   0  0  0

+  2  1  2  0

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+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+957-52-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.1642    0.2016    0.2251 C   0  0  0

+    0.7271   -0.9625    0.2094 C   0  0  0

+    1.1482    1.2655    0.0309 C   0  0  0

+   -1.2581    0.4682    0.4032 C   0  0  0

+    2.1682   -0.7543   -0.0023 C   0  0  0

+   -0.1663   -2.1216    0.3961 C   0  0  0

+    2.4229    0.5448   -0.1074 C   0  0  0

+    0.7033    2.4973    0.0258 C   0  0  0

+   -2.0538   -0.5616    0.5641 C   0  0  0

+   -1.6614    1.8846    0.3834 C   0  0  0

+    3.2810   -1.7167   -0.1059 C   0  0  0

+   -1.4605   -1.9171    0.5653 C   0  0  0

+    3.8019    1.0095   -0.3234 C   0  0  0

+   -0.7255    2.8002    0.2079 C   0  0  0

+   -3.5362   -0.3685    0.7548 C   0  0  0

+    4.5109   -1.2971   -0.2995 C   0  0  0

+    4.7888    0.1449   -0.4139 C   0  0  0

+   -4.3550   -0.3786   -0.8516 Cl  0  0  0

+    0.2355   -3.1315    0.0000 H   0  0  0

+    1.4172    3.3169    0.0000 H   0  0  0

+   -2.7119    2.1635    0.0000 H   0  0  0

+    3.0735   -2.7836    0.0000 H   0  0  0

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+   -1.0288    3.8439    0.0000 H   0  0  0

+   -2.9173    0.5249    0.0000 H   0  0  0

+   -4.0464    0.5912    0.0000 H   0  0  0

+    5.3307   -2.0107    0.0000 H   0  0  0

+    5.8169    0.4976    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+501-92-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -2.0948   -0.3934   -0.7444 C   0  0  0

+   -2.8942   -0.2538    0.5255 C   0  0  0

+   -0.6296   -0.2206   -0.4372 C   0  0  0

+   -3.8012    0.6858    0.6285 C   0  0  0

+    0.1400   -1.3199   -0.1048 C   0  0  0

+   -0.0560    1.0364   -0.4938 C   0  0  0

+    1.4837   -1.1642    0.1768 C   0  0  0

+    1.2868    1.1973   -0.2131 C   0  0  0

+    2.0603    0.0964    0.1259 C   0  0  0

+    3.3816    0.2521    0.4029 O   0  0  0

+   -2.6658   -1.2286    0.0000 H   0  0  0

+   -1.5710   -1.2589    0.0000 H   0  0  0

+   -3.3685   -1.1474    0.0000 H   0  0  0

+   -3.5221    1.6583    0.0000 H   0  0  0

+   -4.7829    0.4412    0.0000 H   0  0  0

+   -0.2747   -2.2427    0.0000 H   0  0  0

+   -0.6528    1.8533    0.0000 H   0  0  0

+    2.0786   -1.9825    0.0000 H   0  0  0

+    1.6989    2.1213    0.0000 H   0  0  0

+    4.3864    0.3705    0.0000 H   0  0  0

+  2  1  1  0

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+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+541-73-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.0002   -0.6103    0.0004 C   0  0  0

+   -1.1978    0.0815    0.0003 C   0  0  0

+    1.1979    0.0817    0.0002 C   0  0  0

+   -1.1971    1.4654    0.0000 C   0  0  0

+   -2.7015   -0.7859   -0.0001 Cl  0  0  0

+    1.1973    1.4650   -0.0001 C   0  0  0

+    2.7015   -0.7859   -0.0002 Cl  0  0  0

+   -0.0001    2.1560   -0.0002 C   0  0  0

+   -0.0002   -1.6479    0.0000 H   0  0  0

+   -2.0955    1.9846    0.0000 H   0  0  0

+    2.0957    1.9841    0.0000 H   0  0  0

+    0.0000    3.1936    0.0000 H   0  0  0

+  1  2  2  0

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+  6  8  1  0

+  1  9  1  0

+  4 10  1  0

+  6 11  1  0

+  8 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95860-07-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    1.3722   -0.1573   -0.0031 C   0  0  0

+    0.0699   -0.6413   -0.0027 C   0  0  0

+    1.6005    1.2127   -0.0008 C   0  0  0

+    2.4494   -1.0464    0.0001 N   0  0  0

+   -0.9927    0.2404   -0.0001 C   0  0  0

+    0.5330    2.0892    0.0018 C   0  0  0

+    3.0114    1.7424   -0.0017 C   0  0  0

+    2.2148   -2.4428    0.0037 O   0  0  0

+   -0.7618    1.6041    0.0022 C   0  0  0

+   -2.3803   -0.2743   -0.0002 N   0  3  0

+   -3.3182    0.5029    0.0021 O   0  0  0

+   -2.5845   -1.4751   -0.0026 O   0  5  0

+   -0.1043   -1.6661    0.0000 H   0  0  0

+    3.4233   -0.6830    0.0000 H   0  0  0

+    0.7032    3.1147    0.0000 H   0  0  0

+    3.3768    0.7692    0.0000 H   0  0  0

+    3.9846    2.1078    0.0000 H   0  0  0

+    2.6460    2.7156    0.0000 H   0  0  0

+    2.0426   -3.4679    0.0000 H   0  0  0

+   -1.5635    2.2658    0.0000 H   0  0  0

+  1  2  1  0

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+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92072-09-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.8184    0.1121   -0.0044 C   0  0  0

+   -0.2831   -0.7718   -0.0001 C   0  0  0

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+    3.0155    1.8490   -0.0120 C   0  0  0

+    4.6074   -0.0577    0.0176 N   0  3  0

+   -3.1117    1.6692   -0.0240 C   0  0  0

+   -3.9946   -0.5873   -0.0083 C   0  0  0

+   -2.5274   -2.5770    0.0089 N   0  3  0

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+   -3.3033    3.0619   -0.0355 C   0  0  0

+   -2.4687   -3.1915   -1.0411 O   0  0  0

+   -2.4093   -3.2664    1.2401 O   0  5  0

+   -0.8701   -2.8338    0.0000 H   0  0  0

+    1.6033    3.4160    0.0000 H   0  0  0

+    3.3031   -2.1962    0.0000 H   0  0  0

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+   -0.1073    4.0936    0.0000 H   0  0  0

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+   -4.8233   -1.2396    0.0000 H   0  0  0

+   -2.3661    4.9611    0.0000 H   0  0  0

+   -5.1890    1.1663    0.0000 H   0  0  0

+   -4.2807    3.4580    0.0000 H   0  0  0

+  1  2  2  0

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+ 15 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 23 35  1  0

+ 24 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+70403-81-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+   -0.5485    0.2441   -0.0088 C   0  0  0

+   -1.2284   -0.9897   -0.0254 C   0  0  0

+    0.9241    0.2782    0.0203 C   0  0  0

+   -1.2850    1.4274   -0.0261 C   0  0  0

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+    1.6035    1.4962    0.0364 C   0  0  0

+   -2.6869    1.3907   -0.0591 C   0  0  0

+   -0.6422    2.6214   -0.0104 O   0  0  0

+    0.9431   -2.2147    0.0147 C   0  0  0

+   -1.2058   -3.3579   -0.0319 N   0  0  0

+   -3.3599    0.2027   -0.0643 C   0  0  0

+   -3.2915   -2.2546   -0.0702 C   0  0  0

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+   -3.3863    2.5559   -0.0751 O   0  0  0

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+   -2.5231   -3.4019   -0.0589 C   0  0  0

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+   -3.4991    2.9886    1.2822 C   0  0  0

+    5.0637    0.3650    0.1006 O   0  0  0

+    5.4391    1.7438    0.1112 C   0  0  0

+    1.0677    2.3938    0.0000 H   0  0  0

+   -4.4052    0.1939    0.0000 H   0  0  0

+   -4.3352   -2.3135    0.0000 H   0  0  0

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+   -1.7777    2.9591    0.0000 H   0  0  0

+   -2.9999   -4.3322    0.0000 H   0  0  0

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+ 22 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+ 24 37  1  0

+ 24 38  1  0

+ 24 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88-05-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -1.0671   -0.0001    0.0014 C   0  0  0

+   -0.3711   -1.2020    0.0007 C   0  0  0

+   -0.3708    1.2022    0.0010 C   0  0  0

+   -2.4638    0.0000   -0.0035 N   0  0  0

+    1.0101   -1.1985   -0.0002 C   0  0  0

+   -1.1221   -2.5086    0.0015 C   0  0  0

+    1.0100    1.1985    0.0001 C   0  0  0

+   -1.1217    2.5088    0.0012 C   0  0  0

+    1.6999   -0.0002   -0.0005 C   0  0  0

+    3.2069   -0.0003   -0.0011 C   0  0  0

+   -2.9847    0.9023    0.0000 H   0  0  0

+   -2.9848   -0.9022    0.0000 H   0  0  0

+    1.5327   -2.0998    0.0000 H   0  0  0

+   -2.0254   -1.9894    0.0000 H   0  0  0

+   -1.6413   -3.4119    0.0000 H   0  0  0

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+   -2.0250    1.9897    0.0000 H   0  0  0

+    3.2068   -1.0421    0.0000 H   0  0  0

+    4.2487   -0.0004    0.0000 H   0  0  0

+    3.2070    1.0415    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  9 10  1  0

+  7  9  1  0

+  4 11  1  0

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+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+779-02-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -1.2042    0.9295   -0.0028 C   0  0  0

+   -1.2042   -0.5372   -0.0018 C   0  0  0

+   -0.0001    1.6308   -0.0026 C   0  0  0

+   -2.4424    1.6076    0.0020 C   0  0  0

+   -0.0002   -1.2385   -0.0003 C   0  0  0

+   -2.4423   -1.2154   -0.0021 C   0  0  0

+    1.2045    0.9295   -0.0015 C   0  0  0

+   -3.5969    0.8938    0.0074 C   0  0  0

+    1.2045   -0.5372    0.0004 C   0  0  0

+   -0.0003   -2.7455    0.0012 C   0  0  0

+   -3.5969   -0.5016   -0.0032 C   0  0  0

+    2.4422    1.6074   -0.0008 C   0  0  0

+    2.4421   -1.2153    0.0016 C   0  0  0

+    3.5971    0.8934    0.0007 C   0  0  0

+    3.5970   -0.5015    0.0018 C   0  0  0

+   -0.0002    2.6770    0.0000 H   0  0  0

+   -2.4700    2.6534    0.0000 H   0  0  0

+   -2.4698   -2.2612    0.0000 H   0  0  0

+   -4.5107    1.4032    0.0000 H   0  0  0

+   -1.0465   -2.7454    0.0000 H   0  0  0

+   -0.0004   -3.7917    0.0000 H   0  0  0

+    1.0459   -2.7456    0.0000 H   0  0  0

+   -4.5107   -1.0110    0.0000 H   0  0  0

+    2.4697    2.6532    0.0000 H   0  0  0

+    2.4695   -2.2611    0.0000 H   0  0  0

+    4.5109    1.4028    0.0000 H   0  0  0

+    4.5107   -1.0110    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+298-00-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+    2.1850   -0.2054    0.1056 P   0  0  0

+    1.2542   -0.7783    1.2878 O   0  0  0

+    3.7334   -0.3645    0.5168 O   0  0  0

+    1.9017   -1.0300   -1.2479 O   0  0  0

+    1.7979    1.5962   -0.1720 S   0  0  0

+   -0.0337   -0.5465    0.9211 C   0  0  0

+    4.4995    0.2847   -0.4999 C   0  0  0

+    1.0540   -0.2141   -2.0589 C   0  0  0

+   -0.8205   -1.5879    0.4516 C   0  0  0

+   -0.5655    0.7311    1.0211 C   0  0  0

+   -2.1297   -1.3497    0.0798 C   0  0  0

+   -1.8749    0.9641    0.6482 C   0  0  0

+   -2.6556   -0.0748    0.1755 C   0  0  0

+   -4.0584    0.1775   -0.2234 N   0  3  0

+   -4.5228    1.3004   -0.1396 O   0  0  0

+   -4.7484   -0.7377   -0.6356 O   0  5  0

+    5.1332   -0.4631    0.0000 H   0  0  0

+    5.2473    0.9184    0.0000 H   0  0  0

+    3.8658    1.0325    0.0000 H   0  0  0

+    1.7337    0.4921    0.0000 H   0  0  0

+    0.3478    0.4656    0.0000 H   0  0  0

+    0.3743   -0.9203    0.0000 H   0  0  0

+   -0.4643   -2.5011    0.0000 H   0  0  0

+    0.0480    1.4956    0.0000 H   0  0  0

+   -2.7458   -2.1120    0.0000 H   0  0  0

+   -2.2340    1.8761    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77784-21-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 46                          1 V2000

+   -0.3091    0.9615    0.0466 C   0  0  0

+   -1.2297   -0.1050    0.0421 C   0  0  0

+    1.1242    0.6557    0.0763 C   0  0  0

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+   -2.1394    2.5497   -0.0154 C   0  0  0

+   -0.0979    3.4704    0.0142 O   0  0  0

+    0.5610   -1.7226    0.0894 C   0  0  0

+   -1.6813   -2.4988    0.0589 N   0  0  0

+   -3.0544    1.5115   -0.0067 C   0  0  0

+   -3.5678   -0.9285    0.0123 C   0  0  0

+    2.9018   -1.0077    0.1244 C   0  0  0

+    3.4212    1.3474    0.1129 C   0  0  0

+   -2.3199    3.9037   -0.0397 O   0  0  0

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+    3.3125   -2.3030    0.1437 O   0  0  0

+   -3.7602   -3.2682    0.0328 O   0  0  0

+    5.1587   -0.2791    0.1592 O   0  0  0

+    3.6382   -2.6532   -1.2029 C   0  0  0

+    5.8591    0.9665    0.1608 C   0  0  0

+    1.7863    2.6704    0.0000 H   0  0  0

+    0.8734   -2.7193    0.0000 H   0  0  0

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+   -0.2171    5.0838    0.0000 H   0  0  0

+   -1.5759    5.3547    0.0000 H   0  0  0

+   -2.1405   -4.2383    0.0000 H   0  0  0

+   -0.7941   -4.8461    0.0000 H   0  0  0

+   -0.1863   -3.4997    0.0000 H   0  0  0

+    2.8733   -3.3646    0.0000 H   0  0  0

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+ 26 37  1  0

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+ 26 39  1  0

+ 27 40  1  0

+ 27 41  1  0

+ 27 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+434-07-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 59                          1 V2000

+   -0.1635   -0.1363   -0.4501 C   0  0  1

+   -1.0627    0.9999    0.0544 C   0  0  2

+    1.2648    0.0576    0.0679 C   0  0  2

+   -0.6855   -1.5032   -0.0194 C   0  0  0

+   -2.4601    0.7450   -0.4787 C   0  0  1

+   -0.5219    2.3238   -0.4930 C   0  0  0

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+   -2.1504   -1.7047   -0.4418 C   0  0  0

+   -2.9547   -0.5756    0.1716 C   0  0  2

+   -3.5362    1.7360   -0.0216 C   0  0  0

+    0.8878    2.5414    0.0530 C   0  0  0

+    3.1826    1.6427    0.2587 C   0  0  0

+    3.5826   -0.8079   -0.2680 C   0  0  0

+   -4.4512   -0.5709   -0.1214 C   0  0  1

+   -2.7206   -0.5306    1.6829 C   0  0  0

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+   -1.2209   -0.2986    0.0000 H   0  0  0

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+   -2.5187   -1.5812    0.0000 H   0  0  0

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+   -3.7412   -1.6614    0.0000 H   0  0  0

+   -5.9504   -1.9520    0.0000 H   0  0  0

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+ 22 55  1  0

+ 24 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+65089-17-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+   -1.8750    0.5987    0.0976 C   0  0  0

+   -2.9600    1.4621    0.0913 N   0  0  0

+   -0.6341    1.0754    0.1099 N   0  0  0

+   -2.0702   -0.7835    0.0968 C   0  0  0

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+   -5.0095    0.6565    1.0819 C   0  0  0

+   -4.7941    0.7553   -1.3106 C   0  0  0

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+   -1.1450   -3.3328    0.1036 Cl  0  0  0

+   -6.2889    0.1562    0.9426 C   0  0  0

+   -4.4313    0.8774    2.4559 C   0  0  0

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+    8.3753   -0.0998    0.1828 C   0  0  0

+    8.3527   -0.9208   -0.9866 O   0  0  0

+   -2.8092    2.4616    0.0000 H   0  0  0

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+   -5.9240   -0.7864    0.0000 H   0  0  0

+   -4.0706   -0.0668    0.0000 H   0  0  0

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+ 22 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+ 24 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-28-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 93 92                          1 V2000

+    3.8619    0.2745    0.0028 C   0  0  0

+    2.7075    1.2432    0.0132 C   0  0  0

+    5.1233    0.7336    0.0077 O   0  0  0

+    3.6521   -0.9153   -0.0050 O   0  0  0

+    1.3896    0.4660    0.0048 C   0  0  0

+    6.2356   -0.1997   -0.0024 C   0  0  0

+    0.0000    1.6319    0.0174 S   0  0  0

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+   -5.1233    0.7336    0.0078 O   0  0  0

+   -3.6521   -0.9153   -0.0100 O   0  0  0

+   12.5333    0.1651    0.0015 C   0  0  0

+   -6.2356   -0.1997   -0.0023 C   0  0  0

+   13.7054   -0.8184   -0.0091 C   0  0  0

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+   -8.7255   -0.4059   -0.0045 C   0  0  0

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+  -10.0434    0.3713    0.0039 C   0  0  0

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+  -11.2154   -0.6121   -0.0067 C   0  0  0

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+  -13.7054   -0.8184   -0.0089 C   0  0  0

+  -15.0232   -0.0412   -0.0005 C   0  0  0

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+  -17.5132   -0.2474   -0.0027 C   0  0  0

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+  -16.8223    0.6688    0.0000 H   0  0  0

+  -18.3454    0.5426    0.0000 H   0  0  0

+  -19.3761   -2.1470    0.0000 H   0  0  0

+  -17.8530   -2.0208    0.0000 H   0  0  0

+  -19.4202    0.5348    0.0000 H   0  0  0

+  -20.9915    0.1293    0.0000 H   0  0  0

+  -20.5860   -1.4420    0.0000 H   0  0  0

+  1  2  1  0

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+ 34 89  1  0

+ 34 90  1  0

+ 35 91  1  0

+ 35 92  1  0

+ 35 93  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+87-25-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -0.5262    0.1155    0.1983 C   0  0  0

+   -1.4254   -0.8402   -0.3012 C   0  0  0

+    0.8838   -0.2427    0.4286 C   0  0  0

+   -0.9765    1.4107    0.4702 C   0  0  0

+   -2.7531   -0.4894   -0.5140 C   0  0  0

+   -0.9904   -2.1285   -0.5814 N   0  0  0

+    1.8601    0.3959   -0.2461 O   0  0  0

+    1.1668   -1.1139    1.2271 O   0  0  0

+   -2.2949    1.7406    0.2472 C   0  0  0

+   -3.1828    0.7914   -0.2352 C   0  0  0

+    3.2501    0.0429   -0.0191 C   0  0  0

+    4.1477    0.9106   -0.9035 C   0  0  0

+   -0.2907    2.1607    0.0000 H   0  0  0

+   -3.4478   -1.2311    0.0000 H   0  0  0

+   -1.6617   -2.8915    0.0000 H   0  0  0

+    0.0060   -2.3284    0.0000 H   0  0  0

+   -2.5824    2.7153    0.0000 H   0  0  0

+   -4.1758    1.0074    0.0000 H   0  0  0

+    2.8235   -0.8795    0.0000 H   0  0  0

+    4.0785   -0.5457    0.0000 H   0  0  0

+    4.8540    0.1799    0.0000 H   0  0  0

+    4.8784    1.6169    0.0000 H   0  0  0

+    3.4414    1.6413    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107-92-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.4497   -0.6759    0.0000 C   0  0  0

+   -0.9041   -0.0140    0.0000 C   0  0  0

+    1.5415    0.3959    0.0000 C   0  0  0

+   -2.0176   -0.7635    0.0000 O   0  0  0

+   -0.9872    1.1914    0.0000 O   0  0  0

+    2.9160   -0.2761    0.0000 C   0  0  0

+   -0.1583   -1.6286    0.0000 H   0  0  0

+    1.3276   -1.3877    0.0000 H   0  0  0

+    2.1495    1.3486    0.0000 H   0  0  0

+    0.6636    1.1077    0.0000 H   0  0  0

+   -2.9552   -1.3946    0.0000 H   0  0  0

+    2.4196   -1.2915    0.0000 H   0  0  0

+    3.9314   -0.7725    0.0000 H   0  0  0

+    3.4124    0.7393    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  1  7  1  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88847-89-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -0.0797   -0.2197    0.0007 N   0  0  0

+   -1.3759    0.2137   -0.1173 C   0  0  0

+    1.1256    0.5865   -0.2073 C   0  0  2

+   -0.1183   -1.5400    0.3536 C   0  0  0

+   -2.1844   -0.8901    0.1701 C   0  0  0

+   -1.9407    1.3869   -0.4269 N   0  0  0

+    2.1940   -0.2595   -0.6856 O   0  0  0

+    1.6262    1.1242    1.1516 C   0  0  0

+   -1.3605   -1.9319    0.4564 N   0  0  0

+    0.9664   -2.3230    0.5640 O   0  0  0

+   -3.5878   -0.7316    0.1240 C   0  0  0

+   -3.2474    1.5221   -0.4662 C   0  0  0

+    3.4120    0.4447   -0.3592 C   0  0  1

+    3.1650    1.0288    1.0494 C   0  0  1

+   -4.0868    0.4827   -0.1966 N   0  0  0

+   -4.3305   -1.6676    0.3679 O   0  0  0

+   -3.7820    2.7451   -0.7883 N   0  0  0

+    4.5753   -0.5476   -0.3030 C   0  0  0

+    3.7297    2.3391    1.1274 O   0  0  0

+    4.7461   -1.1544   -1.5855 O   0  0  0

+    0.4763    1.3491    0.0000 H   0  0  0

+    1.9137    2.0836    0.0000 H   0  0  0

+    0.7573    1.6222    0.0000 H   0  0  0

+    1.7785   -2.9092    0.0000 H   0  0  0

+    4.2199    1.0366    0.0000 H   0  0  0

+    4.1665    1.0254    0.0000 H   0  0  0

+   -5.0779    0.6271    0.0000 H   0  0  0

+   -3.1878    3.5513    0.0000 H   0  0  0

+   -4.7773    2.8565    0.0000 H   0  0  0

+    5.5755   -0.6002    0.0000 H   0  0  0

+    4.9462    0.3827    0.0000 H   0  0  0

+    4.1261    3.2589    0.0000 H   0  0  0

+    5.0175   -2.1185    0.0000 H   0  0  0

+  1  2  1  0

+  3  1  1  0

+  1  4  1  0

+  2  5  2  0

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+  5  9  1  0

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+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105-11-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.3674   -0.3292    0.0023 C   0  0  0

+   -0.3557   -1.3940    0.0016 C   0  0  0

+   -0.9511    1.0795    0.0018 C   0  0  0

+   -2.6434   -0.6363   -0.0021 N   0  0  0

+    0.9511   -1.0795    0.0004 C   0  0  0

+    0.3557    1.3940    0.0006 C   0  0  0

+   -3.6187    0.3903   -0.0014 O   0  0  0

+    1.3674    0.3292   -0.0001 C   0  0  0

+    2.6434    0.6363   -0.0008 N   0  0  0

+    3.6187   -0.3903   -0.0010 O   0  0  0

+   -0.6567   -2.4125    0.0000 H   0  0  0

+   -1.6826    1.8494    0.0000 H   0  0  0

+    1.6826   -1.8494    0.0000 H   0  0  0

+    0.6567    2.4125    0.0000 H   0  0  0

+   -4.3502    1.1603    0.0000 H   0  0  0

+    4.3502   -1.1603    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  4  7  1  0

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+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+479-45-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    0.4667   -0.0009   -0.2688 C   0  0  0

+   -0.2235   -1.2032   -0.1776 C   0  0  0

+   -0.2236    1.2010   -0.1798 C   0  0  0

+    1.8524   -0.0008   -0.4439 N   0  0  0

+   -1.5927   -1.1996    0.0012 C   0  0  0

+    0.5081   -2.4865   -0.2715 N   0  3  0

+   -1.5933    1.1974   -0.0009 C   0  0  0

+    0.5076    2.4844   -0.2759 N   0  3  0

+    2.6995    0.0049    0.6720 N   0  3  0

+    2.4201   -0.0068   -1.7944 C   0  0  0

+   -2.2770   -0.0009    0.0894 C   0  0  0

+    0.0518   -3.4006   -0.9346 O   0  0  0

+    1.5665   -2.6284    0.3145 O   0  5  0

+    0.0258    3.4148   -0.8970 O   0  0  0

+    1.5912    2.6100    0.2661 O   0  5  0

+    3.9079    0.0050    0.5194 O   0  0  0

+    2.2275    0.0099    1.7949 O   0  5  0

+   -3.7448   -0.0010    0.2811 N   0  3  0

+   -4.3488    1.0538    0.3590 O   0  0  0

+   -4.3485   -1.0558    0.3609 O   0  5  0

+   -2.0805   -2.0372    0.0000 H   0  0  0

+   -2.0812    2.0349    0.0000 H   0  0  0

+    2.4099   -0.9760    0.0000 H   0  0  0

+    3.3893   -0.0170    0.0000 H   0  0  0

+    2.4303    0.9624    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+ 11 18  1  0

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+  7 11  2  0

+  5 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+613-47-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.7723    0.6301   -0.0031 C   0  0  0

+   -0.9741   -0.7732   -0.0010 C   0  0  0

+    0.5362    1.1391   -0.0029 C   0  0  0

+   -1.8870    1.4871    0.0006 C   0  0  0

+    0.1373   -1.6337    0.0011 C   0  0  0

+   -2.2852   -1.2796   -0.0008 C   0  0  0

+    1.6032    0.2675   -0.0007 C   0  0  0

+   -3.1416    0.9600    0.0060 C   0  0  0

+    1.3946   -1.1168    0.0013 C   0  0  0

+   -3.3400   -0.4196   -0.0025 C   0  0  0

+    2.9058    0.7699   -0.0004 N   0  0  0

+    4.0077   -0.1194    0.0018 O   0  0  0

+    0.7003    2.1761    0.0000 H   0  0  0

+   -1.7521    2.5283    0.0000 H   0  0  0

+   -0.0034   -2.6742    0.0000 H   0  0  0

+   -2.4501   -2.3165    0.0000 H   0  0  0

+   -3.9724    1.6020    0.0000 H   0  0  0

+    2.2207   -1.7648    0.0000 H   0  0  0

+   -4.3181   -0.8012    0.0000 H   0  0  0

+    3.0684    1.8072    0.0000 H   0  0  0

+    4.8247   -0.7788    0.0000 H   0  0  0

+  1  2  1  0

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+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+76150-91-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+    3.0782   -0.8159   -0.6106 C   0  0  0

+    2.6654   -2.1081   -0.6506 O   0  0  0

+    3.6045   -0.2974    0.5672 C   0  0  0

+    2.9809   -0.0637   -1.6938 N   0  0  0

+    1.3445   -2.1088   -0.3286 C   0  0  0

+    4.0223    1.0223    0.5945 C   0  0  0

+    3.7354   -1.2911    1.9847 Cl  0  0  0

+    3.3706    1.1971   -1.6991 C   0  0  0

+    0.6715   -3.3109   -0.1630 C   0  0  0

+    0.6711   -0.9080   -0.1599 C   0  0  0

+    3.8982    1.7802   -0.5632 C   0  0  0

+   -0.6701   -3.3116    0.1640 C   0  0  0

+   -0.6709   -0.9087    0.1672 C   0  0  0

+    4.4065    3.4400   -0.5841 Cl  0  0  0

+   -1.3451   -2.1104    0.3271 C   0  0  0

+   -2.6661   -2.1111    0.6490 O   0  0  0

+   -3.0800   -0.8193    0.6101 C   0  0  0

+   -3.6005   -0.2984   -0.5694 C   0  0  0

+   -2.9896   -0.0698    1.6957 N   0  0  0

+   -4.0197    1.0209   -0.5956 C   0  0  0

+   -3.7226   -1.2887   -1.9900 Cl  0  0  0

+   -3.3807    1.1906    1.7020 C   0  0  0

+   -3.9027    1.7760    0.5647 C   0  0  0

+   -4.4126    3.4353    0.5868 Cl  0  0  0

+    5.0104    0.9509    0.0000 H   0  0  0

+    2.5097    1.6873    0.0000 H   0  0  0

+    1.1727   -4.1655    0.0000 H   0  0  0

+    1.1716   -0.0530    0.0000 H   0  0  0

+   -1.1702   -4.1668    0.0000 H   0  0  0

+   -1.1718   -0.0539    0.0000 H   0  0  0

+   -5.0075    0.9447    0.0000 H   0  0  0

+   -2.5183    1.6782    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  1  0

+ 12 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+ 18 21  1  0

+ 19 22  1  0

+ 20 23  1  0

+ 23 24  1  0

+  8 11  2  0

+ 13 15  2  0

+ 22 23  2  0

+  6 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 20 31  1  0

+ 22 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89021-88-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 44                          1 V2000

+   -1.5223   -1.5541   -0.0228 C   0  0  1

+   -2.5849   -2.5566    0.3473 C   0  0  0

+   -1.7785   -0.2912    0.6741 N   0  0  0

+   -0.1493   -2.0922    0.3851 C   0  0  0

+   -2.5525   -3.7976   -0.1775 N   0  0  0

+   -3.4691   -2.2467    1.1174 O   0  0  0

+   -2.5502    0.6518    0.0982 C   0  0  0

+    1.1269   -0.8881   -0.0594 S   0  0  0

+   -3.5855   -4.7722    0.1823 C   0  0  0

+   -2.8138    1.9509    0.8151 C   0  0  0

+   -3.0325    0.4549   -0.9971 O   0  0  0

+    2.8201   -1.2301    0.2882 C   0  0  0

+   -3.3219   -6.0713   -0.5346 C   0  0  0

+   -3.7110    2.8380   -0.0503 C   0  0  0

+    3.7669   -0.3368   -0.0415 C   0  0  0

+    3.2642   -2.7219    1.0569 Cl  0  0  0

+   -4.1458   -7.1158   -0.3556 O   0  0  0

+   -2.3690   -6.1727   -1.2705 O   0  0  0

+   -3.9786    4.1569    0.6775 C   0  0  1

+    3.3929    0.9178   -0.7065 C   0  0  0

+    5.4331   -0.6651    0.3184 Cl  0  0  0

+   -4.8623    5.0307   -0.1749 C   0  0  0

+   -4.6476    3.8834    1.9564 N   0  0  0

+    3.3825    2.0610   -0.0175 C   0  0  0

+    2.9642    0.9142   -2.3887 Cl  0  0  0

+   -4.3146    5.8857   -1.0528 O   0  0  0

+   -6.0638    4.9616   -0.0681 O   0  0  0

+    2.9591    3.5472   -0.8083 Cl  0  0  0

+    3.7924    2.0615    1.6695 Cl  0  0  0

+   -0.7786   -0.9293    0.0000 H   0  0  0

+   -0.9009    0.1252    0.0000 H   0  0  0

+   -0.6324   -2.9349    0.0000 H   0  0  0

+    0.6136   -2.6935    0.0000 H   0  0  0

+   -1.6556   -4.1707    0.0000 H   0  0  0

+   -4.1105   -3.9549    0.0000 H   0  0  0

+   -4.4856   -5.1375    0.0000 H   0  0  0

+   -1.8502    1.8284    0.0000 H   0  0  0

+   -2.3886    2.8243    0.0000 H   0  0  0

+   -4.6746    2.9605    0.0000 H   0  0  0

+   -4.1362    1.9646    0.0000 H   0  0  0

+   -4.7474   -7.8785    0.0000 H   0  0  0

+   -3.1241    4.6188    0.0000 H   0  0  0

+   -5.4155    4.4783    0.0000 H   0  0  0

+   -4.7788    2.9209    0.0000 H   0  0  0

+   -3.7906    6.7036    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  7 11  2  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 12 15  2  0

+ 12 16  1  0

+ 13 17  1  0

+ 13 18  2  0

+ 14 19  1  0

+ 15 20  1  0

+ 15 21  1  0

+ 19 22  1  0

+ 19 23  1  0

+ 20 24  2  0

+ 20 25  1  0

+ 22 26  1  0

+ 22 27  2  0

+ 24 28  1  0

+ 24 29  1  0

+  1 30  1  0

+  3 31  1  0

+  4 32  1  0

+  4 33  1  0

+  5 34  1  0

+  9 35  1  0

+  9 36  1  0

+ 10 37  1  0

+ 10 38  1  0

+ 14 39  1  0

+ 14 40  1  0

+ 17 41  1  0

+ 19 42  1  0

+ 23 43  1  0

+ 23 44  1  0

+ 26 45  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122-48-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -0.1342    0.4298   -0.4245 C   0  0  0

+    0.7030   -0.6629   -0.2981 C   0  0  0

+    0.3651    1.7092   -0.2657 C   0  0  0

+   -1.5932    0.2263   -0.7423 C   0  0  0

+    2.0460   -0.4772   -0.0116 C   0  0  0

+    1.7039    1.9014    0.0203 C   0  0  0

+   -2.3849    0.0922    0.5600 C   0  0  0

+    2.5486    0.8105    0.1483 C   0  0  0

+    2.8709   -1.5511    0.1135 O   0  0  0

+   -3.8439   -0.1114    0.2422 C   0  0  0

+    3.8658    0.9979    0.4296 O   0  0  0

+    2.0699   -2.7146   -0.1025 C   0  0  0

+   -4.8430   -0.2722    1.3589 C   0  0  0

+   -4.2124   -0.1456   -0.9073 O   0  0  0

+    0.3141   -1.6096    0.0000 H   0  0  0

+   -0.2710    2.5110    0.0000 H   0  0  0

+   -1.2181    1.1785    0.0000 H   0  0  0

+   -2.2380    1.0210    0.0000 H   0  0  0

+    2.0879    2.8500    0.0000 H   0  0  0

+   -2.7600   -0.8600    0.0000 H   0  0  0

+   -1.7400   -0.7025    0.0000 H   0  0  0

+    4.8790    1.1421    0.0000 H   0  0  0

+    1.2269   -2.1343    0.0000 H   0  0  0

+    1.4896   -3.5576    0.0000 H   0  0  0

+    2.9129   -3.2949    0.0000 H   0  0  0

+   -5.0056    0.7382    0.0000 H   0  0  0

+   -5.8534   -0.4348    0.0000 H   0  0  0

+   -4.6804   -1.2826    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+  6  8  1  0

+  2 15  1  0

+  3 16  1  0

+  4 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+117929-15-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.7362   -0.0704   -0.0011 C   0  0  0

+   -0.7362   -0.0704   -0.0011 C   0  0  0

+    1.4388    1.2254    0.0002 C   0  0  0

+    1.3982   -1.2030    0.0031 C   0  0  0

+   -1.4388    1.2254    0.0002 C   0  0  0

+   -1.3982   -1.2030   -0.0018 C   0  0  0

+    2.7538    1.2434    0.0003 C   0  0  0

+    0.6560    2.4703    0.0008 C   0  0  0

+    2.8707   -1.1793    0.0031 C   0  0  0

+    0.6596   -2.4772    0.0067 C   0  0  0

+   -2.7538    1.2434    0.0004 C   0  0  0

+   -0.6560    2.4703    0.0009 C   0  0  0

+   -2.8707   -1.1793   -0.0016 C   0  0  0

+   -0.6596   -2.4772   -0.0032 C   0  0  0

+    3.5052   -0.0247   -0.0009 C   0  0  0

+   -3.5052   -0.0247   -0.0008 C   0  0  0

+    4.8600   -0.0028   -0.0012 N   0  3  0

+   -4.8600   -0.0028   -0.0002 N   0  3  0

+    5.4860   -1.0476   -0.0022 O   0  0  0

+    5.4518    1.0618   -0.0005 O   0  5  0

+   -5.4860   -1.0476   -0.0012 O   0  0  0

+   -5.4518    1.0618    0.0013 O   0  5  0

+    3.2509    2.1298    0.0000 H   0  0  0

+    1.1474    3.3598    0.0000 H   0  0  0

+    3.3951   -2.0498    0.0000 H   0  0  0

+    1.1670   -3.3577    0.0000 H   0  0  0

+   -3.2509    2.1298    0.0000 H   0  0  0

+   -1.1474    3.3598    0.0000 H   0  0  0

+   -3.3951   -2.0498    0.0000 H   0  0  0

+   -1.1670   -3.3577    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

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+  8 12  2  0

+  9 15  2  0

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+  7 23  1  0

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+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7220-81-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+    1.4678    0.2459    0.3152 C   0  0  0

+    0.0942    0.3830    0.3212 C   0  0  0

+    2.5818    1.2576    0.4944 C   0  0  1

+    2.0637   -0.9978    0.1401 C   0  0  0

+   -0.7115   -0.7628    0.1054 C   0  0  0

+   -0.4707    1.5924    0.5604 O   0  0  0

+    3.8118    0.3394    0.7582 C   0  0  1

+    2.8877    1.9035   -0.8730 C   0  0  0

+    1.2633   -2.1334   -0.0191 C   0  0  0

+    3.4197   -0.8967    0.1409 O   0  0  0

+   -2.1039   -0.5794    0.0208 C   0  0  0

+   -0.1116   -2.0259   -0.0317 C   0  0  0

+   -1.7158    1.8718    0.0875 C   0  0  0

+    4.8711    0.9209   -0.0315 O   0  0  0

+    4.2533    1.3068   -1.2779 C   0  0  0

+   -2.6350    0.7174    0.0212 C   0  0  0

+   -3.2139   -1.5765   -0.0751 C   0  0  0

+   -0.8805   -3.1335   -0.1761 O   0  0  0

+   -2.0478    2.9910   -0.2552 O   0  0  0

+   -4.0781    0.6909   -0.0582 C   0  0  0

+   -4.5169   -0.7572   -0.1248 C   0  0  0

+    0.0119   -4.2438   -0.2899 C   0  0  0

+   -4.8099    1.6593   -0.0697 O   0  0  0

+    1.7447    1.8781    0.0000 H   0  0  0

+    4.6168   -0.3222    0.0000 H   0  0  0

+    3.3146    2.8541    0.0000 H   0  0  0

+    1.9415    2.3399    0.0000 H   0  0  0

+    1.7066   -3.0764    0.0000 H   0  0  0

+    5.1483    1.8404    0.0000 H   0  0  0

+    4.1879    2.3467    0.0000 H   0  0  0

+   -3.8477   -2.4036    0.0000 H   0  0  0

+   -2.4489   -2.2840    0.0000 H   0  0  0

+   -5.4833   -0.3676    0.0000 H   0  0  0

+   -4.9909   -1.6851    0.0000 H   0  0  0

+   -0.8003   -4.8966    0.0000 H   0  0  0

+    0.6647   -5.0560    0.0000 H   0  0  0

+    0.8241   -3.5910    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  2  0

+  4 10  1  0

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+ 20 23  2  0

+  7 10  1  0

+  9 12  1  0

+ 13 16  1  0

+ 14 15  1  0

+ 20 21  1  0

+  3 24  1  0

+  7 25  1  0

+  8 26  1  0

+  8 27  1  0

+  9 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+616-23-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+   -0.4390    0.4350   -0.2165 C   0  0  0

+   -1.6968    1.1200    0.3215 C   0  0  0

+    0.7941    1.0121    0.4816 C   0  0  0

+   -0.5363   -1.3368    0.1028 Cl  0  0  0

+   -2.8485    0.5811   -0.3306 O   0  0  0

+    2.2765    0.2049   -0.1523 Cl  0  0  0

+   -0.4063    1.5087    0.0000 H   0  0  0

+   -0.9965    1.9345    0.0000 H   0  0  0

+   -2.3461    1.9757    0.0000 H   0  0  0

+    1.4944    1.8266    0.0000 H   0  0  0

+    0.1447    1.8677    0.0000 H   0  0  0

+   -3.8214    0.1258    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80-08-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.0000   -1.4625    0.0000 S   0  0  0

+   -1.4200   -0.4193   -0.0002 C   0  0  0

+    1.4200   -0.4193    0.0002 C   0  0  0

+   -0.0002   -2.1146    1.2626 O   0  0  0

+    0.0002   -2.1146   -1.2625 O   0  0  0

+   -1.9757   -0.0109   -1.1986 C   0  0  0

+   -1.9796   -0.0154    1.1983 C   0  0  0

+    1.9757   -0.0109    1.1986 C   0  0  0

+    1.9796   -0.0154   -1.1983 C   0  0  0

+   -3.0888    0.8068   -1.2024 C   0  0  0

+   -3.0924    0.8021    1.2018 C   0  0  0

+    3.0888    0.8068    1.2024 C   0  0  0

+    3.0924    0.8021   -1.2018 C   0  0  0

+   -3.6499    1.2189   -0.0006 C   0  0  0

+    3.6499    1.2189    0.0006 C   0  0  0

+   -4.7753    2.0462   -0.0008 N   0  0  0

+    4.7753    2.0462    0.0008 N   0  0  0

+   -1.6665    0.4099    0.0000 H   0  0  0

+   -2.2870   -0.4375    0.0000 H   0  0  0

+    1.6665    0.4099    0.0000 H   0  0  0

+    2.2870   -0.4375    0.0000 H   0  0  0

+   -2.7797    1.2276    0.0000 H   0  0  0

+   -3.4033    0.3826    0.0000 H   0  0  0

+    2.7797    1.2276    0.0000 H   0  0  0

+    3.4033    0.3826    0.0000 H   0  0  0

+   -4.7178    2.5652    0.0000 H   0  0  0

+   -5.2535    1.8365    0.0000 H   0  0  0

+    5.2535    1.8365    0.0000 H   0  0  0

+    4.7178    2.5652    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

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+  6 10  1  0

+  7 11  2  0

+  8 12  1  0

+  9 13  2  0

+ 10 14  2  0

+ 12 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 11 14  1  0

+ 13 15  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-75-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.4551   -0.2888    0.2456 N   0  0  0

+    0.5306   -1.3695    0.3838 C   0  0  0

+   -0.0405    1.0883    0.5461 C   0  0  0

+   -1.6603   -0.5435   -0.1375 N   0  0  0

+    1.7727   -1.0120   -0.4385 C   0  0  0

+    1.2081    1.4182   -0.2779 C   0  0  0

+   -2.4682    0.3612   -0.2482 O   0  0  0

+    2.2850    0.3647   -0.0090 C   0  0  0

+   -0.3223   -1.9361    0.0000 H   0  0  0

+    0.9606   -2.2989    0.0000 H   0  0  0

+   -0.1170    2.1094    0.0000 H   0  0  0

+   -1.0584    1.1995    0.0000 H   0  0  0

+    1.8424   -2.0336    0.0000 H   0  0  0

+    2.7861   -1.1590    0.0000 H   0  0  0

+    2.0433    2.0107    0.0000 H   0  0  0

+    0.7741    2.3457    0.0000 H   0  0  0

+    3.1858   -0.1223    0.0000 H   0  0  0

+    2.8924    1.1891    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+366-18-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.7418    0.0041   -0.0023 C   0  0  0

+   -0.7418   -0.0041   -0.0023 C   0  0  0

+    1.4259    1.2177   -0.0023 C   0  0  0

+    1.4059   -1.1442    0.0033 N   0  0  0

+   -1.4259   -1.2177   -0.0023 C   0  0  0

+   -1.4059    1.1441    0.0032 N   0  0  0

+    2.8102    1.2095   -0.0018 C   0  0  0

+    2.7226   -1.1805    0.0039 C   0  0  0

+   -2.8102   -1.2095   -0.0018 C   0  0  0

+   -2.7226    1.1805    0.0039 C   0  0  0

+    3.4652   -0.0137   -0.0014 C   0  0  0

+   -3.4652    0.0138   -0.0013 C   0  0  0

+    0.9048    2.1157    0.0000 H   0  0  0

+   -0.9048   -2.1157    0.0000 H   0  0  0

+    3.3463    2.0986    0.0000 H   0  0  0

+    3.2096   -2.0974    0.0000 H   0  0  0

+   -3.3463   -2.0986    0.0000 H   0  0  0

+   -3.2095    2.0975    0.0000 H   0  0  0

+    4.5027   -0.0527    0.0000 H   0  0  0

+   -4.5027    0.0528    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  9 12  1  0

+  8 11  2  0

+ 10 12  2  0

+  3 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105802-11-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    0.7764    0.0041    0.0038 C   0  0  0

+    0.2836   -1.3144    0.0008 C   0  0  0

+    2.2262    0.2082    0.0025 C   0  0  0

+   -0.1133    1.0927    0.0021 C   0  0  0

+   -1.1662   -1.5183    0.0016 C   0  0  0

+    1.1735   -2.4028   -0.0037 C   0  0  0

+    3.0737   -0.9240   -0.0015 C   0  0  0

+    2.7830    1.4903    0.0045 C   0  0  0

+   -1.4535    0.9095   -0.0027 C   0  0  0

+    0.4385    2.4951    0.0063 C   0  0  0

+   -2.0135   -0.3860    0.0054 C   0  0  0

+   -1.7234   -2.8002   -0.0019 C   0  0  0

+    2.5138   -2.2194   -0.0058 C   0  0  0

+    4.4646   -0.7368   -0.0029 C   0  0  0

+    4.1398    1.6376    0.0027 C   0  0  0

+   -2.3486    2.0886   -0.0043 N   0  3  0

+   -3.4045   -0.5728    0.0060 C   0  0  0

+   -3.0802   -2.9471   -0.0016 C   0  0  0

+    4.9767    0.5264   -0.0005 C   0  0  0

+   -2.7132    2.5750   -1.0597 O   0  0  0

+   -2.7204    2.5723    1.0499 O   0  5  0

+   -3.9168   -1.8358    0.0029 C   0  0  0

+    0.7883   -3.3823    0.0000 H   0  0  0

+    2.1590    2.3379    0.0000 H   0  0  0

+    1.4180    2.1097    0.0000 H   0  0  0

+    0.8239    3.4746    0.0000 H   0  0  0

+   -0.5410    2.8805    0.0000 H   0  0  0

+   -1.0996   -3.6480    0.0000 H   0  0  0

+    3.1503   -3.0577    0.0000 H   0  0  0

+    5.1097   -1.5685    0.0000 H   0  0  0

+    4.5580    2.6035    0.0000 H   0  0  0

+   -4.0494    0.2591    0.0000 H   0  0  0

+   -3.4986   -3.9129    0.0000 H   0  0  0

+    6.0204    0.6630    0.0000 H   0  0  0

+   -4.9605   -1.9722    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

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+ 14 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2835-68-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    2.0774   -0.0050    0.0021 C   0  0  0

+    2.7506   -1.1726    0.0030 N   0  0  0

+    2.6859    1.0477   -0.0038 O   0  0  0

+    0.6022   -0.0042    0.0021 C   0  0  0

+   -0.0975    1.2059    0.0011 C   0  0  0

+   -0.0990   -1.2137   -0.0028 C   0  0  0

+   -1.4738    1.2034    0.0006 C   0  0  0

+   -1.4749   -1.2096   -0.0033 C   0  0  0

+   -2.1690   -0.0026    0.0011 C   0  0  0

+   -3.5595   -0.0018    0.0006 N   0  0  0

+    2.2283   -2.0759    0.0000 H   0  0  0

+    3.7940   -1.1732    0.0000 H   0  0  0

+    0.4231    2.1102    0.0000 H   0  0  0

+    0.4206   -2.1186    0.0000 H   0  0  0

+   -1.9966    2.1064    0.0000 H   0  0  0

+   -1.9987   -2.1120    0.0000 H   0  0  0

+   -4.0807    0.9022    0.0000 H   0  0  0

+   -4.0817   -0.9052    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  2  0

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+ 10  9  1  0

+  8  9  1  0

+  2 11  1  0

+  2 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+79-24-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.3865   -0.0158    0.0908 N   0  3  0

+   -0.9204   -0.5019    0.5402 C   0  0  0

+    0.6031    1.1812    0.0303 O   0  0  0

+    1.2580   -0.8088   -0.2177 O   0  5  0

+   -2.0099    0.0241   -0.3964 C   0  0  0

+   -1.5098   -1.1950    0.0000 H   0  0  0

+   -0.3984   -1.2471    0.0000 H   0  0  0

+   -1.6143    0.8435    0.0000 H   0  0  0

+   -2.8293    0.4197    0.0000 H   0  0  0

+   -2.4055   -0.7953    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  5  8  1  0

+  5  9  1  0

+  5 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1622-57-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.4459    0.8519   -0.0024 C   0  0  0

+   -0.2636   -0.5408   -0.0009 C   0  0  0

+    0.7901    1.4170   -0.0018 N   0  0  0

+   -1.7409    1.3760    0.0010 C   0  0  0

+    1.1058   -0.7500    0.0006 N   0  0  0

+   -1.3650   -1.3831   -0.0015 C   0  0  0

+    1.7030    0.4778    0.0000 C   0  0  0

+   -2.8231    0.5248    0.0057 C   0  0  0

+    1.7865   -2.0473    0.0024 C   0  0  0

+   -2.6374   -0.8498   -0.0036 C   0  0  0

+    3.0646    0.6965    0.0006 N   0  0  0

+   -1.8866    2.4026    0.0000 H   0  0  0

+   -1.2327   -2.4115    0.0000 H   0  0  0

+   -3.7840    0.9142    0.0000 H   0  0  0

+    0.8684   -2.5291    0.0000 H   0  0  0

+    2.2682   -2.9654    0.0000 H   0  0  0

+    2.7046   -1.5656    0.0000 H   0  0  0

+   -3.4602   -1.4807    0.0000 H   0  0  0

+    3.7189   -0.1079    0.0000 H   0  0  0

+    3.4341    1.6653    0.0000 H   0  0  0

+  1  2  2  0

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+  9 15  1  0

+  9 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7319-59-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 47                          1 V2000

+   -0.7615    0.1558   -0.2907 C   0  0  0

+   -1.1451   -1.1603   -0.1118 C   0  0  0

+    0.5963    0.4493   -0.2437 C   0  0  0

+   -2.0145    0.9686   -0.5089 C   0  0  0

+   -2.5213   -1.3799   -0.1714 C   0  0  0

+   -0.2021   -2.2428    0.1216 C   0  0  0

+    1.5672   -0.6254   -0.0127 C   0  0  0

+    1.0721    1.8191   -0.4208 C   0  0  0

+   -3.1768   -0.0457   -0.4336 C   0  0  0

+   -2.1519    1.9423    0.5594 O   0  0  0

+   -2.9716   -2.6512   -0.0029 C   0  0  0

+    1.1622   -1.9428    0.1663 C   0  0  0

+   -0.7324   -3.5366    0.2896 C   0  0  0

+    2.9964   -0.2783    0.0266 C   0  0  0

+    2.3873    2.1036   -0.3770 C   0  0  0

+   -2.7641    3.1137    0.3252 C   0  0  0

+   -2.0833   -3.7052    0.2226 C   0  0  0

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+   -2.9067    4.1243    1.4340 C   0  0  0

+   -3.2008    3.3578   -0.7746 O   0  0  0

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+    5.2962   -0.9087    0.2706 C   0  0  0

+    5.6805    0.4144    0.0936 C   0  0  0

+   -1.1361    1.5289    0.0000 H   0  0  0

+    0.3814    2.5991    0.0000 H   0  0  0

+   -3.7911    0.7958    0.0000 H   0  0  0

+   -4.0685   -0.5846    0.0000 H   0  0  0

+    1.8682   -2.7090    0.0000 H   0  0  0

+   -0.0994   -4.3641    0.0000 H   0  0  0

+    2.6909    3.1002    0.0000 H   0  0  0

+   -2.4631   -4.6754    0.0000 H   0  0  0

+   -4.6432   -1.9037    0.0000 H   0  0  0

+   -5.4759   -3.1192    0.0000 H   0  0  0

+   -4.2604   -3.9519    0.0000 H   0  0  0

+    3.6910   -2.2653    0.0000 H   0  0  0

+   -1.8751    4.2699    0.0000 H   0  0  0

+   -3.0523    5.1559    0.0000 H   0  0  0

+   -3.9383    3.9787    0.0000 H   0  0  0

+    5.0461    2.3900    0.0000 H   0  0  0

+    6.0239   -1.6543    0.0000 H   0  0  0

+    6.6927    0.6612    0.0000 H   0  0  0

+  1  2  1  0

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+ 21 39  1  0

+ 21 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+ 25 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106671-89-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.4392    0.4150    0.0364 C   0  0  0

+   -1.2380   -0.6761   -0.0510 C   0  0  0

+    1.0443    0.4110    0.0343 C   0  0  0

+   -1.2284    1.5060    0.1198 N   0  0  0

+   -2.5565   -0.2363   -0.0143 N   0  0  0

+   -0.7875   -2.0843   -0.1656 N   0  3  0

+    1.7450    1.3954   -0.6597 C   0  0  0

+    1.7419   -0.5741    0.7312 C   0  0  0

+   -2.4730    1.1282    0.0871 C   0  0  0

+   -3.8212   -0.7820   -0.0579 C   0  0  0

+   -0.6038   -2.5774   -1.2640 O   0  0  0

+   -0.6013   -2.7477    0.8387 O   0  5  0

+    3.1251    1.3876   -0.6582 C   0  0  0

+    3.1216   -0.5732    0.7266 C   0  0  0

+   -4.1800    1.6237    0.1220 S   0  0  0

+   -4.9019   -0.0058    0.0051 C   0  0  0

+    3.8133    0.4041    0.0311 C   0  0  0

+    5.5492    0.3998    0.0292 Cl  0  0  0

+    1.2802    2.3031    0.0000 H   0  0  0

+    1.2737   -1.4800    0.0000 H   0  0  0

+   -3.9309   -1.7958    0.0000 H   0  0  0

+    3.5987    2.2907    0.0000 H   0  0  0

+    3.5905   -1.4788    0.0000 H   0  0  0

+   -5.8859   -0.2733    0.0000 H   0  0  0

+  1  2  2  0

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+  5  9  1  0

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+  7 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 16 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17722-71-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.4078   -0.1619    0.5594 C   0  0  0

+   -1.3989   -1.0714    0.2161 C   0  0  0

+    0.9037   -0.6017    0.7728 N   0  0  0

+   -0.7185    1.1860    0.6852 C   0  0  0

+   -2.6933   -0.6341    0.0055 C   0  0  0

+    1.9226   -0.0366    0.0954 C   0  0  0

+   -2.0119    1.6188    0.4687 C   0  0  0

+   -3.0010    0.7096    0.1368 C   0  0  0

+   -3.9336   -1.7701   -0.4245 Cl  0  0  0

+    3.3449   -0.4144    0.4202 C   0  0  0

+    1.6949    0.7759   -0.7758 O   0  0  0

+   -4.6271    1.2564   -0.1288 Cl  0  0  0

+    4.2994    0.3649   -0.4867 C   0  0  0

+    5.7217   -0.0129   -0.1618 C   0  0  0

+    6.7364    0.5498   -0.8365 O   0  0  0

+    5.9485   -0.8224    0.7061 O   0  0  0

+   -1.1871   -2.0731    0.0000 H   0  0  0

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+  7  8  1  0

+  2 17  1  0

+  3 18  1  0

+  4 19  1  0

+  7 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17948-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 43                          1 V2000

+    0.0970   -0.0723   -0.0656 C   0  0  0

+   -1.2792   -0.0655    0.0687 C   0  0  0

+    0.7488    1.1821   -0.0630 C   0  0  0

+    0.8123   -1.2397   -0.2022 N   0  0  0

+   -2.0102    1.1210    0.1936 C   0  0  0

+   -2.2631   -1.2028    0.1243 C   0  0  0

+    2.2141    1.2064   -0.1928 C   0  0  0

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+    2.1838   -1.2715   -0.0405 C   0  0  0

+    0.1020   -2.4793   -0.5266 C   0  0  0

+   -3.3313    0.8741    0.2991 O   0  0  0

+   -1.3607    2.3623    0.1934 C   0  0  0

+   -3.5302   -0.5019    0.6765 C   0  0  0

+    2.9250   -0.0770   -0.0302 C   0  0  0

+    2.8146    2.2406   -0.4248 O   0  0  0

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+    2.8467   -2.4858    0.1135 C   0  0  0

+   -4.7495   -1.0437   -0.0241 C   0  0  0

+    4.3105   -0.1136    0.1312 C   0  0  0

+    4.2153   -2.5075    0.2720 C   0  0  0

+   -4.8814   -0.9092   -1.5193 C   0  0  0

+   -5.6948   -1.6315    0.6665 C   0  0  0

+    4.9463   -1.3256    0.2848 C   0  0  0

+   -2.8275   -2.0746    0.0000 H   0  0  0

+   -1.4325   -1.8262    0.0000 H   0  0  0

+   -0.7991   -1.9630    0.0000 H   0  0  0

+   -0.4143   -3.3804    0.0000 H   0  0  0

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+   -1.9016    3.2489    0.0000 H   0  0  0

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+    4.8596    0.7679    0.0000 H   0  0  0

+    4.7137   -3.4186    0.0000 H   0  0  0

+   -4.1399   -0.1820    0.0000 H   0  0  0

+   -5.6086   -0.1677    0.0000 H   0  0  0

+   -5.6229   -1.6364    0.0000 H   0  0  0

+   -6.6107   -1.1419    0.0000 H   0  0  0

+   -5.6608   -2.6695    0.0000 H   0  0  0

+    5.9842   -1.3623    0.0000 H   0  0  0

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+ 21 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+133831-62-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -2.2380   -0.6499   -0.2637 C   0  0  0

+   -3.4333    0.0740   -0.2617 C   0  0  0

+   -1.1307   -0.5335    1.1020 S   0  0  0

+   -1.9274   -1.4711   -1.3512 C   0  0  0

+   -4.2951   -0.0215   -1.3334 C   0  0  0

+   -3.7734    0.9410    0.8887 N   0  3  0

+    0.5019   -1.5247    1.0949 S   0  0  0

+   -2.8004   -1.5620   -2.4136 C   0  0  0

+   -3.9785   -0.8327   -2.4104 C   0  0  0

+   -4.8156    1.5714    0.8890 O   0  0  0

+   -2.8872    1.0376    1.9889 O   0  5  0

+    1.9218   -0.8308    0.4367 C   0  0  0

+    1.8875    0.4175   -0.0775 C   0  0  0

+    3.4057   -1.7317    0.4302 Cl  0  0  0

+    3.1633    1.0836   -0.5245 C   0  0  0

+    0.3738    1.2548   -0.2235 Cl  0  0  0

+    4.2213    0.1728   -0.4342 F   0  0  0

+    3.0270    1.5103   -1.8499 F   0  0  0

+    3.4258    2.1862    0.2957 F   0  0  0

+   -1.1499   -1.9507    0.0000 H   0  0  0

+   -5.0767    0.4514    0.0000 H   0  0  0

+   -3.0045   -2.4524    0.0000 H   0  0  0

+   -4.6805   -1.4172    0.0000 H   0  0  0

+  1  2  2  0

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+ 15 19  1  0

+  8  9  1  0

+  4 20  1  0

+  5 21  1  0

+  8 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53-95-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+    1.0023   -0.4572    0.1499 C   0  0  0

+    2.4813   -0.4300    0.0343 C   0  0  0

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+   -1.7287    0.0132    0.3081 C   0  0  0

+    5.1821    0.1410   -0.2303 C   0  0  0

+   -3.1044    0.2503    0.3881 N   0  0  0

+   -3.9181   -0.1617   -0.6041 C   0  0  0

+   -3.6427    0.9233    1.5117 O   0  0  0

+   -3.9178    0.5596   -1.9273 C   0  0  0

+   -4.6507   -1.1130   -0.4322 O   0  0  0

+    0.4707   -2.4938    0.0000 H   0  0  0

+    3.1114   -2.4455    0.0000 H   0  0  0

+    2.3649    2.5448    0.0000 H   0  0  0

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+   -4.2893    1.7316    0.0000 H   0  0  0

+   -2.8827    0.5592    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-44-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 41                          1 V2000

+    0.9873    0.1796   -0.3953 C   0  0  0

+   -0.2545    0.4925    0.4420 C   0  0  0

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+   -1.4447    0.1067   -0.2947 O   0  0  0

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+    0.2088   -3.6307    0.0000 H   0  0  0

+    1.1773   -4.5380    0.0000 H   0  0  0

+    2.0846   -3.5695    0.0000 H   0  0  0

+   -3.6904   -1.0031    0.0000 H   0  0  0

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+    6.3930    0.9621    0.0000 H   0  0  0

+   -4.7746   -0.7512    0.0000 H   0  0  0

+   -4.7396    1.8501    0.0000 H   0  0  0

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+   -6.6781   -1.6372    0.0000 H   0  0  0

+   -5.3530   -1.5649    0.0000 H   0  0  0

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+ 18 40  1  0

+ 18 41  1  0

+ 18 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97-32-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -0.2508   -0.1907    0.0663 C   0  0  0

+   -1.2479    0.7875    0.0325 C   0  0  0

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+    2.1312   -0.7420    0.1400 N   0  0  0

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+   -1.9312   -1.9063    0.0340 C   0  0  0

+   -2.9199   -0.9300   -0.0112 C   0  0  0

+   -3.6307    1.4513   -0.0412 N   0  3  0

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+   -4.2273   -1.2921   -0.0491 O   0  0  0

+   -3.3280    2.6311   -0.0362 O   0  0  0

+   -4.8032    1.1236   -0.0752 O   0  5  0

+    4.4596   -1.3509   -0.0560 C   0  0  0

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+   -4.2605   -2.7207   -0.0446 C   0  0  0

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+   -0.9901    1.7919    0.0000 H   0  0  0

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+   -2.1938   -2.9095    0.0000 H   0  0  0

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+  1  2  2  0

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+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42924-53-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+   -0.9518    0.4299   -0.3061 C   0  0  0

+   -1.4157   -0.8693    0.0208 C   0  0  0

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+    2.7475   -0.1975   -0.7156 C   0  0  0

+   -4.9736   -0.2177    0.4031 O   0  0  0

+    3.4472    0.1577    0.5978 C   0  0  0

+   -5.6152    1.0490    0.2421 C   0  0  0

+    4.9156    0.3789    0.3409 C   0  0  0

+    5.8332    0.7431    1.4795 C   0  0  0

+    5.3569    0.2642   -0.7773 O   0  0  0

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+ 14 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93-76-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.5919   -0.3431    0.0032 C   0  0  0

+    0.1323   -1.5273    0.0012 C   0  0  0

+    0.0728    0.8741    0.0031 C   0  0  0

+   -1.9509   -0.3764   -0.0006 O   0  0  0

+    1.5144   -1.4915   -0.0007 C   0  0  0

+   -0.6970   -3.0524    0.0018 Cl  0  0  0

+    1.4549    0.9060    0.0012 C   0  0  0

+   -2.3973    0.9810    0.0026 C   0  0  0

+    2.1757   -0.2766   -0.0007 C   0  0  0

+    2.2875    2.4293    0.0012 Cl  0  0  0

+   -3.9040    1.0143   -0.0014 C   0  0  0

+    3.9112   -0.2341   -0.0031 Cl  0  0  0

+   -4.5493    2.1913    0.0007 O   0  0  0

+   -4.5311   -0.0185   -0.0064 O   0  0  0

+   -0.4679    1.7619    0.0000 H   0  0  0

+    2.0569   -2.3781    0.0000 H   0  0  0

+   -1.3795    1.1920    0.0000 H   0  0  0

+   -2.4919    2.0161    0.0000 H   0  0  0

+   -5.0490    3.1027    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 11 13  1  0

+ 11 14  2  0

+  7  9  1  0

+  3 15  1  0

+  5 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+116374-67-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 54                          1 V2000

+   -0.9958   -0.4607   -0.2941 C   0  0  0

+   -2.3053    0.0393    0.1437 C   0  0  0

+    0.0611    0.5194   -0.5783 C   0  0  0

+   -0.7887   -1.8222   -0.4215 C   0  0  0

+   -3.3567   -0.9519    0.4256 C   0  0  0

+   -2.5258    1.3272    0.2780 N   0  0  0

+   -0.2995    1.9371   -0.3937 C   0  0  0

+    1.2908    0.1438   -0.9843 N   0  0  0

+   -1.8222   -2.7303   -0.1345 C   0  0  0

+    0.5321   -2.3269   -0.8631 N   0  3  0

+   -3.0532   -2.3229    0.2615 C   0  0  0

+   -4.5919   -0.5576    0.8351 N   0  0  0

+   -1.6093    2.2671    0.0366 C   0  0  0

+    0.6313    2.9401   -0.6367 C   0  0  0

+    2.1229    0.0479    0.2225 C   0  0  0

+    1.2411   -2.9396   -0.0850 O   0  0  0

+    0.9704   -2.0971   -2.1898 O   0  5  0

+   -5.5460   -1.0493   -0.1678 C   0  0  0

+   -4.8758   -1.2842    2.0798 C   0  0  0

+   -1.9433    3.6251    0.2103 C   0  0  0

+    0.2747    4.2735   -0.4574 C   0  0  0

+    3.5743   -0.2225   -0.1789 C   0  0  0

+   -0.9998    4.6062   -0.0372 C   0  0  0

+    4.4409   -0.3224    1.0780 C   0  0  0

+    5.8345   -0.5819    0.6926 N   0  0  0

+    6.3060    0.6146   -0.0172 C   0  0  0

+    6.6084   -0.6661    1.9384 C   0  0  0

+    1.0840   -0.8479    0.0000 H   0  0  0

+   -1.6203   -3.7230    0.0000 H   0  0  0

+   -3.8050   -3.0019    0.0000 H   0  0  0

+    1.6145    2.6960    0.0000 H   0  0  0

+    2.7635    0.8327    0.0000 H   0  0  0

+    1.7418    0.9865    0.0000 H   0  0  0

+   -6.0101   -0.1488    0.0000 H   0  0  0

+   -6.4465   -1.5134    0.0000 H   0  0  0

+   -5.0819   -1.9498    0.0000 H   0  0  0

+   -5.8194   -0.9155    0.0000 H   0  0  0

+   -5.2445   -2.2278    0.0000 H   0  0  0

+   -3.9322   -1.6529    0.0000 H   0  0  0

+   -2.9217    3.8878    0.0000 H   0  0  0

+    0.9889    4.9920    0.0000 H   0  0  0

+    2.9336   -1.0072    0.0000 H   0  0  0

+    3.9554   -1.1611    0.0000 H   0  0  0

+   -1.2747    5.5812    0.0000 H   0  0  0

+    5.0815    0.4624    0.0000 H   0  0  0

+    4.0598    0.6162    0.0000 H   0  0  0

+    7.2485    0.2432    0.0000 H   0  0  0

+    6.6774    1.5571    0.0000 H   0  0  0

+    5.3635    0.9860    0.0000 H   0  0  0

+    6.4988   -1.6732    0.0000 H   0  0  0

+    7.6155   -0.7757    0.0000 H   0  0  0

+    6.7180    0.3410    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+ 10 16  2  0

+ 10 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+ 14 21  2  0

+ 15 22  1  0

+ 20 23  2  0

+ 22 24  1  0

+ 24 25  1  0

+ 25 26  1  0

+ 25 27  1  0

+  7 13  2  0

+  9 11  1  0

+ 21 23  1  0

+  8 28  1  0

+  9 29  1  0

+ 11 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+ 21 41  1  0

+ 22 42  1  0

+ 22 43  1  0

+ 23 44  1  0

+ 24 45  1  0

+ 24 46  1  0

+ 26 47  1  0

+ 26 48  1  0

+ 26 49  1  0

+ 27 50  1  0

+ 27 51  1  0

+ 27 52  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102-71-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+   -0.0004    0.0043    0.4956 N   0  0  0

+   -1.2962    0.4218    1.0474 C   0  0  0

+    1.0085    0.9164    1.0509 C   0  0  0

+    0.2845   -1.3268    1.0479 C   0  0  0

+   -2.2248    0.8421   -0.0936 C   0  0  0

+    1.8441    1.5062   -0.0870 C   0  0  0

+    0.3800   -2.3423   -0.0925 C   0  0  0

+   -2.5873   -0.3077   -0.8608 O   0  0  0

+    1.0305    2.3803   -0.8719 O   0  0  0

+    1.5600   -2.0894   -0.8579 O   0  0  0

+   -2.0105   -0.1325    0.0000 H   0  0  0

+   -1.1395   -0.4687    0.0000 H   0  0  0

+    0.8902    1.8128    0.0000 H   0  0  0

+    0.1598    1.2284    0.0000 H   0  0  0

+    1.1205   -1.6712    0.0000 H   0  0  0

+    0.9787   -0.7475    0.0000 H   0  0  0

+   -1.8851    1.6801    0.0000 H   0  0  0

+   -3.0756    1.1481    0.0000 H   0  0  0

+    2.3982    0.7917    0.0000 H   0  0  0

+    2.5330    2.0919    0.0000 H   0  0  0

+   -0.5162   -2.4621    0.0000 H   0  0  0

+    0.5348   -3.2331    0.0000 H   0  0  0

+   -2.8592   -1.1701    0.0000 H   0  0  0

+    0.4145    3.0422    0.0000 H   0  0  0

+    2.4441   -1.8999    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  7 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14088-71-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -0.0027   -1.4615   -0.1771 C   0  0  0

+   -1.2206   -0.5765   -0.1089 C   0  0  0

+    1.2401   -0.6111   -0.1194 C   0  0  0

+   -0.0114   -2.4329    1.0049 C   0  0  0

+   -0.0183   -2.1998   -1.4005 O   0  0  0

+   -2.1513   -0.6022   -1.1305 C   0  0  0

+   -1.4093    0.2567    0.9782 C   0  0  0

+    1.7697   -0.2439    1.1033 C   0  0  0

+    1.8533   -0.2033   -1.2896 C   0  0  0

+   -0.9985   -3.5678    0.7251 C   0  0  0

+    0.5034   -3.7987    0.5463 C   0  0  0

+   -3.2688    0.2091   -1.0683 C   0  0  0

+   -2.5261    1.0682    1.0415 C   0  0  0

+    2.9100    0.5358    1.1569 C   0  0  0

+    2.9933    0.5761   -1.2373 C   0  0  0

+   -3.4556    1.0467    0.0166 C   0  0  0

+    3.5210    0.9485   -0.0135 C   0  0  0

+   -4.8588    2.0658    0.0954 Cl  0  0  0

+    4.9529    1.9276    0.0529 Cl  0  0  0

+    1.0080   -2.2519    0.0000 H   0  0  0

+   -0.0402   -3.2349    0.0000 H   0  0  0

+   -2.4574   -1.5913    0.0000 H   0  0  0

+   -0.5447    0.8263    0.0000 H   0  0  0

+    1.1825    0.6089    0.0000 H   0  0  0

+    2.4322   -1.0617    0.0000 H   0  0  0

+   -1.8928   -3.0461    0.0000 H   0  0  0

+   -1.3441   -4.5438    0.0000 H   0  0  0

+    0.5225   -4.8339    0.0000 H   0  0  0

+    1.5202   -3.6037    0.0000 H   0  0  0

+   -4.1342   -0.3593    0.0000 H   0  0  0

+   -2.2175    2.0565    0.0000 H   0  0  0

+    2.3280    1.3921    0.0000 H   0  0  0

+    3.5840   -0.2742    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6 12  1  0

+  7 13  2  0

+  8 14  1  0

+  9 15  2  0

+ 12 16  2  0

+ 14 17  2  0

+ 16 18  1  0

+ 17 19  1  0

+ 10 11  1  0

+ 13 16  1  0

+ 15 17  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 14 32  1  0

+ 15 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20265-96-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -3.0907    1.7886    0.0134 C   0  0  0

+   -3.8906    0.7923    0.5588 C   0  0  0

+   -1.8678    1.4594   -0.5565 C   0  0  0

+   -3.5184    3.1188    0.0330 N   0  0  0

+   -3.4681   -0.5220    0.5329 C   0  0  0

+   -1.4501    0.1429   -0.5796 C   0  0  0

+   -2.2489   -0.8473   -0.0357 C   0  0  0

+   -1.7205   -2.5006   -0.0660 Cl  0  0  0

+    8.5371    0.3148    0.0755 Cl  0  0  0

+   -4.8708    0.9734    0.0000 H   0  0  0

+   -1.1787    2.1797    0.0000 H   0  0  0

+   -2.8491    3.8575    0.0000 H   0  0  0

+   -4.4928    3.3290    0.0000 H   0  0  0

+   -4.1550   -1.2444    0.0000 H   0  0  0

+   -0.4704   -0.0412    0.0000 H   0  0  0

+    9.5339    0.3148    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  6  7  2  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17135-78-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.3804    0.4123   -0.0061 C   0  0  0

+   -0.1595   -1.0376   -0.0025 C   0  0  0

+    0.7049    1.2872   -0.0058 C   0  0  0

+   -1.7058    0.8963   -0.0039 C   0  0  0

+    1.1370   -1.5493    0.0012 C   0  0  0

+   -1.2806   -1.8949   -0.0024 C   0  0  0

+    2.0009    0.7753   -0.0021 C   0  0  0

+   -2.7409    0.0159    0.0015 C   0  0  0

+    2.2218   -0.6746    0.0014 C   0  0  0

+   -2.5300   -1.3641   -0.0056 C   0  0  0

+    3.1227    1.6322   -0.0013 C   0  0  0

+   -4.3674    0.6229    0.0047 Cl  0  0  0

+    3.5479   -1.1586    0.0046 C   0  0  0

+    4.3716    1.1004    0.0028 C   0  0  0

+    4.5818   -0.2791    0.0044 C   0  0  0

+    0.5473    2.3218    0.0000 H   0  0  0

+   -1.8904    1.9265    0.0000 H   0  0  0

+    1.2948   -2.5839    0.0000 H   0  0  0

+   -1.1495   -2.9332    0.0000 H   0  0  0

+   -3.3566   -2.0061    0.0000 H   0  0  0

+    2.9923    2.6706    0.0000 H   0  0  0

+    3.7327   -2.1887    0.0000 H   0  0  0

+    5.1986    1.7418    0.0000 H   0  0  0

+    5.5623   -0.6452    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 11 14  2  0

+ 13 15  2  0

+  7  9  1  0

+  8 10  2  0

+ 14 15  1  0

+  3 16  1  0

+  4 17  1  0

+  5 18  1  0

+  6 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1503-91-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    1.9934   -0.4164    0.2713 N   0  0  0

+    0.6047   -0.2677    0.1782 C   0  0  0

+    2.8080    0.4507   -0.3620 C   0  0  0

+    2.5424   -1.4743    1.0358 O   0  0  0

+   -0.1556   -1.2290   -0.4752 C   0  0  0

+   -0.0158    0.8382    0.7436 C   0  0  0

+    3.1395    0.2469   -1.8179 C   0  0  0

+    3.2742    1.3949    0.2397 O   0  0  0

+   -1.5254   -1.0799   -0.5657 C   0  0  0

+   -1.3863    0.9826    0.6502 C   0  0  0

+   -2.1408    0.0264   -0.0061 C   0  0  0

+   -3.8630    0.2111   -0.1223 Cl  0  0  0

+    2.9728   -2.3036    0.0000 H   0  0  0

+    0.2053   -2.0908    0.0000 H   0  0  0

+    0.4980    1.6186    0.0000 H   0  0  0

+    2.6502   -0.5491    0.0000 H   0  0  0

+    3.9355   -0.2424    0.0000 H   0  0  0

+    3.6288    1.0429    0.0000 H   0  0  0

+   -2.0420   -1.8585    0.0000 H   0  0  0

+   -1.7492    1.8436    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  5  9  2  0

+  6 10  1  0

+  9 11  1  0

+ 11 12  1  0

+ 10 11  2  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+126572-80-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.0047    0.2800   -0.0099 C   0  0  0

+   -1.2988   -0.0831    0.0430 C   0  0  0

+    0.3564    1.7018   -0.1472 C   0  0  0

+    1.0758   -0.7669    0.0776 C   0  0  0

+   -1.6655   -1.5141    0.0316 C   0  0  0

+   -2.5380    1.1298    0.1247 Cl  0  0  0

+    1.6531    2.0656   -0.2002 O   0  0  0

+   -0.5144    2.5461   -0.2126 O   0  0  0

+    2.0792   -0.7214   -1.4197 Cl  0  0  0

+    2.1189   -0.4357    1.5104 Cl  0  0  0

+   -1.9761   -2.1207   -1.1308 O   0  0  0

+   -1.6871   -2.1437    1.0697 O   0  0  0

+    0.7187   -1.7096    0.0000 H   0  0  0

+    2.6237    2.3379    0.0000 H   0  0  0

+   -2.4355   -3.0180    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  4 13  1  0

+  7 14  1  0

+ 11 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87-61-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.0001   -0.1448   -0.0019 C   0  0  0

+   -1.1985    0.5479   -0.0008 C   0  0  0

+    1.1987    0.5479   -0.0008 C   0  0  0

+   -0.0003   -1.8808    0.0026 Cl  0  0  0

+   -1.1971    1.9315    0.0014 C   0  0  0

+   -2.7026   -0.3190   -0.0015 Cl  0  0  0

+    1.1977    1.9310    0.0014 C   0  0  0

+    2.7026   -0.3193   -0.0016 Cl  0  0  0

+    0.0001    2.6219    0.0025 C   0  0  0

+   -2.0958    2.4513    0.0000 H   0  0  0

+    2.0965    2.4505    0.0000 H   0  0  0

+    0.0002    3.6600    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  7  9  1  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-34-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 59 60                          1 V2000

+   -2.7572    1.3738   -0.7443 C   0  0  0

+   -3.3651    2.7538   -0.7563 C   0  0  0

+   -1.5735    1.3892    0.1898 C   0  0  0

+   -3.7760    0.3805   -0.2479 C   0  0  0

+   -3.1469    3.6169    0.3029 C   0  0  0

+   -4.1374    3.1431   -1.8343 C   0  0  0

+   -1.4799    2.3572    1.1746 C   0  0  0

+   -0.5881    0.4312    0.0485 C   0  0  0

+   -3.6586   -0.9179   -0.5676 O   0  0  0

+   -4.6984    0.7528    0.4380 O   0  0  0

+   -2.4296    3.2844    1.3905 O   0  0  0

+   -3.7057    4.8961    0.2533 C   0  0  0

+   -4.6932    4.4078   -1.8716 C   0  0  0

+   -0.3601    2.3609    2.0086 C   0  0  0

+    0.5128    0.4366    0.8845 C   0  0  0

+   -4.8477   -1.7306   -0.7516 C   0  0  0

+   -4.4709    5.2839   -0.8247 C   0  0  0

+    0.6245    1.4078    1.8622 C   0  0  0

+   -4.4427   -3.1967   -0.9174 C   0  0  0

+   -3.6404   -3.6169    0.2392 N   0  3  0

+   -3.2749   -5.0322    0.0933 C   0  0  0

+   -2.4209   -2.8011    0.3116 C   0  0  0

+   -4.4232   -3.4377    1.4692 C   0  0  0

+   -4.5336   -5.8966    0.1894 C   0  0  0

+   -2.6097   -5.2495   -1.2673 C   0  0  0

+   -1.3899   -3.5027    1.1980 C   0  0  0

+   -1.8451   -2.6188   -1.0942 C   0  0  0

+   12.2236   -0.1066   -0.2458 Br  0  0  0

+   -2.4173    0.5536    0.0000 H   0  0  0

+   -4.7816    2.5321    0.0000 H   0  0  0

+   -0.9201   -0.3923    0.0000 H   0  0  0

+   -3.0602    5.5057    0.0000 H   0  0  0

+   -5.5780    4.3344    0.0000 H   0  0  0

+   -0.0284    3.1844    0.0000 H   0  0  0

+    1.1053   -0.2247    0.0000 H   0  0  0

+   -5.2652   -0.9470    0.0000 H   0  0  0

+   -5.6724   -2.0595    0.0000 H   0  0  0

+   -4.8383    6.0922    0.0000 H   0  0  0

+    1.4605    1.7069    0.0000 H   0  0  0

+   -5.3304   -3.2134    0.0000 H   0  0  0

+   -4.6467   -4.0608    0.0000 H   0  0  0

+   -3.1484   -5.9110    0.0000 H   0  0  0

+   -2.8056   -2.0009    0.0000 H   0  0  0

+   -4.2251   -2.5722    0.0000 H   0  0  0

+   -5.2887   -3.2396    0.0000 H   0  0  0

+   -4.6213   -4.3032    0.0000 H   0  0  0

+   -5.0362   -5.1647    0.0000 H   0  0  0

+   -5.2655   -6.3992    0.0000 H   0  0  0

+   -4.0310   -6.6285    0.0000 H   0  0  0

+   -2.8854   -6.0935    0.0000 H   0  0  0

+   -1.7657   -5.5252    0.0000 H   0  0  0

+   -2.3340   -4.4055    0.0000 H   0  0  0

+   -1.8894   -4.2367    0.0000 H   0  0  0

+   -0.6559   -4.0022    0.0000 H   0  0  0

+   -0.8904   -2.7687    0.0000 H   0  0  0

+   -1.5771   -3.4652    0.0000 H   0  0  0

+   -0.9987   -2.3508    0.0000 H   0  0  0

+   -2.1131   -1.7724    0.0000 H   0  0  0

+   13.1115   -0.1066    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  7 14  2  0

+  8 15  1  0

+  9 16  1  0

+ 12 17  2  0

+ 14 18  1  0

+ 16 19  1  0

+ 19 20  1  0

+ 20 21  1  0

+ 20 22  1  0

+ 20 23  1  0

+ 21 24  1  0

+ 21 25  1  0

+ 22 26  1  0

+ 22 27  1  0

+  7 11  1  0

+ 13 17  1  0

+ 15 18  2  0

+  1 29  1  0

+  6 30  1  0

+  8 31  1  0

+ 12 32  1  0

+ 13 33  1  0

+ 14 34  1  0

+ 15 35  1  0

+ 16 36  1  0

+ 16 37  1  0

+ 17 38  1  0

+ 18 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 21 42  1  0

+ 22 43  1  0

+ 23 44  1  0

+ 23 45  1  0

+ 23 46  1  0

+ 24 47  1  0

+ 24 48  1  0

+ 24 49  1  0

+ 25 50  1  0

+ 25 51  1  0

+ 25 52  1  0

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+ 26 54  1  0

+ 26 55  1  0

+ 27 56  1  0

+ 27 57  1  0

+ 27 58  1  0

+ 28 59  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+83463-62-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+    0.6118   -0.0407    0.5895 C   0  0  0

+    1.2698   -1.2775    0.1377 C   0  0  0

+    1.4835    1.3854   -0.0868 Cl  0  0  0

+   -1.2527   -0.0251   -0.0338 Br  0  0  0

+    1.7777   -2.2320   -0.2109 N   0  0  0

+    0.0525    0.9666    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  3  0

+  1  6  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+954-46-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.3784   -1.1853    0.0277 C   0  0  0

+   -1.5661   -0.3273   -0.0034 C   0  0  0

+    0.8979   -0.5781    0.0208 C   0  0  0

+   -0.4824   -2.5769    0.0694 C   0  0  0

+   -1.3900    1.0746   -0.0391 C   0  0  0

+   -2.8555   -0.8627    0.0019 C   0  0  0

+    1.0072    0.8312   -0.0150 C   0  0  0

+    2.0410   -1.3896    0.0504 C   0  0  0

+    0.6502   -3.3397    0.0974 C   0  0  0

+   -0.0857    1.6207   -0.0446 C   0  0  0

+   -2.5195    1.9048   -0.0690 C   0  0  0

+   -3.9355   -0.0272   -0.0274 C   0  0  0

+    2.3503    1.4534   -0.0219 N   0  3  0

+    1.9071   -2.7466    0.0852 C   0  0  0

+   -3.7664    1.3520   -0.0634 C   0  0  0

+    2.6009    2.3698    0.7404 O   0  0  0

+    3.2049    1.0490   -0.7897 O   0  5  0

+   -1.4240   -3.0338    0.0000 H   0  0  0

+   -2.9937   -1.9001    0.0000 H   0  0  0

+    2.9934   -0.9556    0.0000 H   0  0  0

+    0.5708   -4.3833    0.0000 H   0  0  0

+    0.0339    2.6605    0.0000 H   0  0  0

+   -2.4064    2.9453    0.0000 H   0  0  0

+   -4.9014   -0.4301    0.0000 H   0  0  0

+    2.7625   -3.3497    0.0000 H   0  0  0

+   -4.6073    1.9751    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+ 11 15  2  0

+ 13 16  2  0

+ 13 17  1  0

+  7 10  1  0

+  9 14  1  0

+ 12 15  1  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26306-61-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.3752   -0.0056    0.8648 C   0  0  0

+   -0.8047   -0.0108    1.5401 O   0  0  0

+    0.9774    1.1984    0.5270 C   0  0  0

+    0.9826   -1.2045    0.5171 C   0  0  0

+   -1.7924   -0.0059    0.6055 C   0  0  0

+    2.1777    1.2012   -0.1594 C   0  0  0

+    0.2239    2.6997    0.9654 Cl  0  0  0

+    2.1826   -1.1966   -0.1691 C   0  0  0

+    0.2361   -2.7125    0.9441 Cl  0  0  0

+   -3.1217   -0.0096    1.0018 C   0  0  0

+   -1.4700    0.0085   -0.7440 C   0  0  0

+    2.7784    0.0051   -0.5094 C   0  0  0

+   -4.1255   -0.0042    0.0531 C   0  0  0

+   -2.4724    0.0140   -1.6935 C   0  0  0

+    4.2852    0.0119   -1.3717 Cl  0  0  0

+   -3.8036    0.0049   -1.2976 C   0  0  0

+   -4.8200    0.0100   -2.2593 N   0  0  0

+    2.6748    2.0092    0.0000 H   0  0  0

+    2.6853   -2.0010    0.0000 H   0  0  0

+   -3.1229   -0.9582    0.0000 H   0  0  0

+   -0.5216    0.0271    0.0000 H   0  0  0

+   -5.0740   -0.0151    0.0000 H   0  0  0

+   -2.4730    0.9626    0.0000 H   0  0  0

+   -5.2902    0.8339    0.0000 H   0  0  0

+   -5.2984   -0.8091    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 12 15  1  0

+ 13 16  2  0

+ 16 17  1  0

+  8 12  1  0

+ 14 16  1  0

+  6 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 17 24  1  0

+ 17 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-46-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -1.3828    0.0001    0.0032 C   0  0  0

+   -0.6909   -1.1983    0.0025 C   0  0  0

+   -0.6911    1.1981    0.0025 C   0  0  0

+   -3.1188    0.0001   -0.0022 Cl  0  0  0

+    0.6909   -1.1983    0.0010 C   0  0  0

+    0.6911    1.1981    0.0011 C   0  0  0

+    1.3828    0.0001    0.0004 C   0  0  0

+    3.1188    0.0001   -0.0015 Cl  0  0  0

+   -1.2097   -2.0970    0.0000 H   0  0  0

+   -1.2099    2.0968    0.0000 H   0  0  0

+    1.2097   -2.0970    0.0000 H   0  0  0

+    1.2099    2.0968    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  6  7  2  0

+  2  9  1  0

+  3 10  1  0

+  5 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+159092-67-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.5115   -0.6057    0.0239 C   0  0  0

+   -0.7604    0.1226   -0.0056 C   0  0  0

+    1.7168    0.1322    0.0021 C   0  0  0

+    0.5547   -2.0001    0.0668 C   0  0  0

+   -0.7328    1.5345   -0.0547 C   0  0  0

+   -1.9861   -0.5454    0.0132 C   0  0  0

+    2.9387   -0.5541    0.0300 C   0  0  0

+    1.6769    1.5452   -0.0468 C   0  0  0

+    1.7616   -2.6396    0.0928 C   0  0  0

+    0.5071    2.2148   -0.0748 C   0  0  0

+   -1.9435    2.2412   -0.0833 C   0  0  0

+   -3.1482    0.1716   -0.0160 C   0  0  0

+    2.9487   -1.9176    0.0775 C   0  0  0

+    4.2136    0.1978    0.0074 N   0  3  0

+   -3.1254    1.5604   -0.0635 C   0  0  0

+   -4.4468   -0.5386    0.0035 N   0  3  0

+    5.1049   -0.1374   -0.7520 O   0  0  0

+    4.3713    1.1516    0.7483 O   0  5  0

+   -5.4873    0.0940   -0.0223 O   0  0  0

+   -4.4748   -1.7556    0.0454 O   0  5  0

+   -0.3315   -2.5523    0.0000 H   0  0  0

+   -2.0142   -1.5892    0.0000 H   0  0  0

+    2.5727    2.0817    0.0000 H   0  0  0

+    1.7925   -3.6833    0.0000 H   0  0  0

+    0.5165    3.2589    0.0000 H   0  0  0

+   -1.9405    3.2854    0.0000 H   0  0  0

+    3.8608   -2.4260    0.0000 H   0  0  0

+   -4.0251    2.0903    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  7 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 14 17  2  0

+ 14 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  8 10  2  0

+  9 13  2  0

+ 12 15  1  0

+  4 21  1  0

+  6 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+394-68-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.5500    0.9682   -0.0026 C   0  0  0

+   -0.0425   -0.3546   -0.0016 C   0  0  0

+    0.3412    2.0537   -0.0017 C   0  0  0

+   -1.9436    1.1643    0.0013 C   0  0  0

+    1.3518   -0.5524    0.0003 C   0  0  0

+   -0.8862   -1.3908   -0.0021 N   0  0  0

+    1.6831    1.8238    0.0002 C   0  0  0

+   -2.7496    0.0613    0.0060 C   0  0  0

+    2.1865    0.5248    0.0013 C   0  0  0

+    1.8596   -1.8044    0.0017 F   0  0  0

+   -2.1850   -1.2121   -0.0035 C   0  0  0

+   -0.0202    3.0232    0.0000 H   0  0  0

+   -2.3465    2.1173    0.0000 H   0  0  0

+    2.3380    2.6248    0.0000 H   0  0  0

+   -3.7783    0.1717    0.0000 H   0  0  0

+    3.2103    0.3755    0.0000 H   0  0  0

+   -2.8071   -2.0388    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  7  9  1  0

+  8 11  2  0

+  3 12  1  0

+  4 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4465-94-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 51                          1 V2000

+   -3.8933    1.0876    0.0834 N   0  0  0

+   -4.6853   -0.3451    0.4743 P   0  0  0

+   -3.1881    0.8482   -1.1828 C   0  0  0

+   -4.9362    2.0838   -0.1960 C   0  0  0

+   -3.5493   -1.5408    0.8091 N   0  0  0

+   -5.6136   -0.1093    1.7684 O   0  0  0

+   -5.5275   -0.7702   -0.6661 O   0  0  0

+   -1.6780    0.8759   -0.9386 C   0  0  0

+   -4.8916    3.1812    0.8692 C   0  0  0

+   -4.3024   -2.7577    1.1407 C   0  0  0

+   -0.8124    0.5821   -2.4927 Cl  0  0  0

+   -6.1715    4.4039    0.5262 Cl  0  0  0

+   -3.9388   -3.8676    0.1524 C   0  0  0

+   -4.7233   -5.1350    0.4978 C   0  0  0

+   -4.3837   -6.1717   -0.4252 O   0  0  0

+   12.2633    1.2607    0.8780 C   0  0  0

+   11.4956    0.0682    0.3040 C   0  0  0

+   13.5012    1.5309    0.0204 C   0  0  0

+   12.3974   -1.1678    0.3064 C   0  0  0

+   10.3071   -0.1912    1.1274 N   0  0  0

+   14.4030    0.2949    0.0228 C   0  0  0

+   13.6353   -0.8976   -0.5512 C   0  0  0

+   -3.9019    0.0596    0.0000 H   0  0  0

+   -2.7478   -0.1201    0.0000 H   0  0  0

+   -5.9581    2.3790    0.0000 H   0  0  0

+   -5.4665    1.1617    0.0000 H   0  0  0

+   -2.4912   -1.4316    0.0000 H   0  0  0

+   -6.6445    0.1526    0.0000 H   0  0  0

+   -0.9642    1.6645    0.0000 H   0  0  0

+   -2.1183    1.8442    0.0000 H   0  0  0

+   -3.8697    2.8860    0.0000 H   0  0  0

+   -4.3613    4.1033    0.0000 H   0  0  0

+   -5.0529   -2.0040    0.0000 H   0  0  0

+   -5.2093   -3.3136    0.0000 H   0  0  0

+   -3.1883   -4.6214    0.0000 H   0  0  0

+   -3.0319   -3.3117    0.0000 H   0  0  0

+   -5.4738   -4.3812    0.0000 H   0  0  0

+   -5.6302   -5.6909    0.0000 H   0  0  0

+   -4.0526   -7.1825    0.0000 H   0  0  0

+   12.3137    2.3232    0.0000 H   0  0  0

+   11.2502    1.5849    0.0000 H   0  0  0

+   10.8890    0.9420    0.0000 H   0  0  0

+   14.4388    2.0332    0.0000 H   0  0  0

+   13.1331    2.5289    0.0000 H   0  0  0

+   11.4598   -1.6701    0.0000 H   0  0  0

+   12.7655   -2.1658    0.0000 H   0  0  0

+    9.5911    0.5954    0.0000 H   0  0  0

+    9.9839   -1.2046    0.0000 H   0  0  0

+   15.2201   -0.3861    0.0000 H   0  0  0

+   15.1790    1.0224    0.0000 H   0  0  0

+   13.5849   -1.9601    0.0000 H   0  0  0

+   14.6484   -1.2218    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 20 48  1  0

+ 21 49  1  0

+ 21 50  1  0

+ 22 51  1  0

+ 22 52  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1135-24-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+    0.0796    0.0380   -0.0041 C   0  0  0

+   -0.9923   -0.8624   -0.0027 C   0  0  0

+   -0.1688    1.4155   -0.0028 C   0  0  0

+    1.4616   -0.4617   -0.0009 C   0  0  0

+   -2.2886   -0.3868    0.0000 C   0  0  0

+   -1.4651    1.8810   -0.0001 C   0  0  0

+    2.4946    0.4090   -0.0023 C   0  0  0

+   -2.5278    0.9871    0.0013 C   0  0  0

+   -3.3325   -1.2584    0.0009 O   0  0  0

+    3.8280   -0.0731    0.0009 C   0  0  0

+   -3.8038    1.4522    0.0040 O   0  0  0

+   -2.7727   -2.5732   -0.0014 C   0  0  0

+    4.8597    0.7965   -0.0005 O   0  0  0

+    4.0418   -1.2706    0.0048 O   0  0  0

+   -0.8130   -1.8854    0.0000 H   0  0  0

+    0.6240    2.0863    0.0000 H   0  0  0

+    1.6442   -1.4841    0.0000 H   0  0  0

+   -1.6483    2.9033    0.0000 H   0  0  0

+    2.3120    1.4314    0.0000 H   0  0  0

+   -4.7795    1.8079    0.0000 H   0  0  0

+   -3.7282   -2.9800    0.0000 H   0  0  0

+   -2.3659   -3.5287    0.0000 H   0  0  0

+   -1.8172   -2.1664    0.0000 H   0  0  0

+    5.6538    1.4658    0.0000 H   0  0  0

+  1  2  2  0

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+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+41122-70-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+   -0.9546    0.4196    0.1761 C   0  0  0

+   -2.4043    0.1309    0.0587 C   0  0  0

+   -0.2685    0.0934    1.3452 C   0  0  0

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+   -5.1151   -0.4092   -0.1615 C   0  0  0

+    3.2258    1.2509    0.5140 C   0  0  0

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+    4.0275    0.0476    0.0137 C   0  0  0

+   -7.6256   -0.9095   -0.3654 N   0  0  0

+    5.5233    0.3454    0.1347 C   0  0  0

+    6.3250   -0.8579   -0.3656 C   0  0  0

+    7.8208   -0.5601   -0.2445 C   0  0  0

+    8.6225   -1.7634   -0.7449 C   0  0  0

+   -0.3948   -0.9281    0.0000 H   0  0  0

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+    9.4791   -1.1927    0.0000 H   0  0  0

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+ 20 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+600-25-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.1600    0.3238   -0.3961 C   0  0  0

+   -1.2435    0.1205   -0.0287 N   0  3  0

+    0.7681    1.4096    0.4939 C   0  0  0

+    1.0694   -1.2168   -0.1711 Cl  0  0  0

+   -2.1164    0.7710   -0.5750 O   0  0  0

+   -1.5375   -0.6991    0.8230 O   0  5  0

+    2.2339    1.6219    0.1102 C   0  0  0

+   -0.4055    1.1467    0.0000 H   0  0  0

+    0.8422    2.4053    0.0000 H   0  0  0

+   -0.1880    1.6974    0.0000 H   0  0  0

+    2.3770    0.6337    0.0000 H   0  0  0

+    3.2221    1.7650    0.0000 H   0  0  0

+    2.0908    2.6101    0.0000 H   0  0  0

+  1  2  1  0

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+  3  9  1  0

+  3 10  1  0

+  7 11  1  0

+  7 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26761-45-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 40                          1 V2000

+    5.6252    0.0460   -0.0783 C   0  0  0

+    4.3709   -0.8182    0.0659 C   0  0  0

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+   -1.3865   -1.6101    0.0000 H   0  0  0

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+   -5.2424   -1.5640    0.0000 H   0  0  0

+   -6.4783    1.5333    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 36  1  0

+ 13 37  1  0

+ 14 38  1  0

+ 15 39  1  0

+ 15 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100325-51-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+    0.5688    0.4255   -0.1163 C   0  0  0

+    1.0368   -0.8895    0.0467 C   0  0  0

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+  1  2  2  0

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+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 22 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+126222-34-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 94 97                          1 V2000

+    3.9100   -0.0279   -0.3742 C   0  0  1

+    2.7491   -0.5055    0.3811 N   0  0  0

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+ 43 93  1  0

+ 44 94  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+114-83-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.7833    0.3260   -0.2746 C   0  0  0

+   -0.5051    0.7599   -0.5948 N   0  0  0

+    1.8179    1.2451   -0.1563 C   0  0  0

+    1.0317   -1.0252   -0.0679 C   0  0  0

+   -1.5476   -0.1685   -0.7137 N   0  0  0

+    3.0909    0.8126    0.1605 C   0  0  0

+    2.3066   -1.4507    0.2485 C   0  0  0

+   -2.6280   -0.0747    0.0864 C   0  0  0

+    3.3358   -0.5335    0.3598 C   0  0  0

+   -3.7494   -1.0733   -0.0415 C   0  0  0

+   -2.6979    0.8135    0.9094 O   0  0  0

+   -0.7103    1.7653    0.0000 H   0  0  0

+    1.6146    2.2509    0.0000 H   0  0  0

+    0.2570   -1.6981    0.0000 H   0  0  0

+   -1.2243   -1.1424    0.0000 H   0  0  0

+    3.8680    1.4827    0.0000 H   0  0  0

+    2.5134   -2.4558    0.0000 H   0  0  0

+    4.3061   -0.8674    0.0000 H   0  0  0

+   -4.4318   -0.3070    0.0000 H   0  0  0

+   -4.5157   -1.7557    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-39-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -1.4583   -0.2140    0.0798 C   0  0  0

+   -2.6509    0.5926    0.0103 C   0  0  0

+   -0.1199    0.3958    0.1286 C   0  0  0

+   -1.6277   -1.5830    0.1043 C   0  0  0

+   -3.8299   -0.0584   -0.0305 C   0  0  0

+    0.9753   -0.3871    0.1932 N   0  0  0

+   -0.0020    1.6064    0.1107 O   0  0  0

+   -3.3476   -1.7716    0.0355 S   0  0  0

+   -5.1942    0.5117   -0.1032 N   0  3  0

+    2.2492    0.1839    0.1067 C   0  0  0

+   -6.1621   -0.2270   -0.1328 O   0  0  0

+   -5.3487    1.7195   -0.1334 O   0  5  0

+    3.3730   -0.6292    0.0377 C   0  0  0

+    2.3924    1.5651    0.0838 C   0  0  0

+    4.6302   -0.0617   -0.0482 C   0  0  0

+    3.6516    2.1266   -0.0021 C   0  0  0

+    4.7692    1.3155   -0.0659 C   0  0  0

+    6.0359   -1.0766   -0.1345 Cl  0  0  0

+   -2.6041    1.6297    0.0000 H   0  0  0

+   -0.8987   -2.3222    0.0000 H   0  0  0

+    0.8721   -1.4201    0.0000 H   0  0  0

+    3.2682   -1.6620    0.0000 H   0  0  0

+    1.5519    2.1745    0.0000 H   0  0  0

+    3.7596    3.1591    0.0000 H   0  0  0

+    5.7166    1.7400    0.0000 H   0  0  0

+  1  2  1  0

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+  4 20  1  0

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+ 13 22  1  0

+ 14 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+534-22-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.7156   -0.0566    0.0018 C   0  0  0

+    0.0512   -1.1618    0.0009 C   0  0  0

+    0.0893    1.0184    0.0007 O   0  0  0

+   -2.2224   -0.0294   -0.0018 C   0  0  0

+    1.3965   -0.7269   -0.0009 C   0  0  0

+    1.3713    0.6180   -0.0010 C   0  0  0

+   -0.2717   -2.1176    0.0000 H   0  0  0

+   -2.2042    0.9793    0.0000 H   0  0  0

+   -3.2311   -0.0112    0.0000 H   0  0  0

+   -2.2406   -1.0381    0.0000 H   0  0  0

+    2.2178   -1.3128    0.0000 H   0  0  0

+    2.1784    1.2232    0.0000 H   0  0  0

+  1  2  2  0

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+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+550-60-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.6388    0.2206   -0.0018 C   0  0  0

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+   -1.0687   -2.1792    0.0002 C   0  0  0

+   -2.9353   -0.5935   -0.0024 C   0  0  0

+    1.1790   -1.3381    0.0012 C   0  0  0

+    1.7127    1.0715   -0.0012 N   0  3  0

+   -2.4706    1.7587    0.0066 C   0  0  0

+    0.2729   -2.4029    0.0015 C   0  0  0

+   -3.3719    0.6955   -0.0035 C   0  0  0

+    2.5137   -1.5934    0.0026 O   0  0  0

+    2.1121    1.5321    1.0533 O   0  0  0

+    2.1136    1.5292   -1.0564 O   0  5  0

+   -0.4630    2.3456    0.0000 H   0  0  0

+   -1.7350   -2.9847    0.0000 H   0  0  0

+   -3.6229   -1.3809    0.0000 H   0  0  0

+   -2.8316    2.7397    0.0000 H   0  0  0

+    0.6316   -3.3848    0.0000 H   0  0  0

+   -4.3988    0.8912    0.0000 H   0  0  0

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+  1  2  1  0

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+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13171-21-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 36                          1 V2000

+   -2.2549   -0.1299    0.0309 P   0  0  0

+   -0.8138   -0.5974    0.5755 O   0  0  0

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+   -3.1203   -1.4248   -0.3770 O   0  0  0

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+    2.2816   -1.3943    1.4943 C   0  0  0

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+    1.4145   -2.6547    1.5183 C   0  0  0

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+   -2.4546   -0.4772    0.0000 H   0  0  0

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+  1  2  1  0

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+ 17 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101901-06-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

+   -0.7379    0.3524    0.2358 C   0  0  0

+   -2.2353    0.4558    0.3945 C   0  0  0

+    0.0342    1.4313   -0.0423 C   0  0  0

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+   -2.9202    0.0041   -0.8969 C   0  0  0

+   -2.6903   -0.4298    1.5562 C   0  0  0

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+ 21 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+ 22 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90301-59-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    1.8848   -0.7767    0.2804 C   0  0  2

+    0.4593   -1.1146    0.2916 N   0  0  0

+    2.0645    0.5685    0.7744 O   0  0  0

+    2.3921   -0.7327   -1.1780 C   0  0  0

+    0.0777   -2.3982    0.1617 C   0  0  0

+   -0.4712   -0.1224    0.4395 C   0  0  0

+    3.3388    0.9997    0.2490 C   0  0  1

+    3.3707    0.4628   -1.1992 C   0  0  1

+   -1.2250   -2.7368    0.1686 N   0  0  0

+    0.9215   -3.2645    0.0360 O   0  0  0

+   -1.7850   -0.4339    0.4498 C   0  0  0

+    3.3905    2.5287    0.2273 C   0  0  0

+    4.6862   -0.0038   -1.5053 O   0  0  0

+   -2.1730   -1.7879    0.3067 C   0  0  0

+   -2.8244    0.6452    0.6115 C   0  0  0

+    3.2708    3.0282    1.5608 O   0  0  0

+   -3.3518   -2.0934    0.3130 O   0  0  0

+   -3.2266    1.1763   -0.7659 C   0  0  0

+   -4.4702    2.4674   -0.5725 Cl  0  0  0

+    2.0455   -1.7749    0.0000 H   0  0  0

+    2.2201   -1.7290    0.0000 H   0  0  0

+    3.3118   -1.1528    0.0000 H   0  0  0

+   -0.1798    0.8458    0.0000 H   0  0  0

+    4.3498    1.0126    0.0000 H   0  0  0

+    2.4088    0.7744    0.0000 H   0  0  0

+   -1.4906   -3.7124    0.0000 H   0  0  0

+    4.2930    2.0728    0.0000 H   0  0  0

+    4.1835    3.1559    0.0000 H   0  0  0

+    5.6391   -0.3418    0.0000 H   0  0  0

+   -3.8219    0.4801    0.0000 H   0  0  0

+   -3.1425   -0.3145    0.0000 H   0  0  0

+    3.0352    4.0114    0.0000 H   0  0  0

+   -2.2291    1.3414    0.0000 H   0  0  0

+   -2.9085    2.1360    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 14 17  2  0

+ 15 18  1  0

+ 18 19  1  0

+  7  8  1  0

+ 11 14  1  0

+  1 20  1  0

+  4 21  1  0

+  4 22  1  0

+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56-05-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    1.1923   -0.2474   -0.0032 C   0  0  0

+   -0.0002   -0.9563   -0.0022 C   0  0  0

+    1.1566    1.0763   -0.0021 N   0  0  0

+    2.7127   -1.0853    0.0014 Cl  0  0  0

+   -1.1922   -0.2475   -0.0002 C   0  0  0

+    0.0000    1.7228   -0.0002 C   0  0  0

+   -1.1564    1.0765    0.0008 N   0  0  0

+   -2.7127   -1.0853    0.0005 Cl  0  0  0

+    0.0000    3.1068    0.0014 N   0  0  0

+   -0.0003   -1.9943    0.0000 H   0  0  0

+    0.8989    3.6258    0.0000 H   0  0  0

+   -0.8989    3.6258    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  5  8  1  0

+  6  9  1  0

+  6  7  2  0

+  2 10  1  0

+  9 11  1  0

+  9 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109897-79-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    1.9041    0.5022    0.1291 C   0  0  0

+    1.6172   -0.8654    0.3091 C   0  0  0

+    3.3416    0.9565    0.1352 C   0  0  2

+    0.9040    1.4029   -0.0422 C   0  0  0

+    0.3112   -1.3174    0.3121 C   0  0  0

+    2.7378   -1.8123    0.4958 C   0  0  0

+    4.2257   -0.1163   -0.4969 C   0  0  1

+    3.7622    1.1882    1.4811 O   0  0  0

+   -0.4365    0.9757   -0.0391 C   0  0  0

+   -0.7356   -0.3996    0.1335 C   0  0  0

+    3.9595   -1.4594    0.1225 C   0  0  0

+    3.9676   -0.1797   -1.9010 O   0  0  0

+   -1.4885    1.8907   -0.2134 C   0  0  0

+   -2.0779   -0.8194    0.1323 C   0  0  0

+   -2.7759    1.4487   -0.2046 C   0  0  0

+   -3.0696    0.0958   -0.0432 C   0  0  0

+   -4.4813   -0.3493   -0.0442 N   0  3  0

+   -5.3757    0.4625   -0.2006 O   0  0  0

+   -4.7484   -1.5274    0.1114 O   0  5  0

+    2.9327    1.9109    0.0000 H   0  0  0

+    1.1228    2.4179    0.0000 H   0  0  0

+    0.1117   -2.3364    0.0000 H   0  0  0

+    2.5212   -2.8278    0.0000 H   0  0  0

+    5.2325    0.1374    0.0000 H   0  0  0

+    4.6716    1.6892    0.0000 H   0  0  0

+    4.7244   -2.1615    0.0000 H   0  0  0

+    2.9593   -0.4274    0.0000 H   0  0  0

+   -1.2898    2.9098    0.0000 H   0  0  0

+   -2.3056   -1.8324    0.0000 H   0  0  0

+   -3.5517    2.1387    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+ 16 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+  7 11  1  0

+  9 10  2  0

+ 15 16  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4309-66-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.4192    0.3103   -0.0014 C   0  0  0

+   -0.0342    0.5498   -0.0015 C   0  0  0

+    2.3074    1.3898   -0.0014 C   0  0  0

+    1.9142   -0.9976    0.0045 C   0  0  0

+   -0.8859   -0.4886   -0.0015 C   0  0  0

+    3.6659    1.1618   -0.0014 C   0  0  0

+    3.2736   -1.2174    0.0045 C   0  0  0

+   -2.3400   -0.2490   -0.0016 C   0  0  0

+    4.1542   -0.1404   -0.0013 C   0  0  0

+   -3.2294   -1.3272   -0.0016 C   0  0  0

+   -2.8363    1.0571    0.0041 C   0  0  0

+    5.5306   -0.3672   -0.0013 N   0  0  0

+   -4.5887   -1.0952   -0.0017 C   0  0  0

+   -4.1986    1.2737    0.0039 C   0  0  0

+   -5.0729    0.2013   -0.0019 C   0  0  0

+   -0.4020    1.5260    0.0000 H   0  0  0

+    1.9418    2.3669    0.0000 H   0  0  0

+    1.2545   -1.8057    0.0000 H   0  0  0

+   -0.5181   -1.4648    0.0000 H   0  0  0

+    4.3293    1.9669    0.0000 H   0  0  0

+    3.6436   -2.1928    0.0000 H   0  0  0

+   -2.8658   -2.3050    0.0000 H   0  0  0

+   -2.1782    1.8665    0.0000 H   0  0  0

+    5.8984   -1.3434    0.0000 H   0  0  0

+    6.1922    0.4394    0.0000 H   0  0  0

+   -5.2537   -1.8990    0.0000 H   0  0  0

+   -4.5706    2.2484    0.0000 H   0  0  0

+   -6.1022    0.3709    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 13 15  1  0

+  7  9  1  0

+ 14 15  2  0

+  2 16  1  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118-58-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    2.0337   -0.1001    0.0532 C   0  0  0

+    0.8848    0.8212   -0.0098 C   0  0  0

+    3.3403    0.3925   -0.0720 C   0  0  0

+    1.8273   -1.4692    0.2438 C   0  0  0

+   -0.3712    0.3332   -0.0048 O   0  0  0

+    1.0704    2.0207   -0.0662 O   0  0  0

+    4.4137   -0.4838   -0.0107 C   0  0  0

+    3.5537    1.7198   -0.2526 O   0  0  0

+    2.9055   -2.3248    0.3021 C   0  0  0

+   -1.5029    1.2408   -0.0668 C   0  0  0

+    4.1950   -1.8345    0.1727 C   0  0  0

+   -2.7843    0.4478   -0.0471 C   0  0  0

+   -3.7025    0.6434    0.9672 C   0  0  0

+   -3.0440   -0.4712   -1.0469 C   0  0  0

+   -4.8781   -0.0841    0.9853 C   0  0  0

+   -4.2192   -1.1984   -1.0288 C   0  0  0

+   -5.1351   -1.0069   -0.0110 C   0  0  0

+    0.8657   -1.8479    0.0000 H   0  0  0

+    5.3799   -0.1170    0.0000 H   0  0  0

+    3.7178    2.7402    0.0000 H   0  0  0

+    2.7473   -3.3461    0.0000 H   0  0  0

+   -0.7691    1.9686    0.0000 H   0  0  0

+   -2.1428    2.0523    0.0000 H   0  0  0

+    4.9960   -2.4876    0.0000 H   0  0  0

+   -3.8795    1.6616    0.0000 H   0  0  0

+   -2.2188   -1.0934    0.0000 H   0  0  0

+   -5.7045    0.5365    0.0000 H   0  0  0

+   -4.0403   -2.2163    0.0000 H   0  0  0

+   -6.0181   -1.5440    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  7 11  2  0

+ 10 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+  9 11  1  0

+ 16 17  1  0

+  4 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+930-37-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.8358    0.0149   -0.5655 C   0  0  0

+   -2.0430   -0.7173    0.0240 C   0  0  0

+   -1.7458    0.6445    0.3387 O   0  0  0

+    0.4294   -0.3979    0.1894 C   0  0  0

+    1.5569    0.2859   -0.3611 O   0  0  0

+    2.7011   -0.1393    0.3820 C   0  0  0

+   -0.3944    0.9050    0.0000 H   0  0  0

+   -3.0358   -0.7555    0.0000 H   0  0  0

+   -1.7571   -1.6688    0.0000 H   0  0  0

+   -0.0917   -1.2438    0.0000 H   0  0  0

+    1.1295   -1.1029    0.0000 H   0  0  0

+    2.3550   -1.0706    0.0000 H   0  0  0

+    3.6324   -0.4854    0.0000 H   0  0  0

+    3.0472    0.7920    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  2  3  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+253-53-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+    0.0193    0.7284    0.0029 C   0  0  0

+    0.0494   -0.6937    0.0009 C   0  0  0

+    1.2388    1.4207    0.0023 C   0  0  0

+   -1.2348    1.3583   -0.0004 C   0  0  0

+   -1.1792   -1.3720    0.0011 C   0  0  0

+    1.2923   -1.3409   -0.0016 C   0  0  0

+    2.3956    0.6981   -0.0002 C   0  0  0

+   -2.3175    0.6117   -0.0052 N   0  0  0

+   -2.2910   -0.6689    0.0030 N   0  0  0

+    2.3955   -0.6276   -0.0020 N   0  0  0

+    1.2603    2.4434    0.0000 H   0  0  0

+   -1.3054    2.3788    0.0000 H   0  0  0

+   -1.2096   -2.3945    0.0000 H   0  0  0

+    1.3403   -2.3627    0.0000 H   0  0  0

+    3.2903    1.1941    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  2  1  0

+  7  3  2  0

+  8  4  2  0

+  9  5  2  0

+ 10  6  2  0

+  8  9  1  0

+  7 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1608-51-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.7726    1.0108   -0.0038 C   0  0  0

+    0.4406    0.4101   -0.0034 C   0  0  0

+    1.8940    2.2222   -0.0002 O   0  0  0

+    2.9734    0.1471   -0.0024 C   0  0  0

+   -0.6568    1.1994    0.0010 C   0  0  0

+    4.2473    0.7178   -0.0027 C   0  0  0

+    2.8377   -1.2425    0.0052 C   0  0  0

+   -1.9968    0.5950    0.0014 C   0  0  0

+    5.3632   -0.0935   -0.0009 C   0  0  0

+    3.9615   -2.0420    0.0069 C   0  0  0

+   -3.1350    1.4092    0.0058 C   0  0  0

+   -2.1400   -0.7975   -0.0086 C   0  0  0

+    5.2216   -1.4698    0.0012 C   0  0  0

+   -4.3880    0.8362    0.0057 C   0  0  0

+   -3.3986   -1.3571   -0.0087 C   0  0  0

+   -4.5227   -0.5441    0.0011 C   0  0  0

+   -5.7543   -1.0996    0.0015 F   0  0  0

+    0.3369   -0.6238    0.0000 H   0  0  0

+   -0.5532    2.2333    0.0000 H   0  0  0

+    4.3549    1.7513    0.0000 H   0  0  0

+    1.8922   -1.6733    0.0000 H   0  0  0

+    6.3120    0.3300    0.0000 H   0  0  0

+    3.8619   -3.0763    0.0000 H   0  0  0

+   -3.0354    2.4435    0.0000 H   0  0  0

+   -1.2989   -1.4075    0.0000 H   0  0  0

+    6.0651   -2.0765    0.0000 H   0  0  0

+   -5.2339    1.4396    0.0000 H   0  0  0

+   -3.5064   -2.3905    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  2  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 14  2  0

+ 17 16  1  0

+ 10 13  1  0

+ 15 16  1  0

+  2 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16543-55-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.5340    0.8241    0.6443 C   0  0  0

+   -0.8527    0.3513    0.2913 C   0  0  0

+    1.5187   -0.1776    0.2100 N   0  0  0

+    0.8420    2.1299   -0.1183 C   0  0  0

+   -1.9371    0.7053    1.0797 C   0  0  0

+   -1.0604   -0.4357   -0.8253 C   0  0  0

+    2.4019    0.4343   -0.7994 C   0  0  0

+    1.5972   -1.3909    0.6412 N   0  0  0

+    2.3311    1.9560   -0.5180 C   0  0  0

+   -3.1942    0.2475    0.7167 C   0  0  0

+   -2.2710   -0.8533   -1.1406 N   0  0  0

+    2.4576   -2.1365    0.2085 O   0  0  0

+   -3.3241   -0.5411   -0.4110 C   0  0  0

+    1.4356    1.0762    0.0000 H   0  0  0

+    0.9863    3.0549    0.0000 H   0  0  0

+   -0.0768    2.3096    0.0000 H   0  0  0

+   -1.9529    1.6413    0.0000 H   0  0  0

+   -0.3744   -1.0727    0.0000 H   0  0  0

+    2.7831   -0.4207    0.0000 H   0  0  0

+    3.3128    0.6504    0.0000 H   0  0  0

+    3.2672    1.9487    0.0000 H   0  0  0

+    2.3891    2.8904    0.0000 H   0  0  0

+   -3.9148    0.8451    0.0000 H   0  0  0

+   -4.1174   -1.0381    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+ 10 13  1  0

+  7  9  1  0

+ 11 13  2  0

+  1 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88-96-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.3479    0.7004   -0.0369 C   0  0  0

+    0.3402   -0.7044    0.0388 C   0  0  0

+    1.5620    1.3803   -0.0791 C   0  0  0

+   -0.9268    1.4504   -0.0776 C   0  0  0

+    1.5469   -1.3980    0.0706 C   0  0  0

+   -0.9425   -1.4402    0.0838 C   0  0  0

+    2.7503    0.6752   -0.0466 C   0  0  0

+   -1.6490    1.4905   -1.2148 N   0  0  0

+   -1.3226    2.0303    0.9144 O   0  0  0

+    2.7428   -0.7064    0.0278 C   0  0  0

+   -1.6241   -1.5361    1.2425 N   0  0  0

+   -1.3816   -1.9583   -0.9241 O   0  0  0

+    1.5750    2.4165    0.0000 H   0  0  0

+    1.5483   -2.4343    0.0000 H   0  0  0

+    3.6522    1.1855    0.0000 H   0  0  0

+   -2.1166    2.4153    0.0000 H   0  0  0

+   -2.2161    0.6232    0.0000 H   0  0  0

+    3.6390   -1.2266    0.0000 H   0  0  0

+   -2.2622   -0.7196    0.0000 H   0  0  0

+   -2.0121   -2.4970    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  6 12  2  0

+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24367-94-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    1.2502   -1.8517    0.3094 C   0  0  0

+   -0.0421   -1.1173    0.0609 C   0  0  0

+    2.4048   -0.8902    0.1928 C   0  0  0

+   -0.5478   -1.0260   -1.2227 C   0  0  0

+   -0.7226   -0.5410    1.1180 C   0  0  0

+    2.8474   -0.2052    1.3094 C   0  0  0

+    3.0229   -0.6992   -1.0296 C   0  0  0

+   -1.7323   -0.3540   -1.4538 C   0  0  0

+   -1.9072    0.1322    0.8937 C   0  0  0

+    3.9053    0.6768    1.2061 C   0  0  0

+    4.0810    0.1811   -1.1399 C   0  0  0

+   -2.4152    0.2302   -0.3953 C   0  0  0

+    4.5246    0.8752   -0.0212 C   0  0  0

+   -3.6153    0.9117   -0.6260 N   0  0  0

+    5.5944    1.7667   -0.1293 N   0  0  0

+   -4.7235    0.5775    0.0644 C   0  0  0

+   -5.9801    1.3957   -0.0855 C   0  0  0

+   -4.7094   -0.3818    0.8065 O   0  0  0

+    0.7341   -2.5497    0.0000 H   0  0  0

+    1.8815   -2.4476    0.0000 H   0  0  0

+   -0.8433   -1.8423    0.0000 H   0  0  0

+   -0.2255    0.1707    0.0000 H   0  0  0

+    2.1975    0.3703    0.0000 H   0  0  0

+    3.4367   -1.4624    0.0000 H   0  0  0

+   -2.2309   -1.0646    0.0000 H   0  0  0

+   -1.6065    0.9466    0.0000 H   0  0  0

+    3.4872    1.4376    0.0000 H   0  0  0

+    4.7321   -0.3931    0.0000 H   0  0  0

+   -3.5185    1.7744    0.0000 H   0  0  0

+    6.4092    1.4670    0.0000 H   0  0  0

+    5.4466    2.6221    0.0000 H   0  0  0

+   -5.5064    2.1232    0.0000 H   0  0  0

+   -6.7076    1.8694    0.0000 H   0  0  0

+   -6.4538    0.6682    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  2  0

+  5  2  1  0

+  6  3  2  0

+  7  3  1  0

+  8  4  1  0

+  9  5  2  0

+ 10  6  1  0

+ 11  7  2  0

+ 12  8  2  0

+ 13 10  2  0

+ 14 12  1  0

+ 15 13  1  0

+ 16 14  1  0

+ 17 16  1  0

+ 18 16  2  0

+  9 12  1  0

+ 11 13  1  0

+  1 19  1  0

+  1 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3271-05-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.2613    0.8004    0.0019 C   0  0  0

+   -0.6831   -0.2520    0.0009 C   0  0  0

+    1.6408    0.4944    0.0015 C   0  0  0

+   -0.1707    2.1429   -0.0026 C   0  0  0

+   -2.0424    0.0595    0.0017 C   0  0  0

+   -0.1981   -1.6352   -0.0006 C   0  0  0

+    2.0500   -0.9174    0.0000 C   0  0  0

+    2.5638    1.5313    0.0020 C   0  0  0

+   -1.5524    2.4171   -0.0075 C   0  0  0

+    0.7908    3.1660   -0.0015 C   0  0  0

+   -2.4530    1.3964    0.0036 C   0  0  0

+   -2.9647   -0.9324    0.0004 O   0  0  0

+    1.1232   -1.8942   -0.0005 N   0  0  0

+   -0.9945   -2.5550   -0.0015 O   0  0  0

+    3.2318   -1.2047   -0.0007 O   0  0  0

+    2.1306    2.8504    0.0029 C   0  0  0

+   -4.2478   -0.3034    0.0017 C   0  0  0

+    1.5688   -3.2898   -0.0009 C   0  0  0

+    3.5893    1.3181    0.0000 H   0  0  0

+   -1.8878    3.4093    0.0000 H   0  0  0

+    0.4887    4.1689    0.0000 H   0  0  0

+   -3.4768    1.6173    0.0000 H   0  0  0

+    2.8387    3.6222    0.0000 H   0  0  0

+   -3.7868    0.6371    0.0000 H   0  0  0

+   -5.1883    0.1576    0.0000 H   0  0  0

+   -4.7088   -1.2439    0.0000 H   0  0  0

+    0.5710   -3.6084    0.0000 H   0  0  0

+    1.8874   -4.2876    0.0000 H   0  0  0

+    2.5666   -2.9712    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  8 16  2  0

+ 12 17  1  0

+ 13 18  1  0

+  7 13  1  0

+  9 11  2  0

+ 10 16  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 16 23  1  0

+ 17 24  1  0

+ 17 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-06-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    2.2697    0.6721   -0.1095 N   0  0  0

+    1.3274   -0.2696    0.0949 C   0  0  0

+    3.6754    0.3764    0.1784 C   0  0  0

+    1.8891    1.9893   -0.6255 C   0  0  0

+   -0.3632    0.0860   -0.2514 S   0  0  0

+    1.7731   -1.8113    0.6912 S   0  0  0

+    4.2838   -0.3983   -0.9923 C   0  0  0

+    1.3385    2.8450    0.5172 C   0  0  0

+   -1.6287   -1.1786    0.0232 C   0  0  0

+   -2.9805   -0.6253   -0.3475 C   0  0  0

+   -3.6886   -1.2006   -1.2898 C   0  0  0

+   -3.6005    0.7735    0.4726 Cl  0  0  0

+    4.6780    0.7707    0.0000 H   0  0  0

+    3.5853    1.4500    0.0000 H   0  0  0

+    2.9551    1.8331    0.0000 H   0  0  0

+    2.4725    2.8950    0.0000 H   0  0  0

+    3.4365   -1.0637    0.0000 H   0  0  0

+    4.9492   -1.2456    0.0000 H   0  0  0

+    5.1311    0.2671    0.0000 H   0  0  0

+    2.2445    3.4280    0.0000 H   0  0  0

+    0.7555    3.7510    0.0000 H   0  0  0

+    0.4325    2.2620    0.0000 H   0  0  0

+   -2.1649   -2.1131    0.0000 H   0  0  0

+   -0.7732   -1.8335    0.0000 H   0  0  0

+   -4.6950   -0.8161    0.0000 H   0  0  0

+   -3.5184   -2.2644    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  7 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+557-11-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.1188   -0.4759    0.1266 N   0  0  0

+   -1.3886   -0.0500   -0.0242 C   0  0  0

+    0.9729    0.4961    0.2259 C   0  0  0

+   -2.3929   -0.9441   -0.1156 N   0  0  0

+   -1.6281    1.1409   -0.0778 O   0  0  0

+    2.2816   -0.2333    0.3879 C   0  0  0

+    3.2331   -0.0762   -0.4987 C   0  0  0

+    0.0831   -1.4619    0.0000 H   0  0  0

+    1.5578    1.3152    0.0000 H   0  0  0

+    0.2240    1.1686    0.0000 H   0  0  0

+   -3.3484   -0.6277    0.0000 H   0  0  0

+   -2.1892   -1.9297    0.0000 H   0  0  0

+    2.1089   -1.2249    0.0000 H   0  0  0

+    3.8716   -0.8542    0.0000 H   0  0  0

+    3.5876    0.8658    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  6  7  2  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141-32-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    1.5552   -0.0520   -0.0011 C   0  0  0

+    0.3147    0.4754    0.0003 O   0  0  0

+    2.7294    0.8316    0.0006 C   0  0  0

+    1.7026   -1.2584    0.0014 O   0  0  0

+   -0.8454   -0.3977   -0.0014 C   0  0  0

+    3.9541    0.3109   -0.0007 C   0  0  0

+   -2.1203    0.4482    0.0006 C   0  0  0

+   -3.3428   -0.4719   -0.0011 C   0  0  0

+   -4.6177    0.3740    0.0009 C   0  0  0

+    2.5966    1.9191    0.0000 H   0  0  0

+   -1.5504   -1.2363    0.0000 H   0  0  0

+   -0.0919   -1.1930    0.0000 H   0  0  0

+    4.0870   -0.7766    0.0000 H   0  0  0

+    4.8294    0.9697    0.0000 H   0  0  0

+   -1.4153    1.2868    0.0000 H   0  0  0

+   -2.8738    1.2435    0.0000 H   0  0  0

+   -4.0478   -1.3105    0.0000 H   0  0  0

+   -2.5893   -1.2672    0.0000 H   0  0  0

+   -4.0120    1.2869    0.0000 H   0  0  0

+   -5.5306    0.9797    0.0000 H   0  0  0

+   -5.2234   -0.5389    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  7  8  1  0

+  8  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+497-23-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -0.6788   -0.0502    0.0017 C   0  0  0

+    0.2256   -1.2031    0.0009 C   0  0  0

+    0.0333    1.0922    0.0007 O   0  0  0

+   -1.8924   -0.1157   -0.0014 O   0  0  0

+    1.4867   -0.7789   -0.0007 C   0  0  0

+    1.4431    0.7313   -0.0009 C   0  0  0

+   -0.0754   -2.2096    0.0000 H   0  0  0

+    2.3485   -1.3796    0.0000 H   0  0  0

+    2.4915    0.6638    0.0000 H   0  0  0

+    1.6078    1.7688    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  5  6  1  0

+  2  7  1  0

+  5  8  1  0

+  6  9  1  0

+  6 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15961-88-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 52                          1 V2000

+   -0.3384   -0.0538   -0.5514 N   0  3  0

+    0.4945   -1.1693   -0.3948 N   0  0  0

+    0.1356    1.0187   -0.8810 O   0  5  0

+   -1.7308   -0.1744   -0.3325 C   0  0  0

+    1.7878   -1.0087   -0.2762 C   0  0  0

+   -2.5557    0.9304   -0.4876 C   0  0  0

+   -2.2722   -1.3988    0.0319 C   0  0  0

+    2.3691    0.3326   -0.0666 C   0  0  0

+    2.7048   -2.1650   -0.3425 C   0  0  0

+   -3.9119    0.8132   -0.2744 C   0  0  0

+   -3.6279   -1.5215    0.2463 C   0  0  0

+    3.7096    0.4599    0.0514 C   0  0  0

+    4.0329   -1.9612   -0.2162 C   0  0  0

+   -4.4624   -0.4110    0.0971 C   0  0  0

+   -5.0404    1.8113   -0.3623 C   0  0  0

+    4.5610   -0.6622   -0.0219 C   0  0  0

+    4.5801    1.6760    0.2677 C   0  0  0

+   -5.9295   -0.2633    0.2612 C   0  0  0

+   -6.2960    1.0532   -0.0076 C   0  0  0

+    5.9581   -0.2220    0.1390 C   0  0  0

+    5.9994    1.1671    0.3133 C   0  0  0

+   -6.9124   -1.1878    0.6190 C   0  0  0

+   -7.6166    1.4387    0.0790 C   0  0  0

+    7.1593   -0.9512    0.1412 C   0  0  0

+    7.2051    1.8075    0.4836 C   0  0  0

+   -8.2316   -0.7930    0.7032 C   0  0  0

+   -8.5857    0.5166    0.4343 C   0  0  0

+    8.3577   -0.2960    0.3139 C   0  0  0

+    8.3853    1.0792    0.4832 C   0  0  0

+   -2.1328    1.8733    0.0000 H   0  0  0

+   -1.6698   -2.2385    0.0000 H   0  0  0

+    1.7617    1.1687    0.0000 H   0  0  0

+    2.3272   -3.1270    0.0000 H   0  0  0

+   -4.0474   -2.4659    0.0000 H   0  0  0

+    4.6734   -2.7722    0.0000 H   0  0  0

+   -4.2811    2.5123    0.0000 H   0  0  0

+   -5.6611    2.6375    0.0000 H   0  0  0

+    5.0171    2.6125    0.0000 H   0  0  0

+    3.6879    2.1975    0.0000 H   0  0  0

+   -6.6748   -2.1935    0.0000 H   0  0  0

+   -7.8605    2.4429    0.0000 H   0  0  0

+    7.1359   -1.9844    0.0000 H   0  0  0

+    7.2385    2.8404    0.0000 H   0  0  0

+   -8.9720   -1.5139    0.0000 H   0  0  0

+   -9.5808    0.7953    0.0000 H   0  0  0

+    9.2413   -0.8320    0.0000 H   0  0  0

+    9.2927    1.5737    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  4  2  0

+  7  4  1  0

+  8  5  2  0

+  9  5  1  0

+ 10  6  1  0

+ 11  7  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 10  2  0

+ 15 10  1  0

+ 16 12  2  0

+ 17 12  1  0

+ 18 14  1  0

+ 19 15  1  0

+ 20 16  1  0

+ 21 17  1  0

+ 22 18  2  0

+ 23 19  2  0

+ 24 20  2  0

+ 25 21  2  0

+ 26 22  1  0

+ 27 23  1  0

+ 28 24  1  0

+ 29 25  1  0

+ 11 14  1  0

+ 13 16  1  0

+ 18 19  1  0

+ 20 21  1  0

+ 26 27  2  0

+ 28 29  2  0

+  6 30  1  0

+  7 31  1  0

+  8 32  1  0

+  9 33  1  0

+ 11 34  1  0

+ 13 35  1  0

+ 15 36  1  0

+ 15 37  1  0

+ 17 38  1  0

+ 17 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+ 25 43  1  0

+ 26 44  1  0

+ 27 45  1  0

+ 28 46  1  0

+ 29 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84850-16-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 42                          1 V2000

+   -0.2468    1.1127   -0.1157 C   0  0  0

+    0.4417   -0.0592   -0.0696 C   0  0  0

+    0.4927    2.4305   -0.1906 C   0  0  0

+   -1.6617    1.1384   -0.1015 C   0  0  0

+    1.9236   -0.1055   -0.0899 C   0  0  0

+   -0.2874   -1.3355    0.0026 C   0  0  0

+    2.0280    2.4000   -0.2049 C   0  0  0

+    1.2748    2.5979    0.9934 O   0  0  0

+   -2.4070   -0.0584   -0.0384 C   0  0  0

+   -2.3439    2.3658   -0.1499 C   0  0  0

+    2.6987    1.0473   -0.1539 C   0  0  0

+    2.5579   -1.3518   -0.0425 C   0  0  0

+   -1.6963   -1.3394    0.0238 C   0  0  0

+    0.4042   -2.5509    0.0502 C   0  0  0

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+   -3.7071    2.3845   -0.1358 C   0  0  0

+    4.0754    0.9637   -0.1704 C   0  0  0

+    3.9340   -1.4266   -0.0600 C   0  0  0

+   -2.3841   -2.5533    0.0916 C   0  0  0

+   -0.2934   -3.7227    0.1163 C   0  0  0

+   -4.4363    1.2029   -0.0731 C   0  0  0

+    4.6949   -0.2726   -0.1234 C   0  0  0

+   -1.6827   -3.7248    0.1368 C   0  0  0

+   -0.1268    3.2711    0.0000 H   0  0  0

+    2.6876    3.2095    0.0000 H   0  0  0

+   -1.8083    3.2622    0.0000 H   0  0  0

+    1.9881   -2.2269    0.0000 H   0  0  0

+    1.4483   -2.5612    0.0000 H   0  0  0

+   -4.3600   -0.8893    0.0000 H   0  0  0

+   -4.2096    3.2998    0.0000 H   0  0  0

+    4.6507    1.8351    0.0000 H   0  0  0

+    4.4039   -2.3591    0.0000 H   0  0  0

+   -3.4282   -2.5658    0.0000 H   0  0  0

+    0.2233   -4.6301    0.0000 H   0  0  0

+   -5.4798    1.2396    0.0000 H   0  0  0

+    5.7373   -0.3344    0.0000 H   0  0  0

+   -2.1969   -4.6336    0.0000 H   0  0  0

+  1  2  2  0

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+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4802-20-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+    1.8074    0.5555    0.2086 C   0  0  0

+    2.4388   -0.6701   -0.4546 C   0  0  0

+    2.6021    1.8067   -0.1705 C   0  0  0

+    0.3615    0.7056   -0.2689 C   0  0  0

+    4.1530   -0.8481    0.1115 S   0  0  0

+   -0.4332   -0.5456    0.1101 C   0  0  0

+   -0.2699    1.9313    0.3944 C   0  0  0

+   -1.8790   -0.3955   -0.3674 C   0  0  0

+   -1.7157    2.0814   -0.0831 C   0  0  0

+   -2.8213   -1.8790    0.0820 S   0  0  0

+   -2.5105    0.8301    0.2959 C   0  0  0

+   -3.9563    0.9802   -0.1816 C   0  0  0

+    1.1925   -0.3447    0.0000 H   0  0  0

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+   -3.1254   -0.0702    0.0000 H   0  0  0

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+   -4.0689   -0.1042    0.0000 H   0  0  0

+  2  1  1  0

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+ 11 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 12 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4418-26-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -1.7804    0.4558    0.0214 C   0  0  0

+   -2.5768   -0.5967    0.5520 C   0  0  0

+   -0.5536    0.1238   -0.5904 C   0  0  0

+   -2.2058    1.7857    0.0993 C   0  0  0

+   -2.1006   -1.9102    0.4392 C   0  0  0

+   -3.7582   -0.3378    1.1471 O   0  0  0

+   -0.1663   -1.1528   -0.6603 O   0  0  0

+    0.2243    1.0903   -1.1027 O   0  0  0

+   -1.9166    2.5981    1.3351 C   0  0  0

+   -2.8678    2.3353   -0.9210 O   0  0  0

+   -0.9114   -2.1452   -0.1630 C   0  0  0

+   -0.4141   -3.5633   -0.2760 C   0  0  0

+   11.0798    0.3522    0.3291 Na  0  3  0

+   -2.7139   -2.6251    0.0000 H   0  0  0

+   -1.0292    2.2822    0.0000 H   0  0  0

+   -1.6007    3.4855    0.0000 H   0  0  0

+   -2.8040    2.9140    0.0000 H   0  0  0

+   -1.3030   -3.8750    0.0000 H   0  0  0

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+  1  2  2  0

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+ 12 18  1  0

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+ 12 20  1  0

+  6 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+140460-98-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 45                          1 V2000

+   -1.9958   -0.1117    0.0996 C   0  0  0

+   -2.6278   -1.4723    0.1349 C   0  0  2

+   -0.5879   -0.0081    0.0634 C   0  0  0

+   -2.7475    1.0197    0.1073 C   0  0  0

+   -4.0717   -1.5488   -0.3219 C   0  0  1

+   -3.7122   -1.5608    1.0612 O   0  0  0

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+   -4.2520    0.9109    0.1385 C   0  0  1

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+   -4.6957   -0.2368   -0.7673 C   0  0  1

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+    1.5068   -1.0053    0.0250 C   0  0  0

+   -4.6838    0.6603    1.4775 O   0  0  0

+   -4.3117    0.0398   -2.1156 O   0  0  0

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+   -5.5895    0.1346    0.0000 H   0  0  0

+   -3.4620    0.6519    0.0000 H   0  0  0

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+ 24 39  1  0

+ 25 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+928-73-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.0305    0.0206    0.0000 N   0  0  0

+   -1.0837    0.6931    0.0000 C   0  0  0

+    1.2572    0.6973    0.0000 N   0  0  0

+   -2.3663   -0.0145    0.0000 C   0  0  0

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+   -2.3900   -1.2302    0.0000 O   0  0  0

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+  7 12  1  0

+  8 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3626-29-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 81                          1 V2000

+   -6.8354   -0.4044    0.0224 N   0  0  0

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+   -5.4933   -0.1896   -0.0288 C   0  0  0

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+ 51 75  1  0

+ 52 76  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95741-56-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -0.0775    0.7132    0.0051 C   0  0  0

+   -0.0775   -0.7135    0.0037 C   0  0  0

+    1.3305    1.1602    0.0032 C   0  0  0

+   -1.2709    1.4057    0.0027 C   0  0  0

+    1.3306   -1.1603    0.0009 C   0  0  0

+   -1.2710   -1.4059    0.0041 C   0  0  0

+    2.1120    0.0000    0.0005 C   0  0  0

+    2.0042    2.3693    0.0028 C   0  0  0

+   -2.4889    0.7095   -0.0028 C   0  0  0

+   -1.2660    2.9127    0.0066 C   0  0  0

+    2.0048   -2.3693   -0.0012 C   0  0  0

+   -2.4889   -0.7096    0.0036 C   0  0  0

+   -1.2662   -2.9129    0.0045 C   0  0  0

+    3.5098    0.0001   -0.0031 C   0  0  0

+    3.3985    2.3864   -0.0001 C   0  0  0

+   -3.7154    1.3976   -0.0074 C   0  0  0

+    3.3990   -2.3862   -0.0041 C   0  0  0

+   -3.7156   -1.3976    0.0022 C   0  0  0

+    4.1564    1.2480   -0.0041 C   0  0  0

+    4.1567   -1.2475   -0.0050 C   0  0  0

+   -4.8823    0.6970   -0.0131 C   0  0  0

+   -4.8823   -0.6967    0.0009 C   0  0  0

+    1.4672    3.2706    0.0000 H   0  0  0

+   -0.2169    2.9093    0.0000 H   0  0  0

+   -1.2626    3.9618    0.0000 H   0  0  0

+   -2.3151    2.9161    0.0000 H   0  0  0

+    1.4680   -3.2707    0.0000 H   0  0  0

+   -2.3153   -2.9162    0.0000 H   0  0  0

+   -1.2629   -3.9620    0.0000 H   0  0  0

+   -0.2171   -2.9096    0.0000 H   0  0  0

+    3.8882    3.3143    0.0000 H   0  0  0

+   -3.7308    2.4466    0.0000 H   0  0  0

+    3.8888   -3.3140    0.0000 H   0  0  0

+   -3.7313   -2.4466    0.0000 H   0  0  0

+    5.2040    1.3053    0.0000 H   0  0  0

+    5.2043   -1.3045    0.0000 H   0  0  0

+   -5.7953    1.2138    0.0000 H   0  0  0

+   -5.7954   -1.2134    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  6 12  2  0

+  6 13  1  0

+  7 14  2  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 14 19  1  0

+ 14 20  1  0

+ 16 21  2  0

+ 18 22  2  0

+  5  7  1  0

+  9 12  1  0

+ 15 19  2  0

+ 17 20  2  0

+ 21 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+61422-45-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+   -1.4586   -0.4590   -0.0035 N   0  0  0

+   -2.5455   -1.2520   -0.0016 C   0  0  0

+   -1.5919    0.9111   -0.0029 C   0  0  0

+   -0.2289   -1.0106   -0.0003 C   0  0  0

+   -3.7850   -0.7279    0.0005 N   0  0  0

+   -2.4058   -2.4595   -0.0021 O   0  0  0

+   -2.8237    1.4607   -0.0004 C   0  0  0

+    0.8637   -0.2215   -0.0022 N   0  0  0

+   -0.1053   -2.2195    0.0043 O   0  0  0

+   -3.9593    0.6089    0.0011 C   0  0  0

+   -2.9746    2.8032    0.0006 F   0  0  0

+    2.2003   -0.8211    0.0013 C   0  0  0

+   -5.0813    1.0817    0.0033 O   0  0  0

+    3.2561    0.2863   -0.0018 C   0  0  0

+    4.6520   -0.3400    0.0018 C   0  0  0

+    5.7078    0.7674   -0.0013 C   0  0  0

+    7.1037    0.1412    0.0023 C   0  0  0

+    8.1595    1.2486   -0.0007 C   0  0  0

+   -0.7703    1.5027    0.0000 H   0  0  0

+   -4.5908   -1.3408    0.0000 H   0  0  0

+    0.7607    0.7857    0.0000 H   0  0  0

+    1.6841   -1.6921    0.0000 H   0  0  0

+    3.0073   -1.4324    0.0000 H   0  0  0

+    3.7723    1.1573    0.0000 H   0  0  0

+    2.4491    0.8976    0.0000 H   0  0  0

+    4.1358   -1.2110    0.0000 H   0  0  0

+    5.4590   -0.9513    0.0000 H   0  0  0

+    6.2240    1.6384    0.0000 H   0  0  0

+    4.9008    1.3787    0.0000 H   0  0  0

+    6.5875   -0.7298    0.0000 H   0  0  0

+    7.9107   -0.4701    0.0000 H   0  0  0

+    8.8923    0.5500    0.0000 H   0  0  0

+    8.8581    1.9814    0.0000 H   0  0  0

+    7.4267    1.9472    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

+  7 11  1  0

+  8 12  1  0

+ 10 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+  7 10  1  0

+  3 19  1  0

+  5 20  1  0

+  8 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+542-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.0000   -0.6796    0.0001 C   0  0  0

+   -1.1573    0.1905    0.4178 C   0  0  0

+    1.1573    0.1904   -0.4179 C   0  0  0

+   -2.2126    0.1121   -0.1641 O   0  0  0

+    2.2126    0.1121    0.1640 O   0  0  0

+   -0.6326   -1.3745    0.0000 H   0  0  0

+    0.6326   -1.3746    0.0000 H   0  0  0

+   -0.8928    1.0923    0.0000 H   0  0  0

+    0.8928    1.0922    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  3  5  2  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-77-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    0.0000   -0.9774    0.0000 C   0  0  0

+   -1.2019   -0.1276    0.0000 C   0  0  0

+    1.2019   -0.1276    0.0000 C   0  0  0

+   -2.1294    0.5283    0.0000 N   0  0  0

+    2.1294    0.5283    0.0000 N   0  0  0

+   -0.6513   -1.7070    0.0000 H   0  0  0

+    0.6513   -1.7070    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  3  0

+  3  5  3  0

+  1  6  1  0

+  1  7  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97-02-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.0082   -0.0524   -0.0114 C   0  0  0

+   -0.2502   -0.6201    0.0331 C   0  0  0

+    1.1435    1.3280   -0.0843 C   0  0  0

+    2.2114   -0.9139    0.0248 N   0  3  0

+   -1.3745    0.1842    0.0051 C   0  0  0

+    0.0116    2.1332   -0.1123 C   0  0  0

+    2.4145    1.9054   -0.1290 N   0  0  0

+    2.3479   -1.8041   -0.7952 O   0  0  0

+    3.0650   -0.7325    0.8745 O   0  5  0

+   -1.2434    1.5591   -0.0675 C   0  0  0

+   -2.7215   -0.4277    0.0525 N   0  3  0

+   -3.7128    0.2795    0.0279 O   0  0  0

+   -2.8385   -1.6384    0.1160 O   0  5  0

+   -0.3522   -1.6509    0.0000 H   0  0  0

+    0.1095    3.1644    0.0000 H   0  0  0

+    3.2571    1.3029    0.0000 H   0  0  0

+    2.5150    2.9364    0.0000 H   0  0  0

+   -2.0874    2.1596    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  6 10  2  0

+  2 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52547-00-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -2.6611   -1.3201   -0.0755 C   0  0  0

+   -3.5356   -0.3467   -0.5012 C   0  0  0

+   -1.5586   -0.9588    0.5339 N   0  0  0

+   -2.9691   -2.7780   -0.3009 C   0  0  0

+   -3.1732    0.9484   -0.2470 C   0  0  0

+   -1.6536    0.7471    0.5610 S   0  0  0

+   -3.8508    2.1238   -0.5570 N   0  0  0

+    7.8136    0.0485   -0.1173 Cl  0  0  0

+   -4.5265   -0.5782    0.0000 H   0  0  0

+   -3.9647   -2.5677    0.0000 H   0  0  0

+   -3.1794   -3.7736    0.0000 H   0  0  0

+   -1.9735   -2.9883    0.0000 H   0  0  0

+   -3.3415    3.0047    0.0000 H   0  0  0

+   -4.8683    2.1245    0.0000 H   0  0  0

+    8.8311    0.0485    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  5  6  1  0

+  2  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93-46-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 52                          1 V2000

+   -5.3873   -0.1292   -0.4069 C   0  0  0

+   -5.4015   -1.2875    0.4106 C   0  0  0

+   -4.4526    0.8860   -0.1490 C   0  0  0

+   -6.3141   -0.0157   -1.4581 C   0  0  0

+   -4.4803   -1.4029    1.4661 C   0  0  0

+   -6.3384   -2.3020    0.1498 C   0  0  0

+   -3.5637    0.7411    0.8942 C   0  0  0

+   -7.2103   -1.0163   -1.6768 C   0  0  0

+   -3.5845   -0.4067    1.6958 C   0  0  0

+   -7.2168   -2.1600   -0.8802 C   0  0  0

+   -2.6326    1.7485    1.1538 N   0  0  0

+   -1.3567    1.6866    0.5816 C   0  0  0

+   -0.3807    2.5990    0.9608 C   0  0  0

+   -1.0649    0.7090   -0.3612 C   0  0  0

+    0.8782    2.5376    0.3967 C   0  0  0

+    0.1935    0.6476   -0.9251 C   0  0  0

+    1.1683    1.5635   -0.5497 C   0  0  0

+    2.4444    1.5013   -1.1215 N   0  0  0

+    3.4229    0.6805   -0.5573 C   0  0  0

+    4.6208    0.4973   -1.2135 C   0  0  0

+    3.1793    0.0566    0.6723 C   0  0  0

+    5.6024   -0.3284   -0.6427 C   0  0  0

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+    5.3449   -0.9604    0.6000 C   0  0  0

+    6.8372   -0.5399   -1.2811 C   0  0  0

+    6.3297   -1.7859    1.1690 C   0  0  0

+    7.7666   -1.3461   -0.6996 C   0  0  0

+    7.5134   -1.9674    0.5221 C   0  0  0

+   -4.7564    1.7658    0.0000 H   0  0  0

+   -6.6413    0.8556    0.0000 H   0  0  0

+   -4.1551   -2.2750    0.0000 H   0  0  0

+   -6.0347   -3.1818    0.0000 H   0  0  0

+   -8.0787   -0.6814    0.0000 H   0  0  0

+   -2.7185   -0.7478    0.0000 H   0  0  0

+   -7.9272   -2.7613    0.0000 H   0  0  0

+   -2.9848    2.6100    0.0000 H   0  0  0

+   -0.7012    3.4728    0.0000 H   0  0  0

+   -1.6390   -0.0236    0.0000 H   0  0  0

+    1.4526    3.2700    0.0000 H   0  0  0

+    0.5151   -0.2258    0.0000 H   0  0  0

+    2.7839    2.3679    0.0000 H   0  0  0

+    5.0050    1.3450    0.0000 H   0  0  0

+    2.2762   -0.1684    0.0000 H   0  0  0

+    3.7169   -1.5890    0.0000 H   0  0  0

+    7.2354    0.3014    0.0000 H   0  0  0

+    5.9460   -2.6339    0.0000 H   0  0  0

+    8.6718   -1.1297    0.0000 H   0  0  0

+    7.9725   -2.7770    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+ 11 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+ 17 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+ 19 21  2  0

+ 20 22  2  0

+ 21 23  1  0

+ 22 24  1  0

+ 22 25  1  0

+ 24 26  1  0

+ 25 27  2  0

+ 26 28  2  0

+  7  9  2  0

+  8 10  1  0

+ 16 17  1  0

+ 23 24  2  0

+ 27 28  1  0

+  3 29  1  0

+  4 30  1  0

+  5 31  1  0

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+  8 33  1  0

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+ 10 35  1  0

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+ 13 37  1  0

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+ 20 42  1  0

+ 21 43  1  0

+ 23 44  1  0

+ 25 45  1  0

+ 26 46  1  0

+ 27 47  1  0

+ 28 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64188-66-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -0.3148    1.1006    1.0904 C   0  0  0

+   -0.7265   -0.3782    1.1505 C   0  0  0

+   -1.2178    0.5136    0.0915 N   0  0  0

+    1.0014    1.4426    0.4337 C   0  0  0

+    0.2100   -1.3986    0.5485 C   0  0  0

+   -2.5809    0.9085    0.4709 C   0  0  0

+    1.8016    0.4357   -0.0942 C   0  0  0

+    1.4042    2.7611    0.3620 C   0  0  0

+    1.4034   -0.9920   -0.0375 C   0  0  0

+   -0.1274   -2.7368    0.5839 C   0  0  0

+   -3.5784    0.3274   -0.5332 C   0  0  0

+    3.0162    0.7740   -0.6975 C   0  0  0

+    2.6074    3.0879   -0.2365 C   0  0  0

+    2.2556   -1.9526   -0.5891 C   0  0  0

+    0.7211   -3.6814    0.0361 C   0  0  0

+   -4.9981    0.7387   -0.1381 C   0  0  0

+    3.4107    2.0931   -0.7648 C   0  0  0

+    1.9108   -3.2868   -0.5495 C   0  0  0

+   -5.9956    0.1576   -1.1422 C   0  0  0

+   -0.7037    1.9825    0.0000 H   0  0  0

+   -1.5093   -0.9406    0.0000 H   0  0  0

+   -2.0889    1.7373    0.0000 H   0  0  0

+   -3.2596    1.5929    0.0000 H   0  0  0

+    0.7334    3.4532    0.0000 H   0  0  0

+   -1.0631   -2.9682    0.0000 H   0  0  0

+   -4.0704   -0.5014    0.0000 H   0  0  0

+   -2.8997   -0.3570    0.0000 H   0  0  0

+    3.6913    0.0860    0.0000 H   0  0  0

+    2.9043    4.0049    0.0000 H   0  0  0

+    3.1926   -1.7269    0.0000 H   0  0  0

+    0.4739   -4.6130    0.0000 H   0  0  0

+   -4.5061    1.5675    0.0000 H   0  0  0

+   -5.6768    1.4231    0.0000 H   0  0  0

+    4.3564    2.2792    0.0000 H   0  0  0

+    2.6149   -3.9450    0.0000 H   0  0  0

+   -6.4808    0.9904    0.0000 H   0  0  0

+   -6.8284   -0.3276    0.0000 H   0  0  0

+   -5.5104   -0.6752    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+  8 13  2  0

+  9 14  1  0

+ 10 15  2  0

+ 11 16  1  0

+ 12 17  2  0

+ 14 18  2  0

+ 16 19  1  0

+  2  3  1  0

+  7  9  1  0

+ 13 17  1  0

+ 15 18  1  0

+  1 20  1  0

+  2 21  1  0

+  6 22  1  0

+  6 23  1  0

+  8 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+434-13-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 70                          1 V2000

+    0.1989   -0.9610    0.4111 C   0  0  1

+    1.4053   -0.9162   -0.5074 C   0  0  1

+   -0.6716    0.2787    0.0698 C   0  0  1

+   -0.7858   -2.1083    0.1601 C   0  0  0

+    2.2129    0.3379   -0.1386 C   0  0  1

+    2.2793   -2.1539   -0.2997 C   0  0  0

+   -1.9978   -0.0245    0.7591 C   0  0  2

+    0.0780    1.5025    0.5581 C   0  0  0

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+   -3.1462    0.5633   -0.0635 C   0  0  1

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+    2.9892    0.5051   -2.5073 C   0  0  0

+   -4.4737   -0.0204    0.4243 C   0  0  0

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+    4.7587   -0.8853    0.6170 C   0  0  0

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+   -5.6221    0.5674   -0.3983 C   0  0  0

+    5.5606    0.3681    0.9730 C   0  0  1

+   -6.9297   -0.0074    0.0821 C   0  0  0

+    5.9744    0.2968    2.3389 O   0  0  0

+   -8.0808    0.3670   -0.4978 O   0  0  0

+   -6.9418   -0.8054    0.9893 O   0  0  0

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+   -4.2372    2.0702    0.0000 H   0  0  0

+    4.4392   -1.9078    0.0000 H   0  0  0

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+    7.0301    0.1149    0.0000 H   0  0  0

+   -9.0996    0.6984    0.0000 H   0  0  0

+  1  2  1  0

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+ 22 63  1  0

+ 22 64  1  0

+ 23 65  1  0

+ 25 66  1  0

+ 26 67  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+384-22-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.1265    0.7256    0.0020 C   0  0  0

+   -0.9827   -0.3594    0.0013 C   0  0  0

+    1.3648    0.5085    0.0008 C   0  0  0

+   -0.6381    2.0100   -0.0018 C   0  0  0

+   -0.4350   -1.7345   -0.0008 N   0  3  0

+   -2.3509   -0.1602    0.0029 C   0  0  0

+    2.0162    1.7466    0.0018 F   0  0  0

+    1.7321   -0.2126    1.1419 F   0  0  0

+    1.7305   -0.2099   -1.1426 F   0  0  0

+   -2.0058    2.2091   -0.0064 C   0  0  0

+   -1.1896   -2.6906   -0.0015 O   0  0  0

+    0.7703   -1.9099   -0.0019 O   0  5  0

+   -2.8624    1.1238    0.0049 C   0  0  0

+    0.0041    2.8237    0.0000 H   0  0  0

+   -2.9931   -0.9739    0.0000 H   0  0  0

+   -2.3894    3.1721    0.0000 H   0  0  0

+   -3.8882    1.2731    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+ 10 13  1  0

+  4 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 13 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2438-88-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.1425    0.0002    0.0005 C   0  0  0

+   -0.4530   -1.1986    0.0351 C   0  0  0

+   -0.4523    1.1990    0.0359 C   0  0  0

+   -2.6205    0.0005   -0.0806 N   0  3  0

+    0.9291   -1.2014    0.1052 C   0  0  0

+   -1.3223   -2.7007   -0.0088 Cl  0  0  0

+    0.9295    1.2010    0.1055 C   0  0  0

+   -1.3208    2.7015   -0.0076 Cl  0  0  0

+   -3.2864   -0.0022    0.9392 O   0  0  0

+   -3.1708    0.0036   -1.1672 O   0  5  0

+    1.6233   -0.0005    0.1407 C   0  0  0

+    1.7936   -2.7062    0.1491 Cl  0  0  0

+    1.7948    2.7054    0.1487 Cl  0  0  0

+    2.9810   -0.0009    0.2100 O   0  0  0

+    3.4632   -0.0008   -1.1352 C   0  0  0

+    3.4634   -1.0383    0.0000 H   0  0  0

+    4.5007   -0.0006    0.0000 H   0  0  0

+    3.4630    1.0367    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  5 12  1  0

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+ 11 14  1  0

+ 14 15  1  0

+  7 11  1  0

+ 15 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7422-80-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+    0.0000   -0.1681   -0.2799 N   0  0  0

+   -1.1786    0.5684    0.1960 C   0  0  0

+    1.1786    0.5684    0.1960 C   0  0  0

+    0.0000   -1.4476    0.4107 N   0  0  0

+   -2.4488   -0.1480   -0.2669 C   0  0  0

+    2.4488   -0.1480   -0.2669 C   0  0  0

+   -3.6763    0.6192    0.2287 C   0  0  0

+    3.6763    0.6192    0.2287 C   0  0  0

+   -4.9465   -0.0972   -0.2341 C   0  0  0

+    4.9465   -0.0972   -0.2341 C   0  0  0

+   -0.4589    1.3812    0.0000 H   0  0  0

+   -1.8611    1.4127    0.0000 H   0  0  0

+    1.8611    1.4127    0.0000 H   0  0  0

+    0.4589    1.3812    0.0000 H   0  0  0

+   -0.9402   -1.9904    0.0000 H   0  0  0

+    0.9402   -1.9904    0.0000 H   0  0  0

+   -3.1686   -0.9607    0.0000 H   0  0  0

+   -1.7664   -0.9923    0.0000 H   0  0  0

+    1.7664   -0.9923    0.0000 H   0  0  0

+    3.1686   -0.9607    0.0000 H   0  0  0

+   -2.9565    1.4319    0.0000 H   0  0  0

+   -4.3587    1.4635    0.0000 H   0  0  0

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+    2.9565    1.4319    0.0000 H   0  0  0

+   -5.4798    0.8484    0.0000 H   0  0  0

+   -5.8921   -0.6305    0.0000 H   0  0  0

+   -4.4132   -1.0428    0.0000 H   0  0  0

+    4.4132   -1.0428    0.0000 H   0  0  0

+    5.8921   -0.6305    0.0000 H   0  0  0

+    5.4798    0.8484    0.0000 H   0  0  0

+  1  2  1  0

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+  9 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+113600-15-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+    0.2095    0.6283    0.0061 C   0  0  0

+    0.3012   -0.7955    0.0034 C   0  0  0

+    1.5859    1.1649    0.0038 C   0  0  0

+   -1.0259    1.2427    0.0051 C   0  0  0

+    1.7351   -1.1509   -0.0004 C   0  0  0

+   -0.8455   -1.5631    0.0042 C   0  0  0

+    2.4403    0.0572    0.0000 C   0  0  0

+    2.1806    2.4148    0.0041 C   0  0  0

+   -2.1968    0.4696    0.0003 C   0  0  0

+    2.4854   -2.3140   -0.0039 C   0  0  0

+   -2.1056   -0.9466    0.0066 C   0  0  0

+    3.8352    0.1472   -0.0025 C   0  0  0

+    3.5708    2.5215    0.0006 C   0  0  0

+   -3.4645    1.0780   -0.0028 C   0  0  0

+    3.8779   -2.2413   -0.0069 C   0  0  0

+   -3.2852   -1.7128    0.0064 C   0  0  0

+    4.4003    1.4340   -0.0016 C   0  0  0

+    4.5609   -1.0563   -0.0060 C   0  0  0

+   -4.5858    0.3028   -0.0077 C   0  0  0

+   -4.4950   -1.0902    0.0076 C   0  0  0

+   -5.8020    0.8910   -0.0105 F   0  0  0

+   -1.0898    2.2891    0.0000 H   0  0  0

+   -0.7749   -2.6091    0.0000 H   0  0  0

+    1.5872    3.2791    0.0000 H   0  0  0

+    2.0079   -3.2473    0.0000 H   0  0  0

+    3.9995    3.4782    0.0000 H   0  0  0

+   -3.5469    2.1231    0.0000 H   0  0  0

+    4.4259   -3.1350    0.0000 H   0  0  0

+   -3.2324   -2.7598    0.0000 H   0  0  0

+    5.4412    1.5584    0.0000 H   0  0  0

+    5.6092   -1.0459    0.0000 H   0  0  0

+   -5.3717   -1.6650    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+619-90-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -2.2076   -0.0257    0.0384 C   0  0  0

+   -1.6539   -1.2487   -0.2900 C   0  0  0

+   -1.4062    0.9843    0.5376 C   0  0  0

+   -3.6576    0.2048   -0.1499 N   0  3  0

+   -0.2986   -1.4622   -0.1195 C   0  0  0

+   -0.0513    0.7709    0.7081 C   0  0  0

+   -4.1455    1.2826    0.1396 O   0  0  0

+   -4.3627   -0.6833   -0.5943 O   0  5  0

+    0.5026   -0.4525    0.3794 C   0  0  0

+    1.9799   -0.6850    0.5648 C   0  0  0

+    2.7244    0.2656   -0.2417 O   0  0  0

+    4.0665    0.2457   -0.2346 C   0  0  0

+    4.8392    1.2323   -1.0717 C   0  0  0

+    4.6551   -0.5631    0.4430 O   0  0  0

+   -2.2519   -2.0337    0.0000 H   0  0  0

+   -1.7648    1.9037    0.0000 H   0  0  0

+    0.0600   -2.3816    0.0000 H   0  0  0

+    0.5467    1.5559    0.0000 H   0  0  0

+    1.6643   -1.6200    0.0000 H   0  0  0

+    2.8483   -1.1538    0.0000 H   0  0  0

+    5.6161    0.6238    0.0000 H   0  0  0

+    5.4477    2.0092    0.0000 H   0  0  0

+    4.0623    1.8408    0.0000 H   0  0  0

+  1  2  2  0

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+  6 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83-75-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 60                          1 V2000

+   -0.5038    0.3270   -0.2465 C   0  0  1

+   -1.9611   -0.1134   -0.3995 C   0  0  1

+    0.3846   -0.5887   -1.0485 C   0  0  0

+   -0.3566    1.6887   -0.7288 O   0  0  0

+   -2.1278   -1.4294    0.2035 N   0  0  0

+   -2.8690    0.9201    0.2662 C   0  0  0

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+    0.0166   -1.0092   -2.2951 C   0  0  0

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+   -1.7827   -1.3701    1.6171 C   0  0  0

+   -3.6766    0.2290    1.3740 C   0  0  1

+    2.4174   -1.8995   -1.3211 C   0  0  0

+    2.0545   -0.6538    0.7441 C   0  0  0

+    0.8537   -1.8556   -3.0183 C   0  0  0

+    0.7141    3.7564   -0.6397 O   0  0  0

+    1.2979    2.0836    0.6942 O   0  0  0

+   -4.4788   -0.9127    0.7336 C   0  0  1

+   -2.6841   -0.3903    2.3681 C   0  0  0

+    3.6464   -2.3517   -0.8080 C   0  0  0

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+    3.2536   -1.1127    1.2105 C   0  0  0

+    1.7225    4.6264   -0.0613 C   0  0  0

+   -5.4314   -0.3462   -0.2875 C   0  0  0

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+    1.6671    5.9949   -0.7431 C   0  0  0

+   -6.7203   -0.5431   -0.1610 C   0  0  0

+    4.9479   -1.3686    2.6511 C   0  0  0

+    0.3986    0.6374    0.0000 H   0  0  0

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+    3.8457   -3.2849    0.0000 H   0  0  0

+    2.1700    3.7835    0.0000 H   0  0  0

+    2.6437    4.8757    0.0000 H   0  0  0

+   -5.2489    0.5905    0.0000 H   0  0  0

+    5.0007   -1.9826    0.0000 H   0  0  0

+    2.6206    6.0335    0.0000 H   0  0  0

+    1.6285    6.9484    0.0000 H   0  0  0

+    0.7136    5.9563    0.0000 H   0  0  0

+   -7.3168    0.2018    0.0000 H   0  0  0

+   -7.0672   -1.4321    0.0000 H   0  0  0

+    4.5236   -2.2234    0.0000 H   0  0  0

+    5.8027   -1.7929    0.0000 H   0  0  0

+    5.3722   -0.5138    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 15 21  1  0

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+ 27 52  1  0

+ 28 53  1  0

+ 28 54  1  0

+ 29 55  1  0

+ 29 56  1  0

+ 29 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92-66-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -1.1846    0.0001   -0.0014 C   0  0  0

+   -2.6685    0.0002   -0.0017 C   0  0  0

+   -0.4855    1.1337   -0.4106 C   0  0  0

+   -0.4856   -1.1319    0.4137 C   0  0  0

+   -3.3676   -1.1331   -0.4115 C   0  0  0

+   -3.3678    1.1319    0.4132 C   0  0  0

+    0.8947    1.1285   -0.4085 C   0  0  0

+    0.8941   -1.1270    0.4121 C   0  0  0

+   -4.7480   -1.1274   -0.4099 C   0  0  0

+   -4.7478    1.1265    0.4109 C   0  0  0

+    1.5841   -0.0001   -0.0008 C   0  0  0

+   -5.4369    0.0004   -0.0025 C   0  0  0

+    3.4751   -0.0003   -0.0004 Br  0  0  0

+   -0.9706    2.0067    0.0000 H   0  0  0

+   -0.9706   -2.0050    0.0000 H   0  0  0

+   -2.8827   -2.0063    0.0000 H   0  0  0

+   -2.8831    2.0052    0.0000 H   0  0  0

+    1.3850    1.9987    0.0000 H   0  0  0

+    1.3838   -1.9975    0.0000 H   0  0  0

+   -5.2384   -1.9975    0.0000 H   0  0  0

+   -5.2378    1.9968    0.0000 H   0  0  0

+   -6.4357    0.0008    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-61-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+    1.2304   -1.3242    0.0000 C   0  0  0

+    0.0000   -2.1943    0.0000 C   0  0  0

+    1.7937   -0.9258    1.1987 C   0  0  0

+    1.7970   -0.9307   -1.1983 C   0  0  0

+   -1.2305   -1.3242   -0.0001 C   0  0  0

+    2.9212   -0.1286    1.2023 C   0  0  0

+    2.9248   -0.1333   -1.2019 C   0  0  0

+   -1.7936   -0.9261   -1.1984 C   0  0  0

+   -1.7971   -0.9305    1.1986 C   0  0  0

+    3.4897    0.2733    0.0001 C   0  0  0

+   -2.9214   -0.1286   -1.2021 C   0  0  0

+   -2.9246   -0.1333    1.2021 C   0  0  0

+    4.6298    1.0801    0.0001 N   0  0  0

+   -3.4897    0.2733   -0.0002 C   0  0  0

+    5.2280    1.5030   -1.2687 C   0  0  0

+    5.2276    1.5035    1.2688 C   0  0  0

+   -4.6298    1.0801   -0.0003 N   0  0  0

+   -5.2280    1.5031    1.2684 C   0  0  0

+   -5.2276    1.5034   -1.2691 C   0  0  0

+   -0.3659   -2.6042    0.0000 H   0  0  0

+    0.3659   -2.6042    0.0000 H   0  0  0

+    1.4765   -0.4772    0.0000 H   0  0  0

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+ 19 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+9041-93-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+367376                          1 V2000

+  -29.5563    1.1748   -2.5428 C   0  0  1

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+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112-57-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 35                          1 V2000

+    0.0000   -0.4124   -0.0045 N   0  0  0

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+ 13 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+599-07-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 82 86                          1 V2000

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+ 36 82  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78113-36-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+140140                          1 V2000

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+ 62140  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3228-99-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -1.2885   -0.9705    0.0000 C   0  0  0

+   -1.2483    0.0492    0.8833 C   0  0  0

+    0.0492    1.2483   -0.8833 C   0  0  0

+    1.2483   -0.0492    0.8833 C   0  0  0

+   -0.0492   -1.2483   -0.8833 C   0  0  0

+   -2.7192    0.1072   -0.1576 Cl  0  0  0

+    0.1072    2.7192    0.1576 Cl  0  0  0

+    2.7192   -0.1072   -0.1576 Cl  0  0  0

+   -0.1072   -2.7192    0.1576 Cl  0  0  0

+   -0.2286    0.0090    0.0000 H   0  0  0

+   -1.2081    1.0689    0.0000 H   0  0  0

+    0.6848    0.4499    0.0000 H   0  0  0

+    1.0190    1.5659    0.0000 H   0  0  0

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+    0.5582    0.7025    0.0000 H   0  0  0

+    0.9662   -1.3500    0.0000 H   0  0  0

+    0.1135   -0.2409    0.0000 H   0  0  0

+  2  1  1  0

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+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1141-35-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    0.7256    0.0129   -0.0024 C   0  0  0

+   -0.7523    0.0106   -0.0019 C   0  0  0

+    1.4743    1.0866   -0.0019 N   0  0  0

+    1.4993   -1.0891    0.0024 O   0  0  0

+   -1.4513   -1.1981   -0.0025 C   0  0  0

+   -1.4549    1.2166    0.0050 C   0  0  0

+    2.7786    0.7093   -0.0021 C   0  0  0

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+   -2.8302   -1.1939   -0.0021 C   0  0  0

+   -2.8342    1.2080    0.0054 C   0  0  0

+    3.9861    1.4120   -0.0018 C   0  0  0

+    4.0016   -1.3725    0.0040 C   0  0  0

+   -3.5219    0.0062   -0.0010 C   0  0  0

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+   -5.2579    0.0034   -0.0005 Cl  0  0  0

+   -0.9337   -2.0986    0.0000 H   0  0  0

+   -0.9401    2.1187    0.0000 H   0  0  0

+   -3.3512   -2.0924    0.0000 H   0  0  0

+   -3.3581    2.1049    0.0000 H   0  0  0

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+    4.0160   -2.4111    0.0000 H   0  0  0

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+    6.0909   -1.1750    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3096-52-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.4005   -0.7480   -0.0006 C   0  0  0

+   -1.8862   -0.7111   -0.0005 C   0  0  0

+    0.0813    0.5718   -0.0001 C   0  0  0

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+   -2.8374   -1.7218   -0.0012 C   0  0  0

+   -1.0886    1.4815    0.0004 C   0  0  0

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+   -3.6582    0.9355    0.0001 C   0  0  0

+   -4.1866   -1.4044   -0.0013 C   0  0  0

+   -1.0587    2.6955    0.0012 O   0  0  0

+    2.3359   -0.2564   -0.0008 C   0  0  0

+   -4.5949   -0.0847   -0.0006 C   0  0  0

+    3.7943   -0.0032   -0.0009 N   0  3  0

+    4.5747   -0.9384   -0.0013 O   0  0  0

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+    0.1505   -2.7846    0.0000 H   0  0  0

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+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+422-56-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+   -0.2036   -0.6335    0.1629 C   0  0  0

+   -1.5296    0.0695   -0.1345 C   0  0  0

+    0.9355    0.1075   -0.5401 C   0  0  0

+    0.0236   -0.6359    1.5434 F   0  0  0

+   -0.2599   -1.9516   -0.3026 F   0  0  0

+   -2.5711   -0.6081    0.5084 F   0  0  0

+   -1.4733    1.3875    0.3311 F   0  0  0

+   -1.7568    0.0718   -1.5149 F   0  0  0

+    1.0080    1.8062    0.0600 Cl  0  0  0

+    2.4980   -0.7209   -0.1896 Cl  0  0  0

+    0.0760    0.5977    0.0000 H   0  0  0

+  1  2  1  0

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+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95331-48-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.6453   -0.5118    0.0895 C   0  0  0

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+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+958-93-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 39                          1 V2000

+   -1.2459   -0.1320    0.0593 N   0  0  0

+   -1.7425   -1.3862   -0.2758 C   0  0  0

+   -1.4154    0.9934   -0.8632 C   0  0  0

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+   -5.1547    2.2059   -0.7284 S   0  0  0

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+ 18 38  1  0

+ 19 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67151-57-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -1.6491    0.6837   -0.4400 C   0  0  0

+   -2.6601   -0.2527   -0.2573 C   0  0  0

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+    0.3584   -0.2206    0.3078 N   0  3  0

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+  8 28  1  0

+  9 29  1  0

+ 15 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94-62-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 42                          1 V2000

+   -4.9136    0.4820    0.1881 C   0  0  0

+   -4.9902   -0.8971   -0.0139 C   0  0  0

+   -3.6835    1.1083    0.2184 C   0  0  0

+   -6.1806    0.9734    0.3210 O   0  0  0

+   -3.8302   -1.6418   -0.1849 C   0  0  0

+   -6.3035   -1.2659   -0.0008 O   0  0  0

+   -2.5142    0.3578    0.0460 C   0  0  0

+   -7.0460   -0.0482   -0.2084 C   0  0  0

+   -2.5992   -1.0251   -0.1561 C   0  0  0

+   -1.2029    1.0188    0.0775 C   0  0  0

+   -0.0736    0.2908   -0.0895 C   0  0  0

+    1.1856    0.9255   -0.0592 C   0  0  0

+    2.3182    0.1954   -0.2266 C   0  0  0

+    3.5820    0.8324   -0.1963 C   0  0  0

+    4.7061    0.1077   -0.3625 N   0  0  0

+    3.6534    2.0352   -0.0200 O   0  0  0

+    6.0249    0.7546   -0.3335 C   0  0  0

+    4.6363   -1.3451   -0.5701 C   0  0  0

+    6.9035    0.0371    0.6961 C   0  0  0

+    5.5335   -2.0344    0.4627 C   0  0  0

+    6.9439   -1.4582    0.3726 C   0  0  0

+   -3.6319    2.1423    0.0000 H   0  0  0

+   -3.8852   -2.6756    0.0000 H   0  0  0

+   -7.7601    0.7014    0.0000 H   0  0  0

+   -7.8674   -0.6783    0.0000 H   0  0  0

+   -1.7354   -1.5958    0.0000 H   0  0  0

+   -1.1482    2.0526    0.0000 H   0  0  0

+   -0.1283   -0.7430    0.0000 H   0  0  0

+    1.2403    1.9593    0.0000 H   0  0  0

+    2.2635   -0.8384    0.0000 H   0  0  0

+    6.7875    1.4547    0.0000 H   0  0  0

+    5.4409    1.6094    0.0000 H   0  0  0

+    3.6333   -1.0886    0.0000 H   0  0  0

+    4.1834   -2.2761    0.0000 H   0  0  0

+    7.9160   -0.1790    0.0000 H   0  0  0

+    7.3515    0.9704    0.0000 H   0  0  0

+    4.7688   -2.7323    0.0000 H   0  0  0

+    6.0867   -2.9094    0.0000 H   0  0  0

+    7.2176   -2.4566    0.0000 H   0  0  0

+    7.9680   -1.3063    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+ 10 11  2  0

+ 11 12  1  0

+ 12 13  2  0

+ 13 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+ 15 17  1  0

+ 15 18  1  0

+ 17 19  1  0

+ 18 20  1  0

+ 19 21  1  0

+  6  8  1  0

+  7  9  1  0

+ 20 21  1  0

+  3 22  1  0

+  5 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 21 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+125279-82-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -2.1570    0.0025    0.0072 C   0  0  0

+   -1.7971   -1.3314    0.0531 C   0  0  0

+   -1.1841    0.9807   -0.0881 C   0  0  0

+   -3.5862    0.3841    0.0541 N   0  3  0

+   -0.4638   -1.6905    0.0038 C   0  0  0

+    0.1501    0.6269   -0.1378 C   0  0  0

+   -3.9045    1.5591    0.0138 O   0  0  0

+   -4.4441   -0.4768    0.1331 O   0  5  0

+    0.5139   -0.7113   -0.0919 C   0  0  0

+    1.8260   -1.0619   -0.1402 O   0  0  0

+    2.5746    0.1516   -0.2357 C   0  0  0

+    4.0684   -0.1740   -0.2942 C   0  0  0

+    4.8699    1.1253   -0.3965 C   0  0  0

+    4.7274    0.4091    0.8318 O   0  0  0

+   -2.5292   -2.0638    0.0000 H   0  0  0

+   -1.4548    1.9803    0.0000 H   0  0  0

+   -0.1960   -2.6909    0.0000 H   0  0  0

+    0.8801    1.3615    0.0000 H   0  0  0

+    2.9076    1.1322    0.0000 H   0  0  0

+    1.6376    0.5927    0.0000 H   0  0  0

+    4.3295   -1.1762    0.0000 H   0  0  0

+    5.8831    1.3396    0.0000 H   0  0  0

+    4.2739    1.9722    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  9 10  1  0

+ 10 11  1  0

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+ 12 14  1  0

+  6  9  1  0

+ 13 14  1  0

+  2 15  1  0

+  3 16  1  0

+  5 17  1  0

+  6 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5234-06-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -1.9553    0.6210    0.0016 C   0  0  0

+   -2.0842   -0.7909   -0.0046 C   0  0  0

+   -0.6760    1.1964    0.0658 C   0  0  0

+   -3.1116    1.4188   -0.0506 C   0  0  0

+   -0.9295   -1.5902    0.0534 C   0  0  0

+   -3.3653   -1.3649   -0.0684 C   0  0  0

+    0.4251    0.3898    0.1211 C   0  0  0

+   -4.3359    0.8272   -0.1064 C   0  0  0

+    0.2955   -1.0023    0.1148 C   0  0  0

+   -4.4620   -0.5607   -0.1230 C   0  0  0

+    1.6626    0.9477    0.1827 O   0  0  0

+    2.5997   -0.1300    0.2300 C   0  0  0

+    4.0208    0.4325    0.3008 C   0  0  0

+    5.0242   -0.7215    0.3514 C   0  0  0

+    4.7584    0.0091   -0.8476 O   0  0  0

+   -0.5663    2.2392    0.0000 H   0  0  0

+   -3.0310    2.4643    0.0000 H   0  0  0

+   -1.0123   -2.6355    0.0000 H   0  0  0

+   -3.4760   -2.4076    0.0000 H   0  0  0

+   -5.1980    1.4241    0.0000 H   0  0  0

+    1.1561   -1.6014    0.0000 H   0  0  0

+   -5.4179   -0.9918    0.0000 H   0  0  0

+    1.7359   -0.7245    0.0000 H   0  0  0

+    3.0930   -1.0553    0.0000 H   0  0  0

+    4.0963    1.4784    0.0000 H   0  0  0

+    4.5646   -1.6640    0.0000 H   0  0  0

+    6.0713   -0.7764    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 13 15  1  0

+  7  9  2  0

+  8 10  1  0

+ 14 15  1  0

+  3 16  1  0

+  4 17  1  0

+  5 18  1  0

+  6 19  1  0

+  8 20  1  0

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+ 10 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3074-03-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.2581    0.4709   -0.0036 C   0  0  0

+    0.0578   -0.9324   -0.0011 C   0  0  0

+    1.7195    0.7349   -0.0023 C   0  0  0

+   -0.8125    1.3214   -0.0016 C   0  0  0

+    1.3910   -1.5765    0.0019 C   0  0  0

+   -1.2173   -1.4603   -0.0016 C   0  0  0

+    2.3998   -0.4947    0.0010 C   0  0  0

+    2.4461    1.9197   -0.0034 C   0  0  0

+   -2.1235    0.8064    0.0030 C   0  0  0

+    1.6147   -2.7709    0.0049 O   0  0  0

+   -2.3284   -0.5963   -0.0047 C   0  0  0

+    3.7922   -0.5154    0.0024 C   0  0  0

+    3.8294    1.8833   -0.0012 C   0  0  0

+   -3.2356    1.6625    0.0057 C   0  0  0

+   -3.6381   -1.1019   -0.0048 C   0  0  0

+    4.4989    0.6730    0.0005 C   0  0  0

+   -4.4938    1.1369    0.0106 C   0  0  0

+   -4.6946   -0.2402   -0.0073 C   0  0  0

+   -0.6580    2.3543    0.0000 H   0  0  0

+   -1.3570   -2.4953    0.0000 H   0  0  0

+    1.9480    2.8377    0.0000 H   0  0  0

+    4.3018   -1.4270    0.0000 H   0  0  0

+    4.3717    2.7759    0.0000 H   0  0  0

+   -3.1000    2.6981    0.0000 H   0  0  0

+   -3.8023   -2.1333    0.0000 H   0  0  0

+    5.5432    0.6567    0.0000 H   0  0  0

+   -5.3189    1.7772    0.0000 H   0  0  0

+   -5.6680   -0.6188    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  8 13  2  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 14 17  2  0

+ 15 18  2  0

+  5  7  1  0

+  9 11  1  0

+ 13 16  1  0

+ 17 18  1  0

+  4 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+621-90-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.9320    0.4625   -0.0013 C   0  0  0

+   -0.4241    0.6124   -0.0015 N   0  0  0

+    1.7621    1.5887   -0.0014 C   0  0  0

+    1.4963   -0.8180    0.0047 C   0  0  0

+   -1.1879   -0.4271   -0.0014 N   0  0  0

+    3.1298    1.4333   -0.0013 C   0  0  0

+    2.8645   -0.9651    0.0048 C   0  0  0

+   -2.5468   -0.2769   -0.0016 C   0  0  0

+    3.6871    0.1581   -0.0011 C   0  0  0

+   -3.3773   -1.4006   -0.0015 C   0  0  0

+   -3.1120    1.0013    0.0040 C   0  0  0

+    5.0711    0.0051   -0.0010 N   0  0  0

+   -4.7474   -1.2413   -0.0017 C   0  0  0

+   -4.4834    1.1450    0.0037 C   0  0  0

+    5.6598   -1.3364   -0.0008 C   0  0  0

+   -5.2998    0.0273   -0.0020 C   0  0  0

+    1.3471    2.5402    0.0000 H   0  0  0

+    0.8835   -1.6559    0.0000 H   0  0  0

+    3.7464    2.2684    0.0000 H   0  0  0

+    3.2838   -1.9147    0.0000 H   0  0  0

+   -2.9642   -2.3529    0.0000 H   0  0  0

+   -2.5009    1.8404    0.0000 H   0  0  0

+    5.6858    0.8416    0.0000 H   0  0  0

+   -5.3656   -2.0752    0.0000 H   0  0  0

+   -4.9046    2.0938    0.0000 H   0  0  0

+    4.7092   -1.7535    0.0000 H   0  0  0

+    6.0769   -2.2870    0.0000 H   0  0  0

+    6.6104   -0.9193    0.0000 H   0  0  0

+   -6.3316    0.1414    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  2  0

+ 12 15  1  0

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+  7  9  1  0

+ 14 16  1  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63104-32-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.4580   -0.3236   -0.0015 C   0  0  0

+   -1.8127    0.0520   -0.0013 C   0  0  0

+    0.5419    0.6656   -0.0002 C   0  0  0

+   -0.0978   -1.7422    0.0030 C   0  0  0

+   -2.1535    1.4244    0.0003 C   0  0  0

+   -2.8227   -0.9360   -0.0021 C   0  0  0

+    1.9402    0.2409   -0.0004 C   0  0  0

+    0.1782    2.0253    0.0018 C   0  0  0

+    1.2372   -2.1120    0.0024 C   0  0  0

+   -1.1673   -2.7406    0.0077 C   0  0  0

+   -1.1271    2.3953    0.0012 C   0  0  0

+   -3.5058    1.7866    0.0006 C   0  0  0

+   -2.4608   -2.3509   -0.0038 C   0  0  0

+   -4.1598   -0.5329   -0.0019 C   0  0  0

+    2.2525   -1.1421   -0.0019 C   0  0  0

+    2.9759    1.1833    0.0003 C   0  0  0

+   -4.4820    0.8122   -0.0008 C   0  0  0

+    3.6058   -1.5354   -0.0026 C   0  0  0

+    4.2734    0.7655   -0.0004 C   0  0  0

+    2.6569    2.6562    0.0014 C   0  0  0

+    4.5857   -0.5918   -0.0018 C   0  0  0

+    0.9293    2.7653    0.0000 H   0  0  0

+    1.4941   -3.1346    0.0000 H   0  0  0

+   -0.9278   -3.7674    0.0000 H   0  0  0

+   -1.3784    3.4193    0.0000 H   0  0  0

+   -3.7783    2.8051    0.0000 H   0  0  0

+   -3.2219   -3.0805    0.0000 H   0  0  0

+   -4.9265   -1.2566    0.0000 H   0  0  0

+   -5.4966    1.0991    0.0000 H   0  0  0

+    3.8583   -2.5591    0.0000 H   0  0  0

+    5.0501    1.4785    0.0000 H   0  0  0

+    3.6874    2.8794    0.0000 H   0  0  0

+    2.4337    3.6867    0.0000 H   0  0  0

+    1.6264    2.4330    0.0000 H   0  0  0

+    5.5963   -0.8923    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

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+  8 11  2  0

+  9 15  2  0

+ 10 13  1  0

+ 14 17  2  0

+ 19 21  1  0

+  8 22  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110-97-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    2.4257   -0.1330   -0.3356 C   0  0  0

+    1.1675    0.7200   -0.1616 C   0  0  0

+    3.6416    0.7803   -0.5039 C   0  0  0

+    2.6053   -0.9576    0.8175 O   0  0  0

+    0.0000   -0.1569    0.0000 N   0  0  0

+   -1.1675    0.7200    0.1615 C   0  0  0

+   -2.4257   -0.1329    0.3356 C   0  0  0

+   -3.6416    0.7804    0.5038 C   0  0  0

+   -2.6053   -0.9577   -0.8174 O   0  0  0

+    1.5000   -0.7592    0.0000 H   0  0  0

+    1.8926    1.5704    0.0000 H   0  0  0

+    0.4021    1.5343    0.0000 H   0  0  0

+    4.3128   -0.1133    0.0000 H   0  0  0

+    4.5352    1.4515    0.0000 H   0  0  0

+    2.9704    1.6739    0.0000 H   0  0  0

+    2.8431   -2.0496    0.0000 H   0  0  0

+    0.0000   -1.2745    0.0000 H   0  0  0

+   -0.4021    1.5343    0.0000 H   0  0  0

+   -1.8926    1.5704    0.0000 H   0  0  0

+   -1.5000   -0.7591    0.0000 H   0  0  0

+   -2.9704    1.6740    0.0000 H   0  0  0

+   -4.5352    1.4516    0.0000 H   0  0  0

+   -4.3128   -0.1132    0.0000 H   0  0  0

+   -2.8431   -2.0497    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  7  9  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25953-06-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+   -2.5053    0.5679   -0.0642 C   0  0  0

+   -3.1340    1.7980   -0.0935 N   0  0  0

+   -1.3684    0.3988    0.7212 C   0  0  0

+   -3.0253   -0.4891   -0.8201 C   0  0  0

+   -4.3765    2.0036    0.6550 C   0  0  0

+   -2.5582    2.8966   -0.8731 C   0  0  0

+   -0.7319   -0.8254    0.7590 C   0  0  0

+   -2.4352   -1.7106   -0.8156 C   0  0  0

+   -4.0497    2.2374    2.1313 C   0  0  0

+   -2.9159    2.7163   -2.3497 C   0  0  0

+   -1.2729   -1.9310   -0.0367 C   0  0  0

+    0.3744   -1.0023    1.5194 O   0  0  0

+   -0.6858   -3.1214   -0.0237 N   0  0  0

+   -1.1435   -4.0335   -0.6887 O   0  0  0

+   10.4075    0.8090   -0.0939 Cl  0  0  0

+   -0.8428    1.1358    0.0000 H   0  0  0

+   -3.9305   -0.4859    0.0000 H   0  0  0

+   -5.0759    2.5783    0.0000 H   0  0  0

+   -4.7505    1.1793    0.0000 H   0  0  0

+   -1.6655    2.7468    0.0000 H   0  0  0

+   -2.6938    3.7916    0.0000 H   0  0  0

+   -2.9860   -2.4290    0.0000 H   0  0  0

+   -3.5230    1.5012    0.0000 H   0  0  0

+   -3.3135    2.7641    0.0000 H   0  0  0

+   -4.5764    2.9736    0.0000 H   0  0  0

+   -3.3233    3.5246    0.0000 H   0  0  0

+   -3.7242    2.3089    0.0000 H   0  0  0

+   -2.5085    1.9080    0.0000 H   0  0  0

+    1.2682   -1.1452    0.0000 H   0  0  0

+   11.3127    0.8090    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+ 11 13  1  0

+ 13 14  2  0

+  8 11  2  0

+  3 16  1  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  6 20  1  0

+  6 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+150-78-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.3841   -0.2565    0.0021 C   0  0  0

+   -0.6905   -1.4578    0.0015 C   0  0  0

+   -0.6908    0.9445    0.0016 C   0  0  0

+   -2.7440   -0.2565   -0.0026 O   0  0  0

+    0.6905   -1.4578    0.0005 C   0  0  0

+    0.6908    0.9445    0.0006 C   0  0  0

+   -3.1570    1.1115   -0.0007 C   0  0  0

+    1.3841   -0.2565    0.0001 C   0  0  0

+    2.7440   -0.2565   -0.0009 O   0  0  0

+    3.1570    1.1115   -0.0011 C   0  0  0

+   -1.2105   -2.3585    0.0000 H   0  0  0

+   -1.2109    1.8452    0.0000 H   0  0  0

+    1.2105   -2.3585    0.0000 H   0  0  0

+    1.2109    1.8452    0.0000 H   0  0  0

+   -2.1613    1.4121    0.0000 H   0  0  0

+   -3.4576    2.1072    0.0000 H   0  0  0

+   -4.1527    0.8109    0.0000 H   0  0  0

+    4.1527    0.8109    0.0000 H   0  0  0

+    3.4576    2.1072    0.0000 H   0  0  0

+    2.1613    1.4121    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  9 10  1  0

+  6  8  2  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6201-87-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -2.3233    0.2999    0.0610 S   0  0  0

+   -2.2463    1.5153    0.7932 O   0  0  0

+   -3.1692   -0.7977    0.3756 O   0  0  0

+   -2.6755    0.6979   -1.3652 O   0  0  0

+   -0.6855   -0.3494    0.0375 C   0  0  0

+    0.4000    0.5129    0.0215 C   0  0  0

+   -0.4863   -1.7154    0.0407 C   0  0  0

+    0.2020    1.8558    0.0240 O   0  0  0

+    1.7023   -0.0052    0.0033 C   0  0  0

+    0.8028   -2.2374    0.0227 C   0  0  0

+    2.8615    0.9052   -0.0142 C   0  0  0

+    1.8963   -1.3889    0.0013 C   0  0  0

+    0.9948   -3.6238    0.0262 N   0  0  0

+    2.6953    2.1029    0.1058 O   0  0  0

+    4.1056    0.4093   -0.1633 O   0  0  0

+   -3.3643    1.4762    0.0000 H   0  0  0

+   -1.3039   -2.3571    0.0000 H   0  0  0

+    0.0504    2.8840    0.0000 H   0  0  0

+    2.8592   -1.7800    0.0000 H   0  0  0

+    0.1745   -4.2620    0.0000 H   0  0  0

+    1.9576   -4.0151    0.0000 H   0  0  0

+    5.0710    0.0245    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  2  0

+  4  1  1  0

+  5  1  1  0

+  6  5  2  0

+  7  5  1  0

+  8  6  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  9  1  0

+ 12  9  2  0

+ 13 10  1  0

+ 14 11  2  0

+ 15 11  1  0

+ 10 12  1  0

+  4 16  1  0

+  7 17  1  0

+  8 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 15 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2402-77-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    0.0848    0.7252    0.0027 C   0  0  0

+    0.1846   -0.6563    0.0003 C   0  0  0

+    1.2445    1.4856    0.0028 C   0  0  0

+   -1.4713    1.4946   -0.0015 Cl  0  0  0

+    1.3644   -1.2468   -0.0020 N   0  0  0

+   -1.2585   -1.6214    0.0008 Cl  0  0  0

+    2.4654    0.8276    0.0004 C   0  0  0

+    2.4868   -0.5537   -0.0020 C   0  0  0

+    1.1998    2.5241    0.0000 H   0  0  0

+    3.3537    1.3673    0.0000 H   0  0  0

+    3.3985   -1.0530    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  7  8  2  0

+  3  9  1  0

+  7 10  1  0

+  8 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-37-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -2.0094    0.0616   -0.0746 S   0  0  0

+   -2.5217   -1.0761   -0.7546 O   0  0  0

+   -2.2278    1.4137   -0.4535 O   0  0  0

+   -2.5105   -0.0525    1.3580 O   0  0  0

+   -0.2604   -0.1491   -0.0392 C   0  0  0

+    0.5675    0.9577   -0.0368 C   0  0  0

+    0.2804   -1.4211   -0.0080 C   0  0  0

+    1.9447    0.7933   -0.0085 C   0  0  0

+    1.6523   -1.5928    0.0203 C   0  0  0

+    2.7851    1.9125   -0.0056 N   0  0  0

+    2.4889   -0.4889    0.0175 C   0  0  0

+    3.8384   -0.6563    0.0453 O   0  0  0

+   -3.5214   -0.2827    0.0000 H   0  0  0

+    0.1591    1.9107    0.0000 H   0  0  0

+   -0.3443   -2.2486    0.0000 H   0  0  0

+    2.0550   -2.5482    0.0000 H   0  0  0

+    3.8144    1.7879    0.0000 H   0  0  0

+    2.3784    2.8662    0.0000 H   0  0  0

+    4.8673   -0.7839    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  2  0

+  4  1  1  0

+  5  1  1  0

+  6  5  2  0

+  7  5  1  0

+  8  6  1  0

+  9  7  2  0

+ 10  8  1  0

+ 11  8  2  0

+ 12 11  1  0

+  9 11  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+22224-92-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 41                          1 V2000

+    1.8334   -0.2048   -0.0347 P   0  0  0

+    1.0220    0.7052    1.0168 O   0  0  0

+    3.4866    0.0070    0.1988 N   0  0  0

+    1.4535   -1.7531    0.1905 O   0  0  0

+    1.4746    0.1957   -1.4135 O   0  0  0

+   -0.2970    0.5788    0.7103 C   0  0  0

+    3.7588    1.4388    0.0153 C   0  0  0

+    1.9258   -2.4650   -0.9550 C   0  0  0

+   -1.0394   -0.4570    1.2576 C   0  0  0

+   -0.9002    1.4893   -0.1452 C   0  0  0

+    4.3302    2.0194    1.3104 C   0  0  0

+    4.7710    1.6244   -1.1169 C   0  0  0

+    1.5949   -3.9511   -0.8039 C   0  0  0

+   -2.3789   -0.5863    0.9471 C   0  0  0

+   -2.2392    1.3620   -0.4570 C   0  0  0

+   -2.9825    0.3214    0.0863 C   0  0  0

+   -3.1855   -1.7116    1.5424 C   0  0  0

+   -4.6912    0.1572   -0.3113 S   0  0  0

+   -4.8922    1.5724   -1.4282 C   0  0  0

+    4.1678   -0.7166    0.0000 H   0  0  0

+    2.8785    1.9000    0.0000 H   0  0  0

+    2.8098   -2.9190    0.0000 H   0  0  0

+    2.5883   -1.7243    0.0000 H   0  0  0

+   -0.5434   -1.3181    0.0000 H   0  0  0

+   -0.4720    2.3861    0.0000 H   0  0  0

+    5.0385    1.3223    0.0000 H   0  0  0

+    5.0273    2.7277    0.0000 H   0  0  0

+    3.6219    2.7165    0.0000 H   0  0  0

+    4.9502    0.6469    0.0000 H   0  0  0

+    5.7485    1.8036    0.0000 H   0  0  0

+    4.5918    2.6019    0.0000 H   0  0  0

+    0.6249   -3.7351    0.0000 H   0  0  0

+    1.3789   -4.9211    0.0000 H   0  0  0

+    2.5649   -4.1671    0.0000 H   0  0  0

+   -2.7353    2.2231    0.0000 H   0  0  0

+   -3.9932   -1.1326    0.0000 H   0  0  0

+   -3.7645   -2.5193    0.0000 H   0  0  0

+   -2.3778   -2.2906    0.0000 H   0  0  0

+   -3.9083    1.7121    0.0000 H   0  0  0

+   -5.0319    2.5563    0.0000 H   0  0  0

+   -5.8761    1.4327    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  2  0

+ 14 16  2  0

+ 14 17  1  0

+ 16 18  1  0

+ 18 19  1  0

+ 15 16  1  0

+  3 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 13 34  1  0

+ 15 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 17 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+399-10-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.5322    1.2072   -0.0038 C   0  0  0

+   -0.6955    0.4125   -0.0034 C   0  0  0

+    0.4703    2.4231   -0.0002 O   0  0  0

+    1.8481    0.5343   -0.0024 C   0  0  0

+   -1.8979    1.0274    0.0010 C   0  0  0

+    3.0222    1.2908   -0.0029 C   0  0  0

+    1.9220   -0.8608    0.0051 C   0  0  0

+   -3.1329    0.2281    0.0015 C   0  0  0

+    4.2468    0.6579   -0.0016 C   0  0  0

+    3.1515   -1.4831    0.0063 C   0  0  0

+   -4.3802    0.8611    0.0060 C   0  0  0

+   -3.0660   -1.1694   -0.0084 C   0  0  0

+    4.3143   -0.7270    0.0000 C   0  0  0

+   -5.5331    0.1047    0.0064 C   0  0  0

+   -4.2279   -1.9114   -0.0079 C   0  0  0

+    5.5171   -1.3421    0.0012 F   0  0  0

+   -5.4585   -1.2772    0.0024 C   0  0  0

+   -0.6427   -0.6253    0.0000 H   0  0  0

+   -1.9507    2.0652    0.0000 H   0  0  0

+    2.9727    2.3287    0.0000 H   0  0  0

+    1.0515   -1.4282    0.0000 H   0  0  0

+    5.1209    1.2197    0.0000 H   0  0  0

+    3.2076   -2.5207    0.0000 H   0  0  0

+   -4.4378    1.8986    0.0000 H   0  0  0

+   -2.1430   -1.6468    0.0000 H   0  0  0

+   -6.4604    0.5735    0.0000 H   0  0  0

+   -4.1799   -2.9494    0.0000 H   0  0  0

+   -6.3308   -1.8418    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  2  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 13  1  0

+ 17 14  2  0

+ 10 13  1  0

+ 15 17  1  0

+  2 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+619-24-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.8187    0.1750   -0.0033 C   0  0  0

+   -0.3411   -0.5714   -0.0029 C   0  0  0

+    0.7556    1.5574   -0.0010 C   0  0  0

+    2.1337   -0.5041   -0.0001 N   0  3  0

+   -1.5811    0.0710    0.0000 C   0  0  0

+   -0.4693    2.2003    0.0018 C   0  0  0

+    3.1588    0.1537   -0.0005 O   0  0  0

+    2.1908   -1.7208    0.0030 O   0  5  0

+   -1.6374    1.4660    0.0023 C   0  0  0

+   -2.7894   -0.6975    0.0000 C   0  0  0

+   -3.7479   -1.3072    0.0000 N   0  0  0

+   -0.2924   -1.6078    0.0000 H   0  0  0

+    1.6310    2.1143    0.0000 H   0  0  0

+   -0.5097    3.2370    0.0000 H   0  0  0

+   -2.5555    1.9494    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+ 10 11  3  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+585-71-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.4363    1.0736   -0.1247 C   0  0  0

+   -1.8089   -0.3339   -0.1382 Br  0  0  0

+   -0.6373    1.9702    1.0986 C   0  0  0

+    0.9305    0.4417   -0.0653 C   0  0  0

+    2.0123    1.0792   -0.6429 C   0  0  0

+    1.1034   -0.7730    0.5720 C   0  0  0

+    3.2663    0.4995   -0.5884 C   0  0  0

+    2.3570   -1.3525    0.6266 C   0  0  0

+    3.4381   -0.7176    0.0437 C   0  0  0

+    0.2965    1.6651    0.0000 H   0  0  0

+    0.2816    2.1762    0.0000 H   0  0  0

+   -0.8433    2.8891    0.0000 H   0  0  0

+   -1.5562    1.7642    0.0000 H   0  0  0

+    1.9655    2.0198    0.0000 H   0  0  0

+    0.3478   -1.3351    0.0000 H   0  0  0

+    4.0222    1.0612    0.0000 H   0  0  0

+    2.4031   -2.2931    0.0000 H   0  0  0

+    4.2862   -1.1270    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  2  0

+  9  7  2  0

+  8  9  1  0

+  1 10  1  0

+  3 11  1  0

+  3 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103-76-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.1962    0.1569    0.0004 N   0  0  0

+   -0.4558   -1.0033   -0.6195 C   0  0  0

+   -0.7378    1.2835   -0.1166 C   0  0  0

+    1.3591    0.4841   -0.8353 C   0  0  0

+   -1.7489   -1.3274    0.1295 C   0  0  0

+   -2.0309    0.9594    0.6324 C   0  0  0

+    2.6062    0.5894    0.0448 C   0  0  0

+   -2.6828   -0.2008    0.0125 N   0  0  0

+    2.9340   -0.7014    0.5628 O   0  0  0

+   -0.4627   -2.0021    0.0000 H   0  0  0

+    0.5096   -1.2596    0.0000 H   0  0  0

+    0.1172    1.7999    0.0000 H   0  0  0

+   -1.1217    2.2056    0.0000 H   0  0  0

+    1.7259    1.4131    0.0000 H   0  0  0

+    0.6896    1.2254    0.0000 H   0  0  0

+   -2.6039   -1.8438    0.0000 H   0  0  0

+   -1.3651   -2.2495    0.0000 H   0  0  0

+   -2.0240    1.9582    0.0000 H   0  0  0

+   -2.9963    1.2156    0.0000 H   0  0  0

+    3.5863    0.7818    0.0000 H   0  0  0

+    2.4678    1.5786    0.0000 H   0  0  0

+   -3.6776   -0.2907    0.0000 H   0  0  0

+    3.1799   -1.6695    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78967-07-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+    0.7913    0.9411    0.4299 C   0  0  0

+   -0.4368    1.7459    0.2869 C   0  0  0

+    1.7673    1.8882    0.5485 C   0  0  0

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+   -1.8242    1.2501    0.1209 C   0  0  0

+   -0.0381    2.9933    0.3380 N   0  0  0

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+    0.6268   -1.2525    1.6029 C   0  0  0

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+    1.3178   -4.6469    0.4946 O   0  0  0

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+    1.7752   -5.0337   -0.8028 C   0  0  0

+   -5.6215   -1.2566   -1.2186 C   0  0  0

+    2.6315    0.8741    0.0000 H   0  0  0

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+   -3.4709   -1.2876    0.0000 H   0  0  0

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+   -6.6020   -1.3141    0.0000 H   0  0  0

+   -5.5640   -2.2371    0.0000 H   0  0  0

+   -4.6410   -1.1991    0.0000 H   0  0  0

+  1  2  1  0

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+ 24 39  1  0

+ 25 40  1  0

+ 25 41  1  0

+ 25 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+112022-08-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+   -0.9538    0.5879    0.1524 C   0  0  0

+   -1.9630    1.5453   -0.0154 C   0  0  0

+    0.3867    1.0170    0.0335 C   0  0  0

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+   -0.3419    3.2801   -0.3734 C   0  0  0

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+   -2.5513   -2.5630    0.0490 C   0  0  0

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+    6.1945   -1.6954   -0.9295 C   0  0  0

+    7.5457   -0.0170    0.0263 C   0  0  0

+   -2.4147    3.5845    0.0000 H   0  0  0

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+    5.9696    0.8899    0.0000 H   0  0  0

+    4.6081    1.0496    0.0000 H   0  0  0

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+  1  2  2  0

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+ 22 38  1  0

+ 23 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13674-87-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 34                          1 V2000

+    0.0113   -0.5383   -0.7608 P   0  0  0

+    1.4078   -1.0725   -1.3578 O   0  0  0

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+ 13 32  1  0

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+ 14 34  1  0

+ 14 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107210-39-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 72                          1 V2000

+    0.4760    0.6800   -0.5135 C   0  0  0

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+ 36 68  1  0

+ 36 69  1  0

+ 36 70  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142713-64-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+   -3.3702    0.0751   -0.5310 C   0  0  0

+   -3.8361    0.4369    0.7298 C   0  0  0

+   -2.2060   -0.6662   -0.6493 C   0  0  0

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+    2.3195   -2.6473    0.0956 O   0  0  0

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+    2.7023    1.3466    0.0903 Br  0  0  0

+   -2.6923   -1.4914    0.0000 H   0  0  0

+   -2.6468    0.8792    0.0000 H   0  0  0

+   -5.7860    1.6799    0.0000 H   0  0  0

+   -3.8938   -0.8503    0.0000 H   0  0  0

+   -2.5579   -0.6258    0.0000 H   0  0  0

+   -2.7824    0.7101    0.0000 H   0  0  0

+   -1.4203    0.0973    0.0000 H   0  0  0

+   -0.8444   -2.5969    0.0000 H   0  0  0

+    0.4307   -2.5323    0.0000 H   0  0  0

+    0.7675    0.0022    0.0000 H   0  0  0

+    4.0054    0.1622    0.0000 H   0  0  0

+    3.7445   -1.6653    0.0000 H   0  0  0

+    4.9573   -1.0617    0.0000 H   0  0  0

+    4.3537    0.1511    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+ 13 15  1  0

+ 13 16  1  0

+  7  9  2  0

+  3 17  1  0

+  5 18  1  0

+  6 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2277-92-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.7074    0.0804   -0.2832 C   0  0  0

+    0.2625   -0.0869   -0.5246 C   0  0  0

+    2.3078    1.3364   -0.4430 C   0  0  0

+    2.4855   -1.0124    0.1123 C   0  0  0

+   -0.6135    0.0824    0.4855 N   0  0  0

+   -0.1387   -0.3775   -1.6353 O   0  0  0

+    3.6684    1.4829   -0.2133 C   0  0  0

+    1.5617    2.4052   -0.8205 O   0  0  0

+    3.8378   -0.8486    0.3366 C   0  0  0

+    1.7521   -2.5720    0.3213 Cl  0  0  0

+   -1.9904    0.0511    0.2309 C   0  0  0

+    4.4276    0.3945    0.1719 C   0  0  0

+    4.4180    3.0364   -0.4096 Cl  0  0  0

+    4.8033   -2.2053    0.8275 Cl  0  0  0

+   -2.8950    0.3554    1.2456 C   0  0  0

+   -2.4563   -0.2774   -1.0337 C   0  0  0

+   -4.2566    0.3235    0.9884 C   0  0  0

+   -2.4432    0.6828    2.4861 O   0  0  0

+   -3.8166   -0.3073   -1.2833 C   0  0  0

+   -4.7148   -0.0101   -0.2740 C   0  0  0

+   -5.3872    0.7016    2.2503 Cl  0  0  0

+   -4.3978   -0.7186   -2.8666 Cl  0  0  0

+   -0.5290    1.0850    0.0000 H   0  0  0

+    0.9858    3.2302    0.0000 H   0  0  0

+    5.4303    0.4779    0.0000 H   0  0  0

+   -2.1417   -1.2331    0.0000 H   0  0  0

+   -1.6285    1.2732    0.0000 H   0  0  0

+   -5.7089   -0.1653    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  7 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 11 16  2  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  1  0

+ 17 20  1  0

+ 17 21  1  0

+ 19 22  1  0

+  9 12  1  0

+ 19 20  2  0

+  5 23  1  0

+  8 24  1  0

+ 12 25  1  0

+ 16 26  1  0

+ 18 27  1  0

+ 20 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7473-93-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    0.6511   -0.3320   -0.0020 C   0  0  0

+   -0.6088    0.1551    0.0028 C   0  0  0

+    1.7964    0.5910   -0.0140 C   0  0  0

+   -1.7473   -0.7624    0.0147 C   0  0  0

+    3.1027    0.0906   -0.0190 C   0  0  0

+    1.5850    1.9741   -0.0263 C   0  0  0

+   -1.5596   -1.9651    0.0204 O   0  0  0

+   -3.1269   -0.2291    0.0199 C   0  0  0

+    3.3376   -1.3708   -0.0127 N   0  3  0

+    4.1709    0.9625   -0.0302 C   0  0  0

+    2.6636    2.8324   -0.0375 C   0  0  0

+   -4.2160   -1.1022    0.0313 C   0  0  0

+   -3.3455    1.1500    0.0193 C   0  0  0

+    4.1407   -1.8552    0.7644 O   0  0  0

+    2.7277   -2.0890   -0.7846 O   0  5  0

+    3.9533    2.3293   -0.0366 C   0  0  0

+   -5.5002   -0.5981    0.0366 C   0  0  0

+   -4.6345    1.6407    0.0246 C   0  0  0

+   -5.7099    0.7695    0.0306 C   0  0  0

+    0.8110   -1.3576    0.0000 H   0  0  0

+   -0.7687    1.1807    0.0000 H   0  0  0

+    0.6186    2.3528    0.0000 H   0  0  0

+    5.1408    0.5928    0.0000 H   0  0  0

+    2.5084    3.8587    0.0000 H   0  0  0

+   -4.0600   -2.1284    0.0000 H   0  0  0

+   -2.5398    1.8044    0.0000 H   0  0  0

+    4.7615    2.9807    0.0000 H   0  0  0

+   -6.3109   -1.2463    0.0000 H   0  0  0

+   -4.7984    2.6657    0.0000 H   0  0  0

+   -6.6781    1.1438    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  9  5  1  0

+ 10  5  1  0

+ 11  6  2  0

+ 12  8  2  0

+ 13  8  1  0

+ 14  9  2  0

+ 15  9  1  0

+ 16 10  2  0

+ 17 12  1  0

+ 18 13  2  0

+ 19 17  2  0

+ 11 16  1  0

+ 18 19  1  0

+  1 20  1  0

+  2 21  1  0

+  6 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51940-44-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+    0.3191    0.5024    0.0570 C   0  0  0

+    0.7317   -0.8442    0.1201 C   0  0  0

+    1.2445    1.5025   -0.0936 N   0  0  0

+   -0.9784    0.7712    0.1522 N   0  0  0

+    2.1660   -1.1516    0.0218 C   0  0  0

+   -0.2305   -1.8430    0.2741 C   0  0  0

+    2.5620    1.2640   -0.1876 C   0  0  0

+    0.7759    2.8891   -0.1550 C   0  0  0

+   -1.8575   -0.2077    0.3028 C   0  0  0

+    3.0855   -0.0105   -0.1384 C   0  0  0

+    2.5763   -2.2980    0.0710 O   0  0  0

+   -1.5007   -1.4862    0.3555 N   0  0  0

+    0.7335    3.4761    1.2573 C   0  0  0

+   -3.1966    0.1119    0.3985 N   0  0  0

+    4.5352   -0.2279   -0.2450 C   0  0  0

+   -3.9223   -1.1544    0.5566 C   0  0  0

+   -3.5910    0.6698   -0.9009 C   0  0  0

+    5.0345   -1.4791   -0.1965 O   0  0  0

+    5.2840    0.7206   -0.3769 O   0  0  0

+   -5.4281   -0.8888    0.5469 C   0  0  0

+   -5.0969    0.9355   -0.9106 C   0  0  0

+   -5.8226   -0.3309   -0.7525 N   0  0  0

+    0.0386   -2.8343    0.0000 H   0  0  0

+    3.2080    2.0627    0.0000 H   0  0  0

+   -0.1830    3.2576    0.0000 H   0  0  0

+    0.0348    2.1778    0.0000 H   0  0  0

+    1.7581    3.5501    0.0000 H   0  0  0

+    0.6595    4.5007    0.0000 H   0  0  0

+   -0.2911    3.4021    0.0000 H   0  0  0

+   -4.2159   -2.1388    0.0000 H   0  0  0

+   -2.9782   -1.5593    0.0000 H   0  0  0

+   -2.6268    1.0240    0.0000 H   0  0  0

+   -3.6820    1.6930    0.0000 H   0  0  0

+    5.4152   -2.4332    0.0000 H   0  0  0

+   -6.3923   -1.2431    0.0000 H   0  0  0

+   -5.3370   -1.9120    0.0000 H   0  0  0

+   -4.8033    1.9199    0.0000 H   0  0  0

+   -6.0410    1.3404    0.0000 H   0  0  0

+   -6.8487   -0.3797    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 14 16  1  0

+ 14 17  1  0

+ 15 18  1  0

+ 15 19  2  0

+ 16 20  1  0

+ 17 21  1  0

+ 20 22  1  0

+  7 10  2  0

+  9 12  2  0

+ 21 22  1  0

+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+  8 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+532-32-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -1.9114    0.0615   -0.0275 C   0  0  0

+   -2.7591   -0.9348    0.4742 C   0  0  0

+   -0.6725   -0.2956   -0.5767 C   0  0  0

+   -2.3207    1.4687    0.0161 C   0  0  0

+   -2.3685   -2.2557    0.4238 C   0  0  0

+   -0.2986   -1.6211   -0.6187 C   0  0  0

+   -1.5083    2.4167   -0.4640 O   0  0  0

+   -3.5066    1.8046    0.5362 O   0  0  0

+   -1.1428   -2.5991   -0.1204 C   0  0  0

+    9.4839    0.2885    0.1740 Na  0  3  0

+   -3.7070   -0.7340    0.0000 H   0  0  0

+    0.0146    0.3876    0.0000 H   0  0  0

+   -3.0487   -2.9458    0.0000 H   0  0  0

+    0.6473   -1.8312    0.0000 H   0  0  0

+   -0.8632   -3.5268    0.0000 H   0  0  0

+   -4.4389    2.0687    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6  9  1  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  9 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2255-17-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -0.1976    0.3959    0.8090 C   0  0  0

+   -1.5032    0.6382    1.0981 O   0  0  0

+    0.5113    1.2773    0.0060 C   0  0  0

+    0.4302   -0.7305    1.3212 C   0  0  0

+   -2.3746   -0.0736   -0.0535 P   0  0  0

+    1.8386    1.0287   -0.2865 C   0  0  0

+    1.7572   -0.9745    1.0259 C   0  0  0

+   -2.1432   -1.6658    0.0052 O   0  0  0

+   -3.9347    0.2508    0.1763 O   0  0  0

+   -1.9542    0.4375   -1.3773 O   0  0  0

+    2.4600   -0.0975    0.2201 C   0  0  0

+    2.6093    1.9858   -1.1588 C   0  0  0

+   -2.9322   -2.2367   -1.0406 C   0  0  0

+   -4.0795    1.6695    0.0841 C   0  0  0

+    3.8817   -0.3619   -0.0956 N   0  3  0

+    4.1838   -1.3135   -0.7932 O   0  0  0

+    4.7494    0.3722    0.3422 O   0  5  0

+    0.1768    2.1821    0.0000 H   0  0  0

+   -0.1320   -1.5145    0.0000 H   0  0  0

+    2.0940   -1.8785    0.0000 H   0  0  0

+    3.3607    1.3808    0.0000 H   0  0  0

+    3.2143    2.7372    0.0000 H   0  0  0

+    1.8579    2.5908    0.0000 H   0  0  0

+   -3.4977   -1.4551    0.0000 H   0  0  0

+   -3.7138   -2.8022    0.0000 H   0  0  0

+   -2.3667   -3.0183    0.0000 H   0  0  0

+   -3.1198    1.7675    0.0000 H   0  0  0

+   -4.1775    2.6292    0.0000 H   0  0  0

+   -5.0392    1.5715    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 15 16  2  0

+ 15 17  1  0

+  7 11  1  0

+  3 18  1  0

+  4 19  1  0

+  7 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1212-29-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 41                          1 V2000

+    2.4267    0.2113   -0.2117 C   0  0  0

+    1.1628    0.9438   -0.1015 N   0  0  0

+    3.4263    1.0381   -1.0230 C   0  0  0

+    2.9921   -0.0435    1.1870 C   0  0  0

+    0.0000    0.2699    0.0000 C   0  0  0

+    4.7463    0.2731   -1.1381 C   0  0  0

+    4.3121   -0.8085    1.0719 C   0  0  0

+   -1.1628    0.9438    0.1013 N   0  0  0

+    0.0000   -1.4421    0.0002 S   0  0  0

+    5.3116    0.0183    0.2606 C   0  0  0

+   -2.4267    0.2113    0.2117 C   0  0  0

+   -3.4263    1.0383    1.0228 C   0  0  0

+   -2.9921   -0.0437   -1.1870 C   0  0  0

+   -4.7463    0.2733    1.1380 C   0  0  0

+   -4.3121   -0.8087   -1.0717 C   0  0  0

+   -5.3116    0.0183   -0.2606 C   0  0  0

+    1.9663   -0.6854    0.0000 H   0  0  0

+    1.1628    1.9518    0.0000 H   0  0  0

+    4.0310    1.8445    0.0000 H   0  0  0

+    2.6968    1.7337    0.0000 H   0  0  0

+    3.8483    0.4884    0.0000 H   0  0  0

+    2.9254    0.9623    0.0000 H   0  0  0

+    3.8901   -0.2588    0.0000 H   0  0  0

+    4.8130   -0.7327    0.0000 H   0  0  0

+    3.7074   -1.6149    0.0000 H   0  0  0

+    5.0416   -1.5040    0.0000 H   0  0  0

+   -1.1628    1.9518    0.0000 H   0  0  0

+    6.0643   -0.6521    0.0000 H   0  0  0

+    5.8602    0.8639    0.0000 H   0  0  0

+   -1.9662   -0.6853    0.0000 H   0  0  0

+   -2.6967    1.7338    0.0000 H   0  0  0

+   -4.0310    1.8448    0.0000 H   0  0  0

+   -2.9256    0.9621    0.0000 H   0  0  0

+   -3.8484    0.4881    0.0000 H   0  0  0

+   -4.8128   -0.7325    0.0000 H   0  0  0

+   -3.8900   -0.2585    0.0000 H   0  0  0

+   -5.0417   -1.5042    0.0000 H   0  0  0

+   -3.7074   -1.6152    0.0000 H   0  0  0

+   -5.8604    0.8638    0.0000 H   0  0  0

+   -6.0643   -0.6521    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

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+ 11 12  1  0

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+  7 10  1  0

+ 15 16  1  0

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+  4 21  1  0

+  4 22  1  0

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+  8 27  1  0

+ 10 28  1  0

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+ 12 32  1  0

+ 13 33  1  0

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+ 14 35  1  0

+ 14 36  1  0

+ 15 37  1  0

+ 15 38  1  0

+ 16 39  1  0

+ 16 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+159092-73-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.1728    0.5051   -0.0052 C   0  0  0

+    0.2009   -0.8579   -0.0023 C   0  0  0

+    0.8809    1.5241   -0.0178 C   0  0  0

+   -1.5245    0.8528    0.0096 C   0  0  0

+    1.5701   -1.2126   -0.0110 C   0  0  0

+   -0.7993   -1.8400    0.0098 C   0  0  0

+    2.2303    1.1051   -0.0265 C   0  0  0

+    0.5786    2.8871   -0.0218 C   0  0  0

+   -2.4753   -0.1280    0.0269 C   0  0  0

+    2.5391   -0.2752   -0.0221 C   0  0  0

+    1.9473   -2.6440   -0.0073 N   0  3  0

+   -2.1123   -1.4693    0.0185 C   0  0  0

+    3.2455    2.0721   -0.0386 C   0  0  0

+    1.5903    3.8044   -0.0341 C   0  0  0

+   -3.9084    0.2422    0.0426 N   0  3  0

+    2.7906   -3.0495    0.7724 O   0  0  0

+    1.4145   -3.4162   -0.7840 O   0  5  0

+    2.9190    3.3965   -0.0417 C   0  0  0

+   -4.7618   -0.6267    0.0579 O   0  0  0

+   -4.2343    1.4158    0.0401 O   0  5  0

+   -1.8077    1.8583    0.0000 H   0  0  0

+   -0.5403   -2.8520    0.0000 H   0  0  0

+   -0.4168    3.2038    0.0000 H   0  0  0

+    3.5398   -0.5748    0.0000 H   0  0  0

+   -2.8549   -2.2039    0.0000 H   0  0  0

+    4.2483    1.7794    0.0000 H   0  0  0

+    1.3630    4.8240    0.0000 H   0  0  0

+    3.6781    4.1141    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 11 16  2  0

+ 11 17  1  0

+ 13 18  2  0

+ 15 19  2  0

+ 15 20  1  0

+  7 10  1  0

+  9 12  2  0

+ 14 18  1  0

+  4 21  1  0

+  6 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102-96-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.9917    0.2591   -0.0009 C   0  0  0

+   -0.4510    0.5810    0.0001 C   0  0  0

+    1.9381    1.2841    0.0004 C   0  0  0

+    1.4128   -1.0714    0.0028 C   0  0  0

+   -1.3479   -0.3952   -0.0012 C   0  0  0

+    3.2835    0.9769   -0.0005 C   0  0  0

+    2.7607   -1.3651    0.0019 C   0  0  0

+   -2.7927   -0.0728   -0.0003 N   0  3  0

+    3.6943   -0.3438   -0.0027 C   0  0  0

+   -3.1574    1.0893    0.0016 O   0  0  0

+   -3.6167   -0.9697   -0.0014 O   0  5  0

+   -0.7616    1.5707    0.0000 H   0  0  0

+    1.6312    2.2750    0.0000 H   0  0  0

+    0.7138   -1.8379    0.0000 H   0  0  0

+   -1.0373   -1.3849    0.0000 H   0  0  0

+    3.9882    1.7381    0.0000 H   0  0  0

+    3.0750   -2.3537    0.0000 H   0  0  0

+    4.7067   -0.5697    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  2  0

+  8 11  1  0

+  7  9  1  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1689-84-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.0000   -2.1793   -0.0036 C   0  0  0

+   -1.2093   -1.4785   -0.0026 C   0  0  0

+    1.2091   -1.4788   -0.0029 C   0  0  0

+   -0.0001   -3.6113    0.0005 C   0  0  0

+   -1.2050   -0.1004   -0.0009 C   0  0  0

+    1.2049   -0.1004   -0.0012 C   0  0  0

+   -0.0001   -4.7473    0.0039 N   0  0  0

+    0.0002    0.5928   -0.0006 C   0  0  0

+   -2.8404    0.8489    0.0004 Br  0  0  0

+    2.8404    0.8488    0.0005 Br  0  0  0

+    0.0002    1.9507    0.0006 O   0  0  0

+   -2.1136   -1.9977    0.0000 H   0  0  0

+    2.1133   -1.9981    0.0000 H   0  0  0

+    0.0002    2.9935    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  3  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  6  8  2  0

+  2 12  1  0

+  3 13  1  0

+ 11 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+35142-06-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+    0.0327    0.6271    0.0584 C   0  0  0

+   -0.7343   -0.5560    0.0913 C   0  0  0

+    1.4936    0.5180    0.0088 C   0  0  0

+   -0.6030    1.8762    0.0675 C   0  0  0

+   -2.1466   -0.4628    0.1406 C   0  0  0

+   -0.0927   -1.8113    0.0744 C   0  0  0

+    2.0775   -0.7685   -0.0065 C   0  0  0

+    2.3081    1.6517   -0.0228 C   0  0  0

+   -1.9912    1.9476    0.1098 C   0  0  0

+   -0.1001    3.1427    0.0413 O   0  0  0

+   -2.7538    0.7898    0.1542 C   0  0  0

+   -2.9670   -1.6824    0.1768 C   0  0  0

+    1.2536   -1.9145    0.0274 C   0  0  0

+    3.4792   -0.8842   -0.0551 C   0  0  0

+    3.6663    1.5145   -0.0691 C   0  0  0

+   -2.3593    3.2639    0.1093 O   0  0  0

+   -1.2004    3.9860   -0.3466 C   0  0  0

+   -3.9432   -1.8654   -0.7349 O   0  0  0

+   -2.7652   -2.5257    1.0288 O   0  0  0

+    4.2545    0.2564   -0.0858 C   0  0  0

+    4.0643   -2.1095   -0.0713 O   0  0  0

+   -4.7534   -3.0698   -0.6992 C   0  0  0

+    5.4758   -1.8926   -0.1214 C   0  0  0

+   -0.6709   -2.6797    0.0000 H   0  0  0

+    1.8793    2.6028    0.0000 H   0  0  0

+   -3.7948    0.8581    0.0000 H   0  0  0

+    1.6937   -2.8604    0.0000 H   0  0  0

+    4.2700    2.3654    0.0000 H   0  0  0

+   -0.4713    4.7322    0.0000 H   0  0  0

+   -1.8540    4.7991    0.0000 H   0  0  0

+    5.2944    0.1732    0.0000 H   0  0  0

+   -5.6190   -2.4875    0.0000 H   0  0  0

+   -5.3357   -3.9354    0.0000 H   0  0  0

+   -3.8878   -3.6521    0.0000 H   0  0  0

+    5.6343   -2.9238    0.0000 H   0  0  0

+    6.5070   -1.7341    0.0000 H   0  0  0

+    5.3173   -0.8614    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+  8 15  2  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+ 12 19  2  0

+ 14 20  2  0

+ 14 21  1  0

+ 18 22  1  0

+ 21 23  1  0

+  7 13  1  0

+  9 11  1  0

+ 15 20  1  0

+ 16 17  1  0

+  6 24  1  0

+  8 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 20 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+ 23 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+148193-32-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.8257    0.5023    0.0015 C   0  0  0

+    0.2054   -0.7683    0.0003 C   0  0  0

+    2.2774    0.4204    0.0012 C   0  0  0

+   -0.0267    1.6286   -0.0026 C   0  0  0

+   -1.1662   -0.9103    0.0004 C   0  0  0

+    1.5854   -1.8802   -0.0011 S   0  0  0

+    2.8596   -0.7425   -0.0001 N   0  0  0

+    3.0237    1.5559    0.0018 O   0  0  0

+   -1.3772    1.4682   -0.0075 C   0  0  0

+   -1.9596    0.2064    0.0017 C   0  0  0

+    4.3937    1.1496    0.0013 C   0  0  0

+   -3.4334    0.0694    0.0013 N   0  3  0

+   -4.1374    1.0633    0.0024 O   0  0  0

+   -3.9421   -1.0373   -0.0002 O   0  5  0

+    0.3815    2.5877    0.0000 H   0  0  0

+   -1.5959   -1.8599    0.0000 H   0  0  0

+   -1.9898    2.3114    0.0000 H   0  0  0

+    4.0973    0.1503    0.0000 H   0  0  0

+    5.3930    0.8532    0.0000 H   0  0  0

+    4.6901    2.1489    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  8 11  1  0

+ 10 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+  6  7  1  0

+  9 10  1  0

+  4 15  1  0

+  5 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84987-77-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    1.8255    0.4351   -0.1049 C   0  0  0

+    0.4929   -0.0333   -0.6302 C   0  0  0

+    2.7242   -0.4412    0.2801 C   0  0  0

+    2.1750    2.1332   -0.0156 Cl  0  0  0

+   -0.5445    0.3926    0.2555 O   0  0  0

+    2.4468   -2.1364    0.0289 Cl  0  0  0

+   -1.7763   -0.0795   -0.2940 C   0  0  0

+   -2.9344    0.3449    0.6113 C   0  0  0

+   -4.4886   -0.2506   -0.0820 Cl  0  0  0

+   -0.1437   -0.8358    0.0000 H   0  0  0

+    1.0873   -0.8676    0.0000 H   0  0  0

+    3.6973   -0.1210    0.0000 H   0  0  0

+   -2.3846   -0.9037    0.0000 H   0  0  0

+   -1.1559   -0.8947    0.0000 H   0  0  0

+   -2.3261    1.1691    0.0000 H   0  0  0

+   -3.5547    1.1601    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  8  9  1  0

+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2154-68-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    1.3363   -0.4166   -0.5907 N   0  0  0

+   -0.0255   -0.8883   -0.2793 C   0  0  0

+    1.5567    0.8731    0.0976 C   0  0  0

+    2.2616   -1.3773    0.0101 O   0  0  0

+   -0.6822    0.1757    0.6252 C   0  0  0

+   -0.8311   -1.0423   -1.5710 C   0  0  0

+    0.0432   -2.2273    0.4576 C   0  0  0

+    0.1371    1.4552    0.3113 C   0  0  0

+    2.2479    0.6471    1.4438 C   0  0  0

+    2.3898    1.8096   -0.7797 C   0  0  0

+   -2.1142    0.3798    0.2025 C   0  0  0

+   -3.0961   -0.3117    0.8020 O   0  0  0

+   -2.3785    1.1660   -0.6761 O   0  0  0

+    2.9423   -2.0841    0.0000 H   0  0  0

+   -1.2197   -0.6453    0.0000 H   0  0  0

+   -1.0154   -0.0785    0.0000 H   0  0  0

+   -1.7949   -1.2266    0.0000 H   0  0  0

+   -0.6468   -2.0061    0.0000 H   0  0  0

+   -0.9368   -2.2776    0.0000 H   0  0  0

+    0.0935   -3.2073    0.0000 H   0  0  0

+    1.0232   -2.1770    0.0000 H   0  0  0

+    0.5633    2.3391    0.0000 H   0  0  0

+   -0.7196    1.9337    0.0000 H   0  0  0

+    1.9429   -0.2856    0.0000 H   0  0  0

+    3.1806    0.3421    0.0000 H   0  0  0

+    2.5529    1.5798    0.0000 H   0  0  0

+    3.1230    1.1574    0.0000 H   0  0  0

+    3.0420    2.5428    0.0000 H   0  0  0

+    1.6566    2.4618    0.0000 H   0  0  0

+   -3.8984   -0.8767    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+  5  8  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 12 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81-49-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.2481    1.0455    0.1520 C   0  0  0

+    0.5857   -0.3234    0.1223 C   0  0  0

+    1.3130    2.0588    0.2542 C   0  0  0

+   -1.0947    1.4284    0.0785 C   0  0  0

+    2.0051   -0.7275    0.1935 C   0  0  0

+   -0.4183   -1.2802    0.0258 C   0  0  0

+    2.7175    1.6577    0.0177 C   0  0  0

+    1.0407    3.2114    0.5292 O   0  0  0

+   -2.0869    0.4492   -0.0238 C   0  0  0

+   -1.4397    2.7708    0.1063 N   0  0  0

+    3.0565    0.2925   -0.0118 C   0  0  0

+    2.3050   -1.8837    0.4183 O   0  0  0

+   -1.7484   -0.8868   -0.0415 C   0  0  0

+    0.0273   -3.1175   -0.0144 Br  0  0  0

+    3.7048    2.6178   -0.1761 C   0  0  0

+   -3.9049    0.9599   -0.1242 Br  0  0  0

+    4.3766   -0.0860   -0.2339 C   0  0  0

+    5.0133    2.2243   -0.3965 C   0  0  0

+    5.3469    0.8823   -0.4244 C   0  0  0

+   -0.6966    3.4988    0.0000 H   0  0  0

+   -2.4417    3.0503    0.0000 H   0  0  0

+   -2.4984   -1.6078    0.0000 H   0  0  0

+    3.4579    3.6284    0.0000 H   0  0  0

+    4.6366   -1.0933    0.0000 H   0  0  0

+    5.7665    2.9419    0.0000 H   0  0  0

+    6.3491    0.6034    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 15 18  2  0

+ 17 19  2  0

+  7 11  2  0

+  9 13  2  0

+ 18 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 13 22  1  0

+ 15 23  1  0

+ 17 24  1  0

+ 18 25  1  0

+ 19 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+700-00-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -2.5239   -1.4542    0.0007 N   0  0  0

+   -1.6317   -0.3962    0.0016 C   0  0  0

+   -0.2453   -0.6250    0.0006 C   0  0  0

+   -2.0662    0.8598   -0.0021 N   0  0  0

+    0.6109    0.4893    0.0011 C   0  0  0

+    0.5380   -1.7303   -0.0008 N   0  0  0

+   -1.2224    1.8754   -0.0018 C   0  0  0

+    1.8871   -0.0145   -0.0001 N   0  0  0

+    0.0835    1.7090    0.0021 N   0  0  0

+    1.7897   -1.3742   -0.0012 C   0  0  0

+    3.1270    0.7658   -0.0001 C   0  0  0

+   -3.5272   -1.2748    0.0000 H   0  0  0

+   -2.1777   -2.4128    0.0000 H   0  0  0

+   -1.5961    2.8236    0.0000 H   0  0  0

+    2.5806   -2.0171    0.0000 H   0  0  0

+    3.6699   -0.0968    0.0000 H   0  0  0

+    3.9896    1.3087    0.0000 H   0  0  0

+    2.5841    1.6284    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  2  0

+  8  5  1  0

+  9  5  2  0

+ 10  6  2  0

+ 11  8  1  0

+  7  9  1  0

+  8 10  1  0

+  1 12  1  0

+  1 13  1  0

+  7 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+933-78-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.9278   -0.4517    0.0022 C   0  0  0

+   -0.0498   -1.5266    0.0019 C   0  0  0

+   -0.4360    0.8417    0.0012 C   0  0  0

+   -2.6414   -0.7296   -0.0035 Cl  0  0  0

+    1.3189   -1.3016    0.0006 C   0  0  0

+   -0.5305   -2.7980    0.0033 O   0  0  0

+    0.9296    1.0631   -0.0005 C   0  0  0

+   -1.5331    2.1870    0.0016 Cl  0  0  0

+    1.8061   -0.0077   -0.0003 C   0  0  0

+    3.5192    0.2739   -0.0013 Cl  0  0  0

+    1.9777   -2.1051    0.0000 H   0  0  0

+   -0.8980   -3.7699    0.0000 H   0  0  0

+    1.2976    2.0348    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

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+  7  9  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14692-41-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    0.5899   -0.6387   -0.0010 C   0  0  0

+   -0.8569   -0.4449   -0.0007 C   0  0  0

+    1.4165    0.4898   -0.0005 C   0  0  0

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+   -1.7453   -1.5280   -0.0016 C   0  0  0

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+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96563-07-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

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+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67392-87-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 63                          1 V2000

+    3.0801    0.0202    0.2618 C   0  0  2

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+ 25 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110417-88-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+123125                          1 V2000

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+ 55123  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19331-27-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -0.0772    0.9076    0.0035 C   0  0  0

+   -0.7884   -0.3150    0.0016 C   0  0  0

+    1.3008    0.9497    0.0031 C   0  0  0

+   -1.3740    2.1155   -0.0009 S   0  0  0

+   -2.2275   -0.1284    0.0025 C   0  0  0

+   -0.0191   -1.5006   -0.0008 C   0  0  0

+    2.0112   -0.2215    0.0007 C   0  0  0

+   -2.7256    1.0706   -0.0049 N   0  0  0

+   -3.2823   -1.5073    0.0005 Cl  0  0  0

+    1.3392   -1.4380   -0.0013 C   0  0  0

+    3.4911   -0.1915   -0.0004 N   0  3  0

+    4.1213   -1.2337   -0.0025 O   0  0  0

+    4.0786    0.8755    0.0009 O   0  5  0

+    1.8025    1.8734    0.0000 H   0  0  0

+   -0.4994   -2.4356    0.0000 H   0  0  0

+    1.8941   -2.3308    0.0000 H   0  0  0

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+ 11 13  1  0

+  5  8  2  0

+  7 10  1  0

+  3 14  1  0

+  6 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-45-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -1.6996   -0.1906    0.0820 C   0  0  0

+   -2.9072    0.5928    0.0075 C   0  0  0

+   -0.3732    0.4448    0.1325 C   0  0  0

+   -1.8427   -1.5625    0.1097 C   0  0  0

+   -4.0734   -0.0807   -0.0341 C   0  0  0

+    0.7367   -0.3167    0.2019 N   0  0  0

+   -0.2785    1.6574    0.1117 O   0  0  0

+   -3.5585   -1.7843    0.0371 S   0  0  0

+   -5.4482    0.4629   -0.1115 N   0  3  0

+    1.9995    0.2784    0.1171 C   0  0  0

+   -6.4017   -0.2943   -0.1411 O   0  0  0

+   -5.6257    1.6674   -0.1457 O   0  5  0

+    3.1392   -0.5132    0.0530 C   0  0  0

+    2.1165    1.6619    0.0909 C   0  0  0

+    4.3845    0.0775   -0.0312 C   0  0  0

+    3.3651    2.2465    0.0066 C   0  0  0

+    4.4978    1.4558   -0.0517 C   0  0  0

+    5.5994   -0.7653   -0.0990 N   0  3  0

+    6.6982   -0.2450   -0.1732 O   0  0  0

+    5.5004   -1.9791   -0.0805 O   0  5  0

+   -2.8804    1.6285    0.0000 H   0  0  0

+   -1.1011   -2.2860    0.0000 H   0  0  0

+    0.6534   -1.3494    0.0000 H   0  0  0

+    3.0543   -1.5457    0.0000 H   0  0  0

+    1.2665    2.2543    0.0000 H   0  0  0

+    3.4539    3.2787    0.0000 H   0  0  0

+    5.4353    1.8968    0.0000 H   0  0  0

+  1  2  1  0

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+  4 22  1  0

+  6 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+716-53-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -1.2047    1.2851   -0.0028 C   0  0  0

+   -1.2053   -0.1811   -0.0020 C   0  0  0

+    0.0000    1.9862   -0.0023 C   0  0  0

+   -2.4425    1.9637    0.0018 C   0  0  0

+    0.0001   -0.8834   -0.0007 C   0  0  0

+   -2.4431   -0.8589   -0.0020 C   0  0  0

+    1.2045    1.2853   -0.0010 C   0  0  0

+   -3.5974    1.2503    0.0068 C   0  0  0

+    1.2052   -0.1812   -0.0002 C   0  0  0

+    0.0002   -2.6194    0.0009 Cl  0  0  0

+   -3.5978   -0.1450   -0.0028 C   0  0  0

+    2.4424    1.9639    0.0000 C   0  0  0

+    2.4431   -0.8589    0.0006 C   0  0  0

+    3.5972    1.2505    0.0017 C   0  0  0

+    3.5976   -0.1448    0.0006 C   0  0  0

+    0.0000    3.0327    0.0000 H   0  0  0

+   -2.4696    3.0098    0.0000 H   0  0  0

+   -2.4707   -1.9050    0.0000 H   0  0  0

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+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2675-77-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.0822    0.8639    0.0016 C   0  0  0

+   -1.2893   -0.5082    0.0005 C   0  0  0

+    0.2088    1.3704    0.0017 C   0  0  0

+   -2.1455    1.7121   -0.0032 O   0  0  0

+   -0.2084   -1.3705   -0.0005 C   0  0  0

+   -2.9054   -1.1422    0.0008 Cl  0  0  0

+    1.2893    0.5085    0.0008 C   0  0  0

+   -1.6152    3.0391   -0.0006 C   0  0  0

+    1.0822   -0.8642   -0.0003 C   0  0  0

+    2.9054    1.1425    0.0004 Cl  0  0  0

+    2.1454   -1.7123   -0.0008 O   0  0  0

+    1.6152   -3.0393   -0.0014 C   0  0  0

+    0.3640    2.3992    0.0000 H   0  0  0

+   -0.3636   -2.3993    0.0000 H   0  0  0

+   -0.6491    2.6530    0.0000 H   0  0  0

+   -1.2291    4.0052    0.0000 H   0  0  0

+   -2.5813    3.4252    0.0000 H   0  0  0

+    0.6490   -2.6533    0.0000 H   0  0  0

+    1.2292   -4.0055    0.0000 H   0  0  0

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+  1  2  2  0

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+ 12 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+135086-91-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+   -3.3990   -0.5778   -0.0011 C   0  0  0

+   -4.8692   -0.5588   -0.0010 C   0  0  0

+   -2.9887    0.7544    0.0001 C   0  0  0

+   -2.4887   -1.5643    0.0028 N   0  0  0

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+   -5.8445   -1.5564   -0.0018 C   0  0  0

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+    7.5392    1.3270    0.0012 O   0  0  0

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+ 18 32  1  0

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+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+439-14-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+    0.1960    1.0813   -0.4812 C   0  0  0

+   -0.3408   -0.2552   -0.1808 C   0  0  0

+    1.5882    1.3700   -0.0652 C   0  0  0

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+    1.1429   -3.9810   -0.3179 Cl  0  0  0

+    4.1902    1.9106    0.7122 C   0  0  0

+   -3.5788    2.4204   -0.0804 O   0  0  0

+    1.4918   -1.1918    0.0000 H   0  0  0

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+    2.0983    0.4494    0.0000 H   0  0  0

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+   -1.5818   -3.7650    0.0000 H   0  0  0

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+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+38965-71-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.5630   -0.7743   -0.0413 C   0  0  0

+   -0.5978    0.0266   -0.0284 C   0  0  0

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+   -1.7116    2.2572    0.0299 N   0  3  0

+   -1.9521   -1.9869   -0.1028 C   0  0  0

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+    3.1741    1.9360    0.0678 C   0  0  0

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+    3.2477    3.2913    0.1114 O   0  0  0

+    3.0249   -1.8949    0.0000 H   0  0  0

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+ 21 31  1  0

+ 23 32  1  0

+ 24 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13523-75-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+    2.2794   -1.1911   -0.1182 N   0  0  0

+    1.1382   -0.8568    0.6227 N   0  0  0

+    3.4151   -0.3805   -0.0552 C   0  0  0

+   -0.0298   -0.6228   -0.0077 C   0  0  0

+    4.5472   -0.7104   -0.7891 C   0  0  0

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+   -1.2573   -0.2633    0.7892 C   0  0  0

+   -0.0931   -0.7016   -1.2163 O   0  0  0

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+    4.5371    1.5602    0.7966 C   0  0  0

+   -2.4379   -0.0511   -0.1605 C   0  0  0

+    5.6646    1.2259    0.0687 C   0  0  0

+   -3.6841    0.3139    0.6485 C   0  0  0

+   -4.8469    0.5229   -0.2870 C   0  0  0

+   -3.9973   -0.7751    1.5833 N   0  0  0

+   -5.5589   -0.4074   -0.5830 O   0  0  0

+   -5.0918    1.7424   -0.7913 O   0  0  0

+    2.4281   -2.0705    0.0000 H   0  0  0

+    1.3514    0.0092    0.0000 H   0  0  0

+    4.6975   -1.5895    0.0000 H   0  0  0

+    2.6198    1.1690    0.0000 H   0  0  0

+   -0.6346    0.3752    0.0000 H   0  0  0

+   -1.5294    0.5860    0.0000 H   0  0  0

+    6.4625   -0.3123    0.0000 H   0  0  0

+    4.3907    2.4400    0.0000 H   0  0  0

+   -3.0606   -0.6896    0.0000 H   0  0  0

+   -2.1658   -0.9004    0.0000 H   0  0  0

+    6.3784    1.7606    0.0000 H   0  0  0

+   -3.4796    1.1820    0.0000 H   0  0  0

+   -4.8628   -0.9902    0.0000 H   0  0  0

+   -3.3783   -1.4171    0.0000 H   0  0  0

+   -5.2674    2.6168    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  4  2  0

+  9  5  1  0

+ 10  6  2  0

+ 11  7  1  0

+ 12  9  2  0

+ 13 11  1  0

+ 14 13  1  0

+ 15 13  1  0

+ 16 14  2  0

+ 17 14  1  0

+ 10 12  1  0

+  1 18  1  0

+  2 19  1  0

+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+940-14-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -1.2956   -0.0276    0.0037 C   0  0  0

+   -0.7914   -1.3153    0.0030 C   0  0  0

+   -0.4349    1.0544    0.0027 C   0  0  0

+   -2.7592    0.1927   -0.0007 N   0  3  0

+    0.5739   -1.5237    0.0014 C   0  0  0

+    0.9317    0.8516    0.0011 C   0  0  0

+   -3.2045    1.3264   -0.0001 O   0  0  0

+   -3.5184   -0.7597   -0.0050 O   0  5  0

+    1.4401   -0.4393    0.0005 C   0  0  0

+    2.7838   -0.6416   -0.0007 O   0  0  0

+    3.3647    0.5842   -0.0014 C   0  0  0

+    4.6779    0.6908   -0.0026 C   0  0  0

+   -1.4384   -2.1244    0.0000 H   0  0  0

+   -0.8151    2.0181    0.0000 H   0  0  0

+    0.9511   -2.4886    0.0000 H   0  0  0

+    1.5762    1.6627    0.0000 H   0  0  0

+    2.7758    1.4365    0.0000 H   0  0  0

+    5.2668   -0.1616    0.0000 H   0  0  0

+    5.1216    1.6270    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  2  0

+  6  9  2  0

+  2 13  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1679-02-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 46                          1 V2000

+   -5.8898   -1.5254    0.0000 C   0  0  0

+   -5.0124   -0.3002    0.0008 C   0  0  0

+   -3.6161   -0.4340    0.0007 C   0  0  0

+   -5.5727    0.9431   -0.0039 C   0  0  0

+   -2.8124    0.7296    0.0015 C   0  0  0

+   -3.0073   -1.7083    0.0002 C   0  0  0

+   -4.7792    2.0847   -0.0032 C   0  0  0

+   -1.3551    0.5801    0.0013 C   0  0  0

+   -3.4171    1.9887    0.0021 C   0  0  0

+   -1.6622   -1.8423    0.0004 C   0  0  0

+   -0.8124   -0.7207    0.0003 C   0  0  0

+   -0.5079    1.6977    0.0016 C   0  0  0

+    0.6418   -0.8721    0.0000 C   0  0  0

+    0.8421    1.5571    0.0009 C   0  0  0

+    1.4408    0.2889    0.0007 C   0  0  0

+    1.2424   -2.1447   -0.0004 C   0  0  0

+    2.8977    0.1350    0.0003 C   0  0  0

+    2.5863   -2.2905   -0.0003 C   0  0  0

+    3.4443   -1.1688   -0.0007 C   0  0  0

+    3.7489    1.2430    0.0004 C   0  0  0

+    4.8387   -1.3254   -0.0011 C   0  0  0

+    5.1012    1.0564   -0.0004 C   0  0  0

+    5.6427   -0.2244   -0.0005 C   0  0  0

+    6.0179    2.2526   -0.0008 C   0  0  0

+   -6.7453   -0.9128    0.0000 H   0  0  0

+   -6.5024   -2.3809    0.0000 H   0  0  0

+   -5.0343   -2.1380    0.0000 H   0  0  0

+   -6.6204    1.0398    0.0000 H   0  0  0

+   -3.6120   -2.5694    0.0000 H   0  0  0

+   -5.2336    3.0337    0.0000 H   0  0  0

+   -2.8258    2.8591    0.0000 H   0  0  0

+   -1.2413   -2.8066    0.0000 H   0  0  0

+   -0.9265    2.6630    0.0000 H   0  0  0

+    1.4507    2.4154    0.0000 H   0  0  0

+    0.6319   -3.0017    0.0000 H   0  0  0

+    3.0008   -3.2576    0.0000 H   0  0  0

+    3.3495    2.2165    0.0000 H   0  0  0

+    5.2621   -2.2887    0.0000 H   0  0  0

+    6.6879   -0.3455    0.0000 H   0  0  0

+    6.8531    1.6126    0.0000 H   0  0  0

+    6.6579    3.0878    0.0000 H   0  0  0

+    5.1827    2.8926    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  2  0

+  8  5  1  0

+  9  5  2  0

+ 10  6  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13 11  1  0

+ 14 12  2  0

+ 15 13  2  0

+ 16 13  1  0

+ 17 15  1  0

+ 18 16  2  0

+ 19 17  2  0

+ 20 17  1  0

+ 21 19  1  0

+ 22 20  2  0

+ 23 21  2  0

+ 24 22  1  0

+  7  9  1  0

+ 10 11  1  0

+ 14 15  1  0

+ 18 19  1  0

+ 22 23  1  0

+  1 25  1  0

+  1 26  1  0

+  1 27  1  0

+  4 28  1  0

+  6 29  1  0

+  7 30  1  0

+  9 31  1  0

+ 10 32  1  0

+ 12 33  1  0

+ 14 34  1  0

+ 16 35  1  0

+ 18 36  1  0

+ 20 37  1  0

+ 21 38  1  0

+ 23 39  1  0

+ 24 40  1  0

+ 24 41  1  0

+ 24 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2998-23-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    2.1018   -0.0655   -0.0011 C   0  0  0

+    0.8781    0.4999    0.0003 O   0  0  0

+    3.3026    0.7817    0.0005 C   0  0  0

+    2.2121   -1.2758    0.0014 O   0  0  0

+   -0.3083   -0.3372   -0.0013 C   0  0  0

+    4.5107    0.2235   -0.0008 C   0  0  0

+   -1.5566    0.5475    0.0007 C   0  0  0

+   -2.8068   -0.3345   -0.0009 C   0  0  0

+   -4.0551    0.5502    0.0011 C   0  0  0

+   -5.3052   -0.3319   -0.0005 C   0  0  0

+    3.2027    1.8793    0.0000 H   0  0  0

+   -1.0432   -1.1587    0.0000 H   0  0  0

+    0.4248   -1.1602    0.0000 H   0  0  0

+    4.6106   -0.8741    0.0000 H   0  0  0

+    5.4113    0.8588    0.0000 H   0  0  0

+   -0.8217    1.3689    0.0000 H   0  0  0

+   -2.2897    1.3705    0.0000 H   0  0  0

+   -3.5417   -1.1559    0.0000 H   0  0  0

+   -2.0737   -1.1575    0.0000 H   0  0  0

+   -3.3202    1.3717    0.0000 H   0  0  0

+   -4.7883    1.3732    0.0000 H   0  0  0

+   -5.9407    0.5687    0.0000 H   0  0  0

+   -6.2058   -0.9674    0.0000 H   0  0  0

+   -4.6697   -1.2325    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  2  1  0

+  6  3  2  0

+  7  5  1  0

+  8  7  1  0

+  9  8  1  0

+ 10  9  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18774-09-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.7417   -0.9433   -0.0250 C   0  0  0

+   -0.7422   -0.9429   -0.0244 C   0  0  0

+    1.2055    0.3448   -0.2766 C   0  0  0

+    1.6603   -1.9743    0.1811 C   0  0  0

+   -1.2056    0.3453   -0.2757 C   0  0  0

+   -1.6611   -1.9745    0.1773 C   0  0  0

+    0.0001    1.2360   -0.4500 C   0  0  0

+    2.5600    0.5983   -0.3263 C   0  0  0

+    3.0133   -1.7118    0.1280 C   0  0  0

+   -2.5601    0.5994   -0.3246 C   0  0  0

+   -3.0140   -1.7112    0.1265 C   0  0  0

+    0.0007    2.2632    0.5434 O   0  0  0

+    0.0005    1.8565   -1.8485 C   0  0  0

+    3.4648   -0.4290   -0.1257 C   0  0  0

+   -3.4652   -0.4276   -0.1238 C   0  0  0

+    0.0009    1.5908    1.8495 O   0  0  0

+    1.3307   -2.9503    0.0000 H   0  0  0

+   -1.3317   -2.9506    0.0000 H   0  0  0

+    2.8956    1.5722    0.0000 H   0  0  0

+    3.6864   -2.4917    0.0000 H   0  0  0

+   -2.8954    1.5735    0.0000 H   0  0  0

+   -3.6874   -2.4907    0.0000 H   0  0  0

+    1.0307    1.8558    0.0000 H   0  0  0

+    0.0012    2.8867    0.0000 H   0  0  0

+   -1.0297    1.8572    0.0000 H   0  0  0

+    4.4761   -0.2326    0.0000 H   0  0  0

+   -4.4764   -0.2308    0.0000 H   0  0  0

+    0.0012    0.5606    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  2  0

+ 12 16  1  0

+  5  7  1  0

+  9 14  1  0

+ 11 15  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+159394-72-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    1.2787   -0.5548    0.0073 C   0  0  0

+    2.2555   -1.5538    0.0080 C   0  0  0

+    1.6631    0.7888    0.0029 C   0  0  0

+   -0.1502   -0.9163    0.0052 C   0  0  0

+    3.5908   -1.2079    0.0043 C   0  0  0

+    3.0019    1.1194   -0.0008 C   0  0  0

+   -1.0860    0.0461    0.0046 C   0  0  0

+    3.9638    0.1244   -0.0001 C   0  0  0

+   -2.5151   -0.3154    0.0024 C   0  0  0

+    5.3989    0.4874   -0.0036 N   0  3  0

+   -3.4888    0.6830    0.0017 C   0  0  0

+   -2.8980   -1.6604   -0.0048 C   0  0  0

+    5.7307    1.6594   -0.0075 O   0  0  0

+    6.2480   -0.3858   -0.0026 O   0  5  0

+   -4.8375    0.3316   -0.0008 C   0  0  0

+   -4.2357   -2.0002   -0.0073 C   0  0  0

+   -5.2050   -1.0164   -0.0026 C   0  0  0

+   -5.8444    1.3498   -0.0010 C   0  0  0

+   -6.6431    2.1576   -0.0012 N   0  0  0

+    1.9761   -2.5572    0.0000 H   0  0  0

+    0.9401    1.5387    0.0000 H   0  0  0

+   -0.4339   -1.9186    0.0000 H   0  0  0

+    4.3201   -1.9516    0.0000 H   0  0  0

+    3.2899    2.1204    0.0000 H   0  0  0

+   -0.8023    1.0484    0.0000 H   0  0  0

+   -3.2094    1.6865    0.0000 H   0  0  0

+   -2.1721   -2.4074    0.0000 H   0  0  0

+   -4.5156   -3.0035    0.0000 H   0  0  0

+   -6.2127   -1.2801    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  5  8  2  0

+  7  9  1  0

+  8 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 10 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 15 17  2  0

+ 15 18  1  0

+ 18 19  3  0

+  6  8  1  0

+ 16 17  1  0

+  2 20  1  0

+  3 21  1  0

+  4 22  1  0

+  5 23  1  0

+  6 24  1  0

+  7 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10549-22-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+   -0.3005    0.0002    0.0038 C   0  0  0

+   -1.7819    0.0001   -0.0046 C   0  0  0

+    0.3822    1.2009    0.1610 C   0  0  0

+    0.3823   -1.2009   -0.1614 C   0  0  0

+   -2.4650    1.1964   -0.1912 C   0  0  0

+   -2.4645   -1.1969    0.1899 C   0  0  0

+    1.7629    1.1947    0.1503 C   0  0  0

+   -0.3877    2.4757    0.3694 C   0  0  0

+    1.7624   -1.1945   -0.1521 C   0  0  0

+   -0.3886   -2.4752   -0.3691 C   0  0  0

+   -1.6968    2.4700   -0.4122 C   0  0  0

+   -3.8458    1.1893   -0.1835 C   0  0  0

+   -1.6940   -2.4676    0.4198 C   0  0  0

+   -3.8446   -1.1909    0.1824 C   0  0  0

+    2.4455    0.0002   -0.0005 C   0  0  0

+   -4.5281   -0.0010   -0.0012 C   0  0  0

+    3.9257   -0.0001   -0.0003 N   0  3  0

+    4.5346   -1.0466   -0.1325 O   0  0  0

+    4.5349    1.0463    0.1321 O   0  5  0

+    2.2844    2.0888    0.0000 H   0  0  0

+    0.5797    2.8439    0.0000 H   0  0  0

+   -0.5771    3.4933    0.0000 H   0  0  0

+    2.2839   -2.0886    0.0000 H   0  0  0

+   -0.5792   -3.4926    0.0000 H   0  0  0

+    0.5784   -2.8443    0.0000 H   0  0  0

+   -1.5135    3.4887    0.0000 H   0  0  0

+   -2.6654    2.8350    0.0000 H   0  0  0

+   -4.3670    2.0836    0.0000 H   0  0  0

+   -2.6622   -2.8336    0.0000 H   0  0  0

+   -1.5109   -3.4864    0.0000 H   0  0  0

+   -4.3651   -2.0856    0.0000 H   0  0  0

+   -5.5632   -0.0015    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+ 12 16  2  0

+ 15 17  1  0

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+ 17 19  1  0

+  8 11  1  0

+  9 15  1  0

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+ 14 16  1  0

+  7 20  1  0

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+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99346-50-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+   -6.7372   -1.0000   -0.1664 N   0  0  0

+   -7.6370   -0.0323   -0.4384 C   0  0  0

+   -5.5742   -0.6886    0.4360 C   0  0  0

+   -7.3299    1.3528   -0.0699 C   0  0  0

+   -8.6907   -0.3060   -0.9825 O   0  0  0

+   -5.2886    0.5809    0.7762 N   0  0  0

+   -4.7701   -1.5683    0.6767 O   0  0  0

+   -6.1933    1.6162    0.5123 N   0  0  0

+    7.6310    0.1012   -0.0974 N   0  0  0

+    6.6512    1.1549   -0.3935 C   0  0  0

+    8.7740    0.7577    0.5511 C   0  0  0

+    5.4279    0.5372   -1.0739 C   0  0  0

+    9.8385   -0.2880    0.8887 C   0  0  0

+    4.8378   -0.4314   -0.2045 O   0  0  0

+   10.2751   -0.9281   -0.3120 O   0  0  0

+   -7.0087   -1.9440    0.0000 H   0  0  0

+   -8.0278    2.0440    0.0000 H   0  0  0

+   -4.3365    0.8224    0.0000 H   0  0  0

+    7.4840   -0.8700    0.0000 H   0  0  0

+    7.4300    1.7534    0.0000 H   0  0  0

+    6.1283    1.9864    0.0000 H   0  0  0

+    9.5232    1.3930    0.0000 H   0  0  0

+    8.2094    1.5615    0.0000 H   0  0  0

+    5.3012    1.5113    0.0000 H   0  0  0

+    4.4670    0.7409    0.0000 H   0  0  0

+   10.8111   -0.1507    0.0000 H   0  0  0

+   10.1457    0.6450    0.0000 H   0  0  0

+    4.3268   -1.2702    0.0000 H   0  0  0

+   10.8286   -1.7396    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  2  0

+  9 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+  6  8  1  0

+  1 16  1  0

+  4 17  1  0

+  6 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83053-60-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+    0.8065   -0.1799    0.0025 C   0  0  0

+    1.0513   -1.5710    0.0004 C   0  0  0

+    1.9487    0.7369    0.0018 C   0  0  0

+   -0.5130    0.2957   -0.0005 C   0  0  0

+   -0.0253   -2.4679    0.0002 C   0  0  0

+    2.4273   -2.0577   -0.0022 C   0  0  0

+    3.2580    0.2061   -0.0009 C   0  0  0

+    1.7631    2.1225    0.0033 C   0  0  0

+   -1.5606   -0.5937   -0.0057 C   0  0  0

+   -0.7549    1.6325    0.0023 O   0  0  0

+   -1.3265   -1.9856    0.0023 C   0  0  0

+   -0.0404   -3.9780   -0.0019 C   0  0  0

+    3.4628   -1.1933   -0.0027 C   0  0  0

+    4.3508    1.0862   -0.0016 C   0  0  0

+    2.8477    2.9515    0.0020 C   0  0  0

+   -2.1746    1.7954   -0.0019 C   0  0  0

+   -2.2929   -3.0977    0.0017 C   0  0  0

+   -1.5181   -4.3929   -0.0010 C   0  0  0

+    4.1375    2.4331    0.0002 C   0  0  0

+   -2.5168    3.2866    0.0009 C   0  0  0

+   -3.5008   -2.9909    0.0031 O   0  0  0

+   -4.0369    3.4610   -0.0035 C   0  0  0

+   -4.3791    4.9522   -0.0007 C   0  0  0

+    2.6146   -3.1000    0.0000 H   0  0  0

+    0.7847    2.5276    0.0000 H   0  0  0

+   -2.5553   -0.2305    0.0000 H   0  0  0

+    0.1483   -5.0200    0.0000 H   0  0  0

+    1.0148   -3.8885    0.0000 H   0  0  0

+    4.4520   -1.5712    0.0000 H   0  0  0

+    5.3389    0.7054    0.0000 H   0  0  0

+    2.7049    4.0008    0.0000 H   0  0  0

+   -3.2269    1.6767    0.0000 H   0  0  0

+   -2.1756    0.7364    0.0000 H   0  0  0

+   -2.4714   -4.8541    0.0000 H   0  0  0

+   -1.1429   -5.3832    0.0000 H   0  0  0

+    4.9657    3.0931    0.0000 H   0  0  0

+   -1.4645    3.4053    0.0000 H   0  0  0

+   -2.5158    4.3456    0.0000 H   0  0  0

+   -5.0892    3.3423    0.0000 H   0  0  0

+   -4.0379    2.4020    0.0000 H   0  0  0

+   -3.3470    5.1891    0.0000 H   0  0  0

+   -4.6160    5.9843    0.0000 H   0  0  0

+   -5.4112    4.7153    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+  8 15  2  0

+ 10 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 14 19  2  0

+ 16 20  1  0

+ 17 21  2  0

+ 20 22  1  0

+ 22 23  1  0

+  7 13  1  0

+  9 11  1  0

+ 15 19  1  0

+ 17 18  1  0

+  6 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+ 23 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7433-46-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+   -0.1075    0.0221   -0.0009 C   0  0  0

+   -1.2722    0.7003    0.0009 N   0  0  0

+    1.0622    0.6916    0.0009 N   0  0  0

+   -0.1120   -1.1938    0.0009 O   0  0  0

+   -2.5436   -0.0276   -0.0011 C   0  0  0

+    2.2859   -0.0209   -0.0010 O   0  0  0

+   -1.2685    1.7111    0.0000 H   0  0  0

+    1.0659    1.7024    0.0000 H   0  0  0

+   -3.0458    0.8496    0.0000 H   0  0  0

+   -3.4208   -0.5298    0.0000 H   0  0  0

+   -2.0414   -0.9048    0.0000 H   0  0  0

+    3.1594   -0.5295    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  2  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2381-31-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.5586   -0.1561   -0.0021 C   0  0  0

+   -2.0137   -0.3664   -0.0015 C   0  0  0

+   -0.0484    1.2161   -0.0003 C   0  0  0

+    0.3152   -1.2303    0.0013 C   0  0  0

+   -2.8720    0.7530    0.0009 C   0  0  0

+   -2.5527   -1.6539   -0.0028 C   0  0  0

+    1.3217    1.4515   -0.0004 C   0  0  0

+   -0.9956    2.3298    0.0022 C   0  0  0

+    1.6944   -0.9997    0.0005 C   0  0  0

+   -2.3231    2.1053    0.0023 C   0  0  0

+   -4.2593    0.5504    0.0016 C   0  0  0

+   -3.9192   -1.8202   -0.0016 C   0  0  0

+    2.2083    0.3718   -0.0022 C   0  0  0

+    2.6126   -2.0686    0.0045 C   0  0  0

+   -4.7637   -0.7174   -0.0001 C   0  0  0

+    3.6037    0.5728   -0.0024 C   0  0  0

+    3.9461   -1.8066    0.0043 C   0  0  0

+    4.4355   -0.5014   -0.0042 C   0  0  0

+    4.1688    1.9698    0.0000 C   0  0  0

+   -0.0552   -2.2110    0.0000 H   0  0  0

+   -1.9202   -2.4899    0.0000 H   0  0  0

+    1.6876    2.4338    0.0000 H   0  0  0

+   -0.6369    3.3148    0.0000 H   0  0  0

+   -2.9793    2.9228    0.0000 H   0  0  0

+   -4.9091    1.3730    0.0000 H   0  0  0

+   -4.3256   -2.7865    0.0000 H   0  0  0

+    2.2694   -3.0591    0.0000 H   0  0  0

+   -5.8021   -0.8610    0.0000 H   0  0  0

+    4.6238   -2.6063    0.0000 H   0  0  0

+    5.4720   -0.3447    0.0000 H   0  0  0

+    5.1406    1.5767    0.0000 H   0  0  0

+    4.5619    2.9416    0.0000 H   0  0  0

+    3.1970    2.3629    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+ 14 17  2  0

+ 16 18  2  0

+ 16 19  1  0

+  8 10  2  0

+  9 13  2  0

+ 12 15  1  0

+ 17 18  1  0

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+ 15 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-36-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -0.4156   -0.0223   -0.0009 C   0  0  0

+   -1.8918    0.0365   -0.0003 C   0  0  0

+    0.4498    0.9686    0.0001 N   0  0  0

+    0.6495   -1.4576    0.0049 S   0  0  0

+   -2.5428    1.2719    0.0009 C   0  0  0

+   -2.6391   -1.1436   -0.0067 C   0  0  0

+    1.7821    0.7666   -0.0006 C   0  0  0

+    2.1974   -0.5860    0.0002 C   0  0  0

+   -3.9194    1.3234    0.0015 C   0  0  0

+   -4.0151   -1.0857   -0.0061 C   0  0  0

+    2.8136    1.7358    0.0007 C   0  0  0

+    3.5209   -0.9527    0.0010 C   0  0  0

+   -4.6609    0.1467    0.0009 C   0  0  0

+    4.1209    1.3622    0.0002 C   0  0  0

+    4.4973    0.0262   -0.0039 C   0  0  0

+   -6.0534    0.2021    0.0019 N   0  0  0

+    5.9556   -0.3536   -0.0025 C   0  0  0

+   -1.9871    2.1551    0.0000 H   0  0  0

+   -2.1553   -2.0682    0.0000 H   0  0  0

+   -4.4064    2.2463    0.0000 H   0  0  0

+   -4.5739   -1.9670    0.0000 H   0  0  0

+    2.5676    2.7499    0.0000 H   0  0  0

+    3.7873   -1.9616    0.0000 H   0  0  0

+    4.8602    2.0987    0.0000 H   0  0  0

+   -6.5388    1.1258    0.0000 H   0  0  0

+   -6.6107   -0.6802    0.0000 H   0  0  0

+    5.6926   -1.3634    0.0000 H   0  0  0

+    6.9654   -0.6166    0.0000 H   0  0  0

+    6.2186    0.6562    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

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+  7 11  1  0

+  8 12  1  0

+  9 13  2  0

+ 11 14  2  0

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+ 15 17  1  0

+  7  8  2  0

+ 10 13  1  0

+ 14 15  1  0

+  5 18  1  0

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+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7156-07-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 25                          1 V2000

+   -0.0763    0.0000    0.1015 C   0  0  0

+    0.6717   -1.1701    0.1850 C   0  0  0

+    0.6701    1.1713    0.1836 C   0  0  0

+   -1.4732   -0.0010   -0.0590 C   0  0  0

+    2.1184   -0.7705    0.3442 C   0  0  0

+    0.0098   -2.3573    0.1124 C   0  0  0

+    2.1174    0.7738    0.3430 C   0  0  0

+    0.0064    2.3575    0.1107 C   0  0  0

+   -2.1236   -1.2437   -0.1362 C   0  0  0

+   -2.1261    1.2406   -0.1305 C   0  0  0

+    2.5422    0.0011   -0.8318 N   0  0  0

+   -1.3784   -2.3832   -0.0419 C   0  0  0

+   -1.3819    2.3813   -0.0425 C   0  0  0

+    2.7643   -1.5875    0.0000 H   0  0  0

+    0.5456   -3.2504    0.0000 H   0  0  0

+    2.7626    1.5914    0.0000 H   0  0  0

+    0.5409    3.2514    0.0000 H   0  0  0

+   -3.1638   -1.2942    0.0000 H   0  0  0

+   -3.1664    1.2895    0.0000 H   0  0  0

+    3.5837    0.0013    0.0000 H   0  0  0

+   -1.8653   -3.3038    0.0000 H   0  0  0

+   -1.8700    3.3013    0.0000 H   0  0  0

+  1  2  1  0

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+  3  7  1  0

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+  4  9  1  0

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+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-67-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.0471   -1.3815   -0.0021 C   0  0  0

+   -1.1727   -0.7318   -0.0016 C   0  0  0

+    1.2201   -0.6497   -0.0012 C   0  0  0

+    0.0987   -2.8877    0.0027 C   0  0  0

+   -1.2200    0.6499   -0.0002 C   0  0  0

+    1.1729    0.7316    0.0002 C   0  0  0

+   -0.0474    1.3815    0.0007 C   0  0  0

+   -2.5501    1.3584    0.0009 C   0  0  0

+    2.4515    1.5293    0.0006 C   0  0  0

+   -2.0524   -1.2807    0.0000 H   0  0  0

+    2.1353   -1.1372    0.0000 H   0  0  0

+   -0.9376   -2.9232    0.0000 H   0  0  0

+    0.1342   -3.9240    0.0000 H   0  0  0

+    1.1350   -2.8522    0.0000 H   0  0  0

+   -0.0829    2.4178    0.0000 H   0  0  0

+   -2.0626    2.2736    0.0000 H   0  0  0

+   -3.4653    1.8459    0.0000 H   0  0  0

+   -3.0376    0.4432    0.0000 H   0  0  0

+    3.0004    0.6496    0.0000 H   0  0  0

+    3.3312    2.0782    0.0000 H   0  0  0

+    1.9026    2.4090    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  6  2  0

+  5  7  2  0

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+  2 10  1  0

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+  4 13  1  0

+  4 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108283-47-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    0.6743   -0.5467    0.0113 C   0  0  0

+   -0.7594   -0.7066    0.4473 C   0  0  0

+    1.3660    0.5471    0.3672 O   0  0  0

+    1.2025   -1.4055   -0.6546 O   0  0  0

+   -1.6841   -0.0921   -0.6054 C   0  0  0

+   -1.0692   -2.1347    0.5975 N   0  0  0

+    2.7821    0.6422    0.0607 C   0  0  0

+   -3.0778   -0.2474   -0.1815 N   0  0  0

+    2.9785    0.6140   -1.4564 C   0  0  0

+    3.3388    1.9517    0.6228 C   0  0  0

+    3.5212   -0.5391    0.6926 C   0  0  0

+   -3.7222    0.6601   -0.0249 N   0  3  0

+   -4.3665    1.5677    0.1317 N   0  5  0

+   -0.5221    0.2729    0.0000 H   0  0  0

+   -0.9088    0.5519    0.0000 H   0  0  0

+   -2.0785    0.8354    0.0000 H   0  0  0

+   -2.0290   -2.4421    0.0000 H   0  0  0

+   -0.3230   -2.8122    0.0000 H   0  0  0

+    2.8353   -0.3836    0.0000 H   0  0  0

+    3.9761    0.4708    0.0000 H   0  0  0

+    3.1217    1.6116    0.0000 H   0  0  0

+    4.2663    1.5574    0.0000 H   0  0  0

+    3.7331    2.8792    0.0000 H   0  0  0

+    2.4113    2.3460    0.0000 H   0  0  0

+    2.6668   -1.0737    0.0000 H   0  0  0

+    4.0558   -1.3935    0.0000 H   0  0  0

+    4.3756   -0.0045    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  7  9  1  0

+  7 10  1  0

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+  8 12  2  0

+ 12 13  2  0

+  2 14  1  0

+  5 15  1  0

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+  9 19  1  0

+  9 20  1  0

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+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109143-17-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -1.5771   -0.0078   -0.1632 C   0  0  0

+   -1.9102    0.3923    1.1418 C   0  0  0

+   -0.2400   -0.1495   -0.5101 C   0  0  0

+   -2.7322   -0.1719   -0.8391 O   0  0  0

+   -3.3775    0.4437    1.1735 C   0  0  0

+   -0.9071    0.6436    2.0774 C   0  0  0

+    0.7447    0.1042    0.4300 C   0  0  0

+   -3.7900    0.0970   -0.0528 C   0  0  0

+    0.4044    0.4998    1.7224 C   0  0  0

+    2.0903   -0.0385    0.0805 N   0  0  0

+   -5.2054    0.0158   -0.4794 N   0  3  0

+    2.7716    1.0263   -0.6598 C   0  0  0

+    2.8194   -1.2530    0.4543 C   0  0  0

+   -6.0953    0.2800    0.3092 O   0  0  0

+   -5.4800   -0.3152   -1.6190 O   0  5  0

+    3.2135    2.1215    0.3130 C   0  0  0

+    2.5137   -2.3621   -0.5543 C   0  0  0

+    4.0521    3.4320   -0.5981 Cl  0  0  0

+    3.4111   -3.8567   -0.0943 Cl  0  0  0

+   -0.1755   -1.0275    0.0000 H   0  0  0

+   -3.6644    1.2760    0.0000 H   0  0  0

+   -0.9670    1.5219    0.0000 H   0  0  0

+    0.8147    1.2787    0.0000 H   0  0  0

+    3.2242    0.2711    0.0000 H   0  0  0

+    3.6493    1.0951    0.0000 H   0  0  0

+    3.5822   -1.6925    0.0000 H   0  0  0

+    3.4363   -0.6249    0.0000 H   0  0  0

+    2.7610    2.8767    0.0000 H   0  0  0

+    2.3358    2.0527    0.0000 H   0  0  0

+    1.7509   -1.9226    0.0000 H   0  0  0

+    1.8968   -2.9902    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  5  8  2  0

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+ 13 26  1  0

+ 13 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55-31-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+   -2.4905    0.1270   -0.3925 C   0  0  0

+   -3.2220   -0.7468    0.3908 C   0  0  0

+   -1.3548   -0.3117   -1.0466 C   0  0  0

+   -2.9361    1.5592   -0.5382 C   0  0  0

+   -2.8170   -2.0651    0.5212 C   0  0  0

+   -0.9449   -1.6264   -0.9207 C   0  0  0

+   -2.2926    2.4078    0.5603 C   0  0  0

+   -2.5371    2.0543   -1.8179 O   0  0  0

+   -1.6731   -2.5069   -0.1376 C   0  0  0

+   -3.5350   -2.9256    1.2916 O   0  0  0

+   -2.7270    3.8039    0.4182 N   0  0  0

+   -1.2714   -3.8001   -0.0127 O   0  0  0

+   -2.0771    4.5601    1.4969 C   0  0  0

+   11.1029    0.1316    0.1005 Cl  0  0  0

+   -4.1170   -0.5659    0.0000 H   0  0  0

+   -0.6881    0.3122    0.0000 H   0  0  0

+   -3.8355    1.7169    0.0000 H   0  0  0

+   -0.0490   -1.8028    0.0000 H   0  0  0

+   -1.6938    1.7184    0.0000 H   0  0  0

+   -1.4950    2.8523    0.0000 H   0  0  0

+   -1.9641    2.7653    0.0000 H   0  0  0

+   -4.1200   -3.6267    0.0000 H   0  0  0

+   -3.6212    3.9890    0.0000 H   0  0  0

+   -1.0005   -4.6721    0.0000 H   0  0  0

+   -1.3846    3.9649    0.0000 H   0  0  0

+   -1.4819    5.2526    0.0000 H   0  0  0

+   -2.7696    5.1553    0.0000 H   0  0  0

+   12.0160    0.1316    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  6  9  2  0

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+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+118745-11-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -2.8637    0.1941   -0.0004 C   0  0  0

+   -4.2538    0.0492   -0.0011 N   0  0  0

+   -2.2992    1.4647    0.0014 C   0  0  0

+   -2.0489   -0.9329    0.0044 C   0  0  0

+   -4.8030   -1.1816   -0.0028 C   0  0  0

+   -5.0852    1.1954   -0.0001 O   0  0  0

+   -0.9294    1.6119    0.0021 C   0  0  0

+   -0.6787   -0.7944    0.0052 C   0  0  0

+   -6.0093   -1.3075   -0.0034 O   0  0  0

+   -0.1069    0.4816    0.0011 C   0  0  0

+    1.3583    0.6345    0.0014 C   0  0  0

+    2.1468   -0.4526    0.0005 C   0  0  0

+    3.6126   -0.2998    0.0008 C   0  0  0

+    4.4361   -1.4285   -0.0002 C   0  0  0

+    4.1857    0.9750   -0.0038 C   0  0  0

+    5.8073   -1.2776   -0.0004 C   0  0  0

+    5.5580    1.1102   -0.0039 C   0  0  0

+    6.3674   -0.0125    0.0004 C   0  0  0

+   -2.9134    2.3074    0.0000 H   0  0  0

+   -2.4760   -1.8842    0.0000 H   0  0  0

+   -4.1907   -2.0257    0.0000 H   0  0  0

+   -5.6975    2.0395    0.0000 H   0  0  0

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+    4.0153   -2.3826    0.0000 H   0  0  0

+    3.5771    1.8217    0.0000 H   0  0  0

+    6.4232   -2.1191    0.0000 H   0  0  0

+    5.9870    2.0606    0.0000 H   0  0  0

+    7.4045    0.0957    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+833-50-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.2755    0.0136   -0.0025 C   0  0  0

+   -1.7537    0.0121   -0.0023 C   0  0  0

+    0.4736    1.0868   -0.0018 N   0  0  0

+    0.4975   -1.0888    0.0025 O   0  0  0

+   -2.4533   -1.1955   -0.0031 C   0  0  0

+   -2.4560    1.2185    0.0045 C   0  0  0

+    1.7777    0.7089   -0.0023 C   0  0  0

+    1.7906   -0.6955    0.0005 C   0  0  0

+   -3.8331   -1.1899   -0.0024 C   0  0  0

+   -3.8354    1.2100    0.0051 C   0  0  0

+    2.9856    1.4111   -0.0016 C   0  0  0

+    2.9998   -1.3735    0.0042 C   0  0  0

+   -4.5229    0.0092   -0.0010 C   0  0  0

+    4.1766    0.7206   -0.0018 C   0  0  0

+    4.1844   -0.6667    0.0015 C   0  0  0

+   -1.9370   -2.0954    0.0000 H   0  0  0

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+   -4.3544   -2.0870    0.0000 H   0  0  0

+   -4.3585    2.1060    0.0000 H   0  0  0

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+   -5.5604    0.0081    0.0000 H   0  0  0

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+  1  2  1  0

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+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+55-86-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.0000   -0.5252   -0.3619 N   0  0  0

+   -1.1786    0.2700    0.0079 C   0  0  0

+    1.1786    0.2699    0.0079 C   0  0  0

+   -0.0001   -1.7094    0.5073 C   0  0  0

+   -2.4488   -0.5033   -0.3518 C   0  0  0

+    2.4488   -0.5035   -0.3518 C   0  0  0

+   -3.8953    0.4726    0.1021 Cl  0  0  0

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+   -0.4290    1.0959    0.0000 H   0  0  0

+   -1.8888    1.1299    0.0000 H   0  0  0

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+    0.4291    1.0958    0.0000 H   0  0  0

+   -1.1154   -1.7093    0.0000 H   0  0  0

+   -0.0002   -2.8247    0.0000 H   0  0  0

+    1.1152   -1.7095    0.0000 H   0  0  0

+   -3.1984   -1.3292    0.0000 H   0  0  0

+   -1.7386   -1.3632    0.0000 H   0  0  0

+    1.7385   -1.3634    0.0000 H   0  0  0

+    3.1983   -1.3295    0.0000 H   0  0  0

+  1  2  1  0

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+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117-84-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 66 66                          1 V2000

+    0.7153   -2.8417   -0.1424 C   0  0  0

+   -0.6384   -2.6347    0.1840 C   0  0  0

+    1.5105   -1.7503   -0.7444 C   0  0  0

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+   -1.2738   -1.3249   -0.0742 C   0  0  0

+   -1.3753   -3.6711    0.7509 C   0  0  0

+    2.6398   -1.3291   -0.1431 O   0  0  0

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+    0.5563   -5.0942    0.6789 C   0  0  0

+   -2.5966   -1.1671    0.1252 O   0  0  0

+   -0.6031   -0.3913   -0.4660 O   0  0  0

+   -0.7771   -4.8941    0.9900 C   0  0  0

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+   -3.2206    0.1192   -0.1283 C   0  0  0

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+ 28 65  1  0

+ 28 66  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4075-79-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -0.8106    0.0999   -0.1947 C   0  0  0

+   -2.2815    0.0048   -0.0267 C   0  0  0

+   -0.2130    1.3380   -0.4264 C   0  0  0

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+    3.6817   -0.5687    1.3139 O   0  0  0

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+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66-27-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.3387    0.0068   -0.0906 S   0  0  0

+   -0.8124   -0.3682    0.8319 O   0  0  0

+    0.7390    1.7020    0.4163 C   0  0  0

+    1.3577   -0.9077    0.2894 O   0  0  0

+   -0.2646   -0.0265   -1.3767 O   0  0  0

+   -2.0172    0.0148    0.1657 C   0  0  0

+    1.6618    1.4841    0.0000 H   0  0  0

+    0.9569    2.6248    0.0000 H   0  0  0

+   -0.1838    1.9199    0.0000 H   0  0  0

+   -1.7299    0.9184    0.0000 H   0  0  0

+   -2.9208    0.3021    0.0000 H   0  0  0

+   -2.3045   -0.8888    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  6 10  1  0

+  6 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4514-19-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.2058   -0.4130   -0.0016 C   0  0  0

+   -1.5996   -0.2269   -0.0014 C   0  0  0

+    0.6486    0.7039    0.0000 C   0  0  0

+    0.3457   -1.7688    0.0027 C   0  0  0

+   -2.1254    1.0857   -0.0001 C   0  0  0

+   -2.4642   -1.3441   -0.0021 C   0  0  0

+    2.0922    0.4752   -0.0002 C   0  0  0

+    0.1017    2.0009    0.0022 C   0  0  0

+    1.7184   -1.9519    0.0021 C   0  0  0

+   -0.5769   -2.9047    0.0070 C   0  0  0

+   -1.2420    2.1883    0.0005 C   0  0  0

+   -3.5147    1.2589    0.0001 C   0  0  0

+   -1.9114   -2.6961   -0.0025 C   0  0  0

+   -3.8439   -1.1284   -0.0018 C   0  0  0

+    2.5913   -0.8516   -0.0020 C   0  0  0

+    2.9887    1.5509    0.0008 C   0  0  0

+   -1.7986    3.5887    0.0014 C   0  0  0

+   -4.3478    0.1597   -0.0010 C   0  0  0

+    3.9857   -1.0555   -0.0026 C   0  0  0

+    4.3313    1.3152    0.0002 C   0  0  0

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+    0.7443    2.8372    0.0000 H   0  0  0

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+   -0.1987   -3.8892    0.0000 H   0  0  0

+   -3.9245    2.2306    0.0000 H   0  0  0

+   -2.5654   -3.5235    0.0000 H   0  0  0

+   -4.5042   -1.9508    0.0000 H   0  0  0

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+   -0.8185    3.9782    0.0000 H   0  0  0

+   -2.1881    4.5688    0.0000 H   0  0  0

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+   -5.3924    0.3046    0.0000 H   0  0  0

+    4.3764   -2.0351    0.0000 H   0  0  0

+    5.0029    2.1283    0.0000 H   0  0  0

+    5.8694   -0.1455    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  4  9  2  0

+  4 10  1  0

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+  8 11  2  0

+  9 15  1  0

+ 10 13  2  0

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+ 20 21  1  0

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+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55268-74-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 50                          1 V2000

+    1.4164    0.0282    0.5983 C   0  0  0

+    2.5903   -0.8363    0.2192 C   0  0  0

+    1.6642    1.4183    0.2565 N   0  0  0

+    0.1412   -0.5267   -0.0165 C   0  0  0

+    3.7866   -0.3038   -0.2074 C   0  0  0

+    2.4422   -2.2136    0.3104 C   0  0  0

+    0.7538    2.2408   -0.2825 C   0  0  0

+    3.0155    1.9535    0.5237 C   0  0  0

+   -0.9011    0.5061   -0.0355 N   0  0  0

+    4.0088    1.1797   -0.3410 C   0  0  0

+    4.8374   -1.1506   -0.5352 C   0  0  0

+    3.4864   -3.0531   -0.0189 C   0  0  0

+   -0.5983    1.7633   -0.7373 C   0  0  0

+    1.0306    3.4148   -0.4088 O   0  0  0

+   -2.0908    0.3101    0.5667 C   0  0  0

+    4.6894   -2.5189   -0.4423 C   0  0  0

+   -3.2371   -0.2893   -0.2065 C   0  0  0

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+   -0.7484    2.7730    0.0000 H   0  0  0

+   -1.6181    1.8086    0.0000 H   0  0  0

+    5.5140   -3.1206    0.0000 H   0  0  0

+   -2.4635   -0.9553    0.0000 H   0  0  0

+   -3.4719   -2.5850    0.0000 H   0  0  0

+   -2.6662   -1.6490    0.0000 H   0  0  0

+   -3.6500    1.3872    0.0000 H   0  0  0

+   -4.9896    1.5357    0.0000 H   0  0  0

+   -5.6031   -2.8831    0.0000 H   0  0  0

+   -4.2635   -3.0316    0.0000 H   0  0  0

+   -5.7812    1.0891    0.0000 H   0  0  0

+   -6.5869    0.1531    0.0000 H   0  0  0

+   -6.9325   -0.7572    0.0000 H   0  0  0

+   -6.5749   -2.0608    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  2  0

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+ 15 17  1  0

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+ 21 43  1  0

+ 22 44  1  0

+ 22 45  1  0

+ 23 46  1  0

+ 23 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61064-66-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.5927   -0.3238   -0.0009 C   0  0  0

+   -2.0723   -0.4330   -0.0006 C   0  0  0

+   -0.2272    1.0202   -0.0002 C   0  0  0

+    0.4002   -1.3067    0.0034 C   0  0  0

+   -2.6318    0.8417    0.0004 C   0  0  0

+   -2.9112   -1.5494   -0.0011 C   0  0  0

+   -1.4968    1.8363    0.0007 C   0  0  0

+    1.1024    1.3798    0.0001 C   0  0  0

+    1.7292   -0.9448    0.0019 C   0  0  0

+   -4.0017    0.9995    0.0004 C   0  0  0

+   -4.2802   -1.3820   -0.0007 C   0  0  0

+    2.0876    0.3986   -0.0004 C   0  0  0

+   -4.8268   -0.1111   -0.0005 C   0  0  0

+    3.4351    0.7620   -0.0002 N   0  0  0

+    4.6462   -0.4452   -0.0008 Cl  0  0  0

+    0.1346   -2.3164    0.0000 H   0  0  0

+   -2.5024   -2.5101    0.0000 H   0  0  0

+   -0.8529    2.6581    0.0000 H   0  0  0

+   -2.2551    2.5540    0.0000 H   0  0  0

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+    2.4694   -1.6812    0.0000 H   0  0  0

+   -4.4165    1.9576    0.0000 H   0  0  0

+   -4.9063   -2.2175    0.0000 H   0  0  0

+   -5.8638    0.0101    0.0000 H   0  0  0

+    3.7037    1.7709    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  2  0

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+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-51-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.4382   -0.1911   -0.2525 C   0  0  0

+    0.3952   -1.2712   -0.0312 C   0  0  0

+    0.0770    1.0918   -0.2490 C   0  0  0

+   -1.9076   -0.4123   -0.5037 C   0  0  0

+    1.7443   -1.0687    0.1936 C   0  0  0

+    1.4257    1.2943   -0.0243 C   0  0  0

+   -2.6691    0.2577    0.5029 O   0  0  0

+    2.2594    0.2139    0.1970 C   0  0  0

+    0.0134   -2.2207    0.0000 H   0  0  0

+   -0.5577    1.8946    0.0000 H   0  0  0

+   -2.7429   -1.0035    0.0000 H   0  0  0

+   -1.5255   -1.3616    0.0000 H   0  0  0

+    2.3789   -1.8715    0.0000 H   0  0  0

+    1.8074    2.2438    0.0000 H   0  0  0

+   -3.4374    0.9337    0.0000 H   0  0  0

+    3.2731    0.3543    0.0000 H   0  0  0

+  1  2  2  0

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+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+22433-76-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -1.0864    0.4966   -0.2426 C   0  0  0

+   -1.6939   -0.7362    0.1041 C   0  0  0

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+   -0.8957   -1.8881    0.2185 C   0  0  0

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+   -3.2295    1.5230   -0.1140 C   0  0  0

+    0.4434   -1.8116   -0.0027 C   0  0  0

+   -3.7644    0.2788    0.2140 C   0  0  0

+    2.4298   -0.5491   -0.5657 N   0  0  0

+    3.1932    0.3200    0.1259 C   0  0  0

+    4.6572    0.4630   -0.2014 C   0  0  0

+    2.7019    0.9870    1.0118 O   0  0  0

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+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2519-30-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 76                          1 V2000

+   -6.8372    2.6335   -0.5725 C   0  0  0

+   -5.9070    3.5769   -0.0698 C   0  0  0

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+    1.8168   -4.0718    0.0000 H   0  0  0

+   -0.5752   -3.3435    0.0000 H   0  0  0

+   -6.1485    8.3668    0.0000 H   0  0  0

+   -1.1382    3.4651    0.0000 H   0  0  0

+   -1.8788    0.0998    0.0000 H   0  0  0

+    2.5483   -0.2417    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  8 14  1  0

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+ 12 16  2  0

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+ 26 28  2  0

+ 27 29  1  0

+ 27 30  2  0

+ 28 31  1  0

+ 29 32  1  0

+ 29 33  2  0

+ 30 34  1  0

+ 32 35  1  0

+ 33 36  1  0

+ 34 37  1  0

+ 35 38  2  0

+ 37 39  2  0

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+ 38 42  1  0

+ 42 43  2  0

+ 42 44  1  0

+ 43 45  1  0

+ 44 46  2  0

+ 45 47  2  0

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+  7 11  2  0

+  9 13  1  0

+ 31 32  2  0

+ 34 36  2  0

+ 46 47  1  0

+  6 56  1  0

+  7 57  1  0

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+ 10 59  1  0

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+ 36 68  1  0

+ 43 69  1  0

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+ 45 71  1  0

+ 46 72  1  0

+ 18 73  1  0

+ 25 74  1  0

+ 41 75  1  0

+ 51 76  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+121-44-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    0.0005   -0.0041    0.0158 N   0  0  0

+    1.2030   -0.6428    0.5673 C   0  0  0

+   -1.1526   -0.7274    0.5680 C   0  0  0

+   -0.0481    1.3549    0.5715 C   0  0  0

+    2.1204   -1.0770   -0.5776 C   0  0  0

+   -2.0079   -1.2737   -0.5770 C   0  0  0

+   -0.1155    2.3707   -0.5707 C   0  0  0

+    0.4544   -1.1273    0.0000 H   0  0  0

+    1.2619   -1.5326    0.0000 H   0  0  0

+   -1.1877    0.1636    0.0000 H   0  0  0

+   -1.9429   -0.3144    0.0000 H   0  0  0

+    0.7438    0.9450    0.0000 H   0  0  0

+    0.6979    1.8433    0.0000 H   0  0  0

+    1.7389   -1.8830    0.0000 H   0  0  0

+    2.9264   -1.4585    0.0000 H   0  0  0

+    2.5019   -0.2710    0.0000 H   0  0  0

+   -2.4879   -0.5222    0.0000 H   0  0  0

+   -2.7594   -1.7537    0.0000 H   0  0  0

+   -1.5279   -2.0252    0.0000 H   0  0  0

+    0.7743    2.4297    0.0000 H   0  0  0

+   -0.1745    3.2605    0.0000 H   0  0  0

+   -1.0053    2.3117    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  7 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81316-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -1.0038    0.3228    0.0161 C   0  0  0

+   -0.3472   -0.9117   -0.0258 C   0  0  0

+   -0.1059    1.3949    0.0513 C   0  0  0

+   -2.3940    0.4684    0.0166 C   0  0  0

+    1.0997   -0.6139   -0.0171 C   0  0  0

+   -1.1434   -2.0435   -0.0631 C   0  0  0

+    1.2481    0.8043    0.0306 C   0  0  0

+   -0.6502    2.6668    0.0939 C   0  0  0

+   -3.1671   -0.7044   -0.0270 C   0  0  0

+   -2.9073    1.7760    0.0603 C   0  0  0

+    2.2148   -1.4260   -0.0451 C   0  0  0

+   -2.5318   -1.9153   -0.0580 C   0  0  0

+    2.5069    1.3688    0.0481 C   0  0  0

+   -2.0351    2.8288    0.1000 C   0  0  0

+   -4.6456   -0.6308   -0.0286 N   0  3  0

+    3.4985   -0.8603   -0.0280 C   0  0  0

+    3.6460    0.5504    0.0183 C   0  0  0

+   -5.2951   -1.4136    0.6415 O   0  0  0

+   -5.2127    0.2126   -0.6999 O   0  5  0

+    4.6471   -1.6714   -0.0573 C   0  0  0

+    4.9373    1.1072    0.0339 C   0  0  0

+    5.8803   -1.0958   -0.0408 C   0  0  0

+    6.0251    0.2897    0.0041 C   0  0  0

+   -0.7037   -2.9952    0.0000 H   0  0  0

+   -0.0229    3.5068    0.0000 H   0  0  0

+   -3.9424    1.9419    0.0000 H   0  0  0

+    2.1026   -2.4683    0.0000 H   0  0  0

+   -3.1149   -2.7865    0.0000 H   0  0  0

+    2.6123    2.4118    0.0000 H   0  0  0

+   -2.4252    3.8019    0.0000 H   0  0  0

+    4.5538   -2.7156    0.0000 H   0  0  0

+    5.0614    2.1482    0.0000 H   0  0  0

+    6.7341   -1.7042    0.0000 H   0  0  0

+    6.9861    0.7086    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  2  0

+ 13 17  2  0

+ 15 18  2  0

+ 15 19  1  0

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+ 21 23  2  0

+  5  7  2  0

+  9 12  2  0

+ 10 14  2  0

+ 16 17  1  0

+ 22 23  1  0

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+  8 25  1  0

+ 10 26  1  0

+ 11 27  1  0

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+ 13 29  1  0

+ 14 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+ 22 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2403-27-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.9995    1.4696   -0.0026 C   0  0  0

+   -2.1278    0.5395   -0.0030 C   0  0  0

+   -1.2004    2.6703    0.0026 O   0  0  0

+    0.3855    0.9518   -0.0022 C   0  0  0

+   -3.3930    1.0126    0.0022 C   0  0  0

+    1.4650    1.8373   -0.0017 C   0  0  0

+    0.6192   -0.4251    0.0036 C   0  0  0

+   -4.5281    0.0769    0.0018 C   0  0  0

+    2.7544    1.3481   -0.0009 C   0  0  0

+    1.9129   -0.9018    0.0044 C   0  0  0

+   -5.8398    0.5628    0.0072 C   0  0  0

+   -4.3014   -1.3038   -0.0099 C   0  0  0

+    2.9797   -0.0182   -0.0005 C   0  0  0

+   -6.8984   -0.3209    0.0068 C   0  0  0

+   -5.3705   -2.1740   -0.0102 C   0  0  0

+    4.7509   -0.6805    0.0001 Br  0  0  0

+   -6.6657   -1.6852    0.0010 C   0  0  0

+   -1.9564   -0.4850    0.0000 H   0  0  0

+   -3.5644    2.0371    0.0000 H   0  0  0

+    1.2973    2.8624    0.0000 H   0  0  0

+   -0.1800   -1.0886    0.0000 H   0  0  0

+    3.5583    2.0059    0.0000 H   0  0  0

+    2.0880   -1.9257    0.0000 H   0  0  0

+   -6.0160    1.5865    0.0000 H   0  0  0

+   -3.3301   -1.6721    0.0000 H   0  0  0

+   -7.8730    0.0383    0.0000 H   0  0  0

+   -5.2038   -3.1993    0.0000 H   0  0  0

+   -7.4672   -2.3459    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  2  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 13  1  0

+ 17 14  2  0

+ 10 13  1  0

+ 15 17  1  0

+  2 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13558-31-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    0.1494   -0.0895    0.4410 C   0  0  0

+   -1.2166   -0.6094    0.3112 C   0  0  0

+    0.3362    1.2993    0.3154 C   0  0  0

+    1.2867   -0.9913    0.7005 C   0  0  0

+   -2.2784    0.2834    0.0692 C   0  0  0

+   -1.4657   -1.9840    0.4264 C   0  0  0

+   -0.8261    2.1504    0.0641 C   0  0  0

+    1.6243    1.8649    0.4291 C   0  0  0

+    2.0003   -1.5616   -0.3741 C   0  0  0

+    1.6682   -1.2817    2.0106 C   0  0  0

+   -2.0589    1.6104   -0.0443 O   0  0  0

+   -3.5673   -0.2148   -0.0525 C   0  0  0

+   -2.7381   -2.4572    0.3038 C   0  0  0

+   -0.6577    3.4986   -0.0596 C   0  0  0

+    1.7878    3.2021    0.3054 C   0  0  0

+    3.0727   -2.4112   -0.1128 C   0  0  0

+    1.6134   -1.2598   -1.7667 C   0  0  0

+    2.7345   -2.1266    2.2476 C   0  0  0

+   -3.7969   -1.5783    0.0646 C   0  0  0

+    0.6313    4.0604    0.0551 C   0  0  0

+    3.4312   -2.6903    1.1923 C   0  0  0

+    2.2981   -1.8071   -2.7898 O   0  0  0

+    0.6777   -0.5179   -1.9899 O   0  0  0

+   -5.0899   -2.0731   -0.0580 N   0  0  0

+    0.7945    5.3722   -0.0654 N   0  0  0

+   -0.6811   -2.6408    0.0000 H   0  0  0

+    2.4454    1.2544    0.0000 H   0  0  0

+    2.2958   -0.4736    0.0000 H   0  0  0

+   -4.3601    0.4321    0.0000 H   0  0  0

+   -2.9096   -3.4660    0.0000 H   0  0  0

+   -1.4772    4.1113    0.0000 H   0  0  0

+    2.7281    3.6056    0.0000 H   0  0  0

+    2.4407   -3.2159    0.0000 H   0  0  0

+    3.3740   -1.3279    0.0000 H   0  0  0

+    4.2327   -3.3264    0.0000 H   0  0  0

+    3.0974   -2.4460    0.0000 H   0  0  0

+   -5.8844   -1.4283    0.0000 H   0  0  0

+   -5.2510   -3.0836    0.0000 H   0  0  0

+    0.9208    6.3876    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  7 14  2  0

+  8 15  2  0

+  9 16  2  0

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+ 10 18  1  0

+ 12 19  2  0

+ 14 20  1  0

+ 16 21  1  0

+ 17 22  1  0

+ 17 23  2  0

+ 19 24  1  0

+ 20 25  2  0

+  7 11  1  0

+ 13 19  1  0

+ 15 20  1  0

+ 18 21  2  0

+  6 26  1  0

+  8 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 24 37  1  0

+ 24 38  1  0

+ 25 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23703-14-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.8873   -0.1427   -0.1468 C   0  0  0

+   -2.3561    0.0122   -0.0026 C   0  0  0

+   -0.1401    0.8426   -0.7886 C   0  0  0

+   -0.2496   -1.2715    0.3642 C   0  0  0

+   -3.1945   -1.0883   -0.1664 C   0  0  0

+   -2.9013    1.2577    0.3029 C   0  0  0

+    1.2259    0.6934   -0.9200 C   0  0  0

+    1.1165   -1.4104    0.2272 C   0  0  0

+   -4.5600   -0.9387   -0.0306 C   0  0  0

+   -4.2678    1.3959    0.4364 C   0  0  0

+    1.8528   -0.4316   -0.4161 C   0  0  0

+   -5.0961    0.3008    0.2675 C   0  0  0

+    3.3444   -0.5889   -0.5626 C   0  0  0

+    4.0440    0.0313    0.6485 C   0  0  0

+    5.5584   -0.1284    0.4997 C   0  0  0

+    4.8872    1.1007    0.2156 O   0  0  0

+   -0.5474    1.7885    0.0000 H   0  0  0

+   -0.8131   -2.1335    0.0000 H   0  0  0

+   -2.7884   -2.0347    0.0000 H   0  0  0

+   -2.2950    2.0901    0.0000 H   0  0  0

+    1.7951    1.5516    0.0000 H   0  0  0

+    1.5291   -2.3539    0.0000 H   0  0  0

+   -5.1716   -1.7673    0.0000 H   0  0  0

+   -4.6795    2.3399    0.0000 H   0  0  0

+   -6.1186    0.4237    0.0000 H   0  0  0

+    2.9895   -1.5556    0.0000 H   0  0  0

+    4.1951   -1.1693    0.0000 H   0  0  0

+    3.2951    0.7382    0.0000 H   0  0  0

+    5.6577   -1.1534    0.0000 H   0  0  0

+    6.5428    0.1742    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  9 12  2  0

+ 11 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+  8 11  1  0

+ 10 12  1  0

+ 15 16  1  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+626-15-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -2.1982   -0.2002   -1.1959 C   0  0  0

+   -3.5826   -0.5300    0.1605 Br  0  0  0

+   -1.0518    0.5522   -0.5708 C   0  0  0

+   -0.0004   -0.1399    0.0001 C   0  0  0

+   -1.0489    1.9347   -0.5735 C   0  0  0

+    1.0513    0.5503    0.5736 C   0  0  0

+    0.0025    2.6248   -0.0002 C   0  0  0

+    2.1976   -0.2043    1.1962 C   0  0  0

+    1.0516    1.9325    0.5756 C   0  0  0

+    3.5821   -0.5297   -0.1613 Br  0  0  0

+   -2.3764   -1.2135    0.0000 H   0  0  0

+   -1.3387   -0.7658    0.0000 H   0  0  0

+   -0.0011   -1.1688    0.0000 H   0  0  0

+   -1.9538    2.4244    0.0000 H   0  0  0

+    0.0038    3.6537    0.0000 H   0  0  0

+    1.3382   -0.7700    0.0000 H   0  0  0

+    2.3774   -1.2173    0.0000 H   0  0  0

+    1.9576    2.4200    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  1  0

+  9  6  2  0

+ 10  8  1  0

+  7  9  1  0

+  1 11  1  0

+  1 12  1  0

+  4 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61166-05-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.1317   -0.1775   -0.0028 C   0  0  0

+   -1.5011   -0.7242   -0.0015 C   0  0  0

+   -0.2609    1.2192   -0.0010 C   0  0  0

+    1.1333   -0.7606   -0.0001 C   0  0  0

+   -2.3695    0.3778    0.0009 C   0  0  0

+   -2.0166   -2.0178   -0.0023 C   0  0  0

+   -1.6083    1.5330    0.0012 N   0  0  0

+    0.8845    2.0097   -0.0017 C   0  0  0

+    2.2558    0.0389   -0.0018 C   0  0  0

+   -3.7440    0.1622    0.0019 C   0  0  0

+   -3.3815   -2.2112   -0.0007 C   0  0  0

+   -2.1513    2.8936    0.0043 C   0  0  0

+    2.1299    1.4197   -0.0040 C   0  0  0

+    3.6010   -0.5788    0.0010 N   0  3  0

+   -4.2409   -1.1236    0.0004 C   0  0  0

+    4.5946    0.1256   -0.0005 O   0  0  0

+    3.7142   -1.7915    0.0049 O   0  5  0

+    1.2304   -1.7960    0.0000 H   0  0  0

+   -1.3740   -2.8354    0.0000 H   0  0  0

+    0.8005    3.0462    0.0000 H   0  0  0

+   -4.3969    0.9716    0.0000 H   0  0  0

+   -3.7679   -3.1767    0.0000 H   0  0  0

+   -1.1855    3.2790    0.0000 H   0  0  0

+   -2.5367    3.8594    0.0000 H   0  0  0

+   -3.1171    2.5082    0.0000 H   0  0  0

+    2.9825    2.0151    0.0000 H   0  0  0

+   -5.2691   -1.2790    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+  8 13  2  0

+  9 14  1  0

+ 10 15  1  0

+ 14 16  2  0

+ 14 17  1  0

+  5  7  1  0

+  9 13  1  0

+ 11 15  2  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+576-24-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.2888   -0.2996   -0.0021 C   0  0  0

+   -1.6392    0.0204   -0.0012 C   0  0  0

+    0.6592    0.7082   -0.0007 C   0  0  0

+    0.2104   -1.9623    0.0023 Cl  0  0  0

+   -2.0346    1.3501    0.0011 C   0  0  0

+   -2.5729   -0.9674   -0.0030 O   0  0  0

+    0.2608    2.0332    0.0015 C   0  0  0

+    2.3490    0.3102   -0.0013 Cl  0  0  0

+   -1.0843    2.3530    0.0024 C   0  0  0

+   -3.0438    1.5914    0.0000 H   0  0  0

+   -3.2857   -1.7215    0.0000 H   0  0  0

+    0.9727    2.7882    0.0000 H   0  0  0

+   -1.3805    3.3475    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  7  9  1  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+  9 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5926-90-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -3.6276    0.3111   -0.4280 C   0  0  0

+   -4.8556   -0.5666   -0.1779 C   0  0  0

+   -4.4350    0.4411    0.7439 O   0  0  0

+   -2.3603   -0.4765   -0.0894 C   0  0  0

+   -1.2134    0.3433   -0.3230 O   0  0  0

+   -0.0683   -0.4442    0.0097 C   0  0  0

+    1.2008    0.3792   -0.2193 C   0  0  0

+    2.4269   -0.4638    0.1369 C   0  0  0

+    3.6959    0.3596   -0.0921 C   0  0  0

+    4.9220   -0.4835    0.2641 C   0  0  0

+    6.1911    0.3399    0.0352 C   0  0  0

+   -3.2367    1.3564    0.0000 H   0  0  0

+   -5.9698   -0.5033    0.0000 H   0  0  0

+   -4.5452   -1.6385    0.0000 H   0  0  0

+   -3.0685   -1.3390    0.0000 H   0  0  0

+   -1.5980   -1.2916    0.0000 H   0  0  0

+   -0.8153   -1.2733    0.0000 H   0  0  0

+    0.6562   -1.2931    0.0000 H   0  0  0

+    1.9478    1.2084    0.0000 H   0  0  0

+    0.4763    1.2281    0.0000 H   0  0  0

+    1.6799   -1.2930    0.0000 H   0  0  0

+    3.1514   -1.3126    0.0000 H   0  0  0

+    4.4429    1.1887    0.0000 H   0  0  0

+    2.9714    1.2085    0.0000 H   0  0  0

+    4.1750   -1.3126    0.0000 H   0  0  0

+    5.6465   -1.3324    0.0000 H   0  0  0

+    6.7985   -0.5963    0.0000 H   0  0  0

+    7.1273    0.9473    0.0000 H   0  0  0

+    5.5837    1.2761    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  1  0

+  9 10  1  0

+ 10 11  1  0

+  2  3  1  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  4 15  1  0

+  4 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24471-48-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.0587   -0.0156   -0.0901 C   0  0  0

+   -1.4092   -0.0894   -0.0014 C   0  0  0

+    0.6957    1.3136   -0.1054 C   0  0  0

+    0.7744   -1.1135   -0.1482 C   0  0  0

+   -2.1730    1.1694    0.0680 C   0  0  0

+   -2.0137   -1.2536    0.0152 C   0  0  0

+    2.0058    1.3975   -0.1841 C   0  0  0

+   -0.1456    2.5175   -0.0329 C   0  0  0

+    2.2413   -1.0160   -0.2364 C   0  0  0

+    0.1007   -2.4230   -0.1249 C   0  0  0

+   -1.4536    2.4518    0.0462 C   0  0  0

+   -3.4849    1.1215    0.1477 C   0  0  0

+   -1.2149   -2.4889   -0.0551 C   0  0  0

+   -3.4829   -1.3037    0.1046 C   0  0  0

+    2.8169    0.1688   -0.2557 C   0  0  0

+   -4.1719   -0.1825    0.1666 C   0  0  0

+    4.3179    0.2688   -0.3463 C   0  0  0

+    4.9078   -0.3923    0.7749 O   0  0  0

+    2.4968    2.3844    0.0000 H   0  0  0

+    0.3392    3.5075    0.0000 H   0  0  0

+    2.8568   -1.9304    0.0000 H   0  0  0

+    0.6982   -3.3493    0.0000 H   0  0  0

+   -2.0343    3.3887    0.0000 H   0  0  0

+   -4.0716    2.0547    0.0000 H   0  0  0

+   -1.7174   -3.4700    0.0000 H   0  0  0

+   -4.0044   -2.2748    0.0000 H   0  0  0

+   -5.2736   -0.2189    0.0000 H   0  0  0

+    5.2811    0.8049    0.0000 H   0  0  0

+    4.0057    1.3260    0.0000 H   0  0  0

+    5.6417   -1.2148    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

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+  7 15  1  0

+ 12 16  1  0

+ 15 17  1  0

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+  8 11  2  0

+  9 15  2  0

+ 10 13  2  0

+ 14 16  2  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

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+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-83-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.1829   -0.7500   -0.2472 C   0  0  0

+   -1.2623   -0.6428    0.2436 C   0  0  0

+    0.9793    0.3391    0.3337 N   0  0  0

+   -1.8098    0.6144   -0.1583 O   0  0  0

+    2.3481    0.1787   -0.1748 C   0  0  0

+   -0.0820   -1.7464    0.0000 H   0  0  0

+    1.1132   -1.1944    0.0000 H   0  0  0

+   -2.2615   -0.8970    0.0000 H   0  0  0

+   -1.1722   -1.6699    0.0000 H   0  0  0

+    0.5670    1.2841    0.0000 H   0  0  0

+   -2.2215    1.5597    0.0000 H   0  0  0

+    2.2281   -0.8453    0.0000 H   0  0  0

+    3.3721    0.0587    0.0000 H   0  0  0

+    2.4681    1.2027    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-61-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 52                          1 V2000

+    0.7111   -1.9003   -0.0783 C   0  0  0

+   -0.6858   -1.8241    0.0784 C   0  0  0

+    1.4893   -0.6881   -0.4112 C   0  0  0

+    1.3560   -3.1231    0.0880 C   0  0  0

+   -1.3838   -0.5317   -0.0900 C   0  0  0

+   -1.4063   -2.9735    0.3924 C   0  0  0

+    2.4955   -0.2921    0.3920 O   0  0  0

+    1.2214   -0.0495   -1.4089 O   0  0  0

+    0.6249   -4.2525    0.4048 C   0  0  0

+   -2.7297   -0.4843   -0.0610 O   0  0  0

+   -0.7436    0.4872   -0.2545 O   0  0  0

+   -0.7494   -4.1797    0.5485 C   0  0  0

+    3.2599    0.8984    0.0650 C   0  0  0

+   -3.4151    0.7850   -0.2264 C   0  0  0

+    3.7639    1.5508    1.3539 C   0  0  0

+    4.4530    0.5135   -0.8120 C   0  0  0

+   -4.7757    0.5479   -0.8848 C   0  0  0

+   -3.6179    1.4373    1.1426 C   0  0  0

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+    5.2584    1.7679   -1.1566 C   0  0  0

+   -5.4979    1.8854   -1.0591 C   0  0  0

+   -4.3401    2.7748    0.9684 C   0  0  0

+    5.7624    2.4203    0.1323 C   0  0  0

+   -5.7007    2.5376    0.3099 C   0  0  0

+    2.3861   -3.1691    0.0000 H   0  0  0

+   -2.4370   -2.9419    0.0000 H   0  0  0

+    1.0934   -5.1710    0.0000 H   0  0  0

+   -1.2993   -5.0520    0.0000 H   0  0  0

+    2.4173    1.4927    0.0000 H   0  0  0

+   -2.4647    1.1849    0.0000 H   0  0  0

+    4.1829    0.6086    0.0000 H   0  0  0

+    4.7920    1.4723    0.0000 H   0  0  0

+    4.0531   -0.4369    0.0000 H   0  0  0

+    5.3654    0.0332    0.0000 H   0  0  0

+   -5.7304    0.1582    0.0000 H   0  0  0

+   -4.4907   -0.4431    0.0000 H   0  0  0

+   -2.5995    1.2755    0.0000 H   0  0  0

+   -3.0216    2.2785    0.0000 H   0  0  0

+    4.9692    3.7556    0.0000 H   0  0  0

+    3.6569    3.2855    0.0000 H   0  0  0

+    4.8394    2.7101    0.0000 H   0  0  0

+    4.2303    1.8464    0.0000 H   0  0  0

+   -6.5163    2.0472    0.0000 H   0  0  0

+   -6.0942    1.0442    0.0000 H   0  0  0

+   -3.3855    3.1645    0.0000 H   0  0  0

+   -4.6252    3.7658    0.0000 H   0  0  0

+    6.6455    1.8879    0.0000 H   0  0  0

+    6.1897    3.3587    0.0000 H   0  0  0

+   -5.9213    3.5449    0.0000 H   0  0  0

+   -6.6976    2.2740    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  2  0

+  7 13  1  0

+ 10 14  1  0

+ 13 15  1  0

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+ 15 19  1  0

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+ 21 24  1  0

+  9 12  1  0

+ 20 23  1  0

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+  9 27  1  0

+ 12 28  1  0

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+ 22 45  1  0

+ 22 46  1  0

+ 23 47  1  0

+ 23 48  1  0

+ 24 49  1  0

+ 24 50  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64-67-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.0000   -0.5880    0.0002 S   0  0  0

+   -1.0436    0.3132    0.6444 O   0  0  0

+    1.0436    0.3129   -0.6446 O   0  0  0

+    0.6634   -1.2399    1.0745 O   0  0  0

+   -0.6634   -1.2405   -1.0738 O   0  0  0

+   -2.0456    0.5575   -0.3446 C   0  0  0

+    2.0456    0.5577    0.3443 C   0  0  0

+   -3.1310    1.4625    0.2417 C   0  0  0

+    3.1310    1.4624   -0.2425 C   0  0  0

+   -2.8370    0.1209    0.0000 H   0  0  0

+   -1.9262   -0.3384    0.0000 H   0  0  0

+    1.9264   -0.3382    0.0000 H   0  0  0

+    2.8370    0.1212    0.0000 H   0  0  0

+   -2.5522    2.1567    0.0000 H   0  0  0

+   -3.8252    2.0413    0.0000 H   0  0  0

+   -3.7098    0.7683    0.0000 H   0  0  0

+    3.7097    0.7681    0.0000 H   0  0  0

+    3.8253    2.0411    0.0000 H   0  0  0

+    2.5523    2.1567    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  6  8  1  0

+  7  9  1  0

+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+  8 14  1  0

+  8 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93-52-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.7162    0.4308    0.2137 C   0  0  0

+    0.2500    0.2091    0.4824 C   0  0  0

+    2.5566    0.8175    1.2412 C   0  0  0

+    2.2219    0.2421   -1.0587 C   0  0  0

+   -0.5769    1.1618   -0.3834 C   0  0  0

+   -0.2223   -1.6490    0.0470 Br  0  0  0

+    3.9012    1.0209    0.9948 C   0  0  0

+    3.5670    0.4456   -1.3052 C   0  0  0

+   -2.4896    0.8725   -0.0328 Br  0  0  0

+    4.4060    0.8377   -0.2792 C   0  0  0

+   -0.7065   -0.0178    0.0000 H   0  0  0

+    2.2748    1.7593    0.0000 H   0  0  0

+    2.1203   -0.7357    0.0000 H   0  0  0

+    0.2730    1.6559    0.0000 H   0  0  0

+   -0.9032    2.0891    0.0000 H   0  0  0

+    3.9984    1.9991    0.0000 H   0  0  0

+    3.8516   -0.4953    0.0000 H   0  0  0

+    5.3881    0.8815    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  8 10  2  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  7 16  1  0

+  8 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98114-61-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 13                          1 V2000

+   -3.4245   -0.9821   -0.4531 C   0  0  0

+   -4.4646   -0.1629    0.1740 N   0  0  0

+   -2.2825   -1.2048    0.5404 C   0  0  0

+   -4.7880    0.9745   -0.3414 N   0  0  0

+   -1.1963   -2.0603   -0.1145 C   0  0  0

+   -5.6528    1.6556    0.1800 O   0  0  0

+    7.7489    0.3363   -0.0053 K   0  3  0

+   -4.1860   -1.4367    0.0000 H   0  0  0

+   -3.2720   -1.8558    0.0000 H   0  0  0

+   -1.5210   -0.7502    0.0000 H   0  0  0

+   -2.4350   -0.3311    0.0000 H   0  0  0

+   -1.7450   -2.7570    0.0000 H   0  0  0

+   -0.4996   -2.6090    0.0000 H   0  0  0

+   -0.6476   -1.3636    0.0000 H   0  0  0

+   -6.3495    2.2043    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  3  5  1  0

+  4  6  1  0

+  1  8  1  0

+  1  9  1  0

+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85815-37-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 59                          1 V2000

+   -3.8709   -0.4769    0.6364 N   0  0  0

+   -2.6658    0.1556    0.9524 C   0  0  0

+   -4.0728   -1.3932   -0.3362 C   0  0  0

+   -5.1099   -0.2903    1.2708 N   0  0  0

+   -2.2581    1.2926    0.2380 C   0  0  0

+   -1.8701   -0.3342    1.9772 C   0  0  0

+   -5.3292   -1.7436   -0.3138 N   0  0  0

+   -3.0262   -1.9199   -1.2840 C   0  0  0

+   -5.9700   -1.0788    0.6600 C   0  0  0

+   -3.0994    1.8263   -0.8502 C   0  0  0

+   -1.0516    1.9164    0.5636 C   0  0  0

+   -0.6790    0.2923    2.2891 C   0  0  0

+   -2.5480   -3.2209   -0.8095 N   0  0  0

+   -7.4041   -1.2121    0.9943 C   0  0  0

+   -4.4385    2.3718   -0.5488 C   0  0  0

+   -2.6904    1.8170   -1.9952 O   0  0  0

+   -0.2698    1.4124    1.5828 C   0  0  0

+   -1.6030   -3.8855   -1.5034 C   0  0  0

+   -7.8011   -2.1161    1.9118 N   0  0  0

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+   -5.2337    2.8895   -1.5758 C   0  0  0

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+   -8.0177   -3.5109    1.5198 C   0  0  0

+   -8.0159   -1.7038    3.3010 C   0  0  0

+   -6.4846    3.3972   -1.2858 C   0  0  0

+   -4.6498    2.8945   -3.2107 Cl  0  0  0

+   -6.1704    2.8782    1.0370 C   0  0  0

+   -0.0909   -5.7371   -1.9392 N   0  0  0

+   -6.9506    3.3941    0.0167 C   0  0  0

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+   -1.8995   -1.2045    0.0000 H   0  0  0

+   -2.1581   -1.8508    0.0000 H   0  0  0

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+   -8.1513   -4.3714    0.0000 H   0  0  0

+   -7.1572   -3.6445    0.0000 H   0  0  0

+   -7.2436   -1.3015    0.0000 H   0  0  0

+   -8.4182   -0.9315    0.0000 H   0  0  0

+   -8.7882   -2.1061    0.0000 H   0  0  0

+   -6.3206    4.2524    0.0000 H   0  0  0

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+   -0.0409   -6.6065    0.0000 H   0  0  0

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+   -7.7853    3.6421    0.0000 H   0  0  0

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+   21.6317   -0.2426    0.0000 H   0  0  0

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+ 33 56  1  0

+ 33 57  1  0

+ 34 58  1  0

+ 34 59  1  0

+ 35 60  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+575-44-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.4340    0.4330    0.0019 C   0  0  0

+   -0.0899   -0.8837    0.0005 C   0  0  0

+    1.8311    0.6199    0.0016 C   0  0  0

+   -0.4466    1.5275   -0.0023 C   0  0  0

+   -1.4823   -1.0714    0.0008 C   0  0  0

+    0.7912   -1.9787   -0.0016 C   0  0  0

+    2.6610   -0.4786   -0.0001 C   0  0  0

+    2.3541    1.8731    0.0025 O   0  0  0

+   -1.7898    1.3130   -0.0076 C   0  0  0

+   -2.3100    0.0150    0.0024 C   0  0  0

+    2.1362   -1.7679   -0.0023 C   0  0  0

+   -3.6564   -0.1678    0.0026 O   0  0  0

+   -0.0715    2.5018    0.0000 H   0  0  0

+   -1.8820   -2.0359    0.0000 H   0  0  0

+    0.4148   -2.9525    0.0000 H   0  0  0

+    3.6962   -0.3430    0.0000 H   0  0  0

+    2.7562    2.8366    0.0000 H   0  0  0

+   -2.4414    2.1287    0.0000 H   0  0  0

+    2.7844   -2.5863    0.0000 H   0  0  0

+   -4.6909   -0.3083    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68006-83-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.1194   -0.4042   -0.0016 C   0  0  0

+   -1.3520   -0.4819   -0.0010 C   0  0  0

+    0.4497    0.9597   -0.0003 C   0  0  0

+    1.1351   -1.3610    0.0018 C   0  0  0

+   -1.8171    0.8416    0.0008 C   0  0  0

+   -2.2585   -1.5393   -0.0021 C   0  0  0

+   -0.7216    1.6883    0.0011 N   0  0  0

+    1.7255    1.3301   -0.0002 N   0  0  0

+    2.4454   -0.9246   -0.0003 C   0  0  0

+   -3.1872    1.0824    0.0018 C   0  0  0

+   -3.6124   -1.2808   -0.0015 C   0  0  0

+    2.7067    0.4440   -0.0013 C   0  0  0

+    3.5794   -1.9171    0.0033 C   0  0  0

+   -4.0735    0.0266    0.0011 C   0  0  0

+    4.0239    0.8861   -0.0016 N   0  0  0

+    0.9107   -2.3786    0.0000 H   0  0  0

+   -1.9142   -2.5228    0.0000 H   0  0  0

+   -0.7745    2.7290    0.0000 H   0  0  0

+   -3.5438    2.0616    0.0000 H   0  0  0

+   -4.2918   -2.0709    0.0000 H   0  0  0

+    2.8931   -2.7012    0.0000 H   0  0  0

+    4.3635   -2.6034    0.0000 H   0  0  0

+    4.2657   -1.1330    0.0000 H   0  0  0

+   -5.0988    0.2128    0.0000 H   0  0  0

+    4.8050    0.1963    0.0000 H   0  0  0

+    4.2307    1.9074    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+37393-11-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 72                          1 V2000

+   -0.1767   -1.8053    0.4760 C   0  0  0

+    0.2527   -3.1178    0.1973 C   0  0  0

+    0.7591   -0.7892    0.6186 C   0  0  0

+   -1.6193   -1.5120    0.6095 C   0  0  0

+   -0.7328   -4.1996    0.0444 C   0  0  0

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+    2.1174   -1.0695    0.4861 C   0  0  0

+   -2.6082   -2.5984    0.4501 C   0  0  0

+   -1.9910   -0.3805    0.8502 O   0  0  0

+   -2.1759   -3.9094    0.1831 C   0  0  0

+   -0.3606   -5.3318   -0.1964 O   0  0  0

+    2.5438   -2.3590    0.2121 C   0  0  0

+    2.0433   -4.6469   -0.2011 O   0  0  0

+    3.0283   -0.0733    0.6258 O   0  0  0

+   -3.9693   -2.3326    0.5739 C   0  0  0

+   -3.1134   -4.9280    0.0401 C   0  0  0

+    4.0162   -2.6480    0.0719 C   0  0  0

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+   -4.8880   -3.3561    0.4231 C   0  0  0

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+    4.4090    2.4209    0.3933 C   0  0  2

+    5.6033    0.4794   -0.4168 O   0  0  0

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+    3.1211    3.2250    0.1831 C   0  0  2

+    5.5373    3.2905    0.2803 O   0  0  0

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+   -2.7832    2.0862   -0.7740 C   0  0  1

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+   -5.1361    2.1336   -1.3337 O   0  0  0

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+    0.4406    0.2000    0.0000 H   0  0  0

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+  1  2  2  0

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+ 37 65  1  0

+ 38 66  1  0

+ 39 67  1  0

+ 40 68  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+37515-51-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 34                          1 V2000

+    0.2195    0.8085    0.0022 C   0  0  0

+   -0.5234   -0.3872    0.0012 C   0  0  0

+    1.6824    0.7370    0.0017 C   0  0  0

+   -0.4399    2.0507   -0.0021 C   0  0  0

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+   -3.9947    1.0682    0.0022 C   0  0  0

+   -4.1442   -1.3234   -0.0010 C   0  0  0

+    2.0644   -2.9590   -0.0015 O   0  0  0

+    4.4443    0.5330   -0.0006 C   0  0  0

+   -4.7458   -0.0692    0.0010 C   0  0  0

+    0.1291    2.9325    0.0000 H   0  0  0

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+   -5.7928    0.0023    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-07-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.7492   -0.0001    0.0042 C   0  0  0

+    1.4402   -1.1971    0.0031 C   0  0  0

+    1.4406    1.1972    0.0032 C   0  0  0

+   -0.7577    0.0000    0.0002 C   0  0  0

+    2.8228   -1.1972    0.0010 C   0  0  0

+    2.8227    1.1971    0.0010 C   0  0  0

+   -1.3587    1.6999    0.0027 Cl  0  0  0

+   -1.3549   -0.8463   -1.4756 Cl  0  0  0

+   -1.3627   -0.8535    1.4687 Cl  0  0  0

+    3.5139   -0.0002   -0.0001 C   0  0  0

+    0.9218   -2.0949    0.0000 H   0  0  0

+    0.9223    2.0951    0.0000 H   0  0  0

+    3.3411   -2.0951    0.0000 H   0  0  0

+    3.3411    2.0949    0.0000 H   0  0  0

+    4.5507   -0.0002    0.0000 H   0  0  0

+  1  2  2  0

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+  6 10  1  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-02-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.7055   -0.4215    0.0000 C   0  0  0

+   -0.4957    0.4129    0.0000 C   0  0  0

+    1.9129    0.1471    0.0000 C   0  0  0

+   -1.5934   -0.1040    0.0000 O   0  0  0

+    0.6220   -1.4190    0.0000 H   0  0  0

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+    2.7350   -0.4239    0.0000 H   0  0  0

+    1.9964    1.1446    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75464-10-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+   -1.2313   -0.0001    0.1024 C   0  0  0

+   -0.4817   -1.2564    0.0663 C   0  0  0

+   -0.4817    1.2565    0.0665 C   0  0  0

+   -2.6358   -0.0001    0.1642 C   0  0  0

+    0.9336   -1.2232   -0.0018 C   0  0  0

+   -1.1473   -2.4872    0.0986 C   0  0  0

+    0.9333    1.2234   -0.0016 C   0  0  0

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+   -3.4460   -0.0002   -1.1065 C   0  0  0

+   -3.1968   -0.0002    1.2428 O   0  0  0

+    1.6194    0.0000   -0.0337 C   0  0  0

+    1.6456   -2.4436   -0.0362 C   0  0  0

+   -0.4345   -3.6500    0.0647 C   0  0  0

+    1.6453    2.4438   -0.0357 C   0  0  0

+   -0.4348    3.6501    0.0635 C   0  0  0

+   -4.9364   -0.0002   -0.7610 C   0  0  0

+    2.9693    0.0000   -0.0976 O   0  0  0

+    0.9541   -3.6349   -0.0030 C   0  0  0

+    3.0007   -2.4421   -0.1009 O   0  0  0

+    0.9538    3.6351   -0.0023 C   0  0  0

+    3.0005    2.4423   -0.1004 O   0  0  0

+   -2.1963   -2.5156    0.0000 H   0  0  0

+   -2.1964    2.5155    0.0000 H   0  0  0

+   -3.9707   -0.9090    0.0000 H   0  0  0

+   -2.9212   -0.9090    0.0000 H   0  0  0

+   -0.9422   -4.5684    0.0000 H   0  0  0

+   -0.9426    4.5685    0.0000 H   0  0  0

+   -4.9364    1.0492    0.0000 H   0  0  0

+   -5.9858   -0.0002    0.0000 H   0  0  0

+   -4.9364   -1.0496    0.0000 H   0  0  0

+    4.0187    0.0000    0.0000 H   0  0  0

+    1.4827   -4.5415    0.0000 H   0  0  0

+    4.0501   -2.4409    0.0000 H   0  0  0

+    1.4823    4.5417    0.0000 H   0  0  0

+    4.0499    2.4411    0.0000 H   0  0  0

+  1  2  2  0

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+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98151-92-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.0441   -0.1130   -0.0013 C   0  0  0

+   -1.4006    0.2579   -0.0010 C   0  0  0

+    0.9559    0.8744    0.0002 C   0  0  0

+    0.3117   -1.5330    0.0028 C   0  0  0

+   -2.4049   -0.7347   -0.0016 C   0  0  0

+   -1.7422    1.6300    0.0005 C   0  0  0

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+    1.6444   -1.9069    0.0021 C   0  0  0

+   -0.7705   -2.5176    0.0072 C   0  0  0

+   -3.7497   -0.3302   -0.0012 C   0  0  0

+   -2.0579   -2.1068   -0.0021 C   0  0  0

+   -0.7163    2.6004    0.0011 C   0  0  0

+   -3.0960    1.9937    0.0008 C   0  0  0

+    2.6619   -0.9380   -0.0021 C   0  0  0

+    3.3918    1.3851    0.0008 C   0  0  0

+   -4.0717    1.0235   -0.0002 C   0  0  0

+   -4.7618   -1.2847   -0.0023 N   0  0  0

+    4.0141   -1.3350   -0.0029 C   0  0  0

+    4.6882    0.9639   -0.0001 C   0  0  0

+    4.9968   -0.3942   -0.0019 C   0  0  0

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+   -2.8255   -2.8288    0.0000 H   0  0  0

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+   -4.5190   -2.3101    0.0000 H   0  0  0

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+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86451-37-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+   -0.0326    0.7620   -0.7481 C   0  0  0

+   -1.1315    0.1747    0.1397 C   0  0  0

+    1.2745    0.5183   -0.1329 N   0  0  0

+   -2.4966    0.4292   -0.5028 C   0  0  0

+   -0.9273   -1.2324    0.2825 O   0  0  0

+    1.9266   -0.5598   -0.4094 N   0  0  0

+    1.8410    1.4990    0.7964 C   0  0  0

+   -3.5230   -0.1193    0.3264 O   0  0  0

+    3.0132   -0.7624    0.1021 O   0  0  0

+    0.4037    1.5943    0.0000 H   0  0  0

+   -0.6997    1.4239    0.0000 H   0  0  0

+   -1.2750    1.1034    0.0000 H   0  0  0

+   -2.0602    1.2615    0.0000 H   0  0  0

+   -3.1637    1.0911    0.0000 H   0  0  0

+   -0.7923   -2.1624    0.0000 H   0  0  0

+    2.6547    1.0289    0.0000 H   0  0  0

+    2.3111    2.3127    0.0000 H   0  0  0

+    1.0273    1.9691    0.0000 H   0  0  0

+   -4.3518   -0.5622    0.0000 H   0  0  0

+  1  2  1  0

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+  4 14  1  0

+  5 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6606-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 39                          1 V2000

+   -4.3210   -0.2252    0.0000 O   0  0  0

+   -5.5219    0.3870    0.0000 C   0  0  0

+   -3.1031    0.5654    0.0000 C   0  0  0

+   -6.7545   -0.4131    0.0000 C   0  0  0

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+    5.5219   -0.3870    0.0000 C   0  0  0

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+    5.5853   -1.6007    0.0000 O   0  0  0

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+   -2.3371    1.3578    0.0000 H   0  0  0

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+   -2.6559   -1.1593    0.0000 H   0  0  0

+   -1.1892   -1.2176    0.0000 H   0  0  0

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+   -0.1594   -1.2585    0.0000 H   0  0  0

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+    6.6184    3.0187    0.0000 H   0  0  0

+    5.5753    1.8606    0.0000 H   0  0  0

+    7.9977   -1.2919    0.0000 H   0  0  0

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+ 17 36  1  0

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+ 17 38  1  0

+ 18 39  1  0

+ 18 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56715-28-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    1.2512   -0.2627    0.0359 C   0  0  0

+   -0.0663    0.2361    0.0955 C   0  0  0

+    2.3336    0.6468   -0.0595 C   0  0  0

+    1.5114   -1.6415    0.0753 C   0  0  0

+   -1.1175   -0.6188    0.1876 O   0  0  0

+   -0.2781    1.5854    0.0602 C   0  0  0

+    2.0733    2.0278   -0.0926 C   0  0  0

+    3.6468    0.1507   -0.1189 C   0  0  0

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+   -2.2996    0.1830    0.2284 C   0  0  0

+    0.7888    2.4751   -0.0337 C   0  0  0

+    3.8612   -1.1932   -0.0839 C   0  0  0

+   -3.5275   -0.7238    0.3328 C   0  0  0

+   -4.7933    0.1347    0.3764 C   0  0  0

+   -4.3609   -0.5308   -0.8120 O   0  0  0

+    0.7224   -2.3224    0.0000 H   0  0  0

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+    4.8377   -1.5575    0.0000 H   0  0  0

+   -3.3161   -1.7444    0.0000 H   0  0  0

+   -4.5809    1.1550    0.0000 H   0  0  0

+   -5.8176   -0.0575    0.0000 H   0  0  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122-60-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.8716    0.4240   -0.0662 C   0  0  0

+   -0.3734    0.9615   -0.1553 O   0  0  0

+    1.9807    1.2519    0.0263 C   0  0  0

+    1.0350   -0.9539   -0.0618 C   0  0  0

+   -1.2903   -0.1316   -0.2359 C   0  0  0

+    3.2454    0.7030    0.1168 C   0  0  0

+    2.3015   -1.4977    0.0288 C   0  0  0

+   -2.7185    0.4074   -0.3389 C   0  0  0

+    3.4060   -0.6701    0.1151 C   0  0  0

+   -3.7003   -0.7629   -0.4251 C   0  0  0

+   -3.4782   -0.0384    0.7864 O   0  0  0

+    1.8609    2.2809    0.0000 H   0  0  0

+    0.2051   -1.5739    0.0000 H   0  0  0

+   -1.7625   -1.0537    0.0000 H   0  0  0

+   -0.4269   -0.7042    0.0000 H   0  0  0

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+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+38716-10-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    1.2398   -0.9421    0.4219 C   0  0  2

+   -0.2178   -0.9623    0.2768 N   0  0  0

+    1.6801    0.4107    0.6708 O   0  0  0

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+    3.1276   -0.4016   -1.0196 C   0  0  1

+   -2.2163   -2.1809    0.2076 N   0  0  0

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+   -2.2397    0.1918   -0.0477 C   0  0  0

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+    4.3195   -1.1899   -1.0233 O   0  0  0

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+   -3.0040    1.4734   -0.2586 C   0  0  0

+    3.3450    2.6743    1.1484 O   0  0  0

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+   -2.8950    3.7861   -0.4890 O   0  0  0

+    0.9754   -1.9366    0.0000 H   0  0  0

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+    2.6176   -2.0642    0.0000 H   0  0  0

+   -0.3884    1.1056    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-22-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 30                          1 V2000

+    1.2538    0.3348    0.1942 C   0  0  0

+   -0.0055   -0.2460   -0.4521 C   0  0  0

+    2.4615   -0.5285   -0.1757 C   0  0  0

+    1.4738    1.7624   -0.3102 C   0  0  0

+   -1.2132    0.6173   -0.0822 C   0  0  0

+    3.7208    0.0524    0.4707 C   0  0  0

+   -2.4535    0.0452   -0.7189 C   0  0  0

+    4.8488   -0.7540    0.1252 O   0  0  0

+   -3.4984   -0.2364    0.0194 C   0  0  0

+   -3.9904   -1.6574    0.1182 C   0  0  0

+   -4.2085    0.8607    0.7699 C   0  0  0

+    0.4231    0.9608    0.0000 H   0  0  0

+   -0.7467   -0.9756    0.0000 H   0  0  0

+    0.5859   -1.1016    0.0000 H   0  0  0

+    1.7203   -1.2582    0.0000 H   0  0  0

+    3.0530   -1.3841    0.0000 H   0  0  0

+    2.5018    1.6040    0.0000 H   0  0  0

+    1.6322    2.7904    0.0000 H   0  0  0

+    0.4458    1.9208    0.0000 H   0  0  0

+   -0.4720    1.3469    0.0000 H   0  0  0

+   -1.8046    1.4729    0.0000 H   0  0  0

+    4.4621    0.7820    0.0000 H   0  0  0

+    3.1294    0.9080    0.0000 H   0  0  0

+   -2.0991   -0.9327    0.0000 H   0  0  0

+    5.6949   -1.3589    0.0000 H   0  0  0

+   -4.9733   -1.3171    0.0000 H   0  0  0

+   -4.3307   -2.6403    0.0000 H   0  0  0

+   -3.0075   -1.9977    0.0000 H   0  0  0

+   -3.3353    1.4259    0.0000 H   0  0  0

+   -4.7737    1.7339    0.0000 H   0  0  0

+   -5.0817    0.2955    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  2  0

+  9 10  1  0

+  9 11  1  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  4 18  1  0

+  4 19  1  0

+  5 20  1  0

+  5 21  1  0

+  6 22  1  0

+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97166-13-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+   -0.4293    0.3223   -0.8181 C   0  0  0

+   -1.7960    1.0061   -0.8915 C   0  0  0

+    0.5639    1.2429   -0.1061 C   0  0  0

+   -0.5926   -1.3631    0.1809 Br  0  0  0

+   -2.7892    0.0855   -1.6035 C   0  0  0

+   -2.3859    1.3510    0.7770 Cl  0  0  0

+    2.3201    0.3643   -0.0117 Br  0  0  0

+    0.5393   -0.1575    0.0000 H   0  0  0

+   -1.2811    1.9565    0.0000 H   0  0  0

+    1.1596    2.1449    0.0000 H   0  0  0

+   -0.2604    1.9421    0.0000 H   0  0  0

+   -3.5240    0.8783    0.0000 H   0  0  0

+   -3.5820   -0.6493    0.0000 H   0  0  0

+   -2.0544   -0.7073    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  1  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89795-79-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+    0.0568    0.3160   -0.0025 C   0  0  0

+   -0.1579   -1.0809   -0.0020 C   0  0  0

+    1.3272    0.8644   -0.0005 C   0  0  0

+   -1.5959    0.9579    0.0010 S   0  0  0

+    0.9949   -1.9032    0.0003 C   0  0  0

+   -1.5199   -1.4346   -0.0039 C   0  0  0

+    2.4283    0.0221    0.0022 C   0  0  0

+    1.4984    2.2515   -0.0015 N   0  0  0

+   -2.4476   -0.5253    0.0030 N   0  0  0

+    2.2380   -1.3543    0.0019 C   0  0  0

+    0.8883   -2.9460    0.0000 H   0  0  0

+   -1.7900   -2.4474    0.0000 H   0  0  0

+    3.3977    0.4208    0.0000 H   0  0  0

+    2.4635    2.6605    0.0000 H   0  0  0

+    0.6617    2.8829    0.0000 H   0  0  0

+    3.0749   -1.9855    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6  9  2  0

+  7 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  8 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1609-93-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+   -0.2322   -0.4634    0.0000 C   0  0  0

+   -1.6280   -0.0132    0.0000 C   0  0  0

+    0.7576    0.4317    0.0000 C   0  0  0

+   -2.6281   -0.9176    0.0000 O   0  0  0

+   -1.8834    1.1754    0.0000 O   0  0  0

+    2.4098   -0.1012    0.0000 Cl  0  0  0

+   -0.0198   -1.4521    0.0000 H   0  0  0

+    0.5452    1.4204    0.0000 H   0  0  0

+   -3.3782   -1.5959    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  1  7  1  0

+  3  8  1  0

+  4  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100527-20-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.7329    0.7318   -0.0026 C   0  0  0

+   -0.7329    0.7317   -0.0006 C   0  0  0

+    1.4114    1.9713   -0.0018 C   0  0  0

+    1.4643   -0.4574    0.0004 C   0  0  0

+   -1.4117    1.9714    0.0021 C   0  0  0

+   -1.4640   -0.4573   -0.0018 C   0  0  0

+    0.6740    3.1782    0.0015 C   0  0  0

+    2.8135    1.9830   -0.0037 C   0  0  0

+    2.8293   -0.4126   -0.0011 C   0  0  0

+   -0.6742    3.1783    0.0024 C   0  0  0

+   -2.8134    1.9830    0.0041 C   0  0  0

+   -2.8294   -0.4125   -0.0003 C   0  0  0

+    3.5004    0.8046   -0.0063 C   0  0  0

+    3.6029   -1.6746    0.0021 N   0  3  0

+   -3.5004    0.8042    0.0033 C   0  0  0

+   -3.6028   -1.6746   -0.0016 N   0  3  0

+    4.8205   -1.6426    0.0008 O   0  0  0

+    3.0218   -2.7450    0.0062 O   0  5  0

+   -4.8204   -1.6427   -0.0002 O   0  0  0

+   -3.0217   -2.7450   -0.0039 O   0  5  0

+    0.9696   -1.3775    0.0000 H   0  0  0

+   -0.9693   -1.3774    0.0000 H   0  0  0

+    1.1851    4.0893    0.0000 H   0  0  0

+    3.3302    2.8909    0.0000 H   0  0  0

+   -1.1852    4.0895    0.0000 H   0  0  0

+   -3.3301    2.8909    0.0000 H   0  0  0

+    4.5450    0.8171    0.0000 H   0  0  0

+   -4.5450    0.8166    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  8 13  2  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 14 17  2  0

+ 14 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  7 10  2  0

+  9 13  1  0

+ 12 15  2  0

+  4 21  1  0

+  6 22  1  0

+  7 23  1  0

+  8 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21490-63-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.7650    0.2920   -0.4847 C   0  0  1

+   -0.7650    0.2920   -0.4847 C   0  0  2

+    0.0000    1.0456    0.4581 O   0  0  0

+    1.2750   -0.9885    0.1796 C   0  0  0

+   -1.2750   -0.9885    0.1796 C   0  0  0

+    1.6263    0.8637    0.0000 H   0  0  0

+   -1.6263    0.8637    0.0000 H   0  0  0

+    0.3146   -1.3710    0.0000 H   0  0  0

+    1.6575   -1.9489    0.0000 H   0  0  0

+    2.2354   -0.6060    0.0000 H   0  0  0

+   -2.2354   -0.6060    0.0000 H   0  0  0

+   -1.6575   -1.9489    0.0000 H   0  0  0

+   -0.3146   -1.3710    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  3  1  0

+  1  6  1  0

+  2  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2941-64-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.8093   -0.4263    0.0000 S   0  0  0

+   -0.6892    0.4017    0.0000 C   0  0  0

+    2.3595    0.5080    0.0000 C   0  0  0

+   -0.7120    1.6153    0.0000 O   0  0  0

+   -2.1760   -0.4944    0.0000 Cl  0  0  0

+    3.5409   -0.4643    0.0000 C   0  0  0

+    3.2823    1.4009    0.0000 H   0  0  0

+    1.5766    1.5258    0.0000 H   0  0  0

+    2.7249   -1.4557    0.0000 H   0  0  0

+    4.5323   -1.2803    0.0000 H   0  0  0

+    4.3569    0.5271    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  3  8  1  0

+  6  9  1  0

+  6 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106871-13-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 43                          1 V2000

+   -2.3278   -0.1432   -0.5161 C   0  0  0

+   -1.0033    0.0102   -1.2184 C   0  0  0

+   -2.3324   -1.6953    0.4401 P   0  0  0

+   -2.5846    1.2660    0.6115 P   0  0  0

+   -3.3789   -0.1767   -1.4837 O   0  0  0

+    0.1700   -0.0135   -0.4906 C   0  0  0

+   -0.9639    0.1690   -2.5917 C   0  0  0

+   -3.7831   -1.9125    1.1037 O   0  0  0

+   -1.9996   -2.9296   -0.5385 O   0  0  0

+   -1.3084   -1.6209    1.5062 O   0  0  0

+   -1.5608    1.1566    1.8491 O   0  0  0

+   -2.3227    2.6425   -0.1815 O   0  0  0

+   -3.9750    1.2454    1.1181 O   0  0  0

+    1.3906    0.1280   -1.1388 C   0  0  0

+    0.2492    0.3102   -3.2400 C   0  0  0

+    2.5793    0.1040   -0.4058 N   0  0  0

+    1.4262    0.2930   -2.5174 C   0  0  0

+    2.4713    1.1613    0.6083 C   0  0  0

+    2.6033   -1.1742    0.3178 C   0  0  0

+    2.7479    0.4474   -3.2248 C   0  0  0

+    2.9911    2.4786    0.0291 C   0  0  0

+    4.0006   -1.7895    0.2199 C   0  0  0

+    2.8585    3.7762    1.2738 Cl  0  0  0

+    4.0301   -3.3583    1.1080 Cl  0  0  0

+   -4.3372   -0.2072    0.0000 H   0  0  0

+    0.2156   -0.9712    0.0000 H   0  0  0

+   -1.5974    0.8887    0.0000 H   0  0  0

+   -4.7313   -2.0545    0.0000 H   0  0  0

+   -1.7500   -3.8553    0.0000 H   0  0  0

+   -0.6074    1.0547    0.0000 H   0  0  0

+   -2.1435    3.5844    0.0000 H   0  0  0

+    0.2007    1.2678    0.0000 H   0  0  0

+    1.7634    1.8080    0.0000 H   0  0  0

+    1.6148    0.7303    0.0000 H   0  0  0

+    1.6521   -1.0539    0.0000 H   0  0  0

+    2.3473   -2.0982    0.0000 H   0  0  0

+    2.8591   -0.5049    0.0000 H   0  0  0

+    3.7002    0.5586    0.0000 H   0  0  0

+    2.6367    1.3997    0.0000 H   0  0  0

+    3.6990    1.8319    0.0000 H   0  0  0

+    3.8476    2.9096    0.0000 H   0  0  0

+    4.9518   -1.9097    0.0000 H   0  0  0

+    4.2566   -0.8655    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  2  0

+  4 11  1  0

+  4 12  1  0

+  4 13  2  0

+  6 14  1  0

+  7 15  2  0

+ 14 16  1  0

+ 14 17  2  0

+ 16 18  1  0

+ 16 19  1  0

+ 17 20  1  0

+ 18 21  1  0

+ 19 22  1  0

+ 21 23  1  0

+ 22 24  1  0

+ 15 17  1  0

+  5 25  1  0

+  6 26  1  0

+  7 27  1  0

+  8 28  1  0

+  9 29  1  0

+ 11 30  1  0

+ 12 31  1  0

+ 15 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 21 40  1  0

+ 21 41  1  0

+ 22 42  1  0

+ 22 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+527-62-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    1.1557   -0.7693   -0.0011 C   0  0  0

+    0.1090   -1.6877   -0.0009 C   0  0  0

+    0.8816    0.5893   -0.0006 C   0  0  0

+    2.4448   -1.2047    0.0041 O   0  0  0

+   -1.2039   -1.2386   -0.0004 C   0  0  0

+    0.3805   -3.0608   -0.0019 N   0  0  0

+   -0.4298    1.0308   -0.0005 C   0  0  0

+    2.1838    1.7374   -0.0007 Cl  0  0  0

+   -1.4702    0.1186    0.0001 C   0  0  0

+   -3.1133    0.6789    0.0008 Cl  0  0  0

+    3.4302   -1.5375    0.0000 H   0  0  0

+   -1.9876   -1.9224    0.0000 H   0  0  0

+   -0.4023   -3.7457    0.0000 H   0  0  0

+    1.3650   -3.3962    0.0000 H   0  0  0

+   -0.6339    2.0507    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  9 10  1  0

+  7  9  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2893-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+   -1.4393   -0.8300   -0.0835 C   0  0  0

+   -2.3535    0.1405   -0.2877 N   0  0  0

+   -0.2273   -0.5047    0.4125 N   0  0  0

+   -1.7066   -1.9879   -0.3392 O   0  0  0

+   -2.0502    1.4204    0.0038 C   0  0  0

+   -3.8945   -0.2528   -0.9161 Cl  0  0  0

+    0.0532    0.7974    0.6987 C   0  0  0

+    0.9477   -1.7179    0.6804 Cl  0  0  0

+   -0.8593    1.7347    0.4904 N   0  0  0

+   -2.9633    2.3858   -0.2012 O   0  0  0

+    1.2580    1.1314    1.1937 O   0  0  0

+   10.8099    0.4141   -0.7895 Na  0  3  0

+    2.2087    1.3949    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  2  0

+  7 11  1  0

+  7  9  2  0

+ 11 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+87-56-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.5566   -0.2858   -0.0023 C   0  0  0

+   -0.7852   -0.1408   -0.0012 C   0  0  0

+    1.4274    0.9055   -0.0012 C   0  0  0

+    1.2581   -1.8737    0.0021 Cl  0  0  0

+   -1.6518   -1.3263   -0.0023 C   0  0  0

+   -1.4867    1.4472    0.0016 Cl  0  0  0

+    2.7673    0.7608   -0.0023 O   0  0  0

+    0.9367    2.0165    0.0008 O   0  0  0

+   -2.8574   -1.1960   -0.0013 O   0  0  0

+   -1.2248   -2.2930    0.0000 H   0  0  0

+    3.8180    0.6473    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  5  9  2  0

+  5 10  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+76144-81-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+    2.2849   -0.0266    0.0000 N   0  3  0

+    1.1358    0.8643    0.0000 N   0  0  0

+    3.5205    0.7680    0.0000 C   0  0  0

+    2.2476   -0.8739    1.1994 C   0  0  0

+    2.2476   -0.8739   -1.1994 C   0  0  0

+   -0.0599    0.0110    0.0000 C   0  0  0

+   -1.3130    0.8889    0.0000 C   0  0  0

+   -2.5396    0.0135    0.0000 C   0  0  0

+   -2.4221   -1.2043    0.0000 O   0  0  0

+   -3.6531    0.5206    0.0000 O   0  0  0

+    1.1574    1.9546    0.0000 H   0  0  0

+    4.1103   -0.1492    0.0000 H   0  0  0

+    4.4377    1.3578    0.0000 H   0  0  0

+    2.9307    1.6852    0.0000 H   0  0  0

+    1.1582   -0.8259    0.0000 H   0  0  0

+    2.1996   -1.9633    0.0000 H   0  0  0

+    3.3370   -0.9219    0.0000 H   0  0  0

+    1.1582   -0.8259    0.0000 H   0  0  0

+    2.1996   -1.9633    0.0000 H   0  0  0

+    3.3370   -0.9219    0.0000 H   0  0  0

+   -0.7826   -0.8057    0.0000 H   0  0  0

+    0.6698   -0.7994    0.0000 H   0  0  0

+   -0.5903    1.7056    0.0000 H   0  0  0

+   -2.0428    1.6992    0.0000 H   0  0  0

+   -4.6455    0.9726    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  2  0

+  8 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

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+  4 15  1  0

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+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  5 20  1  0

+  6 21  1  0

+  6 22  1  0

+  7 23  1  0

+  7 24  1  0

+ 10 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+113124-69-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    0.6008   -0.2342   -0.0003 C   0  0  0

+   -0.7947   -0.3135   -0.0014 C   0  0  0

+    1.2111    1.0282    0.0145 C   0  0  0

+    1.4353   -1.4534   -0.0206 C   0  0  0

+   -1.5274    0.9008    0.0117 C   0  0  0

+   -1.7024   -1.3369   -0.0128 N   0  0  0

+    2.6893    1.1104    0.0152 C   0  0  0

+    0.4786    2.1383    0.0282 N   0  0  0

+    2.8978   -1.3411   -0.0205 C   0  0  0

+    0.9096   -2.5498   -0.0369 O   0  0  0

+   -2.9294    0.5136    0.0048 C   0  0  0

+   -0.8354    2.1131    0.0267 C   0  0  0

+   -2.9733   -0.8361   -0.0094 C   0  0  0

+    3.4955   -0.1322    0.0000 C   0  0  0

+    3.2392    2.1931    0.0278 O   0  0  0

+   -4.1406    1.4102    0.0102 C   0  0  0

+   -4.2587   -1.6312   -0.0184 C   0  0  0

+    4.8466   -0.0535   -0.0002 O   0  0  0

+   -5.3598    0.5812   -0.4126 C   0  0  0

+   -5.4051   -0.7090    0.4110 C   0  0  0

+    5.3384   -1.3951   -0.0163 C   0  0  0

+   -1.4580   -2.3580    0.0000 H   0  0  0

+    3.4856   -2.2111    0.0000 H   0  0  0

+   -1.3713    3.0160    0.0000 H   0  0  0

+   -3.4254    2.1789    0.0000 H   0  0  0

+   -4.8244    2.2070    0.0000 H   0  0  0

+   -5.0050   -2.3698    0.0000 H   0  0  0

+   -3.6091   -2.4561    0.0000 H   0  0  0

+   -5.7555    1.5538    0.0000 H   0  0  0

+   -6.3936    0.3977    0.0000 H   0  0  0

+   -6.4226   -0.4500    0.0000 H   0  0  0

+   -5.8744   -1.6483    0.0000 H   0  0  0

+    4.3526   -1.7565    0.0000 H   0  0  0

+    5.6998   -2.3809    0.0000 H   0  0  0

+    6.3242   -1.0337    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+  4 10  2  0

+  5 11  1  0

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+  6 13  1  0

+  7 14  1  0

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+  8 12  2  0

+  9 14  2  0

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+ 19 30  1  0

+ 20 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50-29-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.0009   -0.7465   -0.8815 C   0  0  0

+   -1.2212    0.0908   -0.6054 C   0  0  0

+    1.2392    0.0550   -0.5727 C   0  0  0

+   -0.0290   -1.9981   -0.0020 C   0  0  0

+   -2.2951   -0.4564    0.0722 C   0  0  0

+   -1.2660    1.4071   -1.0247 C   0  0  0

+    2.1863    0.2697   -1.5562 C   0  0  0

+    1.4246    0.5801    0.6928 C   0  0  0

+    1.5409   -2.8728   -0.1478 Cl  0  0  0

+   -0.2927   -1.5191    1.7161 Cl  0  0  0

+   -1.3703   -3.0772   -0.5378 Cl  0  0  0

+   -3.4159    0.3111    0.3261 C   0  0  0

+   -2.3866    2.1758   -0.7713 C   0  0  0

+    3.3221    1.0052   -1.2736 C   0  0  0

+    2.5597    1.3156    0.9765 C   0  0  0

+   -3.4634    1.6274   -0.0980 C   0  0  0

+    3.5107    1.5264   -0.0062 C   0  0  0

+   -4.8711    2.5921    0.2205 Cl  0  0  0

+    4.9369    2.4502    0.3494 Cl  0  0  0

+    0.8746   -1.2353    0.0000 H   0  0  0

+   -2.3597   -1.4555    0.0000 H   0  0  0

+   -0.3883    1.8886    0.0000 H   0  0  0

+    2.5750   -0.6529    0.0000 H   0  0  0

+    0.6384    1.1999    0.0000 H   0  0  0

+   -4.2929   -0.1717    0.0000 H   0  0  0

+   -2.3215    3.1748    0.0000 H   0  0  0

+    4.1058    0.3822    0.0000 H   0  0  0

+    2.1730    2.2391    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  1 20  1  0

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+  7 23  1  0

+  8 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23255-93-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 59                          1 V2000

+   -4.4454    1.7934   -0.8039 C   0  0  0

+   -4.4203    0.4664   -0.3209 C   0  0  0

+   -3.4640    2.2825   -1.6364 C   0  0  0

+   -5.8107    2.7917   -0.2616 S   0  0  0

+   -3.3295   -0.3469   -0.6973 C   0  0  0

+   -5.4767   -0.0656    0.5252 C   0  0  0

+   -2.4113    1.4613   -2.0022 C   0  0  0

+   -3.5349    3.6995   -2.1447 C   0  0  0

+   -6.7619    2.0296    1.0299 C   0  0  0

+   -2.3485    0.1610   -1.5305 C   0  0  0

+   -3.2411   -1.6533   -0.2322 N   0  0  0

+   -6.4766    0.6722    1.2893 C   0  0  0

+   -5.5340   -1.2799    0.6056 O   0  0  0

+   -2.4081    3.9616   -2.9834 O   0  0  0

+   -7.7210    2.7180    1.7415 C   0  0  0

+   -2.1082   -2.4953   -0.6243 C   0  0  0

+   -7.1948    0.0393    2.3161 C   0  0  0

+   -8.4146    2.0624    2.7417 C   0  0  0

+   -2.2519   -3.8757    0.0196 C   0  0  0

+   -8.1387    0.7304    3.0179 C   0  0  0

+   -1.1159   -4.7200   -0.3735 N   0  0  0

+   -0.4924   -5.1943    0.8692 C   0  0  0

+   -1.6790   -5.9014   -1.0408 C   0  0  0

+    0.9837   -4.7921    0.8849 C   0  0  0

+   -1.1179   -6.0009   -2.4607 C   0  0  0

+   14.5498    0.8767    0.5224 S   0  0  0

+   13.7783   -0.4505   -0.4440 C   0  0  0

+   15.4889    1.5338   -0.4789 O   0  0  0

+   13.6258    1.9154    0.8164 O   0  0  0

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+   -1.5445    1.9107    0.0000 H   0  0  0

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+   -4.5054    3.5928    0.0000 H   0  0  0

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+   -1.1705   -2.7672    0.0000 H   0  0  0

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+   -3.1896   -3.6038    0.0000 H   0  0  0

+   -2.6859   -4.7503    0.0000 H   0  0  0

+   -8.9599    0.2023    0.0000 H   0  0  0

+   -1.2377   -5.8250    0.0000 H   0  0  0

+   -0.0379   -6.0584    0.0000 H   0  0  0

+   -2.5945   -5.5620    0.0000 H   0  0  0

+   -1.9350   -6.8436    0.0000 H   0  0  0

+    1.2404   -5.7341    0.0000 H   0  0  0

+    1.9257   -4.5354    0.0000 H   0  0  0

+    0.7270   -3.8501    0.0000 H   0  0  0

+   -1.2884   -6.9623    0.0000 H   0  0  0

+   -0.1565   -6.1714    0.0000 H   0  0  0

+   -0.9474   -5.0395    0.0000 H   0  0  0

+   12.9342    0.0402    0.0000 H   0  0  0

+   13.2876   -1.2946    0.0000 H   0  0  0

+   14.6224   -0.9412    0.0000 H   0  0  0

+   16.2889    2.0936    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 15 18  2  0

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+ 22 24  1  0

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+ 26 27  1  0

+ 26 28  1  0

+ 26 29  2  0

+ 26 30  2  0

+  7 10  1  0

+  9 12  2  0

+ 18 20  1  0

+  7 31  1  0

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+ 10 34  1  0

+ 11 35  1  0

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+ 15 37  1  0

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+ 25 53  1  0

+ 25 54  1  0

+ 27 55  1  0

+ 27 56  1  0

+ 27 57  1  0

+ 28 58  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+492-27-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.8088    0.8512   -0.0028 C   0  0  0

+   -1.3363   -0.4652   -0.0016 C   0  0  0

+    0.5106    1.0425   -0.0021 N   0  0  0

+   -1.6979    1.9432    0.0012 C   0  0  0

+   -0.4462   -1.5623   -0.0002 C   0  0  0

+   -2.7260   -0.6555   -0.0014 C   0  0  0

+    1.3567    0.0289   -0.0003 C   0  0  0

+   -3.0398    1.7209    0.0061 C   0  0  0

+    0.9112   -1.2978    0.0000 C   0  0  0

+   -0.9091   -2.8368    0.0014 O   0  0  0

+   -3.5544    0.4255   -0.0024 C   0  0  0

+    2.8133    0.3026    0.0004 C   0  0  0

+    3.2596    1.5731   -0.0008 O   0  0  0

+    3.6041   -0.6186    0.0020 O   0  0  0

+   -1.3309    2.9133    0.0000 H   0  0  0

+   -3.1207   -1.6146    0.0000 H   0  0  0

+   -3.6907    2.5284    0.0000 H   0  0  0

+    1.5948   -2.0778    0.0000 H   0  0  0

+   -1.2632   -3.8117    0.0000 H   0  0  0

+   -4.5818    0.2830    0.0000 H   0  0  0

+    3.6034    2.5517    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+  7 12  1  0

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+ 12 14  2  0

+  7  9  2  0

+  8 11  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+134998-78-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 50                          1 V2000

+   -0.9434    0.4583   -0.0575 C   0  0  0

+   -1.1923   -0.9194    0.1420 C   0  0  0

+    0.3865    0.9310   -0.1380 C   0  0  0

+   -2.0099    1.3746   -0.1723 C   0  0  0

+   -0.1111   -1.8219    0.2606 C   0  0  0

+   -2.5133   -1.4089    0.2253 C   0  0  0

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+   -3.3999    0.8951   -0.0831 C   0  0  0

+   -1.7400    2.7251   -0.3684 C   0  0  0

+    1.2628   -1.3307    0.1772 C   0  0  0

+   -0.3674   -3.1834    0.4581 C   0  0  0

+   -3.6481   -0.4777    0.1038 C   0  0  0

+   -2.7328   -2.7681    0.4221 C   0  0  0

+    2.7814    0.4501   -0.0925 O   0  0  0

+   -0.4334    3.1731   -0.4512 C   0  0  0

+    2.0134    2.7993   -0.4208 N   0  3  0

+   -4.4711    1.7818   -0.1929 C   0  0  0

+    2.3024   -2.1990    0.2914 O   0  0  0

+   -1.6644   -3.6407    0.5364 C   0  0  0

+   -4.9630   -0.9365    0.1824 C   0  0  0

+    3.4745    0.6980    1.0299 C   0  0  0

+    2.4196    3.6073    0.3952 O   0  0  0

+    2.7506    2.4055   -1.3068 O   0  5  0

+   -5.7622    1.3095   -0.1059 C   0  0  0

+    2.8047   -2.7923   -0.8028 C   0  0  0

+   -6.0072   -0.0455    0.0654 C   0  0  0

+    4.9297    1.0811    0.9477 C   0  0  0

+    2.9300    0.6138    2.1095 O   0  0  0

+    3.9572   -3.7550   -0.6762 C   0  0  0

+    2.3313   -2.5538   -1.8928 O   0  0  0

+   -2.5196    3.4073    0.0000 H   0  0  0

+    0.4189   -3.8578    0.0000 H   0  0  0

+   -3.7013   -3.1359    0.0000 H   0  0  0

+   -0.2464    4.1920    0.0000 H   0  0  0

+   -4.2955    2.8028    0.0000 H   0  0  0

+   -1.8427   -4.6612    0.0000 H   0  0  0

+   -5.1539   -1.9547    0.0000 H   0  0  0

+   -6.5549    1.9765    0.0000 H   0  0  0

+   -6.9829   -0.3937    0.0000 H   0  0  0

+    5.1934    0.0793    0.0000 H   0  0  0

+    5.9315    1.3448    0.0000 H   0  0  0

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+    3.2931   -4.5501    0.0000 H   0  0  0

+    4.7523   -4.4191    0.0000 H   0  0  0

+    4.6213   -2.9599    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+ 28 41  1  0

+ 28 42  1  0

+ 28 43  1  0

+ 30 44  1  0

+ 30 45  1  0

+ 30 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1794-84-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    0.9988   -0.0266   -0.0018 N   0  3  0

+   -0.1451   -0.9418   -0.0017 C   0  0  0

+    0.8153    1.1775   -0.0004 O   0  0  0

+    2.1333   -0.4697    0.0018 O   0  5  0

+   -1.6764    0.0101    0.0006 Cl  0  0  0

+   -0.7694   -1.7308    0.0000 H   0  0  0

+    0.5682   -1.6513    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5329-15-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -1.6424   -0.6272    0.0860 N   0  0  0

+   -2.7330    0.1592   -0.0064 C   0  0  0

+   -0.3607   -0.0563    0.0521 C   0  0  0

+   -4.1026   -0.4610   -0.1095 C   0  0  0

+   -2.6122    1.3662   -0.0066 O   0  0  0

+    0.7658   -0.8746    0.0147 C   0  0  0

+   -0.2154    1.3231    0.0500 C   0  0  0

+    0.6250   -2.2270    0.0111 O   0  0  0

+    2.0295   -0.3090   -0.0191 C   0  0  0

+    1.0457    1.8860    0.0162 C   0  0  0

+    1.9423   -2.7793   -0.0303 C   0  0  0

+    2.1709    1.0722   -0.0158 C   0  0  0

+    3.4468    1.6443   -0.0500 N   0  0  0

+   -1.7493   -1.6630    0.0000 H   0  0  0

+   -4.5322    0.4876    0.0000 H   0  0  0

+   -5.0512   -0.8906    0.0000 H   0  0  0

+   -3.6730   -1.4096    0.0000 H   0  0  0

+   -1.0581    1.9349    0.0000 H   0  0  0

+    2.8734   -0.9191    0.0000 H   0  0  0

+    1.1529    2.9218    0.0000 H   0  0  0

+    1.5397   -3.7396    0.0000 H   0  0  0

+    2.9026   -3.1819    0.0000 H   0  0  0

+    2.3449   -1.8190    0.0000 H   0  0  0

+    4.2909    1.0345    0.0000 H   0  0  0

+    3.5529    2.6802    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  2  2  0

+  6  3  2  0

+  7  3  1  0

+  8  6  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  1  0

+ 12  9  2  0

+ 13 12  1  0

+ 10 12  1  0

+  1 14  1  0

+  4 15  1  0

+  4 16  1  0

+  4 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109621-20-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 30                          1 V2000

+    2.0941    0.2618   -0.2440 C   0  0  1

+    0.8818    1.0628    0.2351 C   0  0  0

+    3.2914    1.1720   -0.3401 C   0  0  0

+    2.3749   -0.8155    0.7082 N   0  0  0

+   -0.5593   -0.0327    0.3509 S   0  0  0

+    4.5251    0.6812   -0.1432 O   0  0  0

+    3.1408    2.3435   -0.5945 O   0  0  0

+    2.9320   -1.9655    0.2797 C   0  0  0

+   -1.8092    1.1504    0.9240 C   0  0  0

+    5.6787    1.5581   -0.2358 C   0  0  0

+    3.2208   -3.0737    1.2593 C   0  0  0

+    3.2008   -2.1085   -0.8943 O   0  0  0

+   -3.1491    0.4325    1.0983 C   0  0  0

+   -4.2033    1.4305    1.5817 C   0  0  0

+   -3.7114   -0.3323   -0.6233 Br  0  0  0

+    1.2472   -0.3440    0.0000 H   0  0  0

+    1.5496    1.8618    0.0000 H   0  0  0

+    0.1627    1.8159    0.0000 H   0  0  0

+    1.3978   -1.1755    0.0000 H   0  0  0

+   -1.0167    1.8259    0.0000 H   0  0  0

+   -2.3962    2.0105    0.0000 H   0  0  0

+    6.3088    0.7291    0.0000 H   0  0  0

+    6.5077    2.1882    0.0000 H   0  0  0

+    5.0486    2.3871    0.0000 H   0  0  0

+    2.2132   -3.3363    0.0000 H   0  0  0

+    3.4834   -4.0813    0.0000 H   0  0  0

+    4.2284   -2.8111    0.0000 H   0  0  0

+   -2.4669   -0.3542    0.0000 H   0  0  0

+   -3.4874    2.1867    0.0000 H   0  0  0

+   -4.9595    2.1464    0.0000 H   0  0  0

+   -4.9192    0.6743    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  8 12  2  0

+  9 13  1  0

+ 13 14  1  0

+ 13 15  1  0

+  1 16  1  0

+  2 17  1  0

+  2 18  1  0

+  4 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33213-65-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.6000   -0.8649   -0.7925 C   0  0  1

+   -0.9125   -0.5714   -0.6448 C   0  0  0

+    1.0839    0.6283   -0.9953 C   0  0  0

+    1.1661   -1.1043    0.6050 C   0  0  0

+    1.0587   -2.0538   -2.0681 Cl  0  0  0

+   -0.9377    0.5837    0.3720 C   0  0  0

+   -1.7243   -1.7363   -0.1362 C   0  0  0

+    0.5217    1.1069    0.3946 C   0  0  1

+    2.8791    0.7629   -1.0954 Cl  0  0  0

+    0.2648    1.4351   -2.3842 Cl  0  0  0

+    1.1681    0.0257    1.2910 C   0  0  0

+    1.7252   -2.6345    1.2045 Cl  0  0  0

+   -1.9827    1.5760    0.0349 C   0  0  0

+   -3.0992   -1.3975   -0.2304 O   0  0  0

+    0.7920    2.8319    0.8442 Cl  0  0  0

+    1.7814    0.2530    2.8991 Cl  0  0  0

+   -3.2342    0.9852   -0.3632 O   0  0  0

+   -3.4357   -0.1848    0.6094 S   0  0  0

+   -4.8542   -0.2677    0.6052 O   0  0  0

+   -1.9061   -0.2712    0.0000 H   0  0  0

+   -1.8869    0.1637    0.0000 H   0  0  0

+   -2.0938   -2.7063    0.0000 H   0  0  0

+   -0.8067   -2.2214    0.0000 H   0  0  0

+   -1.1808    2.2350    0.0000 H   0  0  0

+   -2.5380    2.4529    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  2  0

+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+ 11 16  1  0

+ 13 17  1  0

+ 14 18  1  0

+ 18 19  2  0

+  6  8  1  0

+  8 11  1  0

+ 17 18  1  0

+  2 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2564-06-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    2.0073   -0.0134    0.4076 C   0  0  0

+    0.6074   -0.0317    0.9653 C   0  0  0

+    2.6494    1.1916    0.1909 C   0  0  0

+    2.6513   -1.2016    0.1180 C   0  0  0

+   -0.3577    0.0044   -0.1364 N   0  0  0

+    3.9333    1.2084   -0.3206 C   0  0  0

+    3.9356   -1.1848   -0.3936 C   0  0  0

+   -1.6797   -0.0041    0.1253 C   0  0  0

+    4.5754    0.0200   -0.6156 C   0  0  0

+   -2.6724    0.0330   -1.0080 C   0  0  0

+   -2.0706   -0.0417    1.2728 O   0  0  0

+   -4.3473    0.0112   -0.3408 Cl  0  0  0

+    0.0885   -0.8892    0.0000 H   0  0  0

+    1.1053   -0.9016    0.0000 H   0  0  0

+    2.1280    2.0476    0.0000 H   0  0  0

+    2.1442   -2.0661    0.0000 H   0  0  0

+   -0.3422    1.0066    0.0000 H   0  0  0

+    4.4410    2.0726    0.0000 H   0  0  0

+    4.4577   -2.0404    0.0000 H   0  0  0

+    5.5777    0.0236    0.0000 H   0  0  0

+   -2.1535    0.8905    0.0000 H   0  0  0

+   -3.1703    0.9029    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  1  0

+  8 11  2  0

+ 10 12  1  0

+  7  9  2  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+580-20-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.3219    0.5910   -0.0027 C   0  0  0

+   -0.5507   -0.8081   -0.0009 C   0  0  0

+    0.9987    1.0684   -0.0023 C   0  0  0

+   -1.3592    1.4351    0.0007 N   0  0  0

+    0.5396   -1.6934    0.0018 C   0  0  0

+   -1.8758   -1.2816   -0.0013 C   0  0  0

+    2.0448    0.1744   -0.0001 C   0  0  0

+   -2.5948    0.9964    0.0057 C   0  0  0

+    1.8086   -1.2041    0.0026 C   0  0  0

+   -2.8888   -0.3649   -0.0035 C   0  0  0

+    3.3222    0.6363   -0.0001 O   0  0  0

+    1.1847    2.0899    0.0000 H   0  0  0

+    0.3773   -2.7189    0.0000 H   0  0  0

+   -2.0782   -2.3000    0.0000 H   0  0  0

+   -3.3746    1.6819    0.0000 H   0  0  0

+    2.6119   -1.8620    0.0000 H   0  0  0

+   -3.8772   -0.6829    0.0000 H   0  0  0

+    4.2986    0.9894    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  7  9  2  0

+  8 10  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+577-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.3927    0.7328    0.0705 C   0  0  0

+    0.3230   -0.6583   -0.0533 C   0  0  0

+    1.6412    1.3620    0.1143 C   0  0  0

+   -0.8411    1.5313    0.1482 C   0  0  0

+    1.4836   -1.3990   -0.1312 C   0  0  0

+   -0.9931   -1.3340   -0.1001 N   0  3  0

+    2.7924    0.6076    0.0352 C   0  0  0

+   -1.6224    1.5875    1.4356 C   0  0  0

+   -1.2289    2.1439   -0.8236 O   0  0  0

+    2.7150   -0.7691   -0.0872 C   0  0  0

+   -1.2054   -2.3033    0.6062 O   0  0  0

+   -1.8637   -0.9207   -0.8449 O   0  5  0

+    1.6997    2.3937    0.0000 H   0  0  0

+    1.4344   -2.4312    0.0000 H   0  0  0

+    3.7150    1.0731    0.0000 H   0  0  0

+   -1.5483    2.6182    0.0000 H   0  0  0

+   -2.6531    1.6616    0.0000 H   0  0  0

+   -1.6965    0.5568    0.0000 H   0  0  0

+    3.5810   -1.3329    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80-39-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -1.2671    0.8122    0.0925 S   0  0  0

+   -2.1445   -0.4512   -0.5212 N   0  0  0

+   -1.4070    1.8708   -0.8450 O   0  0  0

+   -1.6057    0.8839    1.4707 O   0  0  0

+    0.4319    0.3481    0.0405 C   0  0  0

+   -2.1856   -1.7297    0.1929 C   0  0  0

+    1.1501    0.4850   -1.1324 C   0  0  0

+    1.0480   -0.1478    1.1745 C   0  0  0

+   -3.0590   -2.7186   -0.5818 C   0  0  0

+    2.4832    0.1208   -1.1732 C   0  0  0

+    2.3807   -0.5118    1.1337 C   0  0  0

+    3.0977   -0.3803   -0.0411 C   0  0  0

+    4.5507   -0.7772   -0.0856 C   0  0  0

+   -3.0553   -0.1498    0.0000 H   0  0  0

+   -1.6807   -2.5455    0.0000 H   0  0  0

+   -1.2587   -1.4821    0.0000 H   0  0  0

+    1.1877    1.4436    0.0000 H   0  0  0

+    0.6117   -1.0022    0.0000 H   0  0  0

+   -3.7781   -2.0835    0.0000 H   0  0  0

+   -3.6941   -3.4377    0.0000 H   0  0  0

+   -2.3399   -3.3537    0.0000 H   0  0  0

+    2.9223    0.9738    0.0000 H   0  0  0

+    2.3398   -1.4703    0.0000 H   0  0  0

+    4.2979   -1.7027    0.0000 H   0  0  0

+    5.4762   -1.0300    0.0000 H   0  0  0

+    4.8035    0.1483    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  2  0

+  5  1  1  0

+  6  2  1  0

+  7  5  2  0

+  8  5  1  0

+  9  6  1  0

+ 10  7  1  0

+ 11  8  2  0

+ 12 10  2  0

+ 13 12  1  0

+ 11 12  1  0

+  2 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129286-37-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -0.0804   -0.0520   -0.0068 C   0  0  0

+    0.4616   -1.3512   -0.0048 C   0  0  0

+    1.0354    0.9085   -0.0035 C   0  0  0

+   -1.4851    0.1079   -0.0059 C   0  0  0

+    1.9325   -1.2268   -0.0012 C   0  0  0

+   -0.3905   -2.4652   -0.0055 C   0  0  0

+    2.2083    0.1445    0.0003 C   0  0  0

+    1.1885    2.2868   -0.0030 C   0  0  0

+   -2.3184   -1.0371    0.0023 C   0  0  0

+   -2.0678    1.3844   -0.0126 C   0  0  0

+    3.0217   -2.0826    0.0011 C   0  0  0

+   -1.7401   -2.3208   -0.0049 C   0  0  0

+    3.4964    0.6854    0.0042 C   0  0  0

+    2.4665    2.8414    0.0020 C   0  0  0

+   -3.7135   -0.8732    0.0084 C   0  0  0

+   -3.4238    1.5087   -0.0074 C   0  0  0

+    4.3140   -1.5594    0.0052 C   0  0  0

+    3.6081    2.0861    0.0042 C   0  0  0

+    4.5745   -0.2162    0.0070 C   0  0  0

+   -4.2465    0.3821    0.0040 C   0  0  0

+   -5.5886    0.5366    0.0108 F   0  0  0

+    0.0234   -3.4291    0.0000 H   0  0  0

+    0.3445    2.9099    0.0000 H   0  0  0

+   -1.4608    2.2400    0.0000 H   0  0  0

+    2.8746   -3.1213    0.0000 H   0  0  0

+   -2.3557   -3.1703    0.0000 H   0  0  0

+    2.5582    3.8865    0.0000 H   0  0  0

+   -4.3426   -1.7127    0.0000 H   0  0  0

+   -3.8557    2.4647    0.0000 H   0  0  0

+    5.1239   -2.2262    0.0000 H   0  0  0

+    4.5512    2.5456    0.0000 H   0  0  0

+    5.5630    0.1350    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  2  0

+ 11 17  1  0

+ 13 18  2  0

+ 13 19  1  0

+ 15 20  2  0

+ 20 21  1  0

+  5  7  1  0

+  9 12  1  0

+ 14 18  1  0

+ 16 20  1  0

+ 17 19  2  0

+  6 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+114656-96-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.5967    0.1264   -0.0040 C   0  0  0

+   -0.7411   -0.2938   -0.0030 C   0  0  0

+    0.8814    1.5004   -0.0018 C   0  0  0

+    1.7008   -0.8491   -0.0013 C   0  0  0

+   -1.7412    0.7035    0.0004 C   0  0  0

+   -1.3499   -1.5202   -0.0051 N   0  0  0

+   -0.0991    2.3936    0.0017 N   0  0  0

+    2.2978    1.9450   -0.0028 C   0  0  0

+    3.1054   -0.3671   -0.0020 C   0  0  0

+    1.4636   -2.0401    0.0018 O   0  0  0

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+   -2.7276   -1.3769   -0.0029 C   0  0  0

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+    2.5613    3.1325   -0.0010 O   0  0  0

+    4.1400   -1.2755    0.0006 N   0  0  0

+   -4.3592    0.4147    0.0036 C   0  0  0

+   -2.4340    3.1089    0.0064 C   0  0  0

+   -3.7653   -2.3030   -0.0033 C   0  0  0

+    5.5836   -1.5250    0.0017 C   0  0  0

+    4.5742   -2.6747    0.0103 C   0  0  0

+   -5.3731   -0.5188    0.0032 C   0  0  0

+   -5.0752   -1.8729   -0.0002 C   0  0  0

+   -0.8459   -2.4358    0.0000 H   0  0  0

+    4.3693    1.2828    0.0000 H   0  0  0

+   -4.5860    1.4350    0.0000 H   0  0  0

+   -1.6945    3.8475    0.0000 H   0  0  0

+   -3.1726    3.8484    0.0000 H   0  0  0

+   -3.1735    2.3703    0.0000 H   0  0  0

+   -3.5518   -3.3261    0.0000 H   0  0  0

+    6.4814   -2.0600    0.0000 H   0  0  0

+    5.9462   -0.5447    0.0000 H   0  0  0

+    3.6491   -3.1611    0.0000 H   0  0  0

+    5.2209   -3.4958    0.0000 H   0  0  0

+   -6.3700   -0.2049    0.0000 H   0  0  0

+   -5.8505   -2.5738    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

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+ 20 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-99-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.1508   -0.0924    0.3675 C   0  0  0

+   -1.1817    0.4606   -0.0680 C   0  0  0

+    0.1486   -0.2929    1.8843 C   0  0  0

+    0.4404   -1.6744   -0.4474 Cl  0  0  0

+    1.4581    1.0644   -0.0839 Cl  0  0  0

+   -2.3057   -0.2351    0.1655 O   0  0  0

+   -1.2383    1.5300   -0.6274 O   0  0  0

+   -0.8881   -0.2815    0.0000 H   0  0  0

+    0.1372   -1.3296    0.0000 H   0  0  0

+    1.1853   -0.3043    0.0000 H   0  0  0

+   -3.1872   -0.7807    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  2  7  2  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91687-67-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -2.2550   -1.3932   -0.1489 C   0  0  0

+   -3.3791   -0.3896   -0.1505 C   0  0  0

+   -0.9755   -0.9718   -0.1063 N   0  0  0

+   -2.5017   -2.5802   -0.1808 O   0  0  0

+   -4.2704   -0.6202    1.0716 C   0  0  0

+   -2.6344    1.4287   -0.0846 Br  0  0  0

+    0.1174   -1.9475   -0.1048 C   0  0  0

+    1.4377   -1.2227   -0.0533 C   0  0  0

+    2.0136   -0.9216    1.1671 C   0  0  0

+    2.0752   -0.8644   -1.2262 C   0  0  0

+    3.2245   -0.2574    1.2149 C   0  0  0

+    3.2865   -0.2000   -1.1796 C   0  0  0

+    3.8606    0.1062    0.0411 C   0  0  0

+    5.3818    0.9406    0.1004 Cl  0  0  0

+   -4.0519    0.3812    0.0000 H   0  0  0

+   -0.7669    0.0298    0.0000 H   0  0  0

+   -4.5267    0.3703    0.0000 H   0  0  0

+   -5.2609   -0.8765    0.0000 H   0  0  0

+   -4.0141   -1.6107    0.0000 H   0  0  0

+   -0.6459   -2.6288    0.0000 H   0  0  0

+    0.7080   -2.7829    0.0000 H   0  0  0

+    2.4966   -1.8235    0.0000 H   0  0  0

+    1.5786    0.0300    0.0000 H   0  0  0

+    3.7244   -1.1500    0.0000 H   0  0  0

+    2.7998    0.6999    0.0000 H   0  0  0

+  1  2  1  0

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+  7 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85723-20-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 63 65                          1 V2000

+    3.6088   -1.0344    0.3967 C   0  0  0

+    2.7994   -1.7565   -0.4779 C   0  0  0

+    3.4159    0.3593    0.8167 C   0  0  0

+    4.6483   -1.9015    0.8079 C   0  0  0

+    3.3338   -2.9892   -0.5865 N   0  0  0

+    1.6603   -1.2949   -1.1152 N   0  0  0

+    4.0555    1.4544    0.0589 C   0  0  0

+    2.7292    0.6123    1.7890 O   0  0  0

+    4.4726   -3.0526    0.2234 N   0  0  0

+    5.7653   -1.5539    1.7580 C   0  0  0

+    2.8050   -4.0820   -1.4066 C   0  0  0

+    0.4918   -1.2343   -0.4464 C   0  0  0

+    3.9348    2.7771    0.4979 C   0  0  0

+    4.7885    1.1738   -1.0960 C   0  0  0

+   -0.7281   -0.6514   -1.1122 C   0  0  0

+    0.4219   -1.6488    0.6911 O   0  0  0

+    4.5370    3.7957   -0.2172 C   0  0  0

+    3.2316    3.0583    1.6167 F   0  0  0

+    5.3834    2.2005   -1.7984 C   0  0  0

+   -1.8638   -0.6993   -0.1817 N   0  0  0

+    5.2563    3.5082   -1.3624 C   0  0  0

+   -3.0135   -0.1196   -0.8888 C   0  0  0

+   -4.2383   -0.1383    0.0280 C   0  0  0

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+   -6.0289   -1.0789    0.0000 H   0  0  0

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+   -7.8044   -1.9091    0.0000 H   0  0  0

+  -10.2326   -0.0870    0.0000 H   0  0  0

+   -9.7441   -1.2345    0.0000 H   0  0  0

+  1  2  2  0

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+ 31 62  1  0

+ 31 63  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141511-29-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -0.7480    0.6403   -0.0339 C   0  0  0

+   -1.5615   -0.4803    0.1074 C   0  0  0

+    0.7247    0.4689   -0.0156 C   0  0  0

+   -1.3204    1.8971   -0.1952 C   0  0  0

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+   -4.9976    1.1171   -0.0897 C   0  0  0

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+   -5.7269   -0.1953   -0.3683 C   0  0  0

+    4.9292   -0.0993    0.0396 N   0  3  0

+    5.6680    0.8449    0.2541 O   0  0  0

+    5.3973   -1.2064   -0.1576 O   0  5  0

+   -0.7219    2.7425    0.0000 H   0  0  0

+   -1.9439   -2.0999    0.0000 H   0  0  0

+   -0.8579   -2.8717    0.0000 H   0  0  0

+    1.1785    2.5080    0.0000 H   0  0  0

+   -3.1214    2.9620    0.0000 H   0  0  0

+   -4.1239   -2.5716    0.0000 H   0  0  0

+   -2.8430   -2.0654    0.0000 H   0  0  0

+    0.0516   -2.9532    0.0000 H   0  0  0

+    1.2630   -2.4342    0.0000 H   0  0  0

+    3.0214   -1.9345    0.0000 H   0  0  0

+    3.5672    2.1783    0.0000 H   0  0  0

+   -4.7263    2.1167    0.0000 H   0  0  0

+   -5.9571    1.5072    0.0000 H   0  0  0

+   -6.2145   -1.4879    0.0000 H   0  0  0

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+  1  2  2  0

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+ 15 33  1  0

+ 15 34  1  0

+ 16 35  1  0

+ 16 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108618-28-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -1.5756   -0.2950   -0.0016 C   0  0  0

+   -2.5984    0.6538    0.0001 C   0  0  0

+   -0.1665    0.1374   -0.0002 C   0  0  0

+   -1.8908   -1.6571    0.0011 C   0  0  0

+   -3.9274    0.2356   -0.0008 C   0  0  0

+    0.8166   -0.7774   -0.0019 C   0  0  0

+   -3.2103   -2.0633    0.0056 C   0  0  0

+   -4.2272   -1.1295   -0.0034 C   0  0  0

+   -4.9839    1.2023    0.0005 C   0  0  0

+    2.2249   -0.3452   -0.0005 C   0  0  0

+   -5.8220    1.9691    0.0015 N   0  0  0

+    3.2497   -1.2960   -0.0022 C   0  0  0

+    2.5401    1.0171   -0.0031 C   0  0  0

+    4.5654   -0.8879   -0.0008 C   0  0  0

+    3.8578    1.4172   -0.0018 C   0  0  0

+    4.8748    0.4679    0.0023 C   0  0  0

+    6.2083    0.8772    0.0042 N   0  0  0

+   -2.3687    1.6738    0.0000 H   0  0  0

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+   -1.1256   -2.3696    0.0000 H   0  0  0

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+    5.3324   -1.5984    0.0000 H   0  0  0

+    4.0942    2.4357    0.0000 H   0  0  0

+    6.9738    0.1650    0.0000 H   0  0  0

+    6.4424    1.8962    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+30039-44-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.0896   -0.5452   -0.3862 C   0  0  0

+    0.7296   -1.4840    0.2130 C   0  0  0

+    0.4338    0.6652   -0.8000 C   0  0  0

+   -1.5520   -0.8442   -0.5938 C   0  0  0

+    2.0721   -1.2121    0.3981 C   0  0  0

+    1.7766    0.9372   -0.6148 C   0  0  0

+   -2.3522    0.1389    0.1145 O   0  0  0

+    2.5956   -0.0013   -0.0158 C   0  0  0

+   -3.6921    0.0704    0.0716 C   0  0  0

+    4.0334    0.2897    0.1820 N   0  3  0

+   -4.5226    1.0907    0.8066 C   0  0  0

+   -4.2323   -0.8092   -0.5564 O   0  0  0

+    4.4946    1.3564   -0.1827 O   0  0  0

+    4.7552   -0.5375    0.7095 O   0  5  0

+   -6.0073    0.7872    0.5959 C   0  0  0

+    0.4122   -2.4207    0.0000 H   0  0  0

+   -0.1891    1.4335    0.0000 H   0  0  0

+   -2.4090   -1.3379    0.0000 H   0  0  0

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+    2.6950   -1.9804    0.0000 H   0  0  0

+    2.0940    1.8739    0.0000 H   0  0  0

+   -3.6656    1.5844    0.0000 H   0  0  0

+   -4.8730    2.0156    0.0000 H   0  0  0

+   -6.2054    1.7562    0.0000 H   0  0  0

+   -6.9763    0.5891    0.0000 H   0  0  0

+   -5.8092   -0.1818    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

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+  9 12  2  0

+ 10 13  2  0

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+  6  8  2  0

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+  6 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134-72-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 61 60                          1 V2000

+  -13.6845   -0.8141   -0.0649 C   0  0  0

+  -14.7224    0.2429    0.2119 C   0  0  2

+  -12.9544   -1.3551    0.9765 C   0  0  0

+  -13.4667   -1.2468   -1.3598 C   0  0  0

+  -14.2523    1.5815   -0.3610 C   0  0  1

+  -14.9100    0.3683    1.6229 O   0  0  0

+  -12.0022   -2.3248    0.7226 C   0  0  0

+  -12.5149   -2.2162   -1.6136 C   0  0  0

+  -15.2298    2.6266   -0.0289 N   0  0  0

+  -12.8933    1.9446    0.2406 C   0  0  0

+  -11.7804   -2.7532   -0.5726 C   0  0  0

+  -15.1734    3.6170   -1.1123 C   0  0  0

+    2.6631   -1.1274    0.1124 C   0  0  0

+    1.6253   -0.0704    0.3892 C   0  0  2

+    3.3938   -1.6683    1.1540 C   0  0  0

+    2.8805   -1.5602   -1.1821 C   0  0  0

+    2.0954    1.2682   -0.1836 C   0  0  1

+    1.4378    0.0550    1.8003 O   0  0  0

+    4.3457   -2.6378    0.9001 C   0  0  0

+    3.8326   -2.5300   -1.4361 C   0  0  0

+    1.1179    2.3133    0.1485 N   0  0  0

+    3.4544    1.6314    0.4180 C   0  0  0

+    4.5671   -3.0666   -0.3955 C   0  0  0

+    1.1743    3.3038   -0.9349 C   0  0  0

+   17.2346    0.3787   -0.1396 S   0  0  0

+   16.1647    1.4352    0.0962 O   0  0  0

+   18.2341    0.4801    1.0037 O   0  0  0

+   16.5838   -0.8736    0.0264 O   0  0  0

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+  -15.2878   -0.4395    0.0000 H   0  0  0

+  -12.3727   -0.6866    0.0000 H   0  0  0

+  -14.1873   -1.7626    0.0000 H   0  0  0

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+  -15.6468    0.8608    0.0000 H   0  0  0

+  -11.2846   -1.8048    0.0000 H   0  0  0

+  -13.0945   -2.8866    0.0000 H   0  0  0

+  -16.0630    2.3248    0.0000 H   0  0  0

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+    3.9754   -0.9997    0.0000 H   0  0  0

+    2.1597   -2.0757    0.0000 H   0  0  0

+    2.6976    0.6180    0.0000 H   0  0  0

+    0.7012    0.5477    0.0000 H   0  0  0

+    5.0636   -2.1183    0.0000 H   0  0  0

+    3.2531   -3.2004    0.0000 H   0  0  0

+    0.2847    2.0115    0.0000 H   0  0  0

+    3.6832    0.7753    0.0000 H   0  0  0

+    4.3105    1.8602    0.0000 H   0  0  0

+    3.2256    2.4875    0.0000 H   0  0  0

+    5.1436   -3.7397    0.0000 H   0  0  0

+    2.0591    3.2534    0.0000 H   0  0  0

+    1.2247    4.1886    0.0000 H   0  0  0

+    0.2895    3.3542    0.0000 H   0  0  0

+   15.5341    2.0579    0.0000 H   0  0  0

+   19.1158    0.5695    0.0000 H   0  0  0

+  1  2  1  0

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+  8 11  1  0

+ 20 23  2  0

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+ 24 57  1  0

+ 24 58  1  0

+ 24 59  1  0

+ 26 60  1  0

+ 27 61  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92-06-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -1.2033   -0.7193    0.0174 C   0  0  0

+   -2.4907    0.0186    0.0384 C   0  0  0

+   -0.0001   -0.0211   -0.0010 C   0  0  0

+   -1.1972   -2.1135    0.0221 C   0  0  0

+   -3.5702   -0.4374   -0.7151 C   0  0  0

+   -2.6261    1.1668    0.8163 C   0  0  0

+    1.2034   -0.7195   -0.0207 C   0  0  0

+   -0.0001   -2.8013    0.0025 C   0  0  0

+   -4.7655    0.2526   -0.6915 C   0  0  0

+   -3.8256    1.8488    0.8324 C   0  0  0

+    2.4908    0.0184   -0.0400 C   0  0  0

+    1.1974   -2.1133   -0.0217 C   0  0  0

+   -4.8927    1.3945    0.0782 C   0  0  0

+    3.5701   -0.4390    0.7129 C   0  0  0

+    2.6263    1.1681   -0.8157 C   0  0  0

+    4.7653    0.2513    0.6913 C   0  0  0

+    3.8258    1.8504   -0.8299 C   0  0  0

+    4.8925    1.3950   -0.0759 C   0  0  0

+   -0.0001    1.0140    0.0000 H   0  0  0

+   -2.0919   -2.6339    0.0000 H   0  0  0

+   -3.6343   -1.4705    0.0000 H   0  0  0

+   -1.7635    1.7389    0.0000 H   0  0  0

+   -0.0001   -3.8364    0.0000 H   0  0  0

+   -5.6318   -0.3139    0.0000 H   0  0  0

+   -3.7664    2.8822    0.0000 H   0  0  0

+    2.0921   -2.6337    0.0000 H   0  0  0

+   -5.7864    1.9166    0.0000 H   0  0  0

+    3.6337   -1.4721    0.0000 H   0  0  0

+    1.7636    1.7401    0.0000 H   0  0  0

+    5.6317   -0.3150    0.0000 H   0  0  0

+    3.7670    2.8838    0.0000 H   0  0  0

+    5.7865    1.9167    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  8 12  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1918-00-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.5893   -0.2036   -0.0686 C   0  0  0

+   -0.7977   -0.4034   -0.1204 C   0  0  0

+    1.0966    1.0956    0.0387 C   0  0  0

+    1.5064   -1.3554   -0.1208 C   0  0  0

+   -1.6519    0.6883   -0.0648 C   0  0  0

+   -1.3019   -1.6586   -0.2249 O   0  0  0

+    0.2316    2.1691    0.0927 C   0  0  0

+    2.8116    1.3567    0.1043 Cl  0  0  0

+    1.8440   -1.8946   -1.3087 O   0  0  0

+    1.9585   -1.8191    0.9075 O   0  0  0

+   -1.1372    1.9666    0.0417 C   0  0  0

+   -3.3701    0.4485   -0.1284 Cl  0  0  0

+   -1.5200   -2.1283    1.1069 C   0  0  0

+    0.6096    3.1356    0.0000 H   0  0  0

+    2.3947   -2.7742    0.0000 H   0  0  0

+   -1.7796    2.7817    0.0000 H   0  0  0

+   -2.4613   -1.6912    0.0000 H   0  0  0

+   -1.9571   -3.0696    0.0000 H   0  0  0

+   -0.5787   -2.5654    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 11  2  0

+  7 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 13 17  1  0

+ 13 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-75-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.6998    1.1652   -0.3838 C   0  0  0

+   -0.5863    1.3048    0.4332 C   0  0  0

+    1.6575    2.3034   -0.0258 C   0  0  0

+    1.5507   -0.5598    0.0233 Br  0  0  0

+   -1.8169   -0.1577   -0.0269 Br  0  0  0

+    0.2251    2.3481    0.0000 H   0  0  0

+   -0.2033    2.5205    0.0000 H   0  0  0

+   -1.7034    1.9185    0.0000 H   0  0  0

+    2.6328    1.4828    0.0000 H   0  0  0

+    2.4781    3.2787    0.0000 H   0  0  0

+    0.6822    3.1240    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97-63-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.2888   -0.3797   -0.0013 C   0  0  0

+   -0.8584    0.3282   -0.0003 O   0  0  0

+    1.5824    0.3175   -0.0004 C   0  0  0

+    0.2532   -1.5945    0.0021 O   0  0  0

+   -2.1365   -0.3607   -0.0011 C   0  0  0

+    1.6265    1.8239    0.0016 C   0  0  0

+    2.7149   -0.3813   -0.0015 C   0  0  0

+   -3.2699    0.6672    0.0003 C   0  0  0

+   -2.9545   -1.0795    0.0000 H   0  0  0

+   -1.5148   -1.2547    0.0000 H   0  0  0

+    2.7150    1.7920    0.0000 H   0  0  0

+    1.6584    2.9124    0.0000 H   0  0  0

+    0.5380    1.8558    0.0000 H   0  0  0

+    2.6830   -1.4698    0.0000 H   0  0  0

+    3.6735    0.1354    0.0000 H   0  0  0

+   -2.5384    1.4738    0.0000 H   0  0  0

+   -4.0765    1.3987    0.0000 H   0  0  0

+   -4.0014   -0.1394    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51-45-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.2579    0.0112    0.3087 C   0  0  0

+   -1.1941    0.0007    0.7120 C   0  0  0

+    1.0181    1.1061    0.1171 C   0  0  0

+    1.0211   -1.0685    0.0833 N   0  0  0

+   -2.0716    0.0221   -0.5411 C   0  0  0

+    2.2650    0.6657   -0.2365 N   0  0  0

+    2.2241   -0.6841   -0.2454 C   0  0  0

+   -3.4870    0.0119   -0.1480 N   0  0  0

+   -1.7039   -0.8547    0.0000 H   0  0  0

+   -0.6991   -0.8633    0.0000 H   0  0  0

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+   -2.5666    0.8861    0.0000 H   0  0  0

+    3.0865    1.2283    0.0000 H   0  0  0

+    3.0193   -1.2835    0.0000 H   0  0  0

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+   -3.9786   -0.8540    0.0000 H   0  0  0

+  1  2  1  0

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+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4196-87-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 58                          1 V2000

+    0.0013    1.3621   -0.3746 C   0  0  0

+   -1.2480    1.1857   -1.2400 C   0  0  0

+    0.0006    0.3154    0.7414 C   0  0  0

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+   -2.4335    1.3546   -0.4188 O   0  0  0

+   -0.0003   -1.0142    0.1579 O   0  0  0

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+   -3.6571    1.2423   -0.9710 C   0  0  0

+   -0.0010   -2.0998    0.9556 C   0  0  0

+    3.6595    1.2376   -0.9708 C   0  0  0

+   -3.7687    0.9997   -2.1560 O   0  0  0

+   -4.8632    1.4142   -0.1354 C   0  0  0

+   -0.0009   -1.9663    2.1629 O   0  0  0

+   -0.0018   -3.4525    0.3620 C   0  0  0

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+    4.8658    1.4080   -0.1352 C   0  0  0

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+ 22 17  2  0

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+ 24 18  1  0

+ 25 19  2  0

+ 26 20  1  0

+ 27 21  2  0

+ 28 22  1  0

+ 29 23  2  0

+ 30 24  2  0

+ 31 26  2  0

+ 32 28  2  0

+ 25 30  1  0

+ 27 31  1  0

+ 29 32  1  0

+  2 33  1  0

+  2 34  1  0

+  3 35  1  0

+  3 36  1  0

+  4 37  1  0

+  4 38  1  0

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+  5 40  1  0

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+ 18 42  1  0

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+ 28 52  1  0

+ 29 53  1  0

+ 30 54  1  0

+ 31 55  1  0

+ 32 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-21-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.3870    0.0229   -0.0008 C   0  0  0

+   -2.8664    0.0229   -0.0009 C   0  0  0

+   -0.6889    1.2320    0.0005 C   0  0  0

+   -0.6892   -1.1859    0.0037 C   0  0  0

+   -3.5399   -1.1435   -0.0022 O   0  0  0

+   -3.4736    1.0746    0.0003 O   0  0  0

+    0.6889    1.2320    0.0005 C   0  0  0

+    0.6891   -1.1859    0.0037 C   0  0  0

+    1.3870    0.0229   -0.0008 C   0  0  0

+    2.8664    0.0229   -0.0009 C   0  0  0

+    3.5399   -1.1435   -0.0022 O   0  0  0

+    3.4736    1.0746    0.0003 O   0  0  0

+   -1.2090    2.1329    0.0000 H   0  0  0

+   -1.2094   -2.0868    0.0000 H   0  0  0

+   -4.0601   -2.0444    0.0000 H   0  0  0

+    1.2090    2.1329    0.0000 H   0  0  0

+    1.2092   -2.0868    0.0000 H   0  0  0

+    4.0601   -2.0444    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

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+  8  9  2  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  7 16  1  0

+  8 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+121-14-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    1.0286   -0.0179   -0.0109 C   0  0  0

+   -0.2225   -0.6052    0.0251 C   0  0  0

+    1.1447    1.3581   -0.0697 C   0  0  0

+    2.2438   -0.8625    0.0196 N   0  3  0

+   -1.3571    0.1837    0.0025 C   0  0  0

+    0.0097    2.1472   -0.0924 C   0  0  0

+    2.5084    1.9982   -0.1086 C   0  0  0

+    2.5068   -1.5855   -0.9247 O   0  0  0

+    2.9807   -0.8345    0.9889 O   0  5  0

+   -1.2410    1.5601   -0.0563 C   0  0  0

+   -2.6966   -0.4450    0.0416 N   0  3  0

+   -3.6965    0.2502    0.0216 O   0  0  0

+   -2.7989   -1.6576    0.0938 O   0  5  0

+   -0.3098   -1.6377    0.0000 H   0  0  0

+    0.0970    3.1798    0.0000 H   0  0  0

+    2.9487    1.0602    0.0000 H   0  0  0

+    3.4464    2.4385    0.0000 H   0  0  0

+    2.0681    2.9362    0.0000 H   0  0  0

+   -2.0915    2.1521    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  6 10  2  0

+  2 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+29743-15-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 45                          1 V2000

+   -1.0061    0.8984   -0.1235 C   0  0  0

+   -1.6397   -0.2401   -0.0813 N   0  0  0

+    0.4643    0.9232   -0.0951 C   0  0  0

+   -3.0078   -0.2632   -0.1077 C   0  0  0

+    1.1466    2.1437   -0.1403 C   0  0  0

+    1.1853   -0.2736   -0.0169 C   0  0  0

+   -3.6802   -1.3486   -0.6734 C   0  0  0

+   -3.7381    0.7960    0.4362 C   0  0  0

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+   -5.0595   -1.3652   -0.6967 C   0  0  0

+   -5.1166    0.7661    0.4061 C   0  0  0

+    3.2348    0.9701   -0.0406 C   0  0  0

+   -5.7764   -0.3100   -0.1613 C   0  0  0

+    4.5920    0.9930   -0.0139 O   0  0  0

+   -7.2829   -0.3354   -0.1904 C   0  0  0

+    5.0267   -0.3662    0.0609 C   0  0  0

+   -7.8064   -1.0041    1.0822 C   0  0  0

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+    8.5500   -1.9122    0.2080 C   0  0  0

+   -1.5378    1.7856    0.0000 H   0  0  0

+    0.6175    3.0324    0.0000 H   0  0  0

+    0.6859   -1.1794    0.0000 H   0  0  0

+   -3.1716   -2.2492    0.0000 H   0  0  0

+   -3.2671    1.7169    0.0000 H   0  0  0

+    3.0281    3.0644    0.0000 H   0  0  0

+    3.0956   -1.1307    0.0000 H   0  0  0

+   -5.5381   -2.2822    0.0000 H   0  0  0

+   -5.6316    1.6631    0.0000 H   0  0  0

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+   -8.6208   -0.3665    0.0000 H   0  0  0

+   -8.4440   -1.8185    0.0000 H   0  0  0

+   -6.9920   -1.6417    0.0000 H   0  0  0

+    7.5700   -0.2097    0.0000 H   0  0  0

+    6.4695    0.6191    0.0000 H   0  0  0

+    6.0066   -2.0688    0.0000 H   0  0  0

+    7.1072   -2.8976    0.0000 H   0  0  0

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+    9.5839   -1.9428    0.0000 H   0  0  0

+    8.5806   -0.8783    0.0000 H   0  0  0

+  2  1  2  0

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+ 20 40  1  0

+ 20 41  1  0

+ 21 42  1  0

+ 21 43  1  0

+ 21 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4836-66-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.7513    0.4676    0.0070 C   0  0  0

+   -1.1489   -0.8555   -0.0340 C   0  0  0

+    0.5943    0.7846    0.0298 C   0  0  0

+   -1.7658    1.5453    0.0204 N   0  3  0

+   -0.2012   -1.8619   -0.0524 C   0  0  0

+   -2.6156   -1.2010   -0.0583 C   0  0  0

+    1.5417   -0.2216    0.0114 C   0  0  0

+   -1.8024    2.3586   -0.8855 O   0  0  0

+   -2.5641    1.6187    0.9374 O   0  5  0

+    1.1439   -1.5450   -0.0301 C   0  0  0

+   -2.7697   -2.6211   -0.0996 O   0  0  0

+    2.9822    0.1178    0.0363 N   0  3  0

+    3.8172   -0.7688    0.0202 O   0  0  0

+    3.3327    1.2837    0.0729 O   0  5  0

+    0.8927    1.7772    0.0000 H   0  0  0

+   -0.4996   -2.8545    0.0000 H   0  0  0

+   -2.7378   -0.1717    0.0000 H   0  0  0

+   -3.6521   -1.2062    0.0000 H   0  0  0

+    1.8543   -2.2998    0.0000 H   0  0  0

+   -2.8815   -3.6515    0.0000 H   0  0  0

+  1  2  2  0

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+  3 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111955-18-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    1.4686   -0.2066   -0.1695 C   0  0  0

+    0.4459    0.5786    0.5259 N   0  0  0

+    2.7238    0.6474   -0.3626 C   0  0  1

+    1.7856   -1.3638    0.6017 O   0  0  0

+   -0.9071    0.3277    0.2900 C   0  0  0

+    0.7955    1.5018    1.3563 N   0  0  0

+    3.7730   -0.1716   -1.1229 C   0  0  2

+    2.3936    1.8157   -1.1164 O   0  0  0

+    2.6410   -2.1878   -0.1881 C   0  0  0

+   -1.5755    1.0075   -0.7208 C   0  0  0

+   -1.5873   -0.6067    1.0621 C   0  0  0

+   -0.0513    2.0913    2.0036 O   0  0  0

+    3.9922   -1.4959   -0.3827 C   0  0  2

+    5.0019    0.5561   -1.1712 O   0  0  0

+   -2.9139    0.7568   -0.9513 C   0  0  0

+   -2.9252   -0.8522    0.8260 C   0  0  0

+    4.5826   -1.2367    0.8926 O   0  0  0

+   -3.5888   -0.1694   -0.1775 C   0  0  0

+   -5.0234   -0.4350   -0.4272 N   0  3  0

+   -5.6193   -1.2505    0.2535 O   0  0  0

+   -5.6080    0.1620   -1.3134 O   0  5  0

+    0.7173   -0.7115    0.0000 H   0  0  0

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+    2.9947   -0.6339    0.0000 H   0  0  0

+    2.1474    2.6868    0.0000 H   0  0  0

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+    3.1397   -2.9432    0.0000 H   0  0  0

+   -1.3042    1.8711    0.0000 H   0  0  0

+   -1.1053   -1.3729    0.0000 H   0  0  0

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+   -3.3971    1.5222    0.0000 H   0  0  0

+   -3.2006   -1.7145    0.0000 H   0  0  0

+    5.4115   -0.8728    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+937-40-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.7177    0.3748    0.4797 C   0  0  0

+   -0.5832    0.9173    1.0130 C   0  0  0

+    1.7026    1.2425    0.0469 C   0  0  0

+    0.9283   -0.9907    0.4288 C   0  0  0

+   -1.6825    0.4936    0.1422 N   0  0  0

+    2.8961    0.7449   -0.4424 C   0  0  0

+    2.1214   -1.4881   -0.0603 C   0  0  0

+   -2.2116   -0.6732    0.2927 N   0  0  0

+   -2.1808    1.3951   -0.8996 C   0  0  0

+    3.1043   -0.6203   -0.4987 C   0  0  0

+   -3.1255   -1.0254   -0.4314 O   0  0  0

+    0.0147    1.6808    0.0000 H   0  0  0

+   -1.1601    1.6968    0.0000 H   0  0  0

+    1.5446    2.1994    0.0000 H   0  0  0

+    0.1648   -1.5887    0.0000 H   0  0  0

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+    2.2799   -2.4449    0.0000 H   0  0  0

+   -1.3320    1.8643    0.0000 H   0  0  0

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+  1  2  1  0

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+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+36050-09-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    1.3210    0.1117   -0.0033 C   0  0  0

+    0.1219   -0.6880   -0.0027 C   0  0  0

+    1.1612    1.4819   -0.0015 C   0  0  0

+    2.6569   -0.5062    0.0001 C   0  0  0

+   -1.0540   -0.0299   -0.0004 C   0  0  0

+   -0.5589    1.6810    0.0010 S   0  0  0

+    3.7585    0.2702   -0.0006 N   0  0  0

+    2.7666   -1.7176    0.0036 O   0  0  0

+   -2.4234   -0.5919    0.0001 N   0  3  0

+   -3.3873    0.1527    0.0024 O   0  0  0

+   -2.5863   -1.7990   -0.0018 O   0  5  0

+    0.1622   -1.7218    0.0000 H   0  0  0

+    1.8925    2.2138    0.0000 H   0  0  0

+    4.6975   -0.1642    0.0000 H   0  0  0

+    3.6652    1.3006    0.0000 H   0  0  0

+  1  2  1  0

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+  5  6  1  0

+  2 12  1  0

+  3 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+81-55-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.2783    0.0396   -0.0265 C   0  0  0

+   -1.2761   -1.3678   -0.0258 C   0  0  0

+   -0.0001    0.7804   -0.0015 C   0  0  0

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+   -3.6832    0.0278   -0.0629 C   0  0  0

+   -2.4963    2.2074   -0.0457 N   0  3  0

+    1.2764   -1.3675    0.0247 C   0  0  0

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+   -3.6885   -1.3521   -0.0725 C   0  0  0

+   -2.5009   -3.4162   -0.0490 O   0  0  0

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+   -1.8763    2.8197   -0.8968 O   0  5  0

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+ 19 28  1  0

+ 21 29  1  0

+ 22 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90-46-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -1.1328    0.7541    0.2378 C   0  0  0

+   -1.2221   -0.5780   -0.1268 C   0  0  0

+    0.0000    1.3233    0.6848 O   0  0  0

+   -2.2754    1.5521    0.1508 C   0  0  0

+   -0.0003   -1.4599   -0.0725 C   0  0  0

+   -2.4238   -1.1139   -0.5486 C   0  0  0

+    1.1334    0.7529    0.2409 C   0  0  0

+   -3.4716    1.0171   -0.2762 C   0  0  0

+    1.2211   -0.5774   -0.1290 C   0  0  0

+    0.0010   -2.1972    1.1516 O   0  0  0

+   -3.5519   -0.3185   -0.6240 C   0  0  0

+    2.2775    1.5500    0.1578 C   0  0  0

+    2.4219   -1.1123   -0.5556 C   0  0  0

+    3.4722    1.0161   -0.2730 C   0  0  0

+    3.5506   -0.3182   -0.6281 C   0  0  0

+   -2.1809    2.5489    0.0000 H   0  0  0

+   -0.8914   -1.9167    0.0000 H   0  0  0

+   -2.5211   -2.1105    0.0000 H   0  0  0

+   -4.2951    1.5867    0.0000 H   0  0  0

+    0.0028   -3.1985    0.0000 H   0  0  0

+   -4.4543   -0.7525    0.0000 H   0  0  0

+    2.1834    2.5469    0.0000 H   0  0  0

+    2.5189   -2.1089    0.0000 H   0  0  0

+    4.2960    1.5853    0.0000 H   0  0  0

+    4.4525   -0.7533    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50-65-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    2.2821    0.7178    0.1717 C   0  0  0

+    0.8147    0.7113    0.3216 C   0  0  0

+    2.9962    1.9186    0.2806 C   0  0  0

+    2.9685   -0.4742   -0.0739 C   0  0  0

+    0.0302    0.4340   -0.7386 N   0  0  0

+    0.3128    0.9561    1.4019 O   0  0  0

+    4.3759    1.9136    0.1384 C   0  0  0

+    2.3407    3.0814    0.5236 O   0  0  0

+    4.3403   -0.4612   -0.2126 C   0  0  0

+   -1.3540    0.3157   -0.5727 C   0  0  0

+    5.0421    0.7300   -0.1093 C   0  0  0

+    5.1923   -1.9427   -0.5177 Cl  0  0  0

+   -1.8878   -0.8083    0.0470 C   0  0  0

+   -2.1971    1.3233   -1.0215 C   0  0  0

+   -3.2554   -0.9212    0.2094 C   0  0  0

+   -0.8380   -2.0685    0.6155 Cl  0  0  0

+   -3.5634    1.2038   -0.8558 C   0  0  0

+   -4.0921    0.0824   -0.2439 C   0  0  0

+   -5.5567   -0.0419   -0.0687 N   0  3  0

+   -6.2948    0.8411   -0.4674 O   0  0  0

+   -6.0237   -1.0272    0.4740 O   0  5  0

+    2.4578   -1.3673    0.0000 H   0  0  0

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+   -1.8027    2.2735    0.0000 H   0  0  0

+   -3.6529   -1.8701    0.0000 H   0  0  0

+   -4.1517    2.0478    0.0000 H   0  0  0

+  1  2  1  0

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+  7 24  1  0

+  8 25  1  0

+ 11 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+611-33-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -2.4152    0.9505   -0.0005 Cl  0  0  0

+   -1.1376   -0.2248   -0.0013 C   0  0  0

+    0.2059    0.1922   -0.0005 C   0  0  0

+   -1.4318   -1.5549    0.0029 C   0  0  0

+    1.2307   -0.7863   -0.0012 C   0  0  0

+    0.5253    1.4902    0.0005 N   0  0  0

+   -0.4219   -2.5141    0.0024 C   0  0  0

+    0.8898   -2.1482   -0.0031 C   0  0  0

+    2.5746   -0.3669   -0.0003 C   0  0  0

+    1.7755    1.8843    0.0009 C   0  0  0

+    2.8309    0.9746    0.0011 C   0  0  0

+   -2.4310   -1.8604    0.0000 H   0  0  0

+   -0.6741   -3.5280    0.0000 H   0  0  0

+    1.6384   -2.8770    0.0000 H   0  0  0

+    3.3542   -1.0625    0.0000 H   0  0  0

+    1.9862    2.9077    0.0000 H   0  0  0

+    3.8175    1.3184    0.0000 H   0  0  0

+  2  1  1  0

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+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+521-61-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -0.9818    0.8290    0.1358 C   0  0  0

+   -0.9254   -0.5796    0.1135 C   0  0  0

+    0.2673    1.6086    0.2798 C   0  0  0

+   -2.2051    1.4726    0.0171 C   0  0  0

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+   -2.1045   -1.3189   -0.0236 C   0  0  0

+    1.5664    0.9274    0.0914 C   0  0  0

+    0.2264    2.7927    0.5497 O   0  0  0

+   -3.3728    0.7251   -0.1239 C   0  0  0

+    1.6176   -0.4797    0.0690 C   0  0  0

+    0.4260   -2.4531    0.4668 O   0  0  0

+   -3.3225   -0.6592   -0.1372 C   0  0  0

+   -2.0597   -2.6739   -0.0460 O   0  0  0

+    2.7353    1.6634   -0.0641 C   0  0  0

+   -4.5681    1.3573   -0.2399 O   0  0  0

+    2.8441   -1.1236   -0.1094 C   0  0  0

+    3.9454    1.0112   -0.2402 C   0  0  0

+   -5.5630    0.3395   -0.3677 C   0  0  0

+    4.0029   -0.3673   -0.2635 C   0  0  0

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+    5.2093    1.8146   -0.4083 C   0  0  0

+   -2.2493    2.5106    0.0000 H   0  0  0

+   -4.2053   -1.2070    0.0000 H   0  0  0

+   -2.0254   -3.7122    0.0000 H   0  0  0

+    2.7002    2.7017    0.0000 H   0  0  0

+   -6.3059    1.0657    0.0000 H   0  0  0

+   -6.2892   -0.4034    0.0000 H   0  0  0

+   -4.8201   -0.3867    0.0000 H   0  0  0

+    4.9266   -0.8428    0.0000 H   0  0  0

+    2.9533   -3.5158    0.0000 H   0  0  0

+    5.7666    0.9378    0.0000 H   0  0  0

+    6.0861    2.3719    0.0000 H   0  0  0

+    4.6520    2.6914    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118174-26-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+   -3.4247    0.5480   -0.0156 C   0  0  0

+   -3.3648   -0.8629    0.0060 C   0  0  0

+   -2.2883    1.2630   -0.0151 N   0  3  0

+   -4.6771    1.1839   -0.0315 C   0  0  0

+   -2.1458   -1.4860    0.0268 N   0  3  0

+   -4.5478   -1.6011    0.0064 C   0  0  0

+   -1.1086    0.6441    0.0061 C   0  0  0

+   -2.3360    2.4799   -0.0337 O   0  5  0

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+   -2.0662   -2.8996    0.0481 O   0  5  0

+   -5.7511   -0.9560   -0.0141 C   0  0  0

+    0.1313    1.4406    0.0069 C   0  0  0

+    1.2847    0.8458    0.0275 N   0  0  0

+    2.4634    1.6030    0.0282 N   0  0  0

+    3.6612    0.9854    0.0496 C   0  0  0

+    3.7249   -0.3597    0.0702 O   0  0  0

+    4.6836    1.6422    0.0502 O   0  0  0

+    5.0096   -1.0274   -0.0392 C   0  0  0

+    5.8868   -0.6443    1.1543 C   0  0  0

+    4.7975   -2.5426   -0.0508 C   0  0  0

+    5.6982   -0.5989   -1.3366 C   0  0  0

+   -4.7350    2.2062    0.0000 H   0  0  0

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+   -0.1178   -1.2081    0.0000 H   0  0  0

+   -6.6174   -1.5019    0.0000 H   0  0  0

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+    6.2392   -1.4683    0.0000 H   0  0  0

+    6.5676   -0.0579    0.0000 H   0  0  0

+    5.1572    0.2705    0.0000 H   0  0  0

+  1  2  2  0

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+ 21 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2508-23-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -1.5289    0.5604    0.0172 C   0  0  0

+   -1.8713   -0.8109   -0.0905 C   0  0  0

+   -0.1822    0.9456   -0.0854 C   0  0  0

+   -2.5436    1.5097    0.2308 C   0  0  0

+   -0.8590   -1.7642   -0.2983 C   0  0  0

+   -3.2196   -1.1935    0.0131 C   0  0  0

+    0.7841   -0.0140   -0.2890 C   0  0  0

+   -3.8378    1.1011    0.3311 C   0  0  0

+    0.4370   -1.3663   -0.3943 C   0  0  0

+   -4.1756   -0.2460    0.2148 C   0  0  0

+    2.1262    0.3661   -0.3922 N   0  0  0

+    3.0185   -0.0557    0.5255 C   0  0  0

+    2.5473    1.1942   -1.4609 O   0  0  0

+    3.0892    0.6166    1.8724 C   0  0  0

+    3.7647   -0.9764    0.2674 O   0  0  0

+    0.0747    1.9446    0.0000 H   0  0  0

+   -2.3153    2.5156    0.0000 H   0  0  0

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+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24260-08-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -1.1345    0.4903   -0.3779 C   0  0  0

+   -0.4583   -0.8336   -0.3990 C   0  0  0

+   -0.4096    1.6160   -0.1878 C   0  0  0

+   -2.5024    0.5709   -0.5580 N   0  0  0

+    0.9930   -0.9175   -0.2139 C   0  0  0

+   -1.1087   -1.8455   -0.5701 O   0  0  0

+    1.0405    1.5303   -0.0030 C   0  0  0

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+    1.7157    0.2069   -0.0243 C   0  0  0

+    1.6920    2.5419    0.1674 O   0  0  0

+   -4.8130   -0.1250   -0.0146 C   0  0  0

+   -2.8836   -0.7128    1.2106 O   0  0  0

+    3.0552    0.1286    0.1470 O   0  0  0

+    3.4002   -1.2564    0.0772 C   0  0  0

+    4.9104   -1.4157    0.2644 C   0  0  0

+   -0.8749    2.5323    0.0000 H   0  0  0

+   -2.8207    1.5481    0.0000 H   0  0  0

+    1.4593   -1.8334    0.0000 H   0  0  0

+   -4.8228    0.9027    0.0000 H   0  0  0

+   -5.8407   -0.1348    0.0000 H   0  0  0

+   -4.8032   -1.1527    0.0000 H   0  0  0

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+    4.8026   -2.4377    0.0000 H   0  0  0

+    5.9324   -1.5235    0.0000 H   0  0  0

+    5.0182   -0.3937    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1421-85-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 42                          1 V2000

+    1.5851    2.2113   -0.2638 C   0  0  0

+    0.6781    1.0071   -0.1575 C   0  0  0

+    3.1023    1.9740   -0.2657 C   0  0  0

+    2.3790    2.3089    0.9204 O   0  0  0

+    1.2268   -0.2762   -0.0655 C   0  0  0

+   -0.6735    1.1926   -0.1524 C   0  0  0

+    3.5982    0.5515   -0.1629 C   0  0  0

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+    3.1744   -1.8092    0.0260 C   0  0  0

+   -0.9973   -1.2095    0.0387 C   0  0  0

+   -2.9881    0.2622   -0.0460 C   0  0  0

+    5.4242   -0.9954   -0.0692 C   0  0  0

+    4.5320   -2.0485    0.0259 C   0  0  0

+   -1.8675   -2.3213    0.1381 C   0  0  0

+   -3.8026   -0.8882    0.0553 C   0  0  0

+   -3.5800    1.5237   -0.1356 C   0  0  0

+   -3.2065   -2.1676    0.1459 C   0  0  0

+   -5.1967   -0.7397    0.0645 C   0  0  0

+   -4.9411    1.6350   -0.1245 C   0  0  0

+   -5.7456    0.5059   -0.0239 C   0  0  0

+    1.0626    3.1160    0.0000 H   0  0  0

+    3.8764    2.6756    0.0000 H   0  0  0

+   -1.0659    2.1608    0.0000 H   0  0  0

+    0.7967   -2.3447    0.0000 H   0  0  0

+    5.6318    1.0995    0.0000 H   0  0  0

+    2.5039   -2.6104    0.0000 H   0  0  0

+    6.4524   -1.1808    0.0000 H   0  0  0

+    4.8870   -3.0311    0.0000 H   0  0  0

+   -1.4643   -3.2851    0.0000 H   0  0  0

+   -2.9842    2.3819    0.0000 H   0  0  0

+   -3.8174   -3.0151    0.0000 H   0  0  0

+   -5.8130   -1.5833    0.0000 H   0  0  0

+   -5.3814    2.5824    0.0000 H   0  0  0

+   -6.7849    0.6123    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  2  0

+ 10 14  1  0

+ 11 15  2  0

+ 12 16  2  0

+ 13 17  1  0

+ 14 18  2  0

+ 14 19  1  0

+ 17 20  2  0

+ 18 21  1  0

+ 19 22  2  0

+ 21 23  2  0

+  3  4  1  0

+  7  8  2  0

+ 10 13  1  0

+ 15 16  1  0

+ 18 20  1  0

+ 22 23  1  0

+  1 24  1  0

+  3 25  1  0

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+  9 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110520-17-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.2235    0.7165   -0.0036 C   0  0  0

+   -0.2355   -0.6989   -0.0025 C   0  0  0

+    1.0637    1.4394   -0.0026 C   0  0  0

+   -1.4078    1.4390    0.0000 C   0  0  0

+    1.0403   -1.4422   -0.0001 C   0  0  0

+   -1.4318   -1.4007   -0.0030 C   0  0  0

+    2.2738    0.7259   -0.0007 C   0  0  0

+    1.0847    2.8351   -0.0029 C   0  0  0

+   -2.6283    0.7629    0.0045 C   0  0  0

+    2.2618   -0.7480    0.0006 C   0  0  0

+    1.0400   -2.8380    0.0010 C   0  0  0

+   -2.6425   -0.7038   -0.0051 C   0  0  0

+    3.4842    1.4212    0.0007 C   0  0  0

+    2.2895    3.5030   -0.0014 C   0  0  0

+   -3.8686    1.4307    0.0079 C   0  0  0

+    3.4612   -1.4621    0.0024 C   0  0  0

+    2.2342   -3.5247    0.0028 C   0  0  0

+   -3.8900   -1.3526   -0.0053 C   0  0  0

+    3.4844    2.7988    0.0004 C   0  0  0

+   -5.0069    0.6847    0.0117 C   0  0  0

+    3.4400   -2.8394    0.0034 C   0  0  0

+   -4.9917   -0.6403   -0.0068 N   0  0  0

+   -1.3859    2.4856    0.0000 H   0  0  0

+   -1.4275   -2.4476    0.0000 H   0  0  0

+    0.1867    3.3732    0.0000 H   0  0  0

+    0.1338   -3.3621    0.0000 H   0  0  0

+    4.3902    0.8967    0.0000 H   0  0  0

+    2.3033    4.5498    0.0000 H   0  0  0

+   -3.9137    2.4766    0.0000 H   0  0  0

+    4.3753   -0.9518    0.0000 H   0  0  0

+    2.2316   -4.5716    0.0000 H   0  0  0

+   -3.9394   -2.3983    0.0000 H   0  0  0

+    4.3934    3.3181    0.0000 H   0  0  0

+   -5.9308    1.1770    0.0000 H   0  0  0

+    4.3408   -3.3729    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

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+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

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+ 12 18  1  0

+ 13 19  2  0

+ 15 20  2  0

+ 16 21  2  0

+ 18 22  2  0

+  7 10  1  0

+  9 12  1  0

+ 14 19  1  0

+ 17 21  1  0

+ 20 22  1  0

+  4 23  1  0

+  6 24  1  0

+  8 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+18458-01-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.0358   -0.2145    0.4475 C   0  0  0

+   -1.4956   -0.3867    0.7797 C   0  0  0

+    0.5368    1.0435    0.4798 C   0  0  0

+    0.7320   -1.3149    0.1160 C   0  0  0

+   -2.3282   -0.2552   -0.4972 C   0  0  0

+    1.8756    1.2015    0.1750 C   0  0  0

+    2.0712   -1.1569   -0.1888 C   0  0  0

+   -3.8103   -0.4300   -0.1598 C   0  0  0

+   -3.2203    0.8541   -0.3719 O   0  0  0

+    2.6423    0.1015   -0.1622 C   0  0  0

+    4.1021    0.2737   -0.4944 C   0  0  0

+   -2.0713   -1.2486    0.0000 H   0  0  0

+   -0.9541   -1.2706    0.0000 H   0  0  0

+   -0.0743    1.8807    0.0000 H   0  0  0

+    0.3074   -2.2605    0.0000 H   0  0  0

+   -2.3485   -1.2915    0.0000 H   0  0  0

+    2.3004    2.1470    0.0000 H   0  0  0

+    2.6828   -1.9938    0.0000 H   0  0  0

+   -4.8151   -0.1756    0.0000 H   0  0  0

+   -3.8779   -1.4643    0.0000 H   0  0  0

+    4.2235   -0.7557    0.0000 H   0  0  0

+    5.1315    0.3951    0.0000 H   0  0  0

+    3.9807    1.3031    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

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+  8  9  1  0

+  2 12  1  0

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+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1204-60-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.0474   -0.3894    0.0730 C   0  0  0

+   -1.4915   -0.0515    0.0175 C   0  0  0

+    0.9074    0.6022   -0.1225 C   0  0  0

+    0.3534   -1.7008    0.3271 C   0  0  0

+   -2.3904   -0.9228   -0.5946 C   0  0  0

+   -1.9540    1.1350    0.5821 C   0  0  0

+    2.2642    0.2765   -0.0682 C   0  0  0

+    1.6971   -2.0197    0.3802 C   0  0  0

+   -3.7322   -0.6038   -0.6430 C   0  0  0

+   -3.2983    1.4441    0.5280 C   0  0  0

+    2.6523   -1.0444    0.1823 C   0  0  0

+    3.2827    1.3189   -0.2744 C   0  0  0

+   -4.1853    0.5783   -0.0853 C   0  0  0

+    4.4603    1.0339   -0.2268 O   0  0  0

+    0.6178    1.5932    0.0000 H   0  0  0

+   -0.3531   -2.4537    0.0000 H   0  0  0

+   -2.1168   -1.9183    0.0000 H   0  0  0

+   -1.2790    1.9162    0.0000 H   0  0  0

+    1.9838   -3.0115    0.0000 H   0  0  0

+   -4.4123   -1.3806    0.0000 H   0  0  0

+   -3.5773    2.4381    0.0000 H   0  0  0

+    3.6540   -1.2944    0.0000 H   0  0  0

+    2.9976    2.3112    0.0000 H   0  0  0

+   -5.1938    0.7993    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 12 14  2  0

+  8 11  2  0

+ 10 13  2  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+124-09-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    0.6087   -0.4634    0.0000 C   0  0  0

+   -0.6087    0.4634    0.0000 C   0  0  0

+    1.8882    0.3755    0.0000 C   0  0  0

+   -1.8882   -0.3755    0.0000 C   0  0  0

+    3.1056   -0.5513    0.0000 C   0  0  0

+   -3.1056    0.5513    0.0000 C   0  0  0

+    4.3341    0.2542    0.0000 N   0  0  0

+   -4.3341   -0.2542    0.0000 N   0  0  0

+   -0.1851   -1.2920    0.0000 H   0  0  0

+    1.3423   -1.3458    0.0000 H   0  0  0

+    0.1851    1.2920    0.0000 H   0  0  0

+   -1.3423    1.3458    0.0000 H   0  0  0

+    2.6820    1.2041    0.0000 H   0  0  0

+    1.1546    1.2579    0.0000 H   0  0  0

+   -2.6820   -1.2041    0.0000 H   0  0  0

+   -1.1546   -1.2579    0.0000 H   0  0  0

+    2.3118   -1.3799    0.0000 H   0  0  0

+    3.8392   -1.4337    0.0000 H   0  0  0

+   -2.3118    1.3799    0.0000 H   0  0  0

+   -3.8392    1.4337    0.0000 H   0  0  0

+    5.3588   -0.2622    0.0000 H   0  0  0

+    4.2690    1.3998    0.0000 H   0  0  0

+   -5.3588    0.2622    0.0000 H   0  0  0

+   -4.2690   -1.3998    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

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+  1  9  1  0

+  1 10  1  0

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+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3740-52-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.9743    0.4258   -0.0572 C   0  0  0

+    0.2770   -0.6706   -0.5285 C   0  0  0

+    2.2707    0.2764    0.3995 C   0  0  0

+    0.3353    1.7609   -0.0472 N   0  3  0

+    0.8759   -1.9166   -0.5433 C   0  0  0

+   -1.1362   -0.5079   -1.0258 C   0  0  0

+    2.8694   -0.9692    0.3847 C   0  0  0

+   -0.0298    2.2692   -1.0921 O   0  0  0

+    0.1745    2.3511    1.0061 O   0  5  0

+    2.1720   -2.0658   -0.0872 C   0  0  0

+   -2.0971   -0.7051    0.1182 C   0  0  0

+   -3.4193   -0.6061   -0.0911 O   0  0  0

+   -1.6774   -0.9524    1.2239 O   0  0  0

+    2.8382    1.0735    0.0000 H   0  0  0

+    0.3084   -2.7137    0.0000 H   0  0  0

+   -0.6394    0.3351    0.0000 H   0  0  0

+   -1.7050    0.2883    0.0000 H   0  0  0

+    3.8462   -1.0271    0.0000 H   0  0  0

+    2.5931   -2.9491    0.0000 H   0  0  0

+   -4.3951   -0.5330    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

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+ 11 13  2  0

+  7 10  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4316-73-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.4467   -0.6614    0.0000 C   0  0  0

+   -0.9149   -0.0157    0.0000 C   0  0  0

+    1.4826    0.3802    0.0000 N   0  0  0

+   -2.0194   -0.7785    0.0000 O   0  0  0

+   -1.0125    1.1886    0.0000 O   0  0  0

+    2.7779   -0.3126    0.0000 C   0  0  0

+   -0.1349   -1.5971    0.0000 H   0  0  0

+    1.3107   -1.3450    0.0000 H   0  0  0

+    1.3196    1.4698    0.0000 H   0  0  0

+   -2.9259   -1.4046    0.0000 H   0  0  0

+    2.2583   -1.2841    0.0000 H   0  0  0

+    3.7494   -0.8322    0.0000 H   0  0  0

+    3.2975    0.6589    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  1  7  1  0

+  1  8  1  0

+  3  9  1  0

+  4 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5307-02-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.7098    0.2699    0.0018 C   0  0  0

+   -0.7152   -1.1233    0.0004 C   0  0  0

+    0.4927    0.9557    0.0017 C   0  0  0

+   -1.8845    0.9554   -0.0024 O   0  0  0

+    0.4831   -1.8204   -0.0010 C   0  0  0

+   -1.9327   -1.8204    0.0010 N   0  0  0

+    1.6912    0.2538    0.0003 C   0  0  0

+   -1.5518    2.3451    0.0003 C   0  0  0

+    1.6833   -1.1342   -0.0011 C   0  0  0

+    2.9076    0.9465   -0.0003 N   0  0  0

+    0.4987    1.9970    0.0000 H   0  0  0

+    0.4792   -2.8617    0.0000 H   0  0  0

+   -2.8327   -1.2965    0.0000 H   0  0  0

+   -1.9364   -2.8617    0.0000 H   0  0  0

+   -0.5391    2.1026    0.0000 H   0  0  0

+   -1.3093    3.3578    0.0000 H   0  0  0

+   -2.5645    2.5876    0.0000 H   0  0  0

+    2.5825   -1.6593    0.0000 H   0  0  0

+    3.8063    0.4205    0.0000 H   0  0  0

+    2.9138    1.9878    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  7  9  2  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-73-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.6769   -1.2103   -0.0021 C   0  0  0

+   -0.7096   -1.1915   -0.0013 C   0  0  0

+    1.3866   -0.0188   -0.0015 C   0  0  0

+    1.3403   -2.3964    0.0021 O   0  0  0

+   -1.3866    0.0190    0.0001 C   0  0  0

+    0.7098    1.1914   -0.0001 C   0  0  0

+   -0.6771    1.2102    0.0008 C   0  0  0

+   -2.7454    0.0375    0.0004 O   0  0  0

+    1.4052    2.3589    0.0006 O   0  0  0

+   -1.2418   -2.0850    0.0000 H   0  0  0

+    2.4264   -0.0330    0.0000 H   0  0  0

+    1.8479   -3.3040    0.0000 H   0  0  0

+   -1.1848    2.1178    0.0000 H   0  0  0

+   -3.7852    0.0517    0.0000 H   0  0  0

+    1.9374    3.2524    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  5  8  1  0

+  6  9  1  0

+  6  7  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+779-03-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.2063    0.9486   -0.0026 C   0  0  0

+   -1.2103   -0.5168   -0.0018 C   0  0  0

+    0.0001    1.6482   -0.0024 C   0  0  0

+   -2.4427    1.6296    0.0022 C   0  0  0

+    0.0001   -1.2241   -0.0003 C   0  0  0

+   -2.4468   -1.1919   -0.0021 C   0  0  0

+    1.2062    0.9487   -0.0014 C   0  0  0

+   -3.5993    0.9182    0.0075 C   0  0  0

+    1.2102   -0.5169    0.0005 C   0  0  0

+    0.0002   -2.6119    0.0000 N   0  0  0

+   -3.6017   -0.4764   -0.0032 C   0  0  0

+    2.4427    1.6297   -0.0015 C   0  0  0

+    2.4468   -1.1920    0.0024 C   0  0  0

+    3.5992    0.9183   -0.0009 C   0  0  0

+    3.6016   -0.4764    0.0035 C   0  0  0

+    0.0001    2.6942    0.0000 H   0  0  0

+   -2.4678    2.6753    0.0000 H   0  0  0

+   -2.4755   -2.2375    0.0000 H   0  0  0

+   -4.5119    1.4293    0.0000 H   0  0  0

+   -0.9056   -3.1350    0.0000 H   0  0  0

+    0.9061   -3.1348    0.0000 H   0  0  0

+   -4.5160   -0.9845    0.0000 H   0  0  0

+    2.4678    2.6754    0.0000 H   0  0  0

+    2.4756   -2.2376    0.0000 H   0  0  0

+    4.5118    1.4294    0.0000 H   0  0  0

+    4.5160   -0.9844    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+  7  9  1  0

+  8 11  1  0

+ 14 15  1  0

+  3 16  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77784-22-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 48                          1 V2000

+   -0.9388    0.4987   -0.0013 C   0  0  0

+   -1.5016   -0.7925   -0.0617 C   0  0  0

+    0.5211    0.6279    0.0485 C   0  0  0

+   -1.7794    1.6171    0.0153 C   0  0  0

+   -0.6348   -1.9705   -0.0951 C   0  0  0

+   -2.8954   -0.9386   -0.0904 C   0  0  0

+    1.3143   -0.5415    0.0329 C   0  0  0

+    1.1309    1.8831    0.1103 C   0  0  0

+   -3.1546    1.4403   -0.0229 C   0  0  0

+   -1.5094    2.9539    0.0656 O   0  0  0

+    0.7146   -1.8184   -0.0405 C   0  0  0

+   -1.1834   -3.2466   -0.1975 N   0  0  0

+   -3.7003    0.1571   -0.0808 C   0  0  0

+   -3.4650   -2.3360   -0.1174 C   0  0  0

+    2.7148   -0.4173    0.0877 C   0  0  0

+    2.4918    1.9819    0.1592 C   0  0  0

+   -3.7532    2.6680   -0.0002 O   0  0  0

+   -2.7213    3.6063   -0.3570 C   0  0  0

+   -2.4473   -3.2742    0.5414 C   0  0  0

+   -0.2664   -4.1576    0.5005 C   0  0  0

+    3.2882    0.8392    0.1492 C   0  0  0

+    3.5002   -1.5275    0.0806 O   0  0  0

+    4.6421    0.9605    0.2004 O   0  0  0

+    3.9435   -1.7112   -1.2654 C   0  0  0

+    4.9295    2.3592    0.2566 C   0  0  0

+    0.5465    2.7455    0.0000 H   0  0  0

+    1.3216   -2.6651    0.0000 H   0  0  0

+   -4.7351    0.0368    0.0000 H   0  0  0

+   -4.3761   -1.8308    0.0000 H   0  0  0

+   -4.0750   -3.1805    0.0000 H   0  0  0

+    2.9401    2.9223    0.0000 H   0  0  0

+   -2.1272    4.4621    0.0000 H   0  0  0

+   -3.5046    4.2931    0.0000 H   0  0  0

+   -3.3311   -3.8258    0.0000 H   0  0  0

+   -2.1495   -4.2725    0.0000 H   0  0  0

+   -1.0006   -4.8967    0.0000 H   0  0  0

+    0.4727   -4.8918    0.0000 H   0  0  0

+    0.4678   -3.4185    0.0000 H   0  0  0

+    3.5447   -2.6736    0.0000 H   0  0  0

+    4.9059   -2.1100    0.0000 H   0  0  0

+    4.3423   -0.7488    0.0000 H   0  0  0

+    5.9500    2.1495    0.0000 H   0  0  0

+    5.1392    3.3797    0.0000 H   0  0  0

+    3.9090    2.5689    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  6 14  1  0

+  7 15  1  0

+  8 16  2  0

+  9 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 15 21  2  0

+ 15 22  1  0

+ 21 23  1  0

+ 22 24  1  0

+ 23 25  1  0

+  7 11  1  0

+  9 13  1  0

+ 14 19  1  0

+ 16 21  1  0

+ 17 18  1  0

+  8 26  1  0

+ 11 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+ 24 41  1  0

+ 25 42  1  0

+ 25 43  1  0

+ 25 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+72492-12-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -2.6536    0.1356    0.0003 C   0  0  0

+   -1.6323   -0.9779    0.0000 C   0  0  0

+   -1.9159    1.3541    0.0014 O   0  0  0

+   -3.9664   -0.0033   -0.7662 C   0  0  0

+   -3.9675   -0.0044    0.7645 C   0  0  0

+   -0.3341   -0.2804   -0.0002 C   0  0  0

+   -1.8349   -2.1737    0.0002 O   0  0  0

+   -0.5861    1.1024    0.0006 C   0  0  0

+    0.9747   -0.7586   -0.0005 C   0  0  0

+    0.4914    1.9904    0.0000 C   0  0  0

+    2.0397    0.1430   -0.0003 C   0  0  0

+    1.7823    1.5223   -0.0012 C   0  0  0

+    3.4239   -0.3496    0.0002 C   0  0  0

+    4.5714    0.6273    0.0005 C   0  0  0

+    3.6431   -1.5425    0.0003 O   0  0  0

+   -3.7672    1.0241    0.0000 H   0  0  0

+   -4.8905    0.4878    0.0000 H   0  0  0

+   -4.8918    0.4865    0.0000 H   0  0  0

+   -4.1662   -1.0319    0.0000 H   0  0  0

+    1.1580   -1.7890    0.0000 H   0  0  0

+    0.3136    3.0217    0.0000 H   0  0  0

+    2.5802    2.1995    0.0000 H   0  0  0

+    5.2498   -0.1696    0.0000 H   0  0  0

+    5.3683    1.3057    0.0000 H   0  0  0

+    3.8930    1.4242    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  6  9  1  0

+  8 10  1  0

+  9 11  2  0

+ 10 12  2  0

+ 11 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+  4  5  1  0

+  6  8  2  0

+ 11 12  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1985-51-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 36                          1 V2000

+    0.0000   -0.1561    0.0000 C   0  0  0

+   -1.2492    0.7272    0.0000 C   0  0  0

+    1.2492    0.7272    0.0000 C   0  0  0

+    0.0000   -1.0394    1.2493 C   0  0  0

+    0.0000   -1.0395   -1.2492 C   0  0  0

+   -2.4348   -0.1111    0.0000 O   0  0  0

+    2.4348   -0.1111    0.0000 O   0  0  0

+   -3.6591    0.4529    0.0000 C   0  0  0

+    3.6591    0.4529    0.0000 C   0  0  0

+   -4.8589   -0.3955    0.0000 C   0  0  0

+   -3.7706    1.6631    0.0000 O   0  0  0

+    4.8589   -0.3955    0.0000 C   0  0  0

+    3.7706    1.6631    0.0000 O   0  0  0

+   -4.7206   -1.8962    0.0000 C   0  0  0

+   -6.0677    0.1613    0.0000 C   0  0  0

+    4.7206   -1.8962    0.0000 C   0  0  0

+    6.0677    0.1613    0.0000 C   0  0  0

+   -0.5500    1.5105    0.0000 H   0  0  0

+   -1.9484    1.5105    0.0000 H   0  0  0

+    1.9484    1.5105    0.0000 H   0  0  0

+    0.5500    1.5105    0.0000 H   0  0  0

+   -1.0500   -1.0394    0.0000 H   0  0  0

+    0.0000   -2.0894    0.0000 H   0  0  0

+    1.0500   -1.0394    0.0000 H   0  0  0

+   -1.0500   -1.0395    0.0000 H   0  0  0

+    0.0000   -2.0895    0.0000 H   0  0  0

+    1.0500   -1.0395    0.0000 H   0  0  0

+   -5.7662   -1.9926    0.0000 H   0  0  0

+   -4.6242   -2.9418    0.0000 H   0  0  0

+   -3.6750   -1.7998    0.0000 H   0  0  0

+   -6.1641    1.2069    0.0000 H   0  0  0

+   -6.9250   -0.4450    0.0000 H   0  0  0

+    3.6750   -1.7998    0.0000 H   0  0  0

+    4.6242   -2.9418    0.0000 H   0  0  0

+    5.7662   -1.9926    0.0000 H   0  0  0

+    6.9250   -0.4450    0.0000 H   0  0  0

+    6.1641    1.2069    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

+  9 13  2  0

+ 10 14  1  0

+ 10 15  2  0

+ 12 16  1  0

+ 12 17  2  0

+  2 18  1  0

+  2 19  1  0

+  3 20  1  0

+  3 21  1  0

+  4 22  1  0

+  4 23  1  0

+  4 24  1  0

+  5 25  1  0

+  5 26  1  0

+  5 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82-71-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.0064    2.6877   -0.0010 N   0  3  0

+   -0.0253    3.2978   -1.0550 O   0  5  0

+    0.0042    3.2956    1.0544 O   0  0  0

+   -0.0027    1.2075   -0.0026 C   0  0  0

+    1.1987    0.5163   -0.0230 C   0  0  0

+   -1.2008    0.5100    0.0221 C   0  0  0

+    2.3747    1.1971   -0.0410 O   0  0  0

+    1.1996   -0.8716   -0.0245 C   0  0  0

+   -2.3801    1.1847    0.0473 O   0  0  0

+   -1.1946   -0.8775    0.0205 C   0  0  0

+    2.4821   -1.6103   -0.0462 N   0  3  0

+    0.0044   -1.5643   -0.0061 C   0  0  0

+   -2.4733   -1.6228    0.0468 N   0  3  0

+    2.6121   -2.5839   -0.7665 O   0  0  0

+    3.4076   -1.2445    0.6561 O   0  5  0

+   -2.5960   -2.5965    0.7681 O   0  0  0

+   -3.4028   -1.2623   -0.6530 O   0  5  0

+    3.2714    1.7162    0.0000 H   0  0  0

+   -3.2794    1.6992    0.0000 H   0  0  0

+    0.0070   -2.6004    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  5  1  0

+  9  6  1  0

+ 10  6  2  0

+ 11  8  1  0

+ 12  8  2  0

+ 13 10  1  0

+ 14 11  2  0

+ 15 11  1  0

+ 16 13  2  0

+ 17 13  1  0

+ 10 12  1  0

+  7 18  1  0

+  9 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-62-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.2135    0.6525   -0.0030 C   0  0  0

+   -0.4701   -0.7412   -0.0009 C   0  0  0

+    1.1128    1.1140   -0.0024 C   0  0  0

+   -1.3005    1.5464    0.0001 C   0  0  0

+    0.6147   -1.6358    0.0013 C   0  0  0

+   -1.7306   -1.1854   -0.0006 N   0  0  0

+    2.1371    0.2172    0.0003 C   0  0  0

+   -2.5633    1.0254    0.0051 C   0  0  0

+    1.8872   -1.1538    0.0014 C   0  0  0

+   -2.7456   -0.3555   -0.0023 C   0  0  0

+    3.5600    0.7137    0.0010 C   0  0  0

+    1.3123    2.1397    0.0000 H   0  0  0

+   -1.1459    2.5798    0.0000 H   0  0  0

+    0.4443   -2.6667    0.0000 H   0  0  0

+   -3.3917    1.6622    0.0000 H   0  0  0

+    2.6901   -1.8226    0.0000 H   0  0  0

+   -3.7171   -0.7402    0.0000 H   0  0  0

+    3.9043   -0.2729    0.0000 H   0  0  0

+    4.5466    1.0580    0.0000 H   0  0  0

+    3.2157    1.7003    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7  9  1  0

+  8 10  2  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+132898-07-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+    0.7191   -0.3073   -0.0020 C   0  0  0

+   -0.7193   -0.5620   -0.0015 C   0  0  0

+    1.1726    1.0355   -0.0008 C   0  0  0

+    1.6022   -1.3046    0.0019 N   0  0  0

+   -1.5943    0.5275    0.0002 C   0  0  0

+   -1.4714   -1.6862   -0.0023 N   0  0  0

+    0.2356    2.0861    0.0004 C   0  0  0

+    2.4863    1.2842   -0.0012 N   0  0  0

+    2.8901   -1.0354    0.0018 C   0  0  0

+   -2.8714   -0.0064    0.0003 N   0  0  0

+   -1.0976    1.8333    0.0013 C   0  0  0

+   -2.7427   -1.3639   -0.0012 C   0  0  0

+    3.3395    0.2841   -0.0028 C   0  0  0

+    3.8886   -2.1641    0.0067 C   0  0  0

+   -4.1279    0.7470    0.0023 C   0  0  0

+   -2.0654    2.9884    0.0026 C   0  0  0

+   -3.7902   -2.2616   -0.0016 N   0  0  0

+    4.8197    0.5672   -0.0038 C   0  0  0

+    0.5708    3.0725    0.0000 H   0  0  0

+    3.1083   -2.8544    0.0000 H   0  0  0

+    4.5789   -2.9444    0.0000 H   0  0  0

+    4.6689   -1.4738    0.0000 H   0  0  0

+   -3.5922    1.6405    0.0000 H   0  0  0

+   -5.0214    1.2827    0.0000 H   0  0  0

+   -4.6636   -0.1465    0.0000 H   0  0  0

+   -1.2668    3.6575    0.0000 H   0  0  0

+   -2.7345    3.7870    0.0000 H   0  0  0

+   -2.8640    2.3193    0.0000 H   0  0  0

+   -4.7728   -1.9155    0.0000 H   0  0  0

+   -3.5986   -3.2856    0.0000 H   0  0  0

+    5.0154   -0.4561    0.0000 H   0  0  0

+    5.8430    0.7629    0.0000 H   0  0  0

+    4.6240    1.5905    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  8 13  2  0

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+  7 11  2  0

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+  7 19  1  0

+ 14 20  1  0

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+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+504-88-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    1.9077    0.0114    0.0290 C   0  0  0

+    0.5049    0.5163    0.2482 C   0  0  0

+    2.9569    0.7640    0.3959 O   0  0  0

+    2.0881   -1.0729   -0.4726 O   0  0  0

+   -0.4965   -0.5258   -0.2541 C   0  0  0

+   -1.8603   -0.0350   -0.0410 N   0  3  0

+   -2.2241    1.0009   -0.5683 O   0  0  0

+   -2.6303   -0.6628    0.6636 O   0  5  0

+    0.9568    1.3728    0.0000 H   0  0  0

+   -0.2802    1.0833    0.0000 H   0  0  0

+    3.7438    1.3284    0.0000 H   0  0  0

+   -0.9484   -1.3823    0.0000 H   0  0  0

+    0.2886   -1.0928    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  6  7  2  0

+  6  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+533-73-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.6921    0.7519    0.0019 C   0  0  0

+   -1.1027   -0.5775    0.0004 C   0  0  0

+    0.6591    1.0576    0.0018 C   0  0  0

+   -1.6160    1.7498   -0.0023 O   0  0  0

+   -0.1601   -1.5927   -0.0011 C   0  0  0

+   -2.4293   -0.8803    0.0009 O   0  0  0

+    1.5994    0.0385    0.0003 C   0  0  0

+    1.1877   -1.2860   -0.0012 C   0  0  0

+    2.9259    0.3377   -0.0002 O   0  0  0

+    0.9677    2.0497    0.0000 H   0  0  0

+   -2.3219    2.5122    0.0000 H   0  0  0

+   -0.4665   -2.5855    0.0000 H   0  0  0

+   -3.4422   -1.1115    0.0000 H   0  0  0

+    1.8933   -2.0486    0.0000 H   0  0  0

+    3.9394    0.5663    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+113163-21-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.1709   -0.3574    0.2231 C   0  0  0

+   -1.2399   -0.3380    0.1170 C   0  0  0

+    0.8899    0.8155    0.0485 C   0  0  0

+    0.8916   -1.6109    0.5113 C   0  0  0

+   -1.8861    0.8892   -0.1705 C   0  0  0

+   -1.9623   -1.4469    0.2827 N   0  0  0

+    0.2350    2.0086   -0.2334 C   0  0  0

+    2.3918    0.7830    0.1695 C   0  0  2

+    2.1877   -1.6987    0.2374 C   0  0  0

+   -1.1224    2.0554   -0.3435 C   0  0  0

+   -3.2897    0.9115   -0.2776 C   0  0  0

+   -3.2703   -1.4311    0.1845 C   0  0  0

+    2.9269   -0.5420   -0.3698 C   0  0  1

+    2.7622    0.9228    1.5425 O   0  0  0

+   -3.9690   -0.2597   -0.0968 C   0  0  0

+    2.7719   -0.5756   -1.7900 O   0  0  0

+    0.3479   -2.4813    0.0000 H   0  0  0

+    0.7728    2.8826    0.0000 H   0  0  0

+    2.2185    1.7945    0.0000 H   0  0  0

+    2.6500   -2.6149    0.0000 H   0  0  0

+   -1.5947    2.9665    0.0000 H   0  0  0

+   -3.7949    1.8048    0.0000 H   0  0  0

+   -3.7825   -2.3204    0.0000 H   0  0  0

+    3.9488   -0.6367    0.0000 H   0  0  0

+    3.7223    1.2852    0.0000 H   0  0  0

+   -4.9952   -0.2660    0.0000 H   0  0  0

+    1.7689   -0.7930    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  1  0

+  8 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+  7 10  2  0

+  9 13  1  0

+ 12 15  1  0

+  4 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-17-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -0.0816   -0.1965   -0.2191 C   0  0  0

+   -1.1202    0.7567    0.3757 C   0  0  0

+    1.2595    0.0608    0.4183 C   0  0  0

+   -0.5043   -1.6425    0.0483 C   0  0  0

+   -2.4818    0.4955   -0.2714 C   0  0  0

+    2.1982    0.3949   -0.2640 O   0  0  0

+    0.2023    0.8038    0.0000 H   0  0  0

+   -0.2711    1.3569    0.0000 H   0  0  0

+   -1.5275    1.7134    0.0000 H   0  0  0

+    1.5326   -0.9425    0.0000 H   0  0  0

+   -1.5024   -1.3507    0.0000 H   0  0  0

+   -0.7961   -2.6406    0.0000 H   0  0  0

+    0.4938   -1.9343    0.0000 H   0  0  0

+   -2.6777    1.5167    0.0000 H   0  0  0

+   -3.5030    0.2996    0.0000 H   0  0  0

+   -2.2859   -0.5257    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+121-50-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    2.3938    0.0172   -0.0006 C   0  0  0

+    0.8900    0.1151   -0.0008 C   0  0  0

+    2.9449    1.3030   -0.0022 F   0  0  0

+    2.8162   -0.6698    1.1426 F   0  0  0

+    2.8163   -0.6727   -1.1420 F   0  0  0

+    0.1240   -1.0342    0.0006 C   0  0  0

+    0.2789    1.3557    0.0032 C   0  0  0

+   -1.2618   -0.9435    0.0004 C   0  0  0

+   -1.1006    1.4506    0.0030 C   0  0  0

+   -1.8733    0.3047   -0.0013 C   0  0  0

+   -2.0397   -2.1045    0.0023 N   0  0  0

+   -3.6052    0.4241   -0.0015 Cl  0  0  0

+    0.5843   -1.9661    0.0000 H   0  0  0

+    0.8579    2.2189    0.0000 H   0  0  0

+   -1.5568    2.3845    0.0000 H   0  0  0

+   -3.0768   -2.0352    0.0000 H   0  0  0

+   -1.5812   -3.0373    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  7  9  2  0

+  8 10  2  0

+  8 11  1  0

+ 10 12  1  0

+  9 10  1  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23214-92-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 72                          1 V2000

+   -0.0751    1.9940    0.6790 C   0  0  0

+   -0.4882    0.8076    0.1281 C   0  0  0

+    1.2932    2.2665    0.8169 C   0  0  0

+   -1.0418    3.0433    1.1650 C   0  0  0

+   -1.9437    0.4625   -0.0562 C   0  0  2

+    0.4561   -0.1402   -0.2911 C   0  0  0

+    2.2431    1.3362    0.4042 C   0  0  0

+    1.6943    3.4443    1.3564 O   0  0  0

+   -2.4304    2.8126    0.5732 C   0  0  2

+   -2.8229    1.3512    0.8207 C   0  0  0

+   -2.1523   -0.9053    0.3007 O   0  0  0

+    1.8178    0.1136   -0.1569 C   0  0  0

+    0.0397   -1.3127   -0.8307 O   0  0  0

+    3.6844    1.6119    0.5458 C   0  0  0

+   -2.4032    3.0872   -0.9083 C   0  0  0

+   -3.3738    3.6793    1.2064 O   0  0  0

+   -3.0331   -1.4583   -0.6794 C   0  0  1

+    2.8192   -0.8777   -0.5930 C   0  0  0

+    4.6492    0.5011    0.3927 C   0  0  0

+    4.0752    2.7381    0.7850 O   0  0  0

+   -3.6745    3.4521   -1.6305 C   0  0  0

+   -1.3626    3.0149   -1.5168 O   0  0  0

+   -2.7761   -2.9616   -0.8060 C   0  0  0

+   -4.3851   -1.2307   -0.2860 O   0  0  0

+    4.2228   -0.7193   -0.1665 C   0  0  0

+    2.4916   -1.8148   -1.2956 O   0  0  0

+    5.9706    0.6514    0.7952 C   0  0  0

+   -3.3920    3.6626   -3.0153 O   0  0  0

+   -3.0041   -3.6238    0.5576 C   0  0  1

+   -4.5342   -1.7159    1.0469 C   0  0  2

+    5.1331   -1.7688   -0.3108 C   0  0  0

+    6.8634   -0.3984    0.6460 C   0  0  0

+   -4.4001   -3.2404    1.0616 C   0  0  1

+   -2.9194   -5.0832    0.4135 N   0  0  0

+   -5.9116   -1.3200    1.5826 C   0  0  0

+    6.4526   -1.5965    0.0988 C   0  0  0

+    4.7342   -2.9485   -0.8473 O   0  0  0

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+    5.8783   -3.8046   -0.8594 C   0  0  0

+   -0.1916    3.5660    0.0000 H   0  0  0

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+   -3.7265    1.7750    0.0000 H   0  0  0

+   -3.3984    0.5358    0.0000 H   0  0  0

+   -0.2943   -2.2532    0.0000 H   0  0  0

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+   -3.2284   -0.4796    0.0000 H   0  0  0

+   -4.4291    4.1053    0.0000 H   0  0  0

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+   -2.0052   -3.5955    0.0000 H   0  0  0

+   -1.9130   -2.4606    0.0000 H   0  0  0

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+   -2.5917    4.2589    0.0000 H   0  0  0

+   -2.0154   -3.7599    0.0000 H   0  0  0

+   -3.5417   -1.8207    0.0000 H   0  0  0

+    7.8440   -0.2126    0.0000 H   0  0  0

+   -4.2722   -4.2302    0.0000 H   0  0  0

+   -3.7534   -5.6315    0.0000 H   0  0  0

+   -2.0276   -5.5313    0.0000 H   0  0  0

+   -5.6359   -0.3608    0.0000 H   0  0  0

+   -6.8708   -1.0443    0.0000 H   0  0  0

+   -6.1873   -2.2792    0.0000 H   0  0  0

+    7.0842   -2.3693    0.0000 H   0  0  0

+   -6.2534   -4.3142    0.0000 H   0  0  0

+    5.2804   -4.6037    0.0000 H   0  0  0

+    6.6774   -4.4025    0.0000 H   0  0  0

+    6.4762   -3.0055    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+ 37 39  1  0

+  7 12  1  0

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+ 19 25  1  0

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+ 32 36  2  0

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+ 27 53  1  0

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+ 35 63  1  0

+ 36 64  1  0

+ 38 65  1  0

+ 39 66  1  0

+ 39 67  1  0

+ 39 68  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23740-25-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.6122    0.3857    0.0220 C   0  0  0

+   -1.3801   -0.7955    0.0089 C   0  0  0

+    0.8593    0.3121    0.0164 C   0  0  0

+   -1.2590    1.6201    0.0462 C   0  0  0

+   -0.7764   -2.0700   -0.0120 C   0  0  0

+   -2.7963   -0.7102    0.0174 C   0  0  0

+    1.5005   -0.9425   -0.0050 C   0  0  0

+    1.6260    1.4777    0.0315 C   0  0  0

+   -2.6627    1.6870    0.0595 C   0  0  0

+   -0.7660    2.8896    0.0604 O   0  0  0

+    0.6963   -2.1749   -0.0204 C   0  0  0

+   -1.5308   -3.1587   -0.0235 N   0  0  0

+   -3.4186    0.5495    0.0373 C   0  0  0

+   -3.5304   -1.9058    0.0049 C   0  0  0

+    2.8959   -1.0075   -0.0114 C   0  0  0

+    3.0010    1.3972    0.0253 C   0  0  0

+   -3.0300    3.0024    0.0825 O   0  0  0

+   -1.8626    3.7347   -0.3331 C   0  0  0

+    1.2375   -3.2651   -0.0398 O   0  0  0

+   -2.8478   -3.1064   -0.0157 C   0  0  0

+    3.6371    0.1593    0.0038 C   0  0  0

+    4.9949    0.0974   -0.0019 O   0  0  0

+    5.4699    1.4450    0.0169 C   0  0  0

+    1.1571    2.4118    0.0000 H   0  0  0

+   -4.4617    0.6162    0.0000 H   0  0  0

+   -4.5754   -1.8882    0.0000 H   0  0  0

+    3.3778   -1.9350    0.0000 H   0  0  0

+    3.5714    2.2730    0.0000 H   0  0  0

+   -1.1316    4.4817    0.0000 H   0  0  0

+   -2.5184    4.5486    0.0000 H   0  0  0

+   -3.3912   -3.9992    0.0000 H   0  0  0

+    6.4556    1.0975    0.0000 H   0  0  0

+    5.8174    2.4307    0.0000 H   0  0  0

+    4.4842    1.7925    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  3  7  2  0

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+  4  9  1  0

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+  7 15  1  0

+  8 16  2  0

+  9 17  1  0

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+ 12 20  2  0

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+  7 11  1  0

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+ 18 29  1  0

+ 18 30  1  0

+ 20 31  1  0

+ 23 32  1  0

+ 23 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97055-37-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.2682    0.1219   -0.0120 C   0  0  0

+   -1.5815    0.3406   -0.0284 C   0  0  0

+    0.6859    1.2765    0.1545 C   0  0  0

+    0.2640   -1.2809   -0.1536 C   0  0  0

+   -2.5158   -0.7949   -0.0441 C   0  0  0

+   -2.1909    1.9661   -0.0312 Cl  0  0  0

+    1.6768    1.0279    1.6401 Cl  0  0  0

+    1.7707    1.3717   -1.2825 Cl  0  0  0

+    1.3167   -1.3797   -1.6140 Cl  0  0  0

+    1.2253   -1.7096    1.3103 Cl  0  0  0

+   -3.0137   -1.2740    1.1132 O   0  0  0

+   -2.8390   -1.3013   -1.1006 O   0  0  0

+    0.3060    1.9995    0.0000 H   0  0  0

+   -0.3297   -1.8418    0.0000 H   0  0  0

+   -3.6022   -1.8403    0.0000 H   0  0  0

+  1  2  2  0

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+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  3 13  1  0

+  4 14  1  0

+ 11 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95152-79-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -0.3979    0.4225    0.0520 C   0  0  0

+   -1.2160   -0.6504   -0.0738 C   0  0  0

+    1.0853    0.3924    0.0475 C   0  0  0

+   -1.1676    1.5236    0.1763 N   0  0  0

+   -2.5263   -0.1891   -0.0186 N   0  0  0

+   -0.7908   -2.0608   -0.2406 N   0  3  0

+    1.8030    1.3887   -0.6112 C   0  0  0

+    1.7662   -0.6295    0.7070 C   0  0  0

+   -2.4186    1.1692    0.1318 C   0  0  0

+   -3.8005   -0.7105   -0.0796 C   0  0  0

+   -0.6171   -2.5166   -1.3567 O   0  0  0

+   -0.6151   -2.7638    0.7384 O   0  5  0

+    3.1829    1.3559   -0.6117 C   0  0  0

+    3.1459   -0.6523    0.7000 C   0  0  0

+   -4.1166    1.6931    0.1873 S   0  0  0

+   -4.8673    0.0817    0.0141 C   0  0  0

+    3.8533    0.3366    0.0399 C   0  0  0

+   -6.3284   -0.2849   -0.0286 C   0  0  0

+    5.3333    0.3068    0.0359 N   0  3  0

+    5.9260   -0.5897    0.6090 O   0  0  0

+    5.9584    1.1789   -0.5406 O   0  5  0

+    1.3525    2.2948    0.0000 H   0  0  0

+    1.2813   -1.5176    0.0000 H   0  0  0

+   -3.9268   -1.7145    0.0000 H   0  0  0

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+   -7.3099   -0.5312    0.0000 H   0  0  0

+   -6.0821   -1.2664    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  2  0

+ 13 17  2  0

+ 16 18  1  0

+ 17 19  1  0

+ 19 20  2  0

+ 19 21  1  0

+  5  9  1  0

+ 14 17  1  0

+ 15 16  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3722-54-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+    0.9725    0.9303   -0.1715 C   0  0  0

+    0.9793   -0.4635    0.0003 C   0  0  0

+   -0.1048    1.6224   -0.5555 O   0  0  0

+    2.1622    1.6234    0.0523 C   0  0  0

+    2.1565   -1.1496    0.3221 C   0  0  0

+   -0.3003   -1.1851   -0.1429 C   0  0  0

+   -1.2995    1.0693   -0.3181 C   0  0  0

+    3.3179    0.9463    0.3992 C   0  0  0

+    3.3248   -0.4384    0.5271 C   0  0  0

+    2.1512   -2.5018    0.4324 O   0  0  0

+   -1.4923   -0.3043   -0.1201 C   0  0  0

+   -0.3704   -2.3944   -0.2684 O   0  0  0

+   -2.4209    1.9037   -0.2698 C   0  0  0

+    4.4615    1.6437    0.6174 O   0  0  0

+    2.3799   -3.0240   -0.8779 C   0  0  0

+   -2.7625   -0.8321    0.0949 C   0  0  0

+   -3.6738    1.3810   -0.0502 C   0  0  0

+    5.1376    1.7318   -0.6385 C   0  0  0

+   -3.8563    0.0135    0.1289 C   0  0  0

+   -5.1028   -0.4888    0.3356 O   0  0  0

+   -6.0035    0.6204    0.3163 C   0  0  0

+    2.1635    2.6492    0.0000 H   0  0  0

+    4.2203   -0.9387    0.0000 H   0  0  0

+   -2.2958    2.9219    0.0000 H   0  0  0

+    1.4403   -3.4355    0.0000 H   0  0  0

+    2.7914   -3.9636    0.0000 H   0  0  0

+    3.3195   -2.6125    0.0000 H   0  0  0

+   -2.8977   -1.8490    0.0000 H   0  0  0

+   -4.4879    2.0052    0.0000 H   0  0  0

+    5.2701    0.7146    0.0000 H   0  0  0

+    6.1548    1.8643    0.0000 H   0  0  0

+    5.0051    2.7490    0.0000 H   0  0  0

+   -5.2072    1.2670    0.0000 H   0  0  0

+   -6.6501    1.4167    0.0000 H   0  0  0

+   -6.7998   -0.0262    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  2  6  1  0

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+  8  9  1  0

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+ 18 31  1  0

+ 18 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-50-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.0000    0.0000    0.3982 N   0  0  0

+   -0.0480   -1.3601   -0.1549 C   0  0  0

+    1.2018    0.6385   -0.1548 C   0  0  0

+   -1.1538    0.7216   -0.1548 C   0  0  0

+   -1.0680   -1.3241    0.0000 H   0  0  0

+   -0.0840   -2.3801    0.0000 H   0  0  0

+    0.9720   -1.3961    0.0000 H   0  0  0

+    1.6807   -0.2628    0.0000 H   0  0  0

+    2.1031    1.1174    0.0000 H   0  0  0

+    0.7229    1.5398    0.0000 H   0  0  0

+   -0.6126    1.5870    0.0000 H   0  0  0

+   -2.0192    1.2628    0.0000 H   0  0  0

+   -1.6950   -0.1438    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1734-79-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.8537   -0.0090    0.0037 C   0  0  0

+   -1.4158   -1.3224    0.0028 C   0  0  0

+   -0.9420    1.0324    0.0032 C   0  0  0

+   -3.3047    0.2831   -0.0010 N   0  3  0

+   -0.0663   -1.6030    0.0014 C   0  0  0

+    0.4114    0.7688    0.0018 C   0  0  0

+   -3.6936    1.4374   -0.0003 O   0  0  0

+   -4.1099   -0.6307   -0.0057 O   0  5  0

+    0.8622   -0.5558    0.0009 C   0  0  0

+    2.3036   -0.8460   -0.0001 C   0  0  0

+    3.1984    0.1696   -0.0005 C   0  0  0

+    4.5809   -0.1087   -0.0015 C   0  0  0

+    5.3837    0.8025   -0.0019 O   0  0  0

+   -2.1057   -2.0980    0.0000 H   0  0  0

+   -1.2781    2.0146    0.0000 H   0  0  0

+    0.2604   -2.5883    0.0000 H   0  0  0

+    1.0940    1.5509    0.0000 H   0  0  0

+    2.6350   -1.8297    0.0000 H   0  0  0

+    2.8670    1.1533    0.0000 H   0  0  0

+    4.9123   -1.0924    0.0000 H   0  0  0

+  1  2  1  0

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+  6  9  2  0

+  2 14  1  0

+  3 15  1  0

+  5 16  1  0

+  6 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+768-52-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.2340    0.0550   -0.3375 C   0  0  0

+    0.7882   -1.1702    0.0101 C   0  0  0

+    1.0292    1.1941   -0.3536 C   0  0  0

+   -1.1184    0.1406   -0.6759 N   0  0  0

+    2.1273   -1.2524    0.3386 C   0  0  0

+    2.3672    1.1049   -0.0241 C   0  0  0

+   -2.1447   -0.1073    0.3398 C   0  0  0

+    2.9159   -0.1167    0.3217 C   0  0  0

+   -2.8274    1.2116    0.7075 C   0  0  0

+   -3.1850   -1.0830   -0.2141 C   0  0  0

+    0.2135   -2.0037    0.0000 H   0  0  0

+    0.5912    2.1069    0.0000 H   0  0  0

+   -1.2063    1.1492    0.0000 H   0  0  0

+    2.5688   -2.1635    0.0000 H   0  0  0

+    2.9452    1.9361    0.0000 H   0  0  0

+   -1.6636   -0.9981    0.0000 H   0  0  0

+    3.9240   -0.2101    0.0000 H   0  0  0

+   -1.9283    1.6770    0.0000 H   0  0  0

+   -3.2928    2.1107    0.0000 H   0  0  0

+   -3.7265    0.7462    0.0000 H   0  0  0

+   -3.8776   -0.3445    0.0000 H   0  0  0

+   -3.9235   -1.7756    0.0000 H   0  0  0

+   -2.4924   -1.8215    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64896-26-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -1.5797   -0.3422    0.0013 C   0  0  0

+   -2.5548    0.6558   -0.0058 C   0  0  0

+   -0.2579   -0.0048   -0.0013 N   0  0  0

+   -1.9588   -1.6912    0.0170 C   0  0  0

+   -3.9029    0.3045   -0.0026 C   0  0  0

+    0.6434   -0.9278    0.0053 N   0  0  0

+   -3.2911   -2.0365    0.0255 C   0  0  0

+   -4.2702   -1.0510    0.0078 C   0  0  0

+   -4.9405    1.3521   -0.0096 C   0  0  0

+    1.9674   -0.5898    0.0026 C   0  0  0

+   -5.5802   -1.3977    0.0114 O   0  0  0

+   -4.5908    2.6475    0.1140 O   0  0  0

+   -6.1108    1.0473   -0.1269 O   0  0  0

+    2.9447   -1.5903    0.0098 C   0  0  0

+    2.3457    0.7566   -0.0130 C   0  0  0

+    4.2775   -1.2465    0.0072 C   0  0  0

+    3.6684    1.0968   -0.0156 C   0  0  0

+    4.6492    0.1010   -0.0026 C   0  0  0

+    6.0781    0.4724   -0.0055 C   0  0  0

+    6.4366    1.7711   -0.0149 O   0  0  0

+    6.9307   -0.3930    0.0007 O   0  0  0

+   -2.2771    1.6550    0.0000 H   0  0  0

+   -1.2330   -2.4320    0.0000 H   0  0  0

+   -3.5653   -3.0367    0.0000 H   0  0  0

+   -6.5828   -1.6630    0.0000 H   0  0  0

+   -4.3205    3.6488    0.0000 H   0  0  0

+    2.6657   -2.5892    0.0000 H   0  0  0

+    1.6205    1.4980    0.0000 H   0  0  0

+    5.0047   -1.9859    0.0000 H   0  0  0

+    3.9456    2.0962    0.0000 H   0  0  0

+    6.7126    2.7708    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+  4  7  1  0

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+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 20 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80-09-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.0000   -1.4931    0.0000 S   0  0  0

+   -1.4200   -0.4500   -0.0002 C   0  0  0

+    1.4200   -0.4500    0.0002 C   0  0  0

+   -0.0002   -2.1452    1.2626 O   0  0  0

+    0.0002   -2.1453   -1.2625 O   0  0  0

+   -1.9759   -0.0414   -1.1982 C   0  0  0

+   -1.9799   -0.0459    1.1980 C   0  0  0

+    1.9759   -0.0414    1.1982 C   0  0  0

+    1.9799   -0.0460   -1.1980 C   0  0  0

+   -3.0897    0.7762   -1.2011 C   0  0  0

+   -3.0933    0.7714    1.2005 C   0  0  0

+    3.0897    0.7762    1.2011 C   0  0  0

+    3.0933    0.7714   -1.2005 C   0  0  0

+   -3.6500    1.1872   -0.0006 C   0  0  0

+    3.6500    1.1872    0.0006 C   0  0  0

+   -4.7453    1.9917   -0.0008 O   0  0  0

+    4.7453    1.9917    0.0007 O   0  0  0

+   -1.6674    0.3786    0.0000 H   0  0  0

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+   -3.4034    0.3526    0.0000 H   0  0  0

+    2.7814    1.1964    0.0000 H   0  0  0

+    3.4034    0.3526    0.0000 H   0  0  0

+   -5.1653    2.3002    0.0000 H   0  0  0

+    5.1653    2.3002    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105708-80-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+   -5.2722   -0.1148   -0.4826 C   0  0  0

+   -6.1476   -0.9444    0.3473 C   0  0  0

+   -4.0078   -0.6890   -0.9652 C   0  0  0

+   -5.6347    1.1814   -0.8082 C   0  0  0

+   -7.3508   -0.4334    0.8203 C   0  0  0

+   -5.7406   -2.3112    0.6694 C   0  0  0

+   -3.6756   -2.0150   -0.6173 C   0  0  0

+   -3.1372    0.0585   -1.7599 C   0  0  0

+   -6.8462    1.6990   -0.3397 C   0  0  0

+   -7.7196    0.8753    0.4994 C   0  0  0

+   -8.2528   -1.2869    1.6742 C   0  0  0

+   -4.5762   -2.8091    0.2125 C   0  0  0

+   -2.4694   -2.5609   -1.0785 C   0  0  0

+   -1.9603   -0.5057   -2.1977 C   0  0  0

+   -7.2471    3.0135   -0.6513 C   0  0  0

+   -8.9320    1.4266    0.9618 C   0  0  0

+   -7.9130   -1.1096    3.0509 O   0  0  0

+   -1.6336   -1.8112   -1.8538 C   0  0  0

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+    9.1546    0.7982   -1.2543 O   0  0  0

+   10.5336    1.2982    0.5785 O   0  0  0

+   20.3529    0.5364    1.4720 Na  0  3  0

+   -4.8987    1.8267    0.0000 H   0  0  0

+   -6.4713   -2.9626    0.0000 H   0  0  0

+   -3.2653    1.0289    0.0000 H   0  0  0

+   -9.1612   -0.9223    0.0000 H   0  0  0

+   -8.2043   -2.2646    0.0000 H   0  0  0

+   -4.4209   -3.7756    0.0000 H   0  0  0

+   -2.3201   -3.5283    0.0000 H   0  0  0

+   -1.2019    0.1132    0.0000 H   0  0  0

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+   -9.6827    0.7984    0.0000 H   0  0  0

+   -7.0452   -0.6568    0.0000 H   0  0  0

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+  7 12  1  0

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+ 18 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+ 22 41  1  0

+ 25 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7570-36-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    2.5169    0.3049   -0.0015 C   0  0  0

+    1.0570    0.5020   -0.0015 C   0  0  0

+    3.3732    1.4099   -0.0014 C   0  0  0

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+   -1.2245   -0.3636   -0.0016 C   0  0  0

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+   -2.0818   -1.4675   -0.0016 C   0  0  0

+   -1.7583    0.9277    0.0042 C   0  0  0

+    6.6463   -0.2526   -0.0014 N   0  0  0

+   -3.4472   -1.2759   -0.0012 C   0  0  0

+   -3.1260    1.1051    0.0046 C   0  0  0

+   -3.9697    0.0070   -0.0007 C   0  0  0

+   -5.6901    0.2393   -0.0007 Cl  0  0  0

+    0.6609    1.4673    0.0000 H   0  0  0

+    2.9792    2.3761    0.0000 H   0  0  0

+    2.4136   -1.8150    0.0000 H   0  0  0

+    0.6321   -1.5261    0.0000 H   0  0  0

+    5.3777    2.0458    0.0000 H   0  0  0

+    4.8133   -2.1325    0.0000 H   0  0  0

+   -1.6894   -2.4343    0.0000 H   0  0  0

+   -1.1236    1.7559    0.0000 H   0  0  0

+    7.0424   -1.2179    0.0000 H   0  0  0

+    7.2843    0.5731    0.0000 H   0  0  0

+   -4.0884   -2.0991    0.0000 H   0  0  0

+   -3.5259    2.0688    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 13 15  1  0

+ 15 16  1  0

+  7  9  1  0

+ 14 15  2  0

+  2 17  1  0

+  3 18  1  0

+  4 19  1  0

+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-69-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.2646    0.0001    0.0032 C   0  0  0

+    0.4316   -1.2022    0.0029 C   0  0  0

+    0.4313    1.2020    0.0008 C   0  0  0

+   -1.6614    0.0000    0.0000 N   0  0  0

+    1.8125   -1.1985    0.0002 C   0  0  0

+    1.8126    1.1985   -0.0018 C   0  0  0

+   -2.3939    1.2687    0.0003 C   0  0  0

+   -2.3938   -1.2687   -0.0036 C   0  0  0

+    2.5024    0.0002   -0.0021 C   0  0  0

+   -0.0874   -2.1053    0.0000 H   0  0  0

+   -0.0878    2.1050    0.0000 H   0  0  0

+    2.3351   -2.0995    0.0000 H   0  0  0

+    2.3351    2.0996    0.0000 H   0  0  0

+   -1.4918    1.7895    0.0000 H   0  0  0

+   -2.9147    2.1708    0.0000 H   0  0  0

+   -3.2960    0.7479    0.0000 H   0  0  0

+   -3.2959   -0.7479    0.0000 H   0  0  0

+   -2.9146   -2.1708    0.0000 H   0  0  0

+   -1.4917   -1.7895    0.0000 H   0  0  0

+    3.5440    0.0002    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6  9  2  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3366-65-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.3646   -0.3485    0.0011 C   0  0  0

+   -1.1007   -0.3830    0.0007 C   0  0  0

+    1.0130    0.9077    0.0004 C   0  0  0

+    1.1209   -1.5228   -0.0036 C   0  0  0

+   -1.8092    0.8399   -0.0004 C   0  0  0

+   -1.8031   -1.5899    0.0018 C   0  0  0

+    2.4133    0.9556    0.0007 C   0  0  0

+    0.2465    2.0965   -0.0002 C   0  0  0

+    2.4831   -1.4557   -0.0035 C   0  0  0

+   -1.1015    2.0641   -0.0015 C   0  0  0

+   -3.2111    0.8176   -0.0008 C   0  0  0

+   -3.1688   -1.5779    0.0019 C   0  0  0

+    3.1359   -0.2210    0.0018 C   0  0  0

+   -3.8691   -0.3773   -0.0002 C   0  0  0

+    4.5315   -0.1760    0.0017 N   0  0  0

+    0.6421   -2.4545    0.0000 H   0  0  0

+   -1.2849   -2.5002    0.0000 H   0  0  0

+    2.9090    1.8784    0.0000 H   0  0  0

+    0.7367    3.0222    0.0000 H   0  0  0

+    3.0456   -2.3394    0.0000 H   0  0  0

+   -1.6359    2.9650    0.0000 H   0  0  0

+   -3.7512    1.7151    0.0000 H   0  0  0

+   -3.6945   -2.4839    0.0000 H   0  0  0

+   -4.9165   -0.3902    0.0000 H   0  0  0

+    5.0842   -1.0658    0.0000 H   0  0  0

+    5.0257    0.7476    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+ 11 14  2  0

+ 13 15  1  0

+  8 10  1  0

+  9 13  1  0

+ 12 14  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7379-35-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -0.4024   -0.0001    0.0030 C   0  0  0

+    0.3082   -1.1921    0.0019 C   0  0  0

+    0.3085    1.1923    0.0016 C   0  0  0

+   -2.1384    0.0000   -0.0011 Cl  0  0  0

+    1.6893   -1.1522   -0.0005 C   0  0  0

+    1.6892    1.1522   -0.0008 C   0  0  0

+    2.3311   -0.0001   -0.0017 N   0  0  0

+   -0.1906   -2.1004    0.0000 H   0  0  0

+   -0.1902    2.1007    0.0000 H   0  0  0

+    2.2271   -2.0379    0.0000 H   0  0  0

+    2.2271    2.0379    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  6  7  1  0

+  2  8  1  0

+  3  9  1  0

+  5 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75-69-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  5  4                          1 V2000

+    0.0000    0.0000   -0.2718 C   0  0  0

+    0.0000    0.0000   -1.6708 F   0  0  0

+   -0.0161    1.6998    0.3292 Cl  0  0  0

+   -1.4640   -0.8639    0.3292 Cl  0  0  0

+    1.4801   -0.8360    0.3292 Cl  0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98911-07-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -0.2345    1.4635   -0.0136 C   0  0  0

+    0.9098    2.1869    0.1113 O   0  0  0

+   -0.7940    0.8527    1.0997 C   0  0  0

+   -0.8455    1.3411   -1.2531 C   0  0  0

+    1.9393    1.3001    0.0899 C   0  0  0

+   -1.9560    0.1181    0.9734 C   0  0  0

+   -2.0079    0.6065   -1.3806 C   0  0  0

+    3.2482    1.7565    0.0236 C   0  0  0

+    1.6836   -0.0626    0.1398 C   0  0  0

+   -2.5650   -0.0096   -0.2682 C   0  0  0

+    4.2931    0.8536    0.0018 C   0  0  0

+    2.7317   -0.9624    0.1178 C   0  0  0

+   -3.7442   -0.7550   -0.3970 N   0  0  0

+    4.0356   -0.5055    0.0460 C   0  0  0

+   -4.7663   -0.5524    0.4579 C   0  0  0

+   -3.8623   -1.7212   -1.4253 O   0  0  0

+    5.3507   -1.6383    0.0185 Cl  0  0  0

+   -5.9640    0.2523    0.0232 C   0  0  0

+   -4.7220   -1.0177    1.5772 O   0  0  0

+   -0.1325    0.0617    0.0000 H   0  0  0

+   -1.2286    2.2985    0.0000 H   0  0  0

+   -1.5685   -0.8375    0.0000 H   0  0  0

+   -2.6719    1.3954    0.0000 H   0  0  0

+    3.4415    2.7694    0.0000 H   0  0  0

+    0.7108   -0.4045    0.0000 H   0  0  0

+    5.2668    1.1931    0.0000 H   0  0  0

+    2.5408   -1.9758    0.0000 H   0  0  0

+   -3.9874   -2.7448    0.0000 H   0  0  0

+   -5.3889    1.1082    0.0000 H   0  0  0

+   -6.8199    0.8274    0.0000 H   0  0  0

+   -6.5391   -0.6036    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  1  0

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+  7 10  2  0

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+ 11 26  1  0

+ 12 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2272-11-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 65 63                          1 V2000

+   -2.2494   -1.7007   -0.8504 C   0  0  0

+   -3.5356   -1.0891   -0.2913 C   0  0  0

+   -1.1189   -1.5283    0.1660 C   0  0  0

+   -4.6491   -1.2590   -1.2925 C   0  0  0

+    0.1673   -2.1399   -0.3930 C   0  0  0

+   -5.8729   -1.4785   -0.8801 C   0  0  0

+    1.2977   -1.9675    0.6234 C   0  0  0

+   -6.5676   -0.4642   -0.0085 C   0  0  0

+    2.5839   -2.5791    0.0644 C   0  0  0

+   -7.9446   -0.1459   -0.5946 C   0  0  0

+    3.7144   -2.4066    1.0808 C   0  0  0

+   -8.6499    0.8838    0.2902 C   0  0  0

+    4.9812   -3.0090    0.5301 C   0  0  0

+  -10.0269    1.2021   -0.2959 C   0  0  0

+    6.1110   -2.9741    1.2542 O   0  0  0

+    4.9800   -3.5235   -0.5631 O   0  0  0

+  -10.7322    2.2318    0.5890 C   0  0  0

+  -12.1092    2.5501    0.0028 C   0  0  0

+  -12.8145    3.5798    0.8877 C   0  0  0

+  -14.1915    3.8981    0.3016 C   0  0  0

+   16.5773    2.4036    0.4624 C   0  0  0

+   15.3164    2.7685   -0.3238 C   0  0  0

+   17.2807    3.6314    0.8570 N   0  0  0

+   15.6806    3.5055   -1.4927 O   0  0  0

+   -2.9004   -2.3733    0.0000 H   0  0  0

+   -1.8200   -2.5325    0.0000 H   0  0  0

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+   -5.6804   -0.1656    0.0000 H   0  0  0

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+    1.9329   -3.2517    0.0000 H   0  0  0

+    3.0133   -3.4109    0.0000 H   0  0  0

+   -8.8318   -0.4445    0.0000 H   0  0  0

+   -7.8990   -1.0809    0.0000 H   0  0  0

+    4.3654   -1.7340    0.0000 H   0  0  0

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+  -10.9141    0.9035    0.0000 H   0  0  0

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+    7.0466   -2.9452    0.0000 H   0  0  0

+   -9.8450    2.5304    0.0000 H   0  0  0

+  -10.7778    3.1668    0.0000 H   0  0  0

+  -12.9964    2.2515    0.0000 H   0  0  0

+  -12.0636    1.6151    0.0000 H   0  0  0

+  -11.9273    3.8784    0.0000 H   0  0  0

+  -12.8601    4.5148    0.0000 H   0  0  0

+  -13.9807    4.8101    0.0000 H   0  0  0

+  -15.1035    4.1089    0.0000 H   0  0  0

+  -14.4023    2.9861    0.0000 H   0  0  0

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+   15.0035    1.8863    0.0000 H   0  0  0

+   18.2168    3.6345    0.0000 H   0  0  0

+   16.8100    4.4405    0.0000 H   0  0  0

+   16.0953    4.3447    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  3  5  1  0

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+ 21 60  1  0

+ 22 61  1  0

+ 22 62  1  0

+ 23 63  1  0

+ 23 64  1  0

+ 24 65  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+816-57-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+   -0.1286   -0.2815   -0.2546 N   0  0  0

+    1.2475   -0.1764   -0.7462 C   0  0  0

+   -0.8531    0.8338   -0.0362 C   0  0  0

+   -0.6486   -1.4415   -0.0358 N   0  0  0

+    2.2061   -0.0657    0.4411 C   0  0  0

+   -1.8034    1.2034   -0.9176 N   0  0  0

+   -0.6496    1.5060    0.9551 O   0  0  0

+   -1.7774   -1.5280    0.4133 O   0  0  0

+    3.6432    0.0439   -0.0724 C   0  0  0

+    0.8681   -0.9939    0.0000 H   0  0  0

+    1.7753   -0.9069    0.0000 H   0  0  0

+    2.5855    0.7518    0.0000 H   0  0  0

+    1.6783    0.6649    0.0000 H   0  0  0

+   -1.9405    2.0942    0.0000 H   0  0  0

+   -2.5063    0.6393    0.0000 H   0  0  0

+    3.7117   -0.8547    0.0000 H   0  0  0

+    4.5418    0.1124    0.0000 H   0  0  0

+    3.5747    0.9425    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  2  0

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+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+82017-48-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -1.1954    0.0218    0.0756 C   0  0  1

+   -0.5387   -1.1267   -0.5688 N   0  0  0

+   -0.9146    1.2842   -0.7298 C   0  0  0

+   -2.6823   -0.2170    0.1332 C   0  0  0

+    0.6873   -1.5066   -0.2598 C   0  0  0

+    0.5490    2.1410   -0.1074 S   0  0  0

+   -3.4891    0.7041    0.6830 O   0  0  0

+   -3.1480   -1.2375   -0.3157 O   0  0  0

+    1.5667   -0.5860    0.5616 C   0  0  0

+    1.1061   -2.5828   -0.6306 O   0  0  0

+    2.0468    0.8151   -0.4800 S   0  0  0

+    0.7902   -0.0816    1.7797 C   0  0  0

+    2.8157   -1.3403    1.0219 C   0  0  0

+   -0.2364    0.1670    0.0000 H   0  0  0

+   -1.1455   -1.8834    0.0000 H   0  0  0

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+  1  2  1  0

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+  2 15  1  0

+  3 16  1  0

+  3 17  1  0

+  7 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+214-17-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.6552   -0.4246   -0.0006 C   0  0  0

+   -0.7761   -0.0962   -0.0004 C   0  0  0

+    1.5861    0.6293   -0.0003 C   0  0  0

+    1.0923   -1.7591    0.0048 C   0  0  0

+   -1.1629    1.3171    0.0000 C   0  0  0

+   -1.7414   -1.0904   -0.0012 C   0  0  0

+    3.0124    0.2971   -0.0005 C   0  0  0

+    1.1554    1.9693    0.0006 C   0  0  0

+    2.4095   -2.0721    0.0046 C   0  0  0

+   -2.5089    1.6713    0.0006 C   0  0  0

+   -0.1511    2.3077    0.0003 C   0  0  0

+   -3.0936   -0.7387   -0.0015 C   0  0  0

+    3.3966   -1.0646   -0.0009 C   0  0  0

+    3.9931    1.2932   -0.0007 C   0  0  0

+   -3.4849    0.6736    0.0007 C   0  0  0

+   -4.1032   -1.7226   -0.0027 C   0  0  0

+    4.7620   -1.3898   -0.0011 C   0  0  0

+    5.3120    0.9426   -0.0014 C   0  0  0

+   -4.8580    0.9965    0.0017 C   0  0  0

+   -5.4079   -1.3441   -0.0034 C   0  0  0

+    5.6938   -0.3950   -0.0009 C   0  0  0

+   -5.7805   -0.0005    0.0022 C   0  0  0

+    0.3810   -2.5322    0.0000 H   0  0  0

+   -1.4583   -2.1021    0.0000 H   0  0  0

+    1.8766    2.7332    0.0000 H   0  0  0

+    2.7010   -3.0814    0.0000 H   0  0  0

+   -2.7886    2.6839    0.0000 H   0  0  0

+   -0.4219    3.3227    0.0000 H   0  0  0

+    3.7162    2.3066    0.0000 H   0  0  0

+   -3.8483   -2.7418    0.0000 H   0  0  0

+    5.0646   -2.3958    0.0000 H   0  0  0

+    6.0480    1.6922    0.0000 H   0  0  0

+   -5.1651    2.0012    0.0000 H   0  0  0

+   -6.1551   -2.0825    0.0000 H   0  0  0

+    6.7149   -0.6420    0.0000 H   0  0  0

+   -6.8014    0.2472    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

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+ 14 29  1  0

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+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3365-85-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -1.3861    0.0009   -0.0016 C   0  0  0

+   -2.8687    0.0010   -0.0017 C   0  0  0

+   -0.6887    1.2086    0.0006 C   0  0  0

+   -0.6886   -1.2073    0.0020 C   0  0  0

+   -3.5669   -0.9259   -0.7747 C   0  0  0

+   -3.5671    0.9244    0.7759 C   0  0  0

+    0.6888    1.2085    0.0011 C   0  0  0

+    0.6885   -1.2073    0.0026 C   0  0  0

+   -4.9456   -0.9242   -0.7728 C   0  0  0

+   -4.9453    0.9223    0.7747 C   0  0  0

+    1.3861    0.0007   -0.0005 C   0  0  0

+   -5.6395    0.0005   -0.0011 C   0  0  0

+    2.8687    0.0006    0.0000 C   0  0  0

+   -7.0352    0.0003   -0.0008 N   0  0  0

+    3.5666   -0.9288    0.7702 C   0  0  0

+    3.5674    0.9266   -0.7742 C   0  0  0

+    4.9452   -0.9270    0.7692 C   0  0  0

+    4.9457    0.9247   -0.7721 C   0  0  0

+    5.6395    0.0005    0.0012 C   0  0  0

+    7.0352    0.0008    0.0021 N   0  0  0

+   -1.2055    2.1038    0.0000 H   0  0  0

+   -1.2055   -2.1025    0.0000 H   0  0  0

+   -3.1062   -1.8512    0.0000 H   0  0  0

+   -3.1074    1.8502    0.0000 H   0  0  0

+    1.2057    2.1037    0.0000 H   0  0  0

+    1.2053   -2.1025    0.0000 H   0  0  0

+   -5.4083   -1.8485    0.0000 H   0  0  0

+   -5.4074    1.8470    0.0000 H   0  0  0

+   -7.5522    0.8954    0.0000 H   0  0  0

+   -7.5519   -0.8950    0.0000 H   0  0  0

+    3.1052   -1.8538    0.0000 H   0  0  0

+    3.1071    1.8521    0.0000 H   0  0  0

+    5.4085   -1.8510    0.0000 H   0  0  0

+    5.4084    1.8490    0.0000 H   0  0  0

+    7.5522   -0.8943    0.0000 H   0  0  0

+    7.5519    0.8961    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+ 11 13  1  0

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+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+835-71-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.0900    0.0132   -0.0024 C   0  0  0

+   -1.3883    0.0112   -0.0022 C   0  0  0

+    0.8388    1.0865   -0.0018 N   0  0  0

+    0.8633   -1.0890    0.0025 O   0  0  0

+   -2.0874   -1.1966   -0.0030 C   0  0  0

+   -2.0909    1.2174    0.0046 C   0  0  0

+    2.1429    0.7090   -0.0023 C   0  0  0

+    2.1563   -0.6953    0.0005 C   0  0  0

+   -3.4672   -1.1914   -0.0023 C   0  0  0

+   -3.4702    1.2085    0.0052 C   0  0  0

+    3.3507    1.4116   -0.0016 C   0  0  0

+    3.3657   -1.3730    0.0042 C   0  0  0

+   -4.1575    0.0075   -0.0008 C   0  0  0

+    4.5418    0.7215   -0.0019 C   0  0  0

+    4.5501   -0.6658    0.0014 C   0  0  0

+   -5.6645    0.0054   -0.0006 C   0  0  0

+   -1.5707   -2.0965    0.0000 H   0  0  0

+   -1.5767    2.1187    0.0000 H   0  0  0

+   -3.9883   -2.0888    0.0000 H   0  0  0

+   -3.9937    2.1045    0.0000 H   0  0  0

+    3.3498    2.4493    0.0000 H   0  0  0

+    3.3800   -2.4106    0.0000 H   0  0  0

+    5.4393    1.2424    0.0000 H   0  0  0

+    5.4541   -1.1753    0.0000 H   0  0  0

+   -5.6659    1.0431    0.0000 H   0  0  0

+   -6.7022    0.0040    0.0000 H   0  0  0

+   -5.6631   -1.0323    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  4  8  1  0

+  5  9  1  0

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+ 12 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+53-96-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.7153   -0.3586   -0.2163 C   0  0  0

+   -2.1903   -0.4083   -0.0639 C   0  0  0

+   -0.2819    0.9605   -0.1025 C   0  0  0

+    0.2194   -1.3730   -0.4348 C   0  0  0

+   -2.6790    0.8784    0.1451 C   0  0  0

+   -3.0819   -1.4825   -0.0991 C   0  0  0

+   -1.4999    1.8201    0.1329 C   0  0  0

+    1.0570    1.2645   -0.2090 C   0  0  0

+    1.5585   -1.0660   -0.5421 C   0  0  0

+   -4.0310    1.0890    0.3159 C   0  0  0

+   -4.4325   -1.2622    0.0724 C   0  0  0

+    1.9839    0.2522   -0.4313 C   0  0  0

+   -4.9086    0.0201    0.2803 C   0  0  0

+    3.3435    0.5600   -0.5396 N   0  0  0

+    4.2410   -0.0660    0.2472 C   0  0  0

+    5.7156    0.1658    0.0404 C   0  0  0

+    3.8618   -0.8161    1.1217 O   0  0  0

+   -0.0868   -2.3612    0.0000 H   0  0  0

+   -2.7192   -2.4514    0.0000 H   0  0  0

+   -0.8266    2.6055    0.0000 H   0  0  0

+   -2.2186    2.5642    0.0000 H   0  0  0

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+    2.2576   -1.8286    0.0000 H   0  0  0

+   -4.3997    2.0556    0.0000 H   0  0  0

+   -5.0898   -2.0611    0.0000 H   0  0  0

+   -5.9289    0.1910    0.0000 H   0  0  0

+    3.5421    1.5753    0.0000 H   0  0  0

+    5.8763   -0.8562    0.0000 H   0  0  0

+    6.7376    0.3265    0.0000 H   0  0  0

+    5.5549    1.1878    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105361-86-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.0693   -0.3841    0.0737 C   0  0  0

+   -1.5157   -0.0560    0.0185 C   0  0  0

+    0.8757    0.6117   -0.1256 C   0  0  0

+    0.3401   -1.6946    0.3320 C   0  0  0

+   -2.4093   -0.9351   -0.5900 C   0  0  0

+   -1.9855    1.1292    0.5799 C   0  0  0

+    2.2454    0.2913   -0.0715 C   0  0  0

+    1.6870   -2.0110    0.3855 C   0  0  0

+   -3.7533   -0.6253   -0.6381 C   0  0  0

+   -3.3319    1.4291    0.5261 C   0  0  0

+    2.6396   -1.0383    0.1848 C   0  0  0

+    3.1670    1.2417   -0.2622 N   0  0  0

+   -4.2137    0.5555   -0.0836 C   0  0  0

+    4.3511    0.9602   -0.2145 O   0  0  0

+    0.5804    1.5981    0.0000 H   0  0  0

+   -0.3612   -2.4484    0.0000 H   0  0  0

+   -2.1294   -1.9259    0.0000 H   0  0  0

+   -1.3173    1.9125    0.0000 H   0  0  0

+    1.9741   -2.9998    0.0000 H   0  0  0

+   -4.4266   -1.4042    0.0000 H   0  0  0

+   -3.6172    2.4184    0.0000 H   0  0  0

+    3.6389   -1.2864    0.0000 H   0  0  0

+   -5.2209    0.7693    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  3 15  1  0

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+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106589-49-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+   -1.1885    0.1813   -0.0149 C   0  0  0

+   -2.4824   -0.5121   -0.0124 C   0  0  0

+   -1.1578    1.5995    0.0400 C   0  0  0

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+   -2.5554   -1.9053   -0.0628 C   0  0  0

+   -0.0007    2.2501    0.0419 N   0  0  0

+   -2.4148    2.3442    0.0944 C   0  0  0

+    1.1999    0.1877   -0.0733 C   0  0  0

+   -3.6006    1.7044    0.0954 C   0  0  0

+   -4.9074   -0.4105    0.0453 C   0  0  0

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+   -4.9531   -1.7737   -0.0045 C   0  0  0

+    2.3797    2.3195   -0.0023 C   0  0  0

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+    2.5958   -1.9489   -0.2075 C   0  0  0

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+    4.9278   -1.7326    0.5583 C   0  0  0

+    0.0042   -1.5799    0.0000 H   0  0  0

+   -1.6788   -2.4779    0.0000 H   0  0  0

+   -2.3938    3.3910    0.0000 H   0  0  0

+   -4.4866    2.2624    0.0000 H   0  0  0

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+   -3.8401   -3.5693    0.0000 H   0  0  0

+   -5.8803   -2.2602    0.0000 H   0  0  0

+    2.3634    3.3664    0.0000 H   0  0  0

+    1.7206   -2.5237    0.0000 H   0  0  0

+    4.4569    2.2296    0.0000 H   0  0  0

+    6.0169   -0.6032    0.0000 H   0  0  0

+    5.3304    0.5834    0.0000 H   0  0  0

+    3.8033   -3.5866    0.0000 H   0  0  0

+    5.3195   -2.7036    0.0000 H   0  0  0

+    5.9599   -1.5566    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+82-05-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -1.1029   -0.1388    0.0024 C   0  0  0

+   -0.0934   -1.1228    0.0023 C   0  0  0

+   -0.7832    1.2379    0.0016 C   0  0  0

+   -2.4617   -0.5343   -0.0026 C   0  0  0

+    1.3276   -0.7294    0.0013 C   0  0  0

+   -0.4515   -2.4656    0.0026 C   0  0  0

+    0.6262    1.6616    0.0001 C   0  0  0

+   -1.8070    2.1789    0.0013 C   0  0  0

+   -2.7817   -1.9027   -0.0071 C   0  0  0

+   -3.4668    0.4490   -0.0025 C   0  0  0

+    1.6813    0.6338    0.0005 C   0  0  0

+    2.3296   -1.6987    0.0006 C   0  0  0

+   -1.7883   -2.8380    0.0031 C   0  0  0

+    0.9157    2.8442   -0.0004 O   0  0  0

+   -3.1339    1.7724    0.0018 C   0  0  0

+    3.0284    0.9998   -0.0015 C   0  0  0

+    3.6549   -1.3173   -0.0008 C   0  0  0

+    4.0028    0.0250   -0.0026 C   0  0  0

+    0.2919   -3.2008    0.0000 H   0  0  0

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+   -3.7828   -2.2046    0.0000 H   0  0  0

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+    3.2974    2.0102    0.0000 H   0  0  0

+    4.4040   -2.0467    0.0000 H   0  0  0

+    5.0117    0.2997    0.0000 H   0  0  0

+  1  2  2  0

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+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68931-03-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 63                          1 V2000

+   -0.2346    1.3546    0.8471 C   0  0  0

+   -1.4394    2.0467    0.9498 C   0  0  0

+    0.9529    2.0544    0.7115 C   0  0  0

+   -0.2241   -0.0047    0.8855 O   0  0  0

+   -2.6442    1.3437    1.0876 N   0  0  0

+   -1.4434    3.4330    0.9157 C   0  0  0

+    0.9411    3.4369    0.6783 C   0  0  0

+    1.1401   -0.4109    0.7583 C   0  0  0

+   -3.6675    1.5887    0.2455 C   0  0  0

+   -0.2539    4.1242    0.7801 C   0  0  0

+    1.2228   -1.9382    0.7943 C   0  0  0

+   -4.8612    0.9990    0.4469 O   0  0  0

+   -3.5130    2.3418   -0.6956 O   0  0  0

+    2.6834   -2.3731    0.6580 C   0  0  0

+   -5.9637    1.2629   -0.4603 C   0  0  0

+    2.7661   -3.9005    0.6940 C   0  0  0

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+    4.2267   -4.3354    0.5578 C   0  0  0

+   -6.1459   -1.0875   -1.1233 N   0  0  0

+    4.3095   -5.8627    0.5937 C   0  0  0

+   -6.3900   -2.2550   -0.2659 C   0  0  0

+   -6.7894   -1.3692   -2.4135 C   0  0  0

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+   -7.5481   -0.6603    0.0000 H   0  0  0

+   -7.1404   -2.3464    0.0000 H   0  0  0

+    5.4737   -7.2927    0.0000 H   0  0  0

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+ 26 62  1  0

+ 26 63  1  0

+ 27 64  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20265-97-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -3.1962    0.8934    0.1095 C   0  0  0

+   -4.0502   -0.1016    0.5611 C   0  0  0

+   -1.9682    0.5573   -0.4412 C   0  0  0

+   -3.5653    2.1991    0.2015 O   0  0  0

+   -3.6785   -1.4284    0.4629 C   0  0  0

+   -1.5950   -0.7685   -0.5402 C   0  0  0

+   -2.4907    2.9711   -0.3383 C   0  0  0

+   -2.4496   -1.7656   -0.0882 C   0  0  0

+   -2.0725   -3.1095   -0.1886 N   0  0  0

+    9.0103    0.1152    0.0766 Cl  0  0  0

+   -5.0191    0.1131    0.0000 H   0  0  0

+   -1.2690    1.2615    0.0000 H   0  0  0

+   -4.3783   -2.1320    0.0000 H   0  0  0

+   -0.6259   -0.9823    0.0000 H   0  0  0

+   -1.9117    2.1652    0.0000 H   0  0  0

+   -1.6848    3.5501    0.0000 H   0  0  0

+   -3.0697    3.7771    0.0000 H   0  0  0

+   -2.7659   -3.8194    0.0000 H   0  0  0

+   -1.1110   -3.3550    0.0000 H   0  0  0

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+  1  2  2  0

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+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2757-90-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+   -2.5677   -1.0003    0.0807 C   0  0  0

+   -3.6583   -1.4174    0.8327 C   0  0  0

+   -2.6924    0.0881   -0.7737 C   0  0  0

+   -1.3466   -1.6701    0.1874 N   0  0  0

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+    4.4082    0.4670   -0.6671 C   0  0  1

+    5.5342    0.8599    0.2542 C   0  0  0

+    4.8497   -0.6287   -1.5404 N   0  0  0

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+  1  2  2  0

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+ 15 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13014-18-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    1.5397    0.3994   -0.0005 C   0  0  0

+    0.0331    0.3671   -0.0011 C   0  0  0

+    2.1041    2.1118   -0.0023 Cl  0  0  0

+    2.1582   -0.4358    1.4728 Cl  0  0  0

+    2.1594   -0.4391   -1.4715 Cl  0  0  0

+   -0.6326   -0.8456    0.0001 C   0  0  0

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+   -2.0158   -0.8751    0.0000 C   0  0  0

+    0.2674   -2.3300    0.0009 Cl  0  0  0

+   -2.0652    1.5205    0.0031 C   0  0  0

+   -2.7322    0.3080   -0.0011 C   0  0  0

+   -4.4679    0.2720   -0.0012 Cl  0  0  0

+   -0.1838    2.4586    0.0000 H   0  0  0

+   -2.5155   -1.7844    0.0000 H   0  0  0

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+  7 13  1  0

+  8 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+128-13-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 71                          1 V2000

+    0.1408   -0.7568    0.5256 C   0  0  1

+    1.3489   -0.7946   -0.3909 C   0  0  1

+   -0.7469    0.4252    0.0501 C   0  0  1

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+ 26 67  1  0

+ 27 68  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56-72-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+   -1.3916    0.1864   -0.7434 C   0  0  0

+   -1.8336   -0.9633   -0.0630 C   0  0  0

+   -0.0612    0.2838   -1.1229 C   0  0  0

+   -2.2637    1.1782   -1.0248 O   0  0  0

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+   -0.9340   -1.9961    0.2250 C   0  0  0

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+   -3.5554    1.0974   -0.6696 C   0  0  0

+   -4.0644   -0.0211    0.0248 C   0  0  0

+   -3.7600   -2.2683    1.0634 C   0  0  0

+    0.3717   -1.8842   -0.1560 C   0  0  0

+    2.1173   -0.6511   -1.2018 O   0  0  0

+   -4.3052    2.0170   -0.9444 O   0  0  0

+   -5.7410   -0.0797    0.4712 Cl  0  0  0

+    2.8903    0.0952   -0.0028 P   0  0  0

+    4.4106    0.3878   -0.4444 O   0  0  0

+    2.1506    1.4862    0.3288 O   0  0  0

+    2.8813   -0.9897    1.5123 S   0  0  0

+    4.9772   -0.8661   -0.8304 C   0  0  0

+    2.9440    2.1513    1.3138 C   0  0  0

+    6.4296   -0.6576   -1.2638 C   0  0  0

+    2.2931    3.4879    1.6755 C   0  0  0

+    0.3215    1.1974    0.0000 H   0  0  0

+   -1.3054   -2.9143    0.0000 H   0  0  0

+   -4.6703   -1.8779    0.0000 H   0  0  0

+   -4.1504   -3.1786    0.0000 H   0  0  0

+   -2.8497   -2.6587    0.0000 H   0  0  0

+    0.9649   -2.6775    0.0000 H   0  0  0

+    4.0403   -1.1875    0.0000 H   0  0  0

+    5.2093   -1.8290    0.0000 H   0  0  0

+    3.5164    1.3429    0.0000 H   0  0  0

+    3.7963    2.6560    0.0000 H   0  0  0

+    6.5704   -1.6381    0.0000 H   0  0  0

+    7.4101   -0.5168    0.0000 H   0  0  0

+    6.2888    0.3229    0.0000 H   0  0  0

+    3.1836    3.9216    0.0000 H   0  0  0

+    1.8594    4.3784    0.0000 H   0  0  0

+    1.4026    3.0542    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  2  0

+  9 14  1  0

+ 12 15  1  0

+ 15 16  1  0

+ 15 17  1  0

+ 15 18  2  0

+ 16 19  1  0

+ 17 20  1  0

+ 19 21  1  0

+ 20 22  1  0

+  7 11  1  0

+  8  9  1  0

+  3 23  1  0

+  6 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 19 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1198-61-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.0001   -1.6535   -0.0014 C   0  0  0

+   -1.2001   -0.9603   -0.0009 C   0  0  0

+    1.2000   -0.9606   -0.0012 C   0  0  0

+    0.0000   -3.0045    0.0037 F   0  0  0

+   -1.1997    0.4245   -0.0003 C   0  0  0

+   -2.3703   -1.6355   -0.0015 F   0  0  0

+    1.1996    0.4246   -0.0006 C   0  0  0

+    2.3701   -1.6359   -0.0012 F   0  0  0

+    0.0002    1.1169    0.0003 C   0  0  0

+   -2.7028    1.2929    0.0003 Cl  0  0  0

+    2.7028    1.2929    0.0002 Cl  0  0  0

+    0.0002    2.4679    0.0009 F   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+  7  9  2  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+824-94-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -2.2167   -0.0667   -0.9352 C   0  0  0

+   -3.1854    0.2221    0.5579 Cl  0  0  0

+   -0.7538   -0.1341   -0.5796 C   0  0  0

+   -0.1791   -1.3474   -0.2498 C   0  0  0

+    0.0127    1.0169   -0.5893 C   0  0  0

+    1.1620   -1.4119    0.0762 C   0  0  0

+    1.3538    0.9577   -0.2642 C   0  0  0

+    1.9318   -0.2580    0.0723 C   0  0  0

+    3.2511   -0.3189    0.3930 O   0  0  0

+    3.7607    1.0129    0.2992 C   0  0  0

+   -2.8907   -0.8166    0.0000 H   0  0  0

+   -1.8275   -0.9968    0.0000 H   0  0  0

+   -0.7386   -2.1862    0.0000 H   0  0  0

+   -0.4436    1.9160    0.0000 H   0  0  0

+    1.6161   -2.3121    0.0000 H   0  0  0

+    1.9110    1.7980    0.0000 H   0  0  0

+    4.7024    0.6526    0.0000 H   0  0  0

+    4.1210    1.9546    0.0000 H   0  0  0

+    2.8190    1.3732    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

+  9  8  1  0

+ 10  9  1  0

+  7  8  1  0

+  1 11  1  0

+  1 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+603-87-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    1.8913    0.0013    0.0198 N   0  3  0

+    2.6833   -0.6483   -0.6392 O   0  5  0

+    2.2760    0.9647    0.6581 O   0  0  0

+    0.4603   -0.3765    0.0401 C   0  0  0

+   -0.5151    0.6013   -0.0582 C   0  0  0

+    0.0978   -1.7068    0.1516 C   0  0  0

+   -0.1601    1.9092   -0.1740 O   0  0  0

+   -1.8615    0.2421   -0.0388 C   0  0  0

+   -1.2372   -2.0639    0.1710 C   0  0  0

+   -2.8518    1.2262   -0.1383 N   0  0  0

+   -2.2174   -1.0931    0.0790 C   0  0  0

+    0.8285   -2.4410    0.0000 H   0  0  0

+    0.1112    2.9089    0.0000 H   0  0  0

+   -1.5031   -3.0650    0.0000 H   0  0  0

+   -2.5868    2.2276    0.0000 H   0  0  0

+   -3.8515    0.9550    0.0000 H   0  0  0

+   -3.2171   -1.3643    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  5  1  0

+  9  6  2  0

+ 10  8  1  0

+ 11  8  2  0

+  9 11  1  0

+  6 12  1  0

+  7 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-35-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.0394   -0.6459    0.3827 N   0  0  0

+   -1.3106   -1.1553    0.6362 C   0  0  0

+    0.3830    0.6540    0.4260 C   0  0  0

+    1.0998   -1.4169    0.0815 C   0  0  0

+   -2.1884   -0.0316    1.1204 C   0  0  0

+   -1.8934   -1.7256   -0.6612 C   0  0  0

+    1.8238    0.7708    0.1169 C   0  0  0

+   -0.3653    1.5771    0.6766 O   0  0  0

+    2.2792   -0.5449   -0.1020 C   0  0  0

+    1.0899   -2.6269   -0.0219 O   0  0  0

+   -2.8984    0.7167    0.2628 N   0  0  0

+   -2.2550    0.2011    2.3083 O   0  0  0

+   -2.0436   -0.5836   -1.6720 C   0  0  0

+    2.7094    1.8319    0.0179 C   0  0  0

+    3.6102   -0.7705   -0.4145 C   0  0  0

+   -2.8816    0.5091   -1.0623 C   0  0  0

+    4.0372    1.5915   -0.2989 C   0  0  0

+    4.4840    0.3010   -0.5128 C   0  0  0

+   -3.5543    1.2144   -1.7830 O   0  0  0

+   -0.7664   -2.0086    0.0000 H   0  0  0

+   -2.8457   -2.0682    0.0000 H   0  0  0

+   -1.3558   -2.5831    0.0000 H   0  0  0

+   -3.3110    1.6408    0.0000 H   0  0  0

+   -1.0556   -0.8028    0.0000 H   0  0  0

+   -1.4996    0.2698    0.0000 H   0  0  0

+    2.3642    2.7832    0.0000 H   0  0  0

+    3.9661   -1.7179    0.0000 H   0  0  0

+    4.6956    2.3601    0.0000 H   0  0  0

+    5.4805    0.1244    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 14 17  2  0

+ 15 18  2  0

+ 16 19  2  0

+  7  9  2  0

+ 13 16  1  0

+ 17 18  1  0

+  2 20  1  0

+  6 21  1  0

+  6 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+618-39-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    1.6767   -0.0265    0.0021 C   0  0  0

+    2.3155   -1.1615    0.0028 N   0  0  0

+    2.3787    1.1591   -0.0045 N   0  0  0

+    0.1960   -0.0102    0.0022 C   0  0  0

+   -0.4907    1.2033    0.0014 C   0  0  0

+   -0.5174   -1.2088   -0.0028 C   0  0  0

+   -1.8708    1.2120    0.0010 C   0  0  0

+   -1.8969   -1.1872   -0.0032 C   0  0  0

+   -2.5727    0.0202    0.0014 C   0  0  0

+    2.8243   -2.0655    0.0000 H   0  0  0

+    3.4160    1.1477    0.0000 H   0  0  0

+    1.8699    2.0631    0.0000 H   0  0  0

+    0.0347    2.0978    0.0000 H   0  0  0

+   -0.0118   -2.1146    0.0000 H   0  0  0

+   -2.3827    2.1142    0.0000 H   0  0  0

+   -2.4285   -2.0780    0.0000 H   0  0  0

+   -3.6100    0.0316    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  2  0

+  9  7  2  0

+  8  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2244-16-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.9358    0.0644    0.3862 C   0  0  1

+   -0.1577   -0.9691   -0.4406 C   0  0  0

+   -0.4879    1.4673   -0.0210 C   0  0  0

+   -2.4115   -0.0884    0.1212 C   0  0  0

+    1.3101   -0.8005   -0.1061 C   0  0  0

+    1.0039    1.6028    0.0551 C   0  0  0

+   -2.9480    0.0849   -1.2763 C   0  0  0

+   -3.2278   -0.3718    1.1058 C   0  0  0

+    1.8310    0.5655    0.0120 C   0  0  0

+    2.0304   -1.7629    0.0590 O   0  0  0

+    3.3188    0.7934    0.0852 C   0  0  0

+    0.1452    0.2479    0.0000 H   0  0  0

+   -1.1361   -1.4641    0.0000 H   0  0  0

+    0.1573   -2.0194    0.0000 H   0  0  0

+   -0.4412    2.5628    0.0000 H   0  0  0

+   -1.5675    1.6591    0.0000 H   0  0  0

+    1.4345    2.6112    0.0000 H   0  0  0

+   -2.6110    1.1283    0.0000 H   0  0  0

+   -3.9914    0.4219    0.0000 H   0  0  0

+   -3.2850   -0.9585    0.0000 H   0  0  0

+   -4.0571    0.3454    0.0000 H   0  0  0

+   -3.4343   -1.4486    0.0000 H   0  0  0

+    3.4848   -0.2904    0.0000 H   0  0  0

+    4.4026    0.9594    0.0000 H   0  0  0

+    3.1528    1.8772    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

+  9 11  1  0

+  6  9  2  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+70021-98-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+    0.5536    0.0020   -0.0077 C   0  0  0

+   -0.7473    0.5368    0.0113 C   0  0  0

+    1.6686    0.8742    0.0202 C   0  0  0

+    0.7340   -1.3999   -0.0485 C   0  0  0

+   -1.8660   -0.3295   -0.0164 C   0  0  0

+   -0.9356    1.9359    0.0575 C   0  0  0

+    3.0292    0.3026   -0.0001 C   0  0  0

+    1.4680    2.2498    0.0665 C   0  0  0

+    2.0865   -1.9559   -0.0687 C   0  0  0

+   -0.3842   -2.2411   -0.0697 C   0  0  0

+   -3.2074    0.2541    0.0042 C   0  0  0

+   -1.6705   -1.7117   -0.0620 C   0  0  0

+    0.1867    2.7807    0.0840 C   0  0  0

+   -2.2441    2.4607    0.0757 C   0  0  0

+    3.2004   -1.1038   -0.0469 C   0  0  0

+    4.1430    1.1297    0.0267 C   0  0  0

+   -3.3482    1.6236    0.0499 C   0  0  0

+   -4.4031   -0.6195   -0.0241 N   0  3  0

+    4.5039   -1.6405   -0.0655 C   0  0  0

+    5.4190    0.5783    0.0076 C   0  0  0

+   -5.3628   -0.3164   -0.7103 O   0  0  0

+   -4.4306   -1.8072    0.7464 O   0  5  0

+    5.5941   -0.7942   -0.0380 C   0  0  0

+    2.2980    2.8959    0.0000 H   0  0  0

+    2.2244   -2.9987    0.0000 H   0  0  0

+   -0.2507   -3.2844    0.0000 H   0  0  0

+   -2.5012   -2.3570    0.0000 H   0  0  0

+    0.0543    3.8242    0.0000 H   0  0  0

+   -2.3843    3.5032    0.0000 H   0  0  0

+    4.0219    2.1745    0.0000 H   0  0  0

+   -4.3129    2.0427    0.0000 H   0  0  0

+    4.6452   -2.6828    0.0000 H   0  0  0

+    6.2596    1.2106    0.0000 H   0  0  0

+    6.5662   -1.1959    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

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+ 11 17  2  0

+ 11 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 18 21  2  0

+ 18 22  1  0

+ 19 23  2  0

+  8 13  2  0

+  9 15  1  0

+ 10 12  2  0

+ 14 17  1  0

+ 20 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97851-14-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.3994   -0.1654    0.3535 C   0  0  0

+   -0.9615    0.4255    0.3466 C   0  0  0

+    1.4897    0.5871   -0.0801 C   0  0  0

+    0.5909   -1.4720    0.7988 C   0  0  0

+   -2.0564   -0.3451   -0.0390 C   0  0  0

+   -1.1501    1.7517    0.7314 C   0  0  0

+    2.7534    0.0354   -0.0721 C   0  0  0

+    1.8573   -2.0185    0.8045 C   0  0  0

+   -3.3204    0.2097   -0.0430 C   0  0  0

+   -2.4181    2.2960    0.7235 C   0  0  0

+    2.9404   -1.2683    0.3676 C   0  0  0

+    3.9117    0.8339   -0.5323 N   0  3  0

+   -3.5011    1.5277    0.3351 C   0  0  0

+   -4.4846   -0.6076   -0.4524 N   0  3  0

+    4.1868   -1.8093    0.3743 O   0  0  0

+    4.0227    1.9981   -0.1918 O   0  0  0

+    4.7538    0.3268   -1.2515 O   0  5  0

+   -5.6004   -0.1192   -0.4564 O   0  0  0

+   -4.3268   -1.7685   -0.7853 O   0  5  0

+    1.3935    1.5834    0.0000 H   0  0  0

+   -0.2032   -2.0813    0.0000 H   0  0  0

+   -1.9566   -1.3411    0.0000 H   0  0  0

+   -0.3553    2.3601    0.0000 H   0  0  0

+    1.9564   -3.0145    0.0000 H   0  0  0

+   -2.5238    3.2914    0.0000 H   0  0  0

+   -4.4196    1.9256    0.0000 H   0  0  0

+    5.1050   -2.2078    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+ 12 16  2  0

+ 12 17  1  0

+ 14 18  2  0

+ 14 19  1  0

+  8 11  2  0

+ 10 13  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  8 24  1  0

+ 10 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89811-25-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -1.3795   -0.0410   -0.0342 C   0  0  0

+   -2.5772   -0.6532    0.0741 O   0  0  0

+   -1.6098    1.3085   -0.2035 C   0  0  0

+   -0.1124   -0.6708    0.0219 C   0  0  0

+   -3.5545    0.2589   -0.0203 C   0  0  0

+   -3.0023    1.4805   -0.1920 C   0  0  0

+    1.0181    0.0681   -0.1019 C   0  0  0

+   -5.0055   -0.0258    0.0510 N   0  3  0

+    2.2847   -0.5613   -0.0457 C   0  0  0

+   -5.8101    0.8833   -0.0471 O   0  0  0

+   -5.3948   -1.1693    0.2079 O   0  5  0

+    3.4082    0.1729   -0.1688 N   0  0  0

+    2.3593   -1.7663    0.1137 O   0  0  0

+    4.7191   -0.4785   -0.1107 C   0  0  0

+    5.8186    0.5725   -0.2755 C   0  0  0

+    5.7113    1.6037    0.8497 C   0  0  0

+    7.1877   -0.1079   -0.2149 C   0  0  0

+   -0.9103    2.0411    0.0000 H   0  0  0

+   -0.0529   -1.6820    0.0000 H   0  0  0

+   -3.4983    2.3637    0.0000 H   0  0  0

+    0.9585    1.0793    0.0000 H   0  0  0

+    3.3486    1.1841    0.0000 H   0  0  0

+    4.1667   -1.3276    0.0000 H   0  0  0

+    5.4988   -1.1251    0.0000 H   0  0  0

+    4.8678    0.9219    0.0000 H   0  0  0

+    6.7188    1.7085    0.0000 H   0  0  0

+    5.6065    2.6112    0.0000 H   0  0  0

+    4.7038    1.4989    0.0000 H   0  0  0

+    6.7369   -1.0150    0.0000 H   0  0  0

+    8.0948   -0.5587    0.0000 H   0  0  0

+    7.6385    0.7992    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

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+  5  6  2  0

+  3 18  1  0

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+  7 21  1  0

+ 12 22  1  0

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+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+156-25-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    0.6419    0.3626   -0.0017 C   0  0  0

+   -0.7103    0.5446   -0.0018 N   0  0  0

+    1.4986    1.4691   -0.0017 C   0  0  0

+    1.1755   -0.9306    0.0042 C   0  0  0

+   -1.4986   -0.4765   -0.0019 N   0  0  0

+    2.8619    1.2815   -0.0011 C   0  0  0

+    2.5403   -1.1100    0.0047 C   0  0  0

+   -2.8536   -0.2942   -0.0020 C   0  0  0

+    3.3890   -0.0070   -0.0006 C   0  0  0

+   -3.7209   -1.3948   -0.0020 C   0  0  0

+   -3.3977    0.9931    0.0038 C   0  0  0

+    4.7690   -0.1927   -0.0004 N   0  0  0

+   -5.0836   -1.1553   -0.0017 C   0  0  0

+   -4.7026    1.1677    0.0042 N   0  0  0

+    5.3258   -1.5478    0.0001 C   0  0  0

+    5.6642    0.9670   -0.0009 C   0  0  0

+   -5.5422    0.1498   -0.0012 C   0  0  0

+    1.1052    2.4326    0.0000 H   0  0  0

+    0.5415   -1.7559    0.0000 H   0  0  0

+    3.4997    2.1039    0.0000 H   0  0  0

+    2.9380   -2.0717    0.0000 H   0  0  0

+   -3.3497   -2.3671    0.0000 H   0  0  0

+   -2.7662    1.8204    0.0000 H   0  0  0

+   -5.7568   -1.9490    0.0000 H   0  0  0

+    4.3632   -1.9433    0.0000 H   0  0  0

+    5.7213   -2.5104    0.0000 H   0  0  0

+    6.2884   -1.1523    0.0000 H   0  0  0

+    6.4880    0.3311    0.0000 H   0  0  0

+    6.3001    1.7908    0.0000 H   0  0  0

+    4.8404    1.6029    0.0000 H   0  0  0

+   -6.5669    0.3319    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  2  0

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+  7  9  2  0

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+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-47-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.9742    0.0001    0.0018 C   0  0  0

+   -1.2783   -1.2022    0.0013 C   0  0  0

+   -1.2785    1.2020    0.0014 C   0  0  0

+   -3.3716    0.0001   -0.0031 N   0  0  0

+    0.1025   -1.1993    0.0004 C   0  0  0

+    0.1028    1.1990    0.0005 C   0  0  0

+    0.7933    0.0001    0.0000 C   0  0  0

+    2.5293    0.0000   -0.0006 Cl  0  0  0

+   -1.7968   -2.1035    0.0000 H   0  0  0

+   -1.7969    2.1034    0.0000 H   0  0  0

+   -3.8915    0.9006    0.0000 H   0  0  0

+   -3.8915   -0.9004    0.0000 H   0  0  0

+    0.6238   -2.0990    0.0000 H   0  0  0

+    0.6242    2.0987    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  6  7  2  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+532-27-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.8333    0.1001   -0.0010 C   0  0  0

+   -0.6210    0.3259   -0.0002 C   0  0  0

+    1.7135    1.1871    0.0003 C   0  0  0

+    1.3422   -1.2024    0.0026 C   0  0  0

+   -1.5658   -0.8482   -0.0017 C   0  0  0

+   -1.0589    1.4566    0.0017 O   0  0  0

+    3.0745    0.9673   -0.0005 C   0  0  0

+    2.7062   -1.4057    0.0018 C   0  0  0

+   -3.2669   -0.2506   -0.0003 Cl  0  0  0

+    3.5706   -0.3250   -0.0027 C   0  0  0

+    1.3410    2.1618    0.0000 H   0  0  0

+    0.6916   -2.0183    0.0000 H   0  0  0

+   -2.0207   -1.7873    0.0000 H   0  0  0

+   -0.6841   -1.4063    0.0000 H   0  0  0

+    3.7324    1.7773    0.0000 H   0  0  0

+    3.0875   -2.3770    0.0000 H   0  0  0

+    4.6017   -0.4851    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  3  7  2  0

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+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18810-04-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 34                          1 V2000

+   -3.1110    0.1428   -0.3170 C   0  0  0

+   -4.3071    0.1323    0.6370 C   0  0  1

+   -1.8128    0.1341    0.4928 C   0  0  0

+   -5.5858    0.1409   -0.1606 C   0  0  0

+   -4.2581   -1.0762    1.4706 N   0  0  0

+   -0.6167    0.1446   -0.4612 C   0  0  0

+   -6.1553    1.3070   -0.5032 O   0  0  0

+   -6.0982   -0.9021   -0.4917 O   0  0  0

+    0.6815    0.1359    0.3486 C   0  0  0

+    1.8299    0.1459   -0.5674 N   0  0  0

+    3.0373    0.1370    0.2694 C   0  0  0

+    4.2781    0.1468   -0.6256 C   0  0  0

+    5.5167    0.1376    0.2328 C   0  0  0

+    4.2703   -1.0434   -1.4866 N   0  0  0

+    6.0682    1.2959    0.6277 O   0  0  0

+    6.0133   -0.9124    0.5656 O   0  0  0

+   -2.6562    0.9277    0.0000 H   0  0  0

+   -3.5674    0.9267    0.0000 H   0  0  0

+   -4.3080    1.0394    0.0000 H   0  0  0

+   -2.2676   -0.6508    0.0000 H   0  0  0

+   -1.3564   -0.6498    0.0000 H   0  0  0

+   -5.0247   -1.5612    0.0000 H   0  0  0

+   -3.4548   -1.4976    0.0000 H   0  0  0

+   -0.1619    0.9295    0.0000 H   0  0  0

+   -1.0731    0.9285    0.0000 H   0  0  0

+   -6.5534    2.1221    0.0000 H   0  0  0

+    0.2267   -0.6490    0.0000 H   0  0  0

+    1.1379   -0.6481    0.0000 H   0  0  0

+    1.8293    1.0530    0.0000 H   0  0  0

+    2.5819   -0.6476    0.0000 H   0  0  0

+    3.4931   -0.6473    0.0000 H   0  0  0

+    4.2779    1.0539    0.0000 H   0  0  0

+    3.4818   -1.4918    0.0000 H   0  0  0

+    5.0529   -1.5021    0.0000 H   0  0  0

+    6.4582    2.1149    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 30  1  0

+ 11 31  1  0

+ 12 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+ 15 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+394-69-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.5812    0.8967   -0.0026 C   0  0  0

+   -0.0023   -0.3968   -0.0016 C   0  0  0

+    0.2607    2.0224   -0.0019 C   0  0  0

+   -1.9112    1.0299    0.0014 N   0  0  0

+    1.3978   -0.5311    0.0004 C   0  0  0

+   -0.8462   -1.5220   -0.0023 C   0  0  0

+    1.6117    1.8569   -0.0003 C   0  0  0

+   -2.7010   -0.0169    0.0062 C   0  0  0

+    2.1808    0.5857    0.0015 C   0  0  0

+    1.9633   -1.7581    0.0018 F   0  0  0

+   -2.1969   -1.3150   -0.0039 C   0  0  0

+   -0.1454    2.9740    0.0000 H   0  0  0

+   -0.4551   -2.4799    0.0000 H   0  0  0

+    2.2262    2.6893    0.0000 H   0  0  0

+   -3.7258    0.1254    0.0000 H   0  0  0

+    3.2107    0.4873    0.0000 H   0  0  0

+   -2.8444   -2.1219    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  3 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+18296-44-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 62                          1 V2000

+    0.6412    1.1630   -0.5365 C   0  0  2

+   -0.2043    0.2162    0.3089 C   0  0  2

+    1.8719    0.3059   -0.8781 C   0  0  2

+    0.7389    2.6533   -0.2712 C   0  0  0

+    0.0985    2.1123   -1.4325 O   0  0  0

+    0.2170   -1.1705   -0.1636 C   0  0  0

+   -1.6926    0.3300    0.0175 C   0  0  1

+    1.3686   -1.1241   -0.7959 C   0  0  0

+    2.9009    0.5152    0.1248 O   0  0  0

+   -0.7065   -2.3056    0.0413 C   0  0  0

+   -2.4380   -0.7413    0.5437 O   0  0  0

+   -2.1968    1.5808    0.5554 O   0  0  0

+    4.1962    0.4034   -0.2092 C   0  0  0

+   -1.9605   -1.9648    0.3652 C   0  0  0

+   -0.2697   -3.7406   -0.1039 C   0  0  0

+   -3.4938    1.8972    0.4156 C   0  0  0

+    5.2641    0.6207    0.8317 C   0  0  0

+    4.5059    0.1286   -1.3443 O   0  0  0

+   -1.3962   -4.6183    0.1585 O   0  0  0

+   -4.0171    3.1955    0.9739 C   0  0  0

+   -4.2416    1.1412   -0.1580 O   0  0  0

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+   -2.4099   -6.8606    0.3591 C   0  0  0

+   -0.1633   -6.4176   -0.1962 O   0  0  0

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+   -3.3443    4.7244   -0.8840 C   0  0  0

+   -0.5790    1.1469    0.0000 H   0  0  0

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+   -1.7933   -7.6520    0.0000 H   0  0  0

+   -4.6798    5.8070    0.0000 H   0  0  0

+   -6.0935    5.9275    0.0000 H   0  0  0

+   -6.2140    4.5138    0.0000 H   0  0  0

+   -2.8610    3.8452    0.0000 H   0  0  0

+   -2.4651    5.2077    0.0000 H   0  0  0

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+  1  2  1  0

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+ 29 55  1  0

+ 29 56  1  0

+ 29 57  1  0

+ 30 58  1  0

+ 30 59  1  0

+ 30 60  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1694-20-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.4754    0.3950   -0.0011 C   0  0  0

+   -0.9846    0.5973   -0.0014 C   0  0  0

+    1.3365    1.4952   -0.0011 C   0  0  0

+    1.0050   -0.8983    0.0050 C   0  0  0

+   -1.8091   -0.4621   -0.0014 C   0  0  0

+    2.7017    1.2981   -0.0008 C   0  0  0

+    2.3719   -1.0799    0.0052 C   0  0  0

+   -3.2690   -0.2598   -0.0016 C   0  0  0

+    3.2188    0.0147   -0.0006 C   0  0  0

+   -4.1304   -1.3603   -0.0017 C   0  0  0

+   -3.7985    1.0331    0.0039 C   0  0  0

+    4.6851   -0.1885   -0.0009 N   0  3  0

+   -5.4952   -1.1633   -0.0020 C   0  0  0

+   -5.1659    1.2148    0.0035 C   0  0  0

+    5.1436   -1.3169   -0.0007 O   0  0  0

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+   -6.0125    0.1204   -0.0023 C   0  0  0

+   -1.3752    1.5588    0.0000 H   0  0  0

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+ 13 26  1  0

+ 14 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+20702-77-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 79 82                          1 V2000

+   -2.9463   -1.1472   -0.1473 C   0  0  2

+   -4.3787   -0.6188   -0.2522 C   0  0  2

+   -2.0623   -0.2696   -0.8477 O   0  0  0

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+ 43 79  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+69866-21-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 85 94                          1 V2000

+   -7.0915   -1.5450   -0.0931 C   0  0  0

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+ 51 85  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+150-90-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 13                          1 V2000

+   -2.9394   -1.1354    0.1902 C   0  0  0

+   -3.9118   -0.0208    0.4783 C   0  0  0

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+   -3.2354    0.3541    0.0000 H   0  0  0

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+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89641-97-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -0.3177    0.0301   -0.0024 C   0  0  0

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+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+456-27-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.9716    0.0001    0.0038 C   0  0  0

+   -0.2828   -1.2002    0.0040 C   0  0  0

+   -0.2830    1.2000    0.0020 C   0  0  0

+   -2.4516    0.0000   -0.0007 N   0  3  0

+    1.0964   -1.2075    0.0023 C   0  0  0

+    1.0966    1.2073    0.0004 C   0  0  0

+   -3.0606    1.0549   -0.0009 O   0  0  0

+   -3.0606   -1.0548   -0.0042 O   0  5  0

+    1.7978    0.0001    0.0005 C   0  0  0

+    3.1528    0.0001   -0.0015 N   0  3  0

+    4.1863    0.0001   -0.0031 N   0  0  0

+   -0.8037   -2.0942    0.0000 H   0  0  0

+   -0.8039    2.0940    0.0000 H   0  0  0

+    1.6102   -2.1056    0.0000 H   0  0  0

+    1.6104    2.1054    0.0000 H   0  0  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  3  0

+  6  9  2  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80657-17-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 45                          1 V2000

+    1.8579   -0.6860   -0.5521 C   0  0  1

+    0.5678   -0.8820    0.2203 C   0  0  1

+    2.5447    0.5611    0.0744 C   0  0  2

+    2.9325   -1.7586   -0.3462 C   0  0  0

+   -0.2513    0.3770    0.0266 C   0  0  0

+   -0.2134   -2.0854   -0.3010 C   0  0  0

+    1.7198    1.7499   -0.2819 C   0  0  0

+    3.9592    0.4989   -0.4872 C   0  0  2

+    2.5999    0.4089    1.5958 C   0  0  0

+    4.2445   -1.0086   -0.7065 C   0  0  0

+   -1.6087    0.3348    0.1073 C   0  0  0

+    0.3825    1.6109   -0.2774 C   0  0  0

+   -1.5386   -2.1686    0.4657 C   0  0  0

+    4.8771    1.0223    0.4749 O   0  0  0

+   -2.2955   -0.8768    0.2699 C   0  0  0

+   -2.3691    1.6388    0.0618 C   0  0  0

+   -3.6584   -0.9147    0.2276 C   0  0  0

+   -3.7076    1.4470   -0.6458 C   0  0  0

+   -4.3998    0.2230   -0.1067 C   0  0  0

+   -5.6065    0.2237    0.0380 O   0  0  0

+    1.2603    0.1707    0.0000 H   0  0  0

+    1.1340   -1.7598    0.0000 H   0  0  0

+    2.1318   -2.4294    0.0000 H   0  0  0

+    3.5294   -2.6158    0.0000 H   0  0  0

+   -0.3696   -3.1182    0.0000 H   0  0  0

+    0.7631   -2.4563    0.0000 H   0  0  0

+    2.1555    2.6992    0.0000 H   0  0  0

+    3.7138    1.5142    0.0000 H   0  0  0

+    1.6179    0.0528    0.0000 H   0  0  0

+    2.9560   -0.5731    0.0000 H   0  0  0

+    3.5819    0.7650    0.0000 H   0  0  0

+    4.6595   -1.9672    0.0000 H   0  0  0

+    5.2431   -0.7021    0.0000 H   0  0  0

+   -0.2072    2.4730    0.0000 H   0  0  0

+   -2.5108   -2.5504    0.0000 H   0  0  0

+   -1.3122   -3.1883    0.0000 H   0  0  0

+    5.7845    1.5397    0.0000 H   0  0  0

+   -1.4068    2.0450    0.0000 H   0  0  0

+   -2.6486    2.6453    0.0000 H   0  0  0

+   -4.1433   -1.8399    0.0000 H   0  0  0

+   -3.6276    2.4885    0.0000 H   0  0  0

+   -4.7068    1.7514    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  8 14  1  0

+ 11 15  1  0

+ 11 16  1  0

+ 15 17  2  0

+ 16 18  1  0

+ 17 19  1  0

+ 19 20  2  0

+  7 12  2  0

+  8 10  1  0

+ 13 15  1  0

+ 18 19  1  0

+  1 21  1  0

+  2 22  1  0

+  4 23  1  0

+  4 24  1  0

+  6 25  1  0

+  6 26  1  0

+  7 27  1  0

+  8 28  1  0

+  9 29  1  0

+  9 30  1  0

+  9 31  1  0

+ 10 32  1  0

+ 10 33  1  0

+ 12 34  1  0

+ 13 35  1  0

+ 13 36  1  0

+ 14 37  1  0

+ 16 38  1  0

+ 16 39  1  0

+ 17 40  1  0

+ 18 41  1  0

+ 18 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59-67-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.1514   -0.0480    0.0033 C   0  0  0

+    0.5525   -1.2586    0.0029 C   0  0  0

+    0.5668    1.1493    0.0009 C   0  0  0

+   -1.6285   -0.0378    0.0001 C   0  0  0

+    1.9356   -1.2130    0.0001 C   0  0  0

+    1.8834    1.1401   -0.0016 N   0  0  0

+   -2.2941    1.1334    0.0005 O   0  0  0

+   -2.2431   -1.0856   -0.0030 O   0  0  0

+    2.5726    0.0147   -0.0021 C   0  0  0

+    0.0501   -2.1662    0.0000 H   0  0  0

+    0.0588    2.0537    0.0000 H   0  0  0

+    2.4889   -2.0905    0.0000 H   0  0  0

+   -2.8066    2.0353    0.0000 H   0  0  0

+    3.6093    0.0515    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6  9  1  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  7 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1155-38-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+    0.8726    2.1547   -0.2534 C   0  0  0

+   -0.1366    1.0337   -0.1533 C   0  0  0

+    2.3631    1.7861   -0.2509 C   0  0  0

+    1.6674    2.1791    0.9339 O   0  0  0

+    0.3005   -0.2966   -0.0627 C   0  0  0

+   -1.4614    1.3384   -0.1524 C   0  0  0

+    2.7344    0.3261   -0.1506 C   0  0  0

+    1.7434   -0.6444   -0.0614 C   0  0  0

+   -0.6246   -1.3255    0.0292 C   0  0  0

+   -2.4213    0.3160   -0.0601 C   0  0  0

+   -1.9018    2.7763   -0.2501 C   0  0  0

+    4.0664   -0.0378   -0.1469 C   0  0  0

+    2.1104   -1.9902    0.0313 C   0  0  0

+   -1.9957   -1.0333    0.0312 C   0  0  0

+   -3.7959    0.6062   -0.0561 C   0  0  0

+    4.4218   -1.3711   -0.0556 C   0  0  0

+    3.4426   -2.3443    0.0350 C   0  0  0

+   -2.9586   -2.0543    0.1238 C   0  0  0

+   -4.6991   -0.4082    0.0353 C   0  0  0

+   -4.2814   -1.7349    0.1235 C   0  0  0

+    0.4331    3.1024    0.0000 H   0  0  0

+    3.1930    2.4207    0.0000 H   0  0  0

+   -0.3017   -2.3190    0.0000 H   0  0  0

+   -0.9029    3.0822    0.0000 H   0  0  0

+   -2.2077    3.7752    0.0000 H   0  0  0

+   -2.9007    2.4704    0.0000 H   0  0  0

+    4.8074    0.6986    0.0000 H   0  0  0

+    1.3741   -2.7313    0.0000 H   0  0  0

+   -4.1222    1.5986    0.0000 H   0  0  0

+    5.4303   -1.6437    0.0000 H   0  0  0

+    3.7124   -3.3535    0.0000 H   0  0  0

+   -2.6610   -3.0557    0.0000 H   0  0  0

+   -5.7206   -0.1892    0.0000 H   0  0  0

+   -4.9945   -2.4983    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 12 16  2  0

+ 13 17  2  0

+ 14 18  1  0

+ 15 19  2  0

+ 18 20  2  0

+  3  4  1  0

+  7  8  2  0

+ 10 14  2  0

+ 16 17  1  0

+ 19 20  1  0

+  1 21  1  0

+  3 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+603-02-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.0537    0.0874   -0.0048 C   0  0  0

+   -0.2132   -0.4647   -0.0244 C   0  0  0

+    1.2089    1.4594    0.0658 C   0  0  0

+    2.2444   -0.7906   -0.0533 N   0  3  0

+   -1.3253    0.3551    0.0266 C   0  0  0

+   -0.3824   -1.9602   -0.1020 C   0  0  0

+    0.0972    2.2789    0.1169 C   0  0  0

+    2.5903    2.0613    0.0876 C   0  0  0

+    2.7286   -1.1014   -1.1268 O   0  0  0

+    2.7400   -1.2023    0.9803 O   0  5  0

+   -1.1702    1.7266    0.0978 C   0  0  0

+   -2.6822   -0.2361    0.0047 N   0  3  0

+   -3.4086   -0.0578   -0.9565 O   0  0  0

+   -3.0722   -0.9008    0.9478 O   0  5  0

+   -1.4119   -1.8437    0.0000 H   0  0  0

+   -0.4989   -2.9897    0.0000 H   0  0  0

+    0.6471   -2.0767    0.0000 H   0  0  0

+    0.2131    3.3084    0.0000 H   0  0  0

+    3.0041    1.1115    0.0000 H   0  0  0

+    3.5401    2.4751    0.0000 H   0  0  0

+    2.1765    3.0111    0.0000 H   0  0  0

+   -2.0035    2.3422    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+  7 11  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-87-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.8679   -0.2736    0.0024 C   0  0  0

+   -0.0031   -1.3729    0.0013 C   0  0  0

+   -0.3407    1.0215    0.0020 C   0  0  0

+   -2.3252   -0.4790   -0.0021 C   0  0  0

+    1.3609   -1.1723   -0.0002 C   0  0  0

+    1.0261    1.2057    0.0005 C   0  0  0

+   -3.0720    0.4763   -0.0012 O   0  0  0

+    1.8751    0.1129   -0.0006 C   0  0  0

+    3.3674    0.3232   -0.0017 C   0  0  0

+   -0.3873   -2.3374    0.0000 H   0  0  0

+   -0.9765    1.8422    0.0000 H   0  0  0

+   -2.7138   -1.4417    0.0000 H   0  0  0

+    2.0041   -1.9873    0.0000 H   0  0  0

+    1.4190    2.1666    0.0000 H   0  0  0

+    3.5123   -0.7048    0.0000 H   0  0  0

+    4.3954    0.4681    0.0000 H   0  0  0

+    3.2225    1.3512    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  8  9  1  0

+  6  8  2  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  9 15  1  0

+  9 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+73-24-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+   -0.2089    0.5153   -0.0020 C   0  0  0

+   -0.6885   -0.8052   -0.0012 C   0  0  0

+    1.1822    0.7158   -0.0002 C   0  0  0

+   -1.2893    1.3325    0.0010 N   0  0  0

+    0.1828   -1.8091    0.0001 N   0  0  0

+   -2.0572   -0.7105   -0.0024 N   0  0  0

+    1.9756   -0.3501    0.0021 N   0  0  0

+    1.7133    1.9938   -0.0013 N   0  0  0

+   -2.3751    0.6150    0.0034 C   0  0  0

+    1.4777   -1.5734    0.0006 C   0  0  0

+   -2.7135   -1.4861    0.0000 H   0  0  0

+    2.7207    2.1252    0.0000 H   0  0  0

+    1.0957    2.8006    0.0000 H   0  0  0

+   -3.3202    0.9878    0.0000 H   0  0  0

+    2.1182   -2.3620    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6  9  1  0

+  7 10  1  0

+  6 11  1  0

+  8 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-48-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+   -0.8496   -0.0479    0.3075 C   0  0  0

+   -0.1502   -0.6565   -0.9146 C   0  0  0

+   -0.3633    1.3932    0.4756 C   0  0  0

+   -2.3403   -0.0526    0.0872 C   0  0  0

+    1.3404   -0.7978   -0.5987 C   0  0  0

+    1.1357    1.4423    0.4233 C   0  0  0

+   -2.9318    0.6946   -1.0803 C   0  0  0

+   -3.1221   -0.7061    0.9105 C   0  0  0

+    1.8765    0.4912   -0.0480 C   0  0  0

+    1.5272   -1.8399    0.3610 O   0  0  0

+    3.3702    0.6907   -0.0435 C   0  0  0

+   -1.2150   -1.0291    0.0000 H   0  0  0

+   -1.0492   -1.1933    0.0000 H   0  0  0

+    0.0802   -1.6779    0.0000 H   0  0  0

+   -0.2727    2.4363    0.0000 H   0  0  0

+   -1.3882    1.6074    0.0000 H   0  0  0

+    2.3813   -0.9111    0.0000 H   0  0  0

+    1.5799    2.3904    0.0000 H   0  0  0

+   -2.1109    1.3445    0.0000 H   0  0  0

+   -3.5817    1.5155    0.0000 H   0  0  0

+   -3.7527    0.0447    0.0000 H   0  0  0

+   -4.1053   -0.3461    0.0000 H   0  0  0

+   -2.9422   -1.7376    0.0000 H   0  0  0

+    1.7119   -2.8705    0.0000 H   0  0  0

+    3.5088   -0.3471    0.0000 H   0  0  0

+    4.4080    0.8293    0.0000 H   0  0  0

+    3.2316    1.7285    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  9 11  1  0

+  6  9  2  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+148-24-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.4499    0.9601   -0.0026 C   0  0  0

+   -0.0289   -0.3924   -0.0015 C   0  0  0

+    0.5093    1.9862   -0.0015 C   0  0  0

+   -1.8280    1.2456    0.0010 C   0  0  0

+    1.3524   -0.6798    0.0003 C   0  0  0

+   -0.9371   -1.3718   -0.0017 N   0  0  0

+    1.8342    1.6720    0.0007 C   0  0  0

+   -2.7033    0.1968    0.0054 C   0  0  0

+    2.2553    0.3447    0.0009 C   0  0  0

+    1.7818   -1.9686    0.0018 O   0  0  0

+   -2.2218   -1.1102   -0.0030 C   0  0  0

+    0.2104    2.9765    0.0000 H   0  0  0

+   -2.1686    2.2224    0.0000 H   0  0  0

+    2.5380    2.4302    0.0000 H   0  0  0

+   -3.7226    0.3731    0.0000 H   0  0  0

+    3.2676    0.1315    0.0000 H   0  0  0

+    2.1088   -2.9500    0.0000 H   0  0  0

+   -2.8956   -1.8951    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  7  9  1  0

+  8 11  2  0

+  3 12  1  0

+  4 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+286-99-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    2.0076    0.6304    0.6828 C   0  0  0

+    1.9388   -0.4632   -0.3642 C   0  0  0

+    3.1502    0.2045   -0.0575 O   0  0  0

+    1.4787    1.9563    0.2012 C   0  0  0

+    1.7677   -1.8400    0.1449 C   0  0  0

+    0.2040    1.7651   -0.6227 C   0  0  0

+    0.3938   -2.4200   -0.1964 C   0  0  0

+   -1.0180    1.9221    0.2845 C   0  0  0

+   -0.6234   -1.2836   -0.3180 C   0  0  0

+   -2.2708    1.4621   -0.4641 C   0  0  0

+   -1.9007   -1.6595    0.4358 C   0  0  0

+   -3.0919    0.5369    0.4363 C   0  0  0

+   -3.0826   -0.8790   -0.1434 C   0  0  0

+    1.0012    0.4697    0.0000 H   0  0  0

+    0.9240   -0.3683    0.0000 H   0  0  0

+    2.4516    2.2601    0.0000 H   0  0  0

+    1.2505    2.9496    0.0000 H   0  0  0

+    1.9952   -2.8335    0.0000 H   0  0  0

+    2.7856   -1.7883    0.0000 H   0  0  0

+   -0.3366    0.9011    0.0000 H   0  0  0

+    0.7628    0.9127    0.0000 H   0  0  0

+   -0.4358   -3.0121    0.0000 H   0  0  0

+    0.8910   -3.3096    0.0000 H   0  0  0

+   -0.5370    2.8206    0.0000 H   0  0  0

+   -1.6867    2.6913    0.0000 H   0  0  0

+    0.2279   -0.7232    0.0000 H   0  0  0

+   -1.0521   -0.3590    0.0000 H   0  0  0

+   -2.2633    2.4813    0.0000 H   0  0  0

+   -3.2223    1.8274    0.0000 H   0  0  0

+   -2.6440   -2.3568    0.0000 H   0  0  0

+   -1.3944   -2.5440    0.0000 H   0  0  0

+   -3.6380    1.3974    0.0000 H   0  0  0

+   -4.0697    0.2493    0.0000 H   0  0  0

+   -4.0834   -0.6864    0.0000 H   0  0  0

+   -3.4672   -1.8228    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

+  9  7  1  0

+ 10  8  1  0

+ 11  9  1  0

+ 12 10  1  0

+ 13 11  1  0

+  2  3  1  0

+ 12 13  1  0

+  1 14  1  0

+  2 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  6 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+ 12 32  1  0

+ 12 33  1  0

+ 13 34  1  0

+ 13 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+555-16-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.9675   -0.0275    0.0038 C   0  0  0

+   -0.3905   -1.2858    0.0034 C   0  0  0

+   -0.1734    1.1058    0.0025 C   0  0  0

+   -2.4415    0.1064   -0.0007 N   0  3  0

+    0.9818   -1.4188    0.0018 C   0  0  0

+    1.2007    0.9894    0.0009 C   0  0  0

+   -2.9525    1.2120   -0.0003 O   0  0  0

+   -3.1434   -0.8890   -0.0047 O   0  5  0

+    1.7913   -0.2782    0.0005 C   0  0  0

+    3.2569   -0.4113   -0.0017 C   0  0  0

+    3.9557    0.5796   -0.0028 O   0  0  0

+   -0.9925   -2.1313    0.0000 H   0  0  0

+   -0.6132    2.0459    0.0000 H   0  0  0

+    1.4130   -2.3628    0.0000 H   0  0  0

+    1.7950    1.8403    0.0000 H   0  0  0

+    3.6924   -1.3534    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  2  0

+  6  9  2  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102-06-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    2.0099    0.0147   -0.3849 C   0  0  0

+    0.6679   -0.3524   -0.5290 N   0  0  0

+    3.0163   -0.8665   -0.7575 C   0  0  0

+    2.3387    1.2639    0.1261 C   0  0  0

+    0.0142   -0.9900    0.5013 C   0  0  0

+    4.3406   -0.5008   -0.6138 C   0  0  0

+    3.6644    1.6233    0.2672 C   0  0  0

+   -1.2722   -1.4464    0.3224 N   0  0  0

+    0.6132   -1.1614    1.6460 N   0  0  0

+    4.6645    0.7411   -0.0996 C   0  0  0

+   -2.3120   -0.5378    0.0995 C   0  0  0

+   -3.3003   -0.8262   -0.8324 C   0  0  0

+   -2.3615    0.6524    0.8140 C   0  0  0

+   -4.3261    0.0730   -1.0498 C   0  0  0

+   -3.3896    1.5470    0.5919 C   0  0  0

+   -4.3695    1.2591   -0.3407 C   0  0  0

+    0.1709    0.5156    0.0000 H   0  0  0

+    2.7933   -1.8415    0.0000 H   0  0  0

+    1.6289    1.9685    0.0000 H   0  0  0

+    5.0529   -1.2030    0.0000 H   0  0  0

+    3.8915    2.5974    0.0000 H   0  0  0

+   -1.4597   -2.4289    0.0000 H   0  0  0

+    1.5748   -1.4366    0.0000 H   0  0  0

+    5.6211    1.0332    0.0000 H   0  0  0

+   -3.5165   -1.8027    0.0000 H   0  0  0

+   -1.4601    1.0858    0.0000 H   0  0  0

+   -5.2294   -0.3565    0.0000 H   0  0  0

+   -3.1761    2.5241    0.0000 H   0  0  0

+   -5.1811    1.8437    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  8 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+  7 10  1  0

+ 15 16  1  0

+  2 17  1  0

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+  4 19  1  0

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+  7 21  1  0

+  8 22  1  0

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+ 10 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-81-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.5215    0.0000   -0.3525 C   0  0  0

+   -0.6813   -0.7065    0.2760 C   0  0  0

+    0.5873    1.4424    0.1536 C   0  0  0

+    1.8054   -0.7359    0.0360 C   0  0  0

+   -1.9141    0.0000   -0.0970 N   0  0  0

+   -0.3985    0.5548    0.0000 H   0  0  0

+   -1.3680   -1.5326    0.0000 H   0  0  0

+    0.0142   -1.5253    0.0000 H   0  0  0

+    1.6605    1.3934    0.0000 H   0  0  0

+    0.6363    2.5156    0.0000 H   0  0  0

+   -0.4859    1.4914    0.0000 H   0  0  0

+    1.2712   -1.6679    0.0000 H   0  0  0

+    2.7374   -1.2701    0.0000 H   0  0  0

+    2.3396    0.1961    0.0000 H   0  0  0

+   -1.9175    1.0743    0.0000 H   0  0  0

+   -2.8427   -0.5401    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101901-07-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

+    2.3038    0.3162   -0.3367 C   0  0  0

+    0.8058    0.4474   -0.2066 C   0  0  0

+    2.8856    1.6219   -0.3048 O   0  0  0

+    2.8485   -0.5163    0.8257 C   0  0  0

+    2.6456   -0.3652   -1.6633 C   0  0  0

+    0.2206    1.5597    0.2991 C   0  0  0

+   -0.1560   -0.4619   -0.5498 N   0  0  0

+    2.4853    2.2673    0.9033 C   0  0  0

+    2.1745   -1.8641    0.8374 C   0  0  0

+    3.9203    0.2534   -2.2407 C   0  0  0

+   -1.2061    1.3468    0.2712 C   0  0  0

+    1.0279    2.7401    0.7798 C   0  0  0

+   -1.3936    0.0492   -0.2751 C   0  0  0

+    2.3837   -2.7103    1.8581 O   0  0  0

+    1.4457   -2.1831   -0.0721 O   0  0  0

+   -2.2953    2.1358    0.6561 C   0  0  0

+   -2.6739   -0.4737   -0.4398 C   0  0  0

+   -3.5461    1.5995    0.4824 C   0  0  0

+   -3.7369    0.3293   -0.0483 C   0  0  0

+   -2.8955   -1.8480   -1.0170 C   0  0  0

+   -5.0044   -0.1409   -0.1911 O   0  0  0

+   -2.7816   -2.8926    0.0950 C   0  0  0

+    3.6560   -1.1170    0.0000 H   0  0  0

+    3.5813    0.1736    0.0000 H   0  0  0

+    1.7440   -0.8125    0.0000 H   0  0  0

+    3.0890   -1.2688    0.0000 H   0  0  0

+    0.0270   -1.4516    0.0000 H   0  0  0

+    3.4565    2.5314    0.0000 H   0  0  0

+    2.5095    3.2735    0.0000 H   0  0  0

+    4.3597   -0.6521    0.0000 H   0  0  0

+    4.8258    0.6928    0.0000 H   0  0  0

+    3.4809    1.1589    0.0000 H   0  0  0

+    1.4282    3.6635    0.0000 H   0  0  0

+    0.1468    3.2266    0.0000 H   0  0  0

+    2.6253   -3.6874    0.0000 H   0  0  0

+   -2.1839    3.1361    0.0000 H   0  0  0

+   -4.3428    2.2145    0.0000 H   0  0  0

+   -3.7296   -1.2847    0.0000 H   0  0  0

+   -3.7574   -2.3678    0.0000 H   0  0  0

+   -5.9480   -0.4910    0.0000 H   0  0  0

+   -3.7821   -3.0017    0.0000 H   0  0  0

+   -2.6725   -3.8931    0.0000 H   0  0  0

+   -1.7811   -2.7835    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

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+  9 14  1  0

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+ 11 16  1  0

+ 13 17  1  0

+ 16 18  2  0

+ 17 19  2  0

+ 17 20  1  0

+ 19 21  1  0

+ 20 22  1  0

+  8 12  1  0

+ 11 13  2  0

+ 18 19  1  0

+  4 23  1  0

+  4 24  1  0

+  5 25  1  0

+  5 26  1  0

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+  8 28  1  0

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+ 10 30  1  0

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+ 12 33  1  0

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+ 14 35  1  0

+ 16 36  1  0

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+ 20 38  1  0

+ 20 39  1  0

+ 21 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+ 22 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+623-15-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.0861    0.2666   -0.0013 C   0  0  0

+   -0.2889    0.5888   -0.0002 C   0  0  0

+    2.1341    1.1676   -0.0004 C   0  0  0

+    1.6121   -0.9766    0.0023 O   0  0  0

+   -1.2215   -0.4047   -0.0013 C   0  0  0

+    3.3123    0.4084   -0.0013 C   0  0  0

+    2.9493   -0.8947    0.0005 C   0  0  0

+   -2.5867   -0.0847   -0.0002 C   0  0  0

+   -3.6181   -1.1835   -0.0014 C   0  0  0

+   -2.9383    1.0788    0.0019 O   0  0  0

+   -0.5866    1.5741    0.0000 H   0  0  0

+    2.0633    2.1944    0.0000 H   0  0  0

+   -0.9238   -1.3900    0.0000 H   0  0  0

+    4.2744    0.7742    0.0000 H   0  0  0

+    3.5966   -1.6949    0.0000 H   0  0  0

+   -4.3686   -0.4791    0.0000 H   0  0  0

+   -4.3225   -1.9340    0.0000 H   0  0  0

+   -2.8676   -1.8879    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  4  7  1  0

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+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+303-45-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 71                          1 V2000

+    3.4798    0.5659   -0.6450 C   0  0  0

+    2.9342   -0.4351    0.1934 C   0  0  0

+    4.8691    0.7860   -0.6493 C   0  0  0

+    2.6244    1.3312   -1.4587 C   0  0  0

+    3.8349   -1.2214    1.0408 C   0  0  0

+    1.5514   -0.6575    0.2012 C   0  0  0

+    5.6969    0.0489    0.1426 C   0  0  0

+    5.4499    1.8517   -1.5426 C   0  0  0

+    1.2839    1.1087   -1.4378 C   0  0  0

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+    0.7319    0.1123   -0.6189 C   0  0  0

+    1.0153   -1.6149    1.0018 O   0  0  0

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+    6.1778    2.8918   -0.6888 C   0  0  0

+    6.4376    1.2138   -2.5216 C   0  0  0

+    0.3793    1.9363   -2.3142 C   0  0  0

+    6.0632   -1.6635    1.7616 O   0  0  0

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+   -0.7316   -0.1140   -0.6189 C   0  0  0

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+   -1.2872   -1.0869   -1.4632 C   0  0  0

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+   -6.9272   -1.9220    0.0000 H   0  0  0

+  1  2  2  0

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+ 37 64  1  0

+ 37 65  1  0

+ 38 66  1  0

+ 38 67  1  0

+ 38 68  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+41340-36-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.1554   -0.3949   -0.3284 C   0  0  0

+   -0.9939    0.4136   -0.2631 C   0  0  0

+    1.2870    0.5221   -0.4845 C   0  0  0

+    0.0366   -1.7832   -0.2377 C   0  0  0

+   -2.2407   -0.1852   -0.1128 C   0  0  0

+   -0.5774    1.7213   -0.3726 N   0  0  0

+    0.7839    1.7665   -0.5037 C   0  0  0

+    2.7403    0.1409   -0.6011 C   0  0  0

+   -1.1972   -2.3499   -0.0857 C   0  0  0

+   -2.3354   -1.5569   -0.0299 C   0  0  0

+   -3.4835    0.6642   -0.0403 C   0  0  0

+    3.3673    0.0892    0.7936 C   0  0  0

+   -3.7679    1.0284    1.4182 C   0  0  0

+    4.7454   -0.2723    0.6831 O   0  0  0

+    0.8852   -2.3798    0.0000 H   0  0  0

+   -1.2034    2.5485    0.0000 H   0  0  0

+    1.3495    2.6361    0.0000 H   0  0  0

+    2.0547   -0.6376    0.0000 H   0  0  0

+    3.1282   -0.8212    0.0000 H   0  0  0

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+   -3.6679   -0.3566    0.0000 H   0  0  0

+    4.0529    0.8677    0.0000 H   0  0  0

+    2.9794    1.0513    0.0000 H   0  0  0

+   -2.9503    1.6669    0.0000 H   0  0  0

+   -4.4064    1.8460    0.0000 H   0  0  0

+   -4.5855    0.3899    0.0000 H   0  0  0

+    5.7488   -0.5355    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1506-02-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 46                          1 V2000

+    2.2471   -2.2732    0.9834 C   0  0  0

+    2.0641   -1.1221   -0.0077 C   0  0  0

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+    0.2543    0.6465   -0.0242 C   0  0  0

+   -0.3530   -1.6728    0.0409 C   0  0  0

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+    2.6316    1.2474   -0.4805 C   0  0  0

+   -1.0882    0.9900   -0.0207 C   0  0  0

+    1.2614    1.7668   -0.0505 C   0  0  0

+   -1.6890   -1.3455    0.0475 C   0  0  0

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+ 18 43  1  0

+ 18 44  1  0

+ 18 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81-61-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -1.2862    0.7466    0.0575 C   0  0  0

+   -1.5853   -0.6314    0.0409 C   0  0  0

+    0.1094    1.1891    0.2367 C   0  0  0

+   -2.3126    1.6788   -0.1014 C   0  0  0

+   -0.5000   -1.6167    0.2030 C   0  0  0

+   -2.9058   -1.0500   -0.1293 C   0  0  0

+    1.2006    0.2065    0.0908 C   0  0  0

+    0.3578    2.3500    0.5012 O   0  0  0

+   -3.6246    1.2414   -0.2755 C   0  0  0

+   -2.0342    3.0061   -0.0871 O   0  0  0

+    0.9020   -1.1721    0.0748 C   0  0  0

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+   -3.9181   -0.1040   -0.2819 C   0  0  0

+   -3.2030   -2.3732   -0.1466 O   0  0  0

+    2.5235    0.6284   -0.0318 C   0  0  0

+    1.9284   -2.1009   -0.0627 C   0  0  0

+    3.5418   -0.3216   -0.1700 C   0  0  0

+    2.8219    1.9516   -0.0176 O   0  0  0

+    3.2388   -1.6729   -0.1831 C   0  0  0

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+    4.0074   -2.3717    0.0000 H   0  0  0

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+  1  2  2  0

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+ 16 25  1  0

+ 18 26  1  0

+ 19 27  1  0

+ 20 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42978-43-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 45                          1 V2000

+   -1.2028    0.1277    0.0965 C   0  0  0

+   -2.4402   -0.5343    0.0079 C   0  0  0

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+ 20 37  1  0

+ 22 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+ 24 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117-79-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.0110    0.5200    0.0789 C   0  0  0

+   -0.8753   -0.8828    0.0586 C   0  0  0

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+    0.5849   -2.6753    0.4109 O   0  0  0

+   -3.2540   -1.1076   -0.1840 C   0  0  0

+    2.6531    1.5680   -0.1344 C   0  0  0

+   -4.6530    0.8475   -0.2908 N   0  0  0

+    2.9179   -1.2056   -0.1735 C   0  0  0

+    3.8954    0.9843   -0.3134 C   0  0  0

+    4.0271   -0.3922   -0.3310 C   0  0  0

+   -2.3736    2.1266    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68603-42-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 53 52                          1 V2000

+    4.5489    0.0903   -0.1013 N   0  0  0

+    3.3253   -0.1622    0.4042 C   0  0  0

+    5.1240   -0.8041   -1.1090 C   0  0  0

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+   -1.6526   -0.2078    0.4016 C   0  0  0

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+   -8.5721   -1.0582    0.0000 H   0  0  0

+  -10.1201    1.0394    0.0000 H   0  0  0

+  -11.3350    0.3795    0.0000 H   0  0  0

+  -10.6751   -0.8354    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 49  1  0

+ 19 50  1  0

+ 20 51  1  0

+ 20 52  1  0

+ 20 53  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61499-28-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    0.0716   -0.6474   -0.6809 N   0  0  0

+   -1.1769   -0.0191   -1.1201 C   0  0  0

+    1.3583   -0.0308   -1.0131 C   0  0  0

+    0.0377   -1.7407    0.0029 N   0  0  0

+   -1.8396    0.6829    0.0669 C   0  0  0

+    1.7520    0.9297    0.0794 C   0  0  0

+    1.0756   -2.2630    0.3680 O   0  0  0

+   -3.0450    1.4871   -0.4244 C   0  0  0

+   -2.2732   -0.2933    1.0161 O   0  0  0

+    3.0441    1.6985   -0.0228 C   0  0  0

+    1.0321    1.0833    1.0367 O   0  0  0

+   -1.9718   -0.3084    0.0000 H   0  0  0

+   -1.2265   -0.8635    0.0000 H   0  0  0

+    1.5000   -0.8648    0.0000 H   0  0  0

+    2.1991   -0.1240    0.0000 H   0  0  0

+   -1.2938    1.3292    0.0000 H   0  0  0

+   -2.5755    2.1908    0.0000 H   0  0  0

+   -3.7487    1.9566    0.0000 H   0  0  0

+   -3.5145    0.7834    0.0000 H   0  0  0

+   -2.6166   -1.0664    0.0000 H   0  0  0

+    3.4766    0.9715    0.0000 H   0  0  0

+    3.7711    2.1310    0.0000 H   0  0  0

+    2.6116    2.4255    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+130933-91-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 42                          1 V2000

+   -1.3908   -0.1370   -0.2960 C   0  0  0

+   -2.0708   -1.4549   -0.5275 C   0  0  2

+    0.0213   -0.0994   -0.1986 C   0  0  0

+   -2.1010    1.0144   -0.1844 C   0  0  0

+   -3.5281   -1.5336   -0.1153 C   0  0  1

+   -2.4827   -2.0907    0.6841 O   0  0  0

+    0.6743    1.1957    0.0176 C   0  0  0

+    0.7530   -1.2955   -0.3114 C   0  0  0

+   -3.6064    0.9700   -0.2754 C   0  0  2

+   -1.4705    2.2435    0.0169 C   0  0  0

+   -4.1197   -0.2633    0.4726 C   0  0  2

+    2.0827    1.2632    0.1202 C   0  0  0

+   -0.1189    2.3473    0.1191 C   0  0  0

+    2.1338   -1.2462   -0.2143 C   0  0  0

+   -3.9987    0.9010   -1.6478 O   0  0  0

+   -3.7698   -0.1704    1.8550 O   0  0  0

+    2.7579    0.0576    0.0030 C   0  0  0

+    3.1008    2.2876    0.3258 C   0  0  0

+    3.0646   -2.3022   -0.2948 C   0  0  0

+    4.2055    0.2952    0.1311 C   0  0  0

+    4.3423    1.7178    0.3316 C   0  0  0

+    4.4030   -2.0638   -0.1743 C   0  0  0

+    5.0200   -0.8260    0.0338 C   0  0  0

+   -1.1677   -1.9787    0.0000 H   0  0  0

+   -4.2859   -2.2517    0.0000 H   0  0  0

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+   -5.1635   -0.2849    0.0000 H   0  0  0

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+   -5.0270    0.7201    0.0000 H   0  0  0

+   -2.7607    0.0975    0.0000 H   0  0  0

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+ 19 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63358-49-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 62                          1 V2000

+   -0.2859   -1.4758   -0.4595 C   0  0  2

+   -1.5369   -1.8786    0.3252 C   0  0  2

+    0.3804   -0.2810    0.0649 N   0  0  0

+   -1.2234   -1.1937   -1.6150 C   0  0  0

+   -2.3259   -1.3949   -0.8284 N   0  0  0

+   -1.8977   -0.6526    1.6407 S   0  0  0

+    1.4773   -0.4166    1.0264 C   0  0  2

+   -0.0159    0.9428   -0.3372 C   0  0  0

+   -1.0611   -0.9029   -2.7812 O   0  0  0

+   -3.1808   -0.2392   -0.5956 C   0  0  2

+   -3.4046    0.0980    0.8925 C   0  0  0

+    2.6652   -1.0483    0.3474 C   0  0  0

+    1.0342   -1.2860    2.1748 C   0  0  0

+    0.7322    2.1667    0.1248 C   0  0  1

+   -0.9746    1.0591   -1.0710 O   0  0  0

+   -4.5123   -0.4558   -1.2673 C   0  0  0

+   -4.6759   -0.5663    1.4249 C   0  0  0

+   -3.4394    1.6108    1.1186 C   0  0  0

+    3.8949   -0.4175    0.3804 C   0  0  0

+    2.5246   -2.2607   -0.3027 C   0  0  0

+    1.7430   -1.3015    3.3209 N   0  0  0

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+   -5.1716    0.5843   -1.8014 O   0  0  0

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+    4.9856   -0.9948   -0.2409 C   0  0  0

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+   -5.6641    1.3612    0.0000 H   0  0  0

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+   -0.9658    2.6059    0.0000 H   0  0  0

+    0.2902    2.2673    0.0000 H   0  0  0

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+  1  2  1  0

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+ 30 56  1  0

+ 30 57  1  0

+ 30 58  1  0

+ 32 59  1  0

+ 34 60  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+52315-07-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 49                          1 V2000

+   -2.4842   -0.9965    0.4934 C   0  0  2

+   -3.4000    0.0703   -0.1099 C   0  0  2

+   -2.4961    0.4189    1.0743 C   0  0  0

+   -1.2701   -1.1698   -0.3823 C   0  0  0

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+   -1.2804    1.3059    0.7985 C   0  0  0

+   -0.1178   -1.6099    0.1472 O   0  0  0

+   -1.3338   -0.9127   -1.5612 O   0  0  0

+   -5.7833    0.6125   -0.0747 C   0  0  0

+    1.0520   -1.7769   -0.6966 C   0  0  1

+   -7.4068    0.3675    0.4891 Cl  0  0  0

+   -5.4471    1.8555   -1.2391 Cl  0  0  0

+    2.2975   -1.5487    0.1206 C   0  0  0

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+    2.2996   -1.8394    1.4726 C   0  0  0

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+    4.4538    2.9915    0.4544 C   0  0  0

+    5.3872    3.7733   -0.2006 C   0  0  0

+   -2.9275   -1.8049    0.0000 H   0  0  0

+   -3.6361    0.9615    0.0000 H   0  0  0

+   -5.0418   -1.0346    0.0000 H   0  0  0

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+ 22 42  1  0

+ 24 43  1  0

+ 25 44  1  0

+ 26 45  1  0

+ 27 46  1  0

+ 28 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1904-98-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.5192    0.9350   -0.0024 C   0  0  0

+   -0.7657   -0.4479   -0.0017 C   0  0  0

+    0.7372    1.3690   -0.0014 N   0  0  0

+   -1.7509    1.5392    0.0014 N   0  0  0

+    0.3358   -1.3210    0.0000 C   0  0  0

+   -2.1113   -0.6139   -0.0030 N   0  0  0

+    1.7454    0.5121    0.0002 C   0  0  0

+   -2.6913    0.5505    0.0041 C   0  0  0

+    1.5583   -0.8015    0.0009 N   0  0  0

+    0.1506   -2.6922    0.0011 N   0  0  0

+    3.0406    1.0032    0.0008 N   0  0  0

+   -1.9307    2.5433    0.0000 H   0  0  0

+   -3.7001    0.7021    0.0000 H   0  0  0

+   -0.7932   -3.0794    0.0000 H   0  0  0

+    0.9578   -3.3159    0.0000 H   0  0  0

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+    3.2043    2.0101    0.0000 H   0  0  0

+  1  2  1  0

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+  4 12  1  0

+  8 13  1  0

+ 10 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16051-77-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -0.4397   -0.3650   -0.8556 C   0  0  0

+   -1.6816    0.5686   -0.8892 C   0  0  0

+    0.6242    0.5260   -0.1619 C   0  0  0

+   -0.7938   -1.4160    0.0670 O   0  0  0

+   -2.8426   -0.3356   -0.4243 C   0  0  0

+   -1.4771    1.5934    0.0869 O   0  0  0

+   -0.2578    1.3526    0.8062 C   0  0  0

+    1.5165   -0.2971    0.5920 O   0  0  0

+   -2.1817   -1.7124   -0.1949 C   0  0  0

+   -3.3626    0.1552    0.8130 O   0  0  0

+    2.8134   -0.0848    0.0646 N   0  3  0

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+    3.7675   -0.6759    0.5376 O   0  5  0

+    0.3211   -0.8847    0.0000 H   0  0  0

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+   -0.3887    2.2645    0.0000 H   0  0  0

+   -3.0412   -2.0443    0.0000 H   0  0  0

+   -1.9187   -2.5954    0.0000 H   0  0  0

+   -4.0326    0.7876    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  8 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  5  9  1  0

+  6  7  1  0

+  1 14  1  0

+  2 15  1  0

+  3 16  1  0

+  5 17  1  0

+  7 18  1  0

+  7 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2835-39-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    1.3742    0.0685   -0.8489 C   0  0  0

+    0.1560    0.6846   -0.2106 C   0  0  0

+    2.4331   -0.1962    0.2233 C   0  0  0

+   -1.0180    0.0344   -0.2391 O   0  0  0

+    0.2360    1.7637    0.3269 O   0  0  0

+    2.0649   -1.4604    1.0025 C   0  0  0

+    3.7971   -0.3869   -0.4431 C   0  0  0

+   -2.1917    0.6280    0.3759 C   0  0  0

+   -3.3696   -0.2967    0.2063 C   0  0  0

+   -3.2223   -1.4366   -0.4223 C   0  0  0

+    0.5901   -0.5318    0.0000 H   0  0  0

+    1.5745   -0.8985    0.0000 H   0  0  0

+    2.6215    0.7732    0.0000 H   0  0  0

+    1.1168   -1.1842    0.0000 H   0  0  0

+    1.7887   -2.4086    0.0000 H   0  0  0

+    3.0130   -1.7365    0.0000 H   0  0  0

+    3.6604   -1.3649    0.0000 H   0  0  0

+    4.7751   -0.5236    0.0000 H   0  0  0

+    3.9338    0.5911    0.0000 H   0  0  0

+   -1.6228    1.4352    0.0000 H   0  0  0

+   -2.9078    1.3080    0.0000 H   0  0  0

+   -4.2836    0.0773    0.0000 H   0  0  0

+   -4.0072   -2.0359    0.0000 H   0  0  0

+   -2.3108   -1.8167    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  8  9  1  0

+  9 10  2  0

+  1 11  1  0

+  1 12  1  0

+  3 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1551-44-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    1.0649    0.1977   -0.1307 C   0  0  0

+   -0.2269    0.6133    0.3857 O   0  0  0

+    2.0433    1.3721   -0.0621 C   0  0  0

+    1.6011   -0.9625    0.7103 C   0  0  0

+   -1.3506    0.0487   -0.0839 C   0  0  0

+    3.4045    0.9342   -0.6063 C   0  0  0

+    2.9624   -1.4004    0.1661 C   0  0  0

+   -2.6914    0.4800    0.4521 C   0  0  0

+   -1.2870   -0.8053   -0.9363 O   0  0  0

+    3.9407   -0.2260    0.2347 C   0  0  0

+   -3.7984   -0.3130   -0.2454 C   0  0  0

+   -5.1597    0.1249    0.2987 C   0  0  0

+    0.3764   -0.5802    0.0000 H   0  0  0

+    2.4849    2.3124    0.0000 H   0  0  0

+    1.1669    1.9299    0.0000 H   0  0  0

+    0.5800   -1.1535    0.0000 H   0  0  0

+    1.5355   -1.9992    0.0000 H   0  0  0

+    4.4256    1.1252    0.0000 H   0  0  0

+    3.4701    1.9709    0.0000 H   0  0  0

+    2.5209   -2.3407    0.0000 H   0  0  0

+    3.8388   -1.9582    0.0000 H   0  0  0

+   -2.1717    1.3795    0.0000 H   0  0  0

+   -3.4610    1.1778    0.0000 H   0  0  0

+    4.6323   -1.0012    0.0000 H   0  0  0

+    4.8092    0.3439    0.0000 H   0  0  0

+   -4.3181   -1.2125    0.0000 H   0  0  0

+   -3.0288   -1.0108    0.0000 H   0  0  0

+   -4.8416    1.1138    0.0000 H   0  0  0

+   -6.1486    0.4430    0.0000 H   0  0  0

+   -5.4778   -0.8640    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  8 11  1  0

+ 11 12  1  0

+  7 10  1  0

+  1 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95741-57-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -1.7695    0.3551   -0.0015 C   0  0  0

+   -1.1077   -0.8773   -0.0007 C   0  0  0

+   -0.8763    1.4317   -0.0012 C   0  0  0

+   -3.1603    0.4946    0.0030 C   0  0  0

+    0.3380   -0.5731    0.0000 C   0  0  0

+   -1.8988   -2.0131   -0.0012 C   0  0  0

+    0.4802    0.8466    0.0001 C   0  0  0

+   -1.4262    2.7020   -0.0022 C   0  0  0

+   -3.9283   -0.6824    0.0087 C   0  0  0

+   -3.6793    1.8006    0.0009 C   0  0  0

+    1.4566   -1.3809    0.0010 C   0  0  0

+   -3.2878   -1.8909   -0.0026 C   0  0  0

+    1.7367    1.4168    0.0005 C   0  0  0

+   -2.8118    2.8580   -0.0030 C   0  0  0

+    2.7378   -0.8094    0.0006 C   0  0  0

+   -4.1207   -3.1468   -0.0036 C   0  0  0

+    2.8792    0.6026    0.0008 C   0  0  0

+    3.8899   -1.6161    0.0002 C   0  0  0

+    4.1682    1.1652    0.0002 C   0  0  0

+    5.1206   -1.0350   -0.0009 C   0  0  0

+    5.2594    0.3518    0.0008 C   0  0  0

+   -1.4545   -2.9635    0.0000 H   0  0  0

+   -0.8020    3.5453    0.0000 H   0  0  0

+   -4.9764   -0.6348    0.0000 H   0  0  0

+   -4.7160    1.9619    0.0000 H   0  0  0

+    1.3488   -2.4245    0.0000 H   0  0  0

+    1.8379    2.4611    0.0000 H   0  0  0

+   -3.2066    3.8300    0.0000 H   0  0  0

+   -4.9950   -2.5669    0.0000 H   0  0  0

+   -4.7006   -4.0211    0.0000 H   0  0  0

+   -3.2464   -3.7267    0.0000 H   0  0  0

+    3.8010   -2.6615    0.0000 H   0  0  0

+    4.2881    2.2075    0.0000 H   0  0  0

+    5.9777   -1.6401    0.0000 H   0  0  0

+    6.2194    0.7750    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

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+  7 13  1  0

+  8 14  1  0

+ 11 15  2  0

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+ 13 17  2  0

+ 15 18  1  0

+ 17 19  1  0

+ 18 20  2  0

+ 19 21  2  0

+  5  7  2  0

+  9 12  2  0

+ 10 14  2  0

+ 15 17  1  0

+ 20 21  1  0

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+  8 23  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23452-05-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+    1.0877   -0.3951    0.0279 C   0  0  0

+   -0.3854   -0.3043    0.0313 C   0  0  0

+    1.8353    0.7757    0.2376 C   0  0  0

+    1.7363   -1.6090   -0.1833 C   0  0  0

+   -0.9616    0.9884   -0.0105 C   0  0  0

+   -1.2016   -1.4217    0.0736 C   0  0  0

+    1.2009    1.9579    0.4475 O   0  0  0

+    3.2186    0.7127    0.2317 C   0  0  0

+    3.1136   -1.6584   -0.1846 C   0  0  0

+    0.9347   -2.8647   -0.4103 C   0  0  0

+   -0.0483    2.1385   -0.0508 C   0  0  0

+   -2.3512    1.1332   -0.0117 C   0  0  0

+   -2.5815   -1.2639    0.0733 C   0  0  0

+    3.8554   -0.5007    0.0235 C   0  0  0

+   -0.3974    3.2086   -0.5124 O   0  0  0

+   -3.1513    0.0035    0.0306 C   0  0  0

+   -2.9113    2.3681   -0.0545 O   0  0  0

+   -3.3825   -2.3590    0.1149 O   0  0  0

+    5.2125   -0.5586    0.0184 O   0  0  0

+   -4.7306   -1.8853    0.1033 C   0  0  0

+   -0.7849   -2.3724    0.0000 H   0  0  0

+    3.7757    1.5886    0.0000 H   0  0  0

+    3.5953   -2.5779    0.0000 H   0  0  0

+    0.0597   -2.3062    0.0000 H   0  0  0

+    0.3762   -3.7397    0.0000 H   0  0  0

+    1.8097   -3.4232    0.0000 H   0  0  0

+   -4.1845    0.1039    0.0000 H   0  0  0

+   -3.3401    3.3134    0.0000 H   0  0  0

+    6.2496   -0.6028    0.0000 H   0  0  0

+   -4.3865   -0.9060    0.0000 H   0  0  0

+   -5.7099   -1.5412    0.0000 H   0  0  0

+   -5.0747   -2.8646    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

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+  5 11  1  0

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+  6 13  2  0

+  8 14  1  0

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+ 12 17  1  0

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+ 18 20  1  0

+  7 11  1  0

+  9 14  2  0

+ 13 16  1  0

+  6 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

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+ 16 27  1  0

+ 17 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+ 20 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+29852-26-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.1962    0.5939   -0.1121 C   0  0  0

+   -1.5315    1.0319   -0.0630 C   0  0  0

+    0.8493    1.5140    0.0833 C   0  0  0

+    0.0956   -0.8187   -0.3605 C   0  0  0

+   -2.5871    0.1131   -0.2580 C   0  0  0

+   -1.8067    2.3965    0.1832 C   0  0  0

+    2.2256    1.0252    0.0258 C   0  0  0

+    0.5504    2.8675    0.3273 C   0  0  0

+   -1.0202   -1.7457   -0.5529 C   0  0  0

+    1.4106   -1.2501   -0.4093 C   0  0  0

+   -2.2929   -1.2952   -0.5109 C   0  0  0

+   -3.9028    0.5767   -0.2037 C   0  0  0

+   -0.7355    3.2976    0.3748 C   0  0  0

+   -3.1403    2.8212    0.2299 C   0  0  0

+    2.4713   -0.3487   -0.2226 C   0  0  0

+    3.3053    1.8971    0.2126 C   0  0  0

+   -0.7482   -3.2054   -0.8108 C   0  0  0

+   -4.1610    1.9144    0.0375 C   0  0  0

+    3.8036   -0.8048   -0.2756 C   0  0  0

+    4.5808    1.4201    0.1544 C   0  0  0

+   -0.6768   -4.0898    0.7588 Cl  0  0  0

+    4.8276    0.0712   -0.0893 C   0  0  0

+    1.3267    3.5660    0.0000 H   0  0  0

+    1.6116   -2.2749    0.0000 H   0  0  0

+   -3.0792   -1.9824    0.0000 H   0  0  0

+   -4.6938   -0.1051    0.0000 H   0  0  0

+   -0.9310    4.3234    0.0000 H   0  0  0

+   -3.3570    3.8428    0.0000 H   0  0  0

+    3.1382    2.9279    0.0000 H   0  0  0

+    0.2102   -3.6202    0.0000 H   0  0  0

+    0.0682   -2.5542    0.0000 H   0  0  0

+   -5.1500    2.2497    0.0000 H   0  0  0

+    3.9997   -1.8305    0.0000 H   0  0  0

+    5.3816    2.0904    0.0000 H   0  0  0

+    5.8117   -0.2781    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

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+  8 13  2  0

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+ 10 15  1  0

+ 14 18  2  0

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+  8 23  1  0

+ 10 24  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+20927-95-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -0.2412   -0.0266   -0.0027 C   0  0  0

+   -1.6426   -0.4881   -0.0017 C   0  0  0

+   -0.3031    1.3741   -0.0003 C   0  0  0

+    0.9895   -0.6736   -0.0003 C   0  0  0

+   -2.4252    0.6748    0.0012 C   0  0  0

+   -2.2481   -1.7402   -0.0034 C   0  0  0

+   -1.6020    1.7463    0.0020 O   0  0  0

+    0.8790    2.1044   -0.0002 C   0  0  0

+    2.1525    0.0683   -0.0023 C   0  0  0

+   -3.8103    0.5595    0.0032 C   0  0  0

+   -3.6239   -1.8348   -0.0022 C   0  0  0

+    2.0946    1.4525   -0.0024 C   0  0  0

+    3.4650   -0.6160    0.0007 N   0  3  0

+   -4.4003   -0.6868    0.0023 C   0  0  0

+    4.4927    0.0378   -0.0010 O   0  0  0

+    3.5174   -1.8329    0.0049 O   0  5  0

+    1.0330   -1.7119    0.0000 H   0  0  0

+   -1.6660   -2.6011    0.0000 H   0  0  0

+    0.8472    3.1432    0.0000 H   0  0  0

+   -4.4021    1.4138    0.0000 H   0  0  0

+   -4.0794   -2.7689    0.0000 H   0  0  0

+    2.9750    2.0047    0.0000 H   0  0  0

+   -5.4365   -0.7660    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  2  0

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+ 13 16  1  0

+  5  7  1  0

+  9 12  2  0

+ 11 14  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3764-01-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -2.7132    1.5163    0.0006 Cl  0  0  0

+   -1.1913    0.6811   -0.0018 C   0  0  0

+   -0.0002    1.3911    0.0005 C   0  0  0

+   -1.1523   -0.6433   -0.0002 N   0  0  0

+    1.1914    0.6810   -0.0010 C   0  0  0

+   -0.0001   -1.2853   -0.0014 C   0  0  0

+    2.7133    1.5162    0.0012 Cl  0  0  0

+    1.1524   -0.6432   -0.0045 N   0  0  0

+   -0.0001   -3.0213    0.0013 Cl  0  0  0

+   -0.0003    2.4311    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  4  2  0

+  7  5  1  0

+  8  5  2  0

+  9  6  1  0

+  6  8  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-56-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -0.3127   -0.0570   -0.0021 C   0  0  0

+   -1.7489   -0.3757   -0.0014 C   0  0  0

+    0.0957    1.3483   -0.0004 C   0  0  0

+    0.6376   -1.0652    0.0015 C   0  0  0

+   -2.6829    0.6813    0.0009 C   0  0  0

+   -2.1639   -1.6381   -0.0025 N   0  0  0

+    1.4455    1.6830   -0.0006 C   0  0  0

+   -0.9290    2.3912    0.0019 C   0  0  0

+    1.9958   -0.7345    0.0007 C   0  0  0

+   -2.2369    2.0695    0.0021 C   0  0  0

+   -4.0527    0.3716    0.0017 C   0  0  0

+   -3.4429   -1.9428   -0.0015 C   0  0  0

+    2.4082    0.6711   -0.0022 C   0  0  0

+    2.9898   -1.7335    0.0042 C   0  0  0

+   -4.4213   -0.9578    0.0000 C   0  0  0

+    3.7853    0.9734   -0.0019 C   0  0  0

+    4.3004   -1.3748    0.0032 C   0  0  0

+    4.6933   -0.0373   -0.0031 C   0  0  0

+    0.3400   -2.0696    0.0000 H   0  0  0

+    1.7386    2.6887    0.0000 H   0  0  0

+   -0.6430    3.3989    0.0000 H   0  0  0

+   -2.9514    2.8356    0.0000 H   0  0  0

+   -4.7754    1.1299    0.0000 H   0  0  0

+   -3.7298   -2.9503    0.0000 H   0  0  0

+    2.7201   -2.7457    0.0000 H   0  0  0

+   -5.4347   -1.2228    0.0000 H   0  0  0

+    4.1062    1.9705    0.0000 H   0  0  0

+    5.0342   -2.1224    0.0000 H   0  0  0

+    5.7149    0.1945    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  2  0

+  9 14  1  0

+ 11 15  1  0

+ 13 16  1  0

+ 14 17  2  0

+ 16 18  2  0

+  8 10  2  0

+  9 13  1  0

+ 12 15  2  0

+ 17 18  1  0

+  4 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+119-75-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.2526    0.5714    1.2417 N   0  0  0

+   -0.9763    0.6996    0.5896 C   0  0  0

+    1.4327    0.4902    0.4983 C   0  0  0

+   -1.5715   -0.4092    0.0016 C   0  0  0

+   -1.6087    1.9356    0.5327 C   0  0  0

+    2.6385    0.2216    1.1335 C   0  0  0

+    1.4021    0.6723   -0.8789 C   0  0  0

+   -0.9047   -1.7292    0.0655 N   0  3  0

+   -2.7865   -0.2788   -0.6422 C   0  0  0

+   -2.8232    2.0588   -0.1126 C   0  0  0

+    3.8032    0.1416    0.3954 C   0  0  0

+    2.5702    0.5909   -1.6105 C   0  0  0

+   -0.8619   -2.4384   -0.9239 O   0  0  0

+   -0.3988   -2.1062    1.1073 O   0  5  0

+   -3.4103    0.9538   -0.7019 C   0  0  0

+    3.7699    0.3285   -0.9741 C   0  0  0

+    0.1736   -0.3417    0.0000 H   0  0  0

+   -1.0916    2.6923    0.0000 H   0  0  0

+    2.5071   -0.6854    0.0000 H   0  0  0

+    0.7234    1.2882    0.0000 H   0  0  0

+   -3.3075   -1.0328    0.0000 H   0  0  0

+   -3.2551    2.8672    0.0000 H   0  0  0

+    4.4852   -0.4706    0.0000 H   0  0  0

+    2.7003    1.4981    0.0000 H   0  0  0

+   -4.3267    0.9629    0.0000 H   0  0  0

+    4.4305    0.9638    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  2  0

+  5  2  1  0

+  6  3  2  0

+  7  3  1  0

+  8  4  1  0

+  9  4  1  0

+ 10  5  2  0

+ 11  6  1  0

+ 12  7  2  0

+ 13  8  2  0

+ 14  8  1  0

+ 15  9  2  0

+ 16 11  2  0

+ 10 15  1  0

+ 12 16  1  0

+  1 17  1  0

+  5 18  1  0

+  6 19  1  0

+  7 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82789-18-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -1.2394    3.5616    0.0194 C   0  0  0

+   -2.2937    3.5848    0.6092 O   0  0  0

+   -0.5915    4.7077   -0.2424 O   0  0  0

+   -0.6487    2.2456   -0.4166 C   0  0  0

+    0.7268    2.0589    0.2407 C   0  0  0

+   -1.5399    1.1515   -0.0127 N   0  0  0

+    1.1738    0.6457   -0.0391 C   0  0  0

+   -1.1342   -0.0562   -0.7457 C   0  0  0

+    0.3314   -0.3127   -0.4911 C   0  0  0

+    2.4788    0.0424    0.0947 C   0  0  0

+   -1.9417   -1.2328   -0.2612 C   0  0  0

+    1.0151   -1.4854   -0.6571 N   0  0  0

+    2.3248   -1.3098   -0.3102 C   0  0  0

+    3.7186    0.5362    0.5130 C   0  0  0

+   -2.7419   -1.9325   -1.1446 C   0  0  0

+   -1.8777   -1.6157    1.0657 C   0  0  0

+    3.4119   -2.1810   -0.3003 C   0  0  0

+    4.7712   -0.3449    0.5123 C   0  0  0

+   -3.4827   -3.0119   -0.7001 C   0  0  0

+   -2.6183   -2.6947    1.5101 C   0  0  0

+    4.6261   -1.6650    0.1180 C   0  0  0

+   -3.4231   -3.3912    0.6276 C   0  0  0

+   -0.1013    5.5748    0.0000 H   0  0  0

+   -0.0524    3.0434    0.0000 H   0  0  0

+    1.7102    2.2169    0.0000 H   0  0  0

+    0.7147    3.0549    0.0000 H   0  0  0

+   -2.5199    1.3296    0.0000 H   0  0  0

+   -2.1207    0.0815    0.0000 H   0  0  0

+    0.5775   -2.3802    0.0000 H   0  0  0

+    3.8763    1.5197    0.0000 H   0  0  0

+   -3.4862   -1.2706    0.0000 H   0  0  0

+   -0.9052   -1.8311    0.0000 H   0  0  0

+    3.2760   -3.1677    0.0000 H   0  0  0

+    5.6954    0.0266    0.0000 H   0  0  0

+   -4.4541   -2.7918    0.0000 H   0  0  0

+   -1.8757   -3.3585    0.0000 H   0  0  0

+    5.4255   -2.2592    0.0000 H   0  0  0

+   -3.7654   -4.3266    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  4  1  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

+  9  7  2  0

+ 10  7  1  0

+ 11  8  1  0

+ 12  9  1  0

+ 13 10  2  0

+ 14 10  1  0

+ 15 11  2  0

+ 16 11  1  0

+ 17 13  1  0

+ 18 14  2  0

+ 19 15  1  0

+ 20 16  2  0

+ 21 17  2  0

+ 22 19  2  0

+  8  9  1  0

+ 12 13  1  0

+ 18 21  1  0

+ 20 22  1  0

+  3 23  1  0

+  4 24  1  0

+  5 25  1  0

+  5 26  1  0

+  6 27  1  0

+  8 28  1  0

+ 12 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109-78-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.0270   -0.6636    0.0000 C   0  0  0

+   -1.3511   -0.1465    0.0000 C   0  0  0

+    1.0113    0.5078    0.0000 C   0  0  0

+   -2.4147    0.2526    0.0000 N   0  0  0

+    2.3492    0.0057    0.0000 O   0  0  0

+   -0.4679   -1.6324    0.0000 H   0  0  0

+    0.9336   -1.2648    0.0000 H   0  0  0

+    1.5062    1.4766    0.0000 H   0  0  0

+    0.1047    1.1090    0.0000 H   0  0  0

+    3.3677   -0.3765    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  3  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+66789-78-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+    0.3339    1.1561   -0.2156 O   0  0  0

+   -0.5209    0.0461    0.0661 C   0  0  0

+    1.6111    0.6954   -0.1490 C   0  0  0

+   -1.9591    0.4922    0.0079 C   0  0  0

+    2.6739    1.5578   -0.3802 C   0  0  0

+    1.8540   -0.6356    0.1555 C   0  0  0

+   -2.9490   -0.3921    0.2418 N   0  0  0

+   -2.2259    1.6470   -0.2495 O   0  0  0

+    2.3730    3.2258   -0.7557 Cl  0  0  0

+    3.9723    1.0875   -0.3116 C   0  0  0

+    3.1537   -1.1023    0.2232 C   0  0  0

+   -4.3472    0.0416    0.1852 C   0  0  0

+    4.2126   -0.2415   -0.0129 C   0  0  0

+    3.4584   -2.7682    0.6050 Cl  0  0  0

+   -5.2266   -1.1290   -0.2588 C   0  0  0

+   -4.7839    0.5085    1.5499 C   0  0  0

+    5.8437   -0.8297    0.0727 Cl  0  0  0

+   -5.0225   -1.3817   -1.7540 C   0  0  0

+   -5.6280    1.3667    1.6532 O   0  0  0

+   -4.2350   -0.0291    2.6506 O   0  0  0

+   -4.6678   -2.8530   -1.9788 C   0  0  0

+   -6.3108   -1.0467   -2.5083 C   0  0  0

+   -0.9382   -0.8901    0.0000 H   0  0  0

+    0.3594   -0.4789    0.0000 H   0  0  0

+    1.0722   -1.2985    0.0000 H   0  0  0

+   -2.7312   -1.3937    0.0000 H   0  0  0

+    4.7555    1.7487    0.0000 H   0  0  0

+   -3.8029    0.9101    0.0000 H   0  0  0

+   -5.9927   -0.4480    0.0000 H   0  0  0

+   -5.9683   -1.8365    0.0000 H   0  0  0

+   -4.1031   -0.9285    0.0000 H   0  0  0

+   -3.5027   -0.7463    0.0000 H   0  0  0

+   -5.6642   -3.0932    0.0000 H   0  0  0

+   -4.4276   -3.8494    0.0000 H   0  0  0

+   -3.6714   -2.6128    0.0000 H   0  0  0

+   -6.0528   -0.0547    0.0000 H   0  0  0

+   -7.3028   -0.7887    0.0000 H   0  0  0

+   -6.5688   -2.0387    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  4  2  0

+  9  5  1  0

+ 10  5  1  0

+ 11  6  2  0

+ 12  7  1  0

+ 13 10  2  0

+ 14 11  1  0

+ 15 12  1  0

+ 16 12  1  0

+ 17 13  1  0

+ 18 15  1  0

+ 19 16  2  0

+ 20 16  1  0

+ 21 18  1  0

+ 22 18  1  0

+ 11 13  1  0

+  2 23  1  0

+  2 24  1  0

+  6 25  1  0

+  7 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+771-97-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -2.9278    1.3940   -0.0019 N   0  0  0

+   -1.7126    0.7032   -0.0023 C   0  0  0

+   -0.5397    1.4015    0.0001 C   0  0  0

+   -1.7127   -0.7032    0.0006 C   0  0  0

+    0.6836    0.7089   -0.0003 C   0  0  0

+   -2.9278   -1.3940    0.0039 N   0  0  0

+   -0.5397   -1.4015    0.0007 C   0  0  0

+    0.6835   -0.7088   -0.0032 C   0  0  0

+    1.9085    1.3974    0.0027 C   0  0  0

+    1.9085   -1.3974   -0.0031 C   0  0  0

+    3.0758    0.6966    0.0026 C   0  0  0

+    3.0757   -0.6967   -0.0002 C   0  0  0

+   -2.9348    2.4423    0.0000 H   0  0  0

+   -3.8322    0.8638    0.0000 H   0  0  0

+   -0.5511    2.4498    0.0000 H   0  0  0

+   -3.8322   -0.8638    0.0000 H   0  0  0

+   -2.9348   -2.4423    0.0000 H   0  0  0

+   -0.5511   -2.4498    0.0000 H   0  0  0

+    1.9235    2.4457    0.0000 H   0  0  0

+    1.9235   -2.4457    0.0000 H   0  0  0

+    3.9882    1.2130    0.0000 H   0  0  0

+    3.9880   -1.2132    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  4  1  0

+  7  4  2  0

+  8  5  2  0

+  9  5  1  0

+ 10  8  1  0

+ 11  9  2  0

+ 12 10  2  0

+  7  8  1  0

+ 11 12  1  0

+  1 13  1  0

+  1 14  1  0

+  3 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+133-32-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -1.7003   -0.0908   -0.3140 C   0  0  0

+   -2.7589    0.5678    0.3374 C   0  0  0

+   -0.6623    0.9213   -0.5243 C   0  0  0

+   -1.8084   -1.4486   -0.6213 C   0  0  0

+   -2.3794    1.8808    0.5040 N   0  0  0

+   -3.9038   -0.1481    0.6724 C   0  0  0

+   -1.1280    2.0727   -0.0152 C   0  0  0

+    0.6749    0.7097   -1.1863 C   0  0  0

+   -2.9436   -2.1313   -0.2871 C   0  0  0

+   -3.9876   -1.4880    0.3639 C   0  0  0

+    1.7082    0.3083   -0.1317 C   0  0  0

+    3.0658    0.0935   -0.8038 C   0  0  0

+    4.0835   -0.3019    0.2349 C   0  0  0

+    5.3533   -0.5432   -0.1274 O   0  0  0

+    3.7565   -0.4017    1.3938 O   0  0  0

+   -0.9740   -1.9653    0.0000 H   0  0  0

+   -3.0271    2.6181    0.0000 H   0  0  0

+   -4.7470    0.3542    0.0000 H   0  0  0

+   -0.6428    2.9258    0.0000 H   0  0  0

+    1.3944    1.3772    0.0000 H   0  0  0

+    0.3891    1.6486    0.0000 H   0  0  0

+   -2.9489   -3.1127    0.0000 H   0  0  0

+   -4.8590   -1.9395    0.0000 H   0  0  0

+    0.9887   -0.3592    0.0000 H   0  0  0

+    1.9940   -0.6306    0.0000 H   0  0  0

+    3.7854    0.7609    0.0000 H   0  0  0

+    2.7800    1.0324    0.0000 H   0  0  0

+    6.3175   -0.7264    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  6 10  2  0

+  8 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+  5  7  1  0

+  9 10  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+635-27-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    1.2184    0.7308    0.0024 C   0  0  0

+    0.1685   -0.2204    0.0019 C   0  0  0

+    0.9001    2.1002    0.0016 C   0  0  0

+    2.4900    0.3181   -0.0018 N   0  0  0

+   -1.1665    0.2189    0.0001 C   0  0  0

+    0.4890   -1.5907    0.0027 C   0  0  0

+   -0.4035    2.4911    0.0003 C   0  0  0

+    2.7923   -0.9575   -0.0065 C   0  0  0

+   -1.4351    1.5549   -0.0011 C   0  0  0

+   -2.4651   -0.9331   -0.0011 Cl  0  0  0

+    1.8085   -1.9440    0.0040 C   0  0  0

+    1.6618    2.8154    0.0000 H   0  0  0

+   -0.2615   -2.3177    0.0000 H   0  0  0

+   -0.6344    3.5101    0.0000 H   0  0  0

+    3.7977   -1.2419    0.0000 H   0  0  0

+   -2.4277    1.8813    0.0000 H   0  0  0

+    2.0797   -2.9530    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7  9  1  0

+  8 11  1  0

+  3 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+152-20-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -0.3146    0.1498    0.1428 P   0  0  0

+   -1.4393    0.3942   -0.9829 O   0  0  0

+   -0.5593   -1.2784    0.8447 O   0  0  0

+    1.6042    0.1748   -0.7582 S   0  0  0

+   -0.3953    1.2204    1.1615 O   0  0  0

+   -2.6691    0.6291   -0.2940 C   0  0  0

+   -0.2562   -2.2761   -0.1323 C   0  0  0

+    2.6435    0.3461    0.7187 C   0  0  0

+   -2.5071    1.4770    0.0000 H   0  0  0

+   -3.5170    0.7911    0.0000 H   0  0  0

+   -2.8311   -0.2188    0.0000 H   0  0  0

+   -1.0821   -2.5270    0.0000 H   0  0  0

+   -0.0053   -3.1020    0.0000 H   0  0  0

+    0.5697   -2.0252    0.0000 H   0  0  0

+    2.7839   -0.5056    0.0000 H   0  0  0

+    3.4952    0.4865    0.0000 H   0  0  0

+    2.5031    1.1978    0.0000 H   0  0  0

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+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3648-20-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 84 84                          1 V2000

+    0.7174    3.7947   -0.1027 C   0  0  0

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+ 34 84  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+31431-39-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+   -0.7181   -0.6033    0.1747 C   0  0  0

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+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17241-59-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.6716    0.4612    0.2431 C   0  0  0

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+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96-23-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.0000    0.1057   -0.1120 C   0  0  0

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+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74014-51-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+127129                          1 V2000

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+ 58127  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7226-23-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.0000   -0.6766    0.0078 C   0  0  0

+   -1.1766   -0.0353    0.0669 N   0  0  0

+    1.1766   -0.0351    0.0666 N   0  0  0

+    0.0001   -1.8878   -0.0984 O   0  0  0

+   -1.2442    1.4196    0.2132 C   0  0  0

+   -2.4193   -0.8066   -0.0172 C   0  0  0

+    1.2441    1.4198    0.2129 C   0  0  0

+    2.4194   -0.8064   -0.0168 C   0  0  0

+   -0.0002    2.0474   -0.4244 C   0  0  0

+   -1.5800    2.4094    0.0000 H   0  0  0

+   -2.2712    1.2255    0.0000 H   0  0  0

+   -2.9705    0.0815    0.0000 H   0  0  0

+   -3.3074   -1.3578    0.0000 H   0  0  0

+   -1.8681   -1.6947    0.0000 H   0  0  0

+    2.2712    1.2259    0.0000 H   0  0  0

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+    1.8682   -1.6945    0.0000 H   0  0  0

+    3.3075   -1.3576    0.0000 H   0  0  0

+    2.9706    0.0817    0.0000 H   0  0  0

+    0.6564    2.8606    0.0000 H   0  0  0

+   -0.6570    2.8605    0.0000 H   0  0  0

+  1  2  1  0

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+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+52-86-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 51                          1 V2000

+    4.4836    0.3317    0.2086 C   0  0  0

+    3.0686    0.8352    0.3325 C   0  0  0

+    5.2887    0.2498    1.3297 C   0  0  0

+    4.9742   -0.0536   -1.0248 C   0  0  0

+    2.6538    1.5252   -0.9707 C   0  0  0

+    2.1257   -0.3437    0.5927 C   0  0  0

+    2.9848    1.7654    1.4141 O   0  0  0

+    6.5862   -0.2122    1.2167 C   0  0  0

+    6.2719   -0.5160   -1.1391 C   0  0  0

+    1.1818    1.9317   -0.8782 C   0  0  0

+    0.6812    0.1604    0.6035 C   0  0  0

+    7.0796   -0.5931   -0.0187 C   0  0  0

+    0.3475    0.7381   -0.7028 N   0  0  0

+    8.7094   -1.1737   -0.1614 Cl  0  0  0

+   -1.0429    1.2040   -0.6155 C   0  0  0

+   -1.9726    0.0030   -0.4308 C   0  0  0

+   -3.4207    0.4883   -0.3399 C   0  0  0

+   -4.3364   -0.6947   -0.1580 C   0  0  0

+   -5.7877   -0.4901   -0.0433 C   0  0  0

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+   -7.9998   -1.3876    0.2329 C   0  0  0

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+ 21 46  1  0

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+ 23 48  1  0

+ 24 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92-67-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.3074   -0.0002   -0.0020 C   0  0  0

+   -1.1761    0.0002   -0.0021 C   0  0  0

+    1.0058    1.1351   -0.4108 C   0  0  0

+    1.0049   -1.1337    0.4121 C   0  0  0

+   -1.8757   -1.1327   -0.4129 C   0  0  0

+   -1.8753    1.1318    0.4142 C   0  0  0

+    2.3841    1.1328   -0.4095 C   0  0  0

+    2.3837   -1.1318    0.4119 C   0  0  0

+   -3.2560   -1.1269   -0.4105 C   0  0  0

+   -3.2551    1.1265    0.4125 C   0  0  0

+    3.0780   -0.0007   -0.0010 C   0  0  0

+   -3.9446    0.0006   -0.0014 C   0  0  0

+    4.4737   -0.0009   -0.0005 N   0  0  0

+    0.5191    2.0077    0.0000 H   0  0  0

+    0.5181   -2.0062    0.0000 H   0  0  0

+   -1.3908   -2.0063    0.0000 H   0  0  0

+   -1.3904    2.0054    0.0000 H   0  0  0

+    2.8732    2.0040    0.0000 H   0  0  0

+    2.8722   -2.0034    0.0000 H   0  0  0

+   -3.7467   -1.9973    0.0000 H   0  0  0

+   -3.7451    1.9973    0.0000 H   0  0  0

+   -4.9438    0.0012    0.0000 H   0  0  0

+    4.9732   -0.8663    0.0000 H   0  0  0

+    4.9734    0.8643    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+874-42-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -2.5569   -0.8698   -0.0014 C   0  0  0

+   -2.9940   -2.0010   -0.0021 O   0  0  0

+   -1.1046   -0.6430   -0.0013 C   0  0  0

+   -0.5960    0.6617   -0.0005 C   0  0  0

+   -0.2229   -1.7300    0.0038 C   0  0  0

+   -1.6792    2.0183    0.0010 Cl  0  0  0

+    0.7690    0.8657   -0.0004 C   0  0  0

+    1.1368   -1.5099    0.0039 C   0  0  0

+    1.6338   -0.2157   -0.0011 C   0  0  0

+    3.3492    0.0506   -0.0010 Cl  0  0  0

+   -3.2126   -0.0564    0.0000 H   0  0  0

+   -0.5952   -2.7061    0.0000 H   0  0  0

+    1.1506    1.8382    0.0000 H   0  0  0

+    1.7956   -2.3207    0.0000 H   0  0  0

+  2  1  2  0

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+ 10  9  1  0

+  8  9  1  0

+  1 11  1  0

+  5 12  1  0

+  7 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+117823-31-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+   -0.0138   -0.4721    0.0604 C   0  0  0

+   -1.3247   -0.1643   -0.0012 C   0  0  0

+    1.0228    0.6065   -0.1217 C   0  0  0

+    0.4036   -1.8557    0.3106 C   0  0  0

+   -1.7487    1.2488   -0.0863 C   0  0  0

+   -2.5150   -1.4278    0.0195 Cl  0  0  0

+    2.0444    0.7144    1.3601 Cl  0  0  0

+    2.0619    0.2081   -1.5403 Cl  0  0  0

+    1.5830   -2.1326    0.3660 O   0  0  0

+   -1.9145    1.9714    1.0388 O   0  0  0

+   -1.9476    1.7588   -1.1702 O   0  0  0

+    0.6010    1.4681    0.0000 H   0  0  0

+   -0.2532   -2.5548    0.0000 H   0  0  0

+   -2.1290    2.9064    0.0000 H   0  0  0

+  1  2  2  0

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+  5 10  1  0

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+  3 12  1  0

+  4 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7496-02-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    0.7960    0.1223   -0.0034 C   0  0  0

+    0.3098   -1.1987    0.0151 C   0  0  0

+    2.2444    0.3335   -0.0179 C   0  0  0

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+    4.1508    1.7721   -0.0509 C   0  0  0

+   -2.3394    2.1913   -0.0170 N   0  3  0

+   -3.3817   -0.4748    0.0369 C   0  0  0

+   -3.0461   -2.8474    0.0591 C   0  0  0

+    4.9933    0.6651   -0.0451 C   0  0  0

+   -3.2759    2.2332   -0.7946 O   0  0  0

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+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  2  0

+ 11 17  1  0

+ 13 18  2  0

+ 15 19  2  0

+ 15 20  1  0

+ 16 21  1  0

+  7 12  2  0

+  9 10  1  0

+ 14 18  1  0

+ 17 21  2  0

+  4 22  1  0

+  6 23  1  0

+  8 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 21 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+732-11-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -3.4372    0.7234    0.0793 C   0  0  0

+   -3.4481   -0.6709   -0.1263 C   0  0  0

+   -2.0378    1.1519   -0.1280 C   0  0  0

+   -4.6135    1.3819    0.4001 C   0  0  0

+   -2.0550   -1.0427   -0.4516 C   0  0  0

+   -4.6342   -1.3765   -0.0020 C   0  0  0

+   -1.2988    0.0698   -0.4324 N   0  0  0

+   -1.6245    2.2904   -0.0392 O   0  0  0

+   -5.7933    0.6637    0.5166 C   0  0  0

+   -1.6591   -2.1647   -0.6948 O   0  0  0

+   -5.8023   -0.7051    0.3239 C   0  0  0

+    0.1398    0.0991   -0.7075 C   0  0  0

+    1.0563   -0.1356    0.8402 S   0  0  0

+    3.0439   -0.0434    0.1086 P   0  0  0

+    4.0620    0.1390    1.3425 O   0  0  0

+    3.3906   -1.4056   -0.6763 O   0  0  0

+    3.2115    1.4034   -1.0540 S   0  0  0

+    5.3446    0.4249    0.7809 C   0  0  0

+    3.0561   -2.4838    0.1999 C   0  0  0

+   -4.6321    2.4006    0.0000 H   0  0  0

+   -4.6266   -2.3953    0.0000 H   0  0  0

+   -6.6799    1.1658    0.0000 H   0  0  0

+   -6.6858   -1.2125    0.0000 H   0  0  0

+    0.7836    0.8888    0.0000 H   0  0  0

+   -0.3067    1.0149    0.0000 H   0  0  0

+    5.5663   -0.5695    0.0000 H   0  0  0

+    6.3390    0.6466    0.0000 H   0  0  0

+    5.1229    1.4193    0.0000 H   0  0  0

+    2.0830   -2.1819    0.0000 H   0  0  0

+    2.7542   -3.4569    0.0000 H   0  0  0

+    4.0292   -2.7857    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+ 14 17  2  0

+ 15 18  1  0

+ 16 19  1  0

+  5  7  1  0

+  9 11  1  0

+  4 20  1  0

+  6 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106807-80-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.3963   -0.4797   -0.0014 N   0  0  0

+   -0.8016    0.1380   -0.0005 C   0  0  0

+    1.5302    0.2488   -0.0006 C   0  0  0

+    0.4636   -1.8941    0.0025 O   0  0  0

+   -1.9354   -0.5905   -0.0013 N   0  0  0

+   -0.8593    1.3520    0.0012 O   0  0  0

+    2.8696   -0.4418   -0.0017 C   0  0  0

+    1.4726    1.4598    0.0010 O   0  0  0

+   -3.2375    0.0809   -0.0003 C   0  0  0

+    0.5116   -2.9038    0.0000 H   0  0  0

+   -1.8874   -1.6002    0.0000 H   0  0  0

+    2.4064   -1.3402    0.0000 H   0  0  0

+    3.7680   -0.9050    0.0000 H   0  0  0

+    3.3328    0.4566    0.0000 H   0  0  0

+   -2.7742    0.9793    0.0000 H   0  0  0

+   -4.1359    0.5442    0.0000 H   0  0  0

+   -3.7008   -0.8175    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  5  9  1  0

+  4 10  1  0

+  5 11  1  0

+  7 12  1  0

+  7 13  1  0

+  7 14  1  0

+  9 15  1  0

+  9 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+65734-38-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.1411   -0.7003    0.2550 C   0  0  0

+    0.7713   -1.6690   -0.1440 C   0  0  0

+    0.3064    0.5639    0.6163 C   0  0  0

+   -1.5060   -0.9953    0.2872 N   0  0  0

+    2.1194   -1.3723   -0.1801 C   0  0  0

+    1.6563    0.8541    0.5778 C   0  0  0

+   -2.4248   -0.0173    0.6898 N   0  0  0

+    2.5616   -0.1123    0.1803 C   0  0  0

+   -3.3939    0.3857   -0.1558 C   0  0  0

+    4.0337    0.2077    0.1400 C   0  0  0

+   -4.3821    1.4377    0.2773 C   0  0  0

+   -3.4705   -0.0983   -1.2651 O   0  0  0

+    4.2615    1.2888   -0.7664 O   0  0  0

+    0.4747   -2.6301    0.0000 H   0  0  0

+   -0.3577    1.3193    0.0000 H   0  0  0

+   -1.8050   -1.9556    0.0000 H   0  0  0

+    2.7863   -2.1252    0.0000 H   0  0  0

+    1.9565    1.8140    0.0000 H   0  0  0

+   -1.8525    0.8098    0.0000 H   0  0  0

+    4.1075   -0.7954    0.0000 H   0  0  0

+    5.0372    0.1403    0.0000 H   0  0  0

+   -3.6490    2.1263    0.0000 H   0  0  0

+   -5.0707    2.1708    0.0000 H   0  0  0

+   -5.1152    0.7491    0.0000 H   0  0  0

+    4.4689    2.2730    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

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+  9 12  2  0

+ 10 13  1  0

+  6  8  2  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+638-03-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+   -3.1702   -0.9911   -0.1654 C   0  0  0

+   -4.1157   -0.0337   -0.4756 C   0  0  0

+   -1.9845   -0.6186    0.4554 C   0  0  0

+   -3.8833    1.2948   -0.1691 C   0  0  0

+   -5.4019   -0.4367   -1.1495 C   0  0  0

+   -1.7543    0.7164    0.7619 C   0  0  0

+   -1.0262   -1.5845    0.7711 N   0  0  0

+   -2.7043    1.6690    0.4488 C   0  0  0

+    8.2025    0.0840   -0.2053 Cl  0  0  0

+   -3.4138   -1.9713    0.0000 H   0  0  0

+   -4.6438    1.9595    0.0000 H   0  0  0

+   -5.7039    0.5271    0.0000 H   0  0  0

+   -6.3657   -0.7387    0.0000 H   0  0  0

+   -5.0999   -1.4005    0.0000 H   0  0  0

+   -0.7914    1.0213    0.0000 H   0  0  0

+   -1.2915   -2.5591    0.0000 H   0  0  0

+   -0.0496   -1.3269    0.0000 H   0  0  0

+   -2.4645    2.6502    0.0000 H   0  0  0

+    9.2125    0.0840    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+148-79-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 23                          1 V2000

+   -0.0951    0.0237   -0.0024 C   0  0  0

+   -1.5717    0.0314   -0.0022 C   0  0  0

+    0.6987    1.1396   -0.0017 N   0  0  0

+    0.6540   -1.0532    0.0023 N   0  0  0

+   -2.2873   -1.1398   -0.0030 C   0  0  0

+   -2.2510    1.1700    0.0044 N   0  0  0

+    2.0117    0.7071   -0.0022 C   0  0  0

+    1.9626   -0.6979    0.0005 C   0  0  0

+   -3.9573   -0.5044   -0.0015 S   0  0  0

+   -3.5602    1.1855    0.0051 C   0  0  0

+    3.2388    1.3550   -0.0016 C   0  0  0

+    3.1557   -1.4272    0.0042 C   0  0  0

+    4.4028    0.6148   -0.0020 C   0  0  0

+    4.3544   -0.7718    0.0016 C   0  0  0

+    0.3757    2.1236    0.0000 H   0  0  0

+   -1.9523   -2.1198    0.0000 H   0  0  0

+   -4.1985    2.0011    0.0000 H   0  0  0

+    3.2805    2.3898    0.0000 H   0  0  0

+    3.1307   -2.4626    0.0000 H   0  0  0

+    5.3192    1.0974    0.0000 H   0  0  0

+    5.2359   -1.3155    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

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+ 11 13  2  0

+ 12 14  2  0

+  7  8  2  0

+  9 10  1  0

+ 13 14  1  0

+  3 15  1  0

+  5 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+ 14 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+464-43-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.1306    0.7762   -0.2466 C   0  0  1

+   -1.1642    0.0504    0.2628 C   0  0  0

+    1.1896    0.2123    0.7488 C   0  0  1

+    0.3996   -0.0047   -1.5687 C   0  0  0

+    0.0551    2.3005   -0.3538 C   0  0  0

+   -0.5783   -1.4040    0.1992 C   0  0  2

+   -1.5270    0.4605    1.6914 C   0  0  0

+   -2.3411    0.2369   -0.6968 C   0  0  0

+    0.7205   -1.2306    1.0438 C   0  0  0

+    2.4690    0.1765    0.1132 O   0  0  0

+   -0.0696   -1.4476   -1.2737 C   0  0  0

+    1.4380    1.1513    0.0000 H   0  0  0

+    1.1887   -0.5711    0.0000 H   0  0  0

+    1.1787    0.5753    0.0000 H   0  0  0

+    1.0252    2.3486    0.0000 H   0  0  0

+    0.0070    3.2706    0.0000 H   0  0  0

+   -0.9150    2.2524    0.0000 H   0  0  0

+   -1.1558   -2.1850    0.0000 H   0  0  0

+   -0.7995    1.1041    0.0000 H   0  0  0

+   -2.1706    1.1880    0.0000 H   0  0  0

+   -2.2545   -0.1831    0.0000 H   0  0  0

+   -2.1891    1.1963    0.0000 H   0  0  0

+   -3.3005    0.3889    0.0000 H   0  0  0

+   -2.4931   -0.7225    0.0000 H   0  0  0

+    0.7047   -2.2018    0.0000 H   0  0  0

+    1.6786   -1.3904    0.0000 H   0  0  0

+    3.4400    0.1493    0.0000 H   0  0  0

+   -0.2261   -2.4062    0.0000 H   0  0  0

+    0.8743   -1.6767    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  6  9  1  0

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+  3 12  1  0

+  4 13  1  0

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+  6 18  1  0

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+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1774-66-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    3.2950    1.0117   -0.0035 C   0  0  0

+    1.9117    0.5392   -0.0036 C   0  0  0

+    3.5302    2.2061    0.0006 O   0  0  0

+    4.4090    0.0386   -0.0022 C   0  0  0

+    0.8942    1.4281    0.0008 C   0  0  0

+    5.7311    0.4864   -0.0020 C   0  0  0

+    4.1427   -1.3321    0.0048 C   0  0  0

+   -0.4975    0.9527    0.0006 C   0  0  0

+    6.7654   -0.4266   -0.0003 C   0  0  0

+    5.1860   -2.2341    0.0065 C   0  0  0

+   -1.5538    1.8701    0.0052 C   0  0  0

+   -0.7718   -0.4196   -0.0099 C   0  0  0

+    6.4946   -1.7834    0.0013 C   0  0  0

+   -2.8556    1.4169    0.0050 C   0  0  0

+   -2.0784   -0.8574   -0.0099 C   0  0  0

+   -3.1192    0.0571    0.0004 C   0  0  0

+   -4.9087   -0.5542    0.0009 Br  0  0  0

+    1.7109   -0.4802    0.0000 H   0  0  0

+    1.0949    2.4475    0.0000 H   0  0  0

+    5.9358    1.5050    0.0000 H   0  0  0

+    3.1608   -1.6717    0.0000 H   0  0  0

+    7.7499   -0.0945    0.0000 H   0  0  0

+    4.9892   -3.2543    0.0000 H   0  0  0

+   -1.3575    2.8904    0.0000 H   0  0  0

+    0.0077   -1.1065    0.0000 H   0  0  0

+    7.2770   -2.4670    0.0000 H   0  0  0

+   -3.6411    2.0970    0.0000 H   0  0  0

+   -2.2836   -1.8759    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  2  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 14  2  0

+ 17 16  1  0

+ 10 13  1  0

+ 15 16  1  0

+  2 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4016-11-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.3427    0.0598   -0.5648 C   0  0  0

+   -2.6018   -0.6330   -0.0399 C   0  0  0

+   -2.2282    0.6852    0.3662 O   0  0  0

+   -0.1178   -0.4772    0.1782 C   0  0  0

+    1.0582    0.1698   -0.3121 O   0  0  0

+    2.1618   -0.3714    0.4168 C   0  0  0

+    3.4593    0.2827   -0.0622 C   0  0  0

+   -0.8477    0.9364    0.0000 H   0  0  0

+   -3.6083   -0.6164    0.0000 H   0  0  0

+   -2.3593   -1.6100    0.0000 H   0  0  0

+   -0.7120   -1.2898    0.0000 H   0  0  0

+    0.5469   -1.2332    0.0000 H   0  0  0

+    1.5352   -1.1593    0.0000 H   0  0  0

+    2.7971   -1.1523    0.0000 H   0  0  0

+    3.9125   -0.6162    0.0000 H   0  0  0

+    4.3582    0.7359    0.0000 H   0  0  0

+    3.0061    1.1816    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  2  3  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  4 11  1  0

+  4 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+999-55-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.8978   -0.1247   -0.0012 C   0  0  0

+   -0.4098    0.2031   -0.0004 O   0  0  0

+    1.9199    0.9311    0.0002 C   0  0  0

+    1.2312   -1.2934    0.0020 O   0  0  0

+   -1.4198   -0.8401   -0.0018 C   0  0  0

+    3.2108    0.6074   -0.0006 C   0  0  0

+   -2.7899   -0.2127   -0.0005 C   0  0  0

+   -2.9131    1.0915    0.0016 C   0  0  0

+    1.6425    1.9033    0.0000 H   0  0  0

+   -1.9419   -1.7059    0.0000 H   0  0  0

+   -0.6186   -1.4568    0.0000 H   0  0  0

+    3.4882   -0.3649    0.0000 H   0  0  0

+    3.9141    1.3337    0.0000 H   0  0  0

+   -3.6141   -0.7983    0.0000 H   0  0  0

+   -2.0889    1.6771    0.0000 H   0  0  0

+   -3.8324    1.5124    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  2  1  0

+  6  3  2  0

+  7  5  1  0

+  8  7  2  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+646-14-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+   -0.0687   -0.1361   -0.1248 C   0  0  0

+   -1.2548    0.5669    0.5383 C   0  0  0

+    1.2377    0.4566    0.4070 C   0  0  0

+   -2.5057   -0.0006    0.0290 N   0  3  0

+    2.4239   -0.2463   -0.2561 C   0  0  0

+   -2.7433   -1.1855    0.1812 O   0  0  0

+   -3.3081    0.7124   -0.5465 O   0  5  0

+    3.7303    0.3463    0.2758 C   0  0  0

+    4.9165   -0.3566   -0.3874 C   0  0  0

+   -0.7647   -0.9009    0.0000 H   0  0  0

+    0.5399   -0.9722    0.0000 H   0  0  0

+   -0.5588    1.3317    0.0000 H   0  0  0

+   -1.8634    1.4030    0.0000 H   0  0  0

+    1.9336    1.2215    0.0000 H   0  0  0

+    0.6291    1.2926    0.0000 H   0  0  0

+    1.7279   -1.0112    0.0000 H   0  0  0

+    3.0325   -1.0824    0.0000 H   0  0  0

+    4.4263    1.1112    0.0000 H   0  0  0

+    3.1217    1.1824    0.0000 H   0  0  0

+    4.3893   -1.2462    0.0000 H   0  0  0

+    5.8061   -0.8838    0.0000 H   0  0  0

+    5.4437    0.5330    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  2  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  1 10  1  0

+  1 11  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  3 15  1  0

+  5 16  1  0

+  5 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33804-48-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+    3.7851   -0.1913    0.3363 C   0  0  0

+    3.2148   -1.4526    0.1961 C   0  0  0

+    2.9766    0.9387    0.3975 C   0  0  0

+    5.1726   -0.0602    0.4216 N   0  0  0

+    1.8469   -1.5868    0.1175 C   0  0  0

+    1.6074    0.8132    0.3195 C   0  0  0

+    5.8824    0.3102   -0.6626 C   0  0  0

+    5.8568   -0.3252    1.6896 C   0  0  0

+    1.0302   -0.4528    0.1786 C   0  0  0

+    5.9146   -0.5761   -1.8810 C   0  0  0

+    6.4951    1.3569   -0.6577 O   0  0  0

+   -0.3269   -0.5815    0.1005 N   0  0  0

+   -1.0785    0.4654    0.1571 N   0  0  0

+   -2.4350    0.3367    0.0790 C   0  0  0

+   -3.2516    1.4708    0.1402 C   0  0  0

+   -3.0121   -0.9293   -0.0683 C   0  0  0

+   -4.6195    1.3369    0.0606 C   0  0  0

+   -4.3804   -1.0550   -0.1472 C   0  0  0

+   -5.1899    0.0755   -0.0806 C   0  0  0

+   -6.5743   -0.0559   -0.1603 N   0  0  0

+   -7.1768   -1.3829   -0.3089 C   0  0  0

+   -7.4278    1.1331   -0.0955 C   0  0  0

+    3.8197   -2.2964    0.0000 H   0  0  0

+    3.4086    1.8827    0.0000 H   0  0  0

+    1.4194   -2.5329    0.0000 H   0  0  0

+    1.0065    1.6598    0.0000 H   0  0  0

+    5.4818   -1.2933    0.0000 H   0  0  0

+    6.8249   -0.7002    0.0000 H   0  0  0

+    6.2318    0.6429    0.0000 H   0  0  0

+    4.8771   -0.6138    0.0000 H   0  0  0

+    5.9523   -1.6136    0.0000 H   0  0  0

+    6.9521   -0.5384    0.0000 H   0  0  0

+   -2.8239    2.4168    0.0000 H   0  0  0

+   -2.4111   -1.7758    0.0000 H   0  0  0

+   -5.2243    2.1807    0.0000 H   0  0  0

+   -4.8121   -1.9992    0.0000 H   0  0  0

+   -8.1221   -0.9537    0.0000 H   0  0  0

+   -7.6060   -2.3282    0.0000 H   0  0  0

+   -6.2315   -1.8121    0.0000 H   0  0  0

+   -6.5844    1.7385    0.0000 H   0  0  0

+   -8.0332    1.9765    0.0000 H   0  0  0

+   -8.2712    0.5277    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  7 11  2  0

+  9 12  1  0

+ 12 13  2  0

+ 13 14  1  0

+ 14 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 16 18  2  0

+ 17 19  2  0

+ 19 20  1  0

+ 20 21  1  0

+ 20 22  1  0

+  6  9  2  0

+ 18 19  1  0

+  2 23  1  0

+  3 24  1  0

+  5 25  1  0

+  6 26  1  0

+  8 27  1  0

+  8 28  1  0

+  8 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 10 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-75-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+    0.5813    0.7003    0.0052 C   0  0  0

+    0.1502   -0.8325   -0.8639 S   0  0  0

+    2.0257    1.0837   -0.3230 C   0  0  0

+   -0.3441    1.8050   -0.4356 C   0  0  0

+   -1.6361   -1.3444    0.1566 P   0  0  0

+    2.9511   -0.0210    0.1178 C   0  0  0

+   -0.5450    2.8689    0.3578 O   0  0  0

+   -0.9054    1.7330   -1.5032 O   0  0  0

+   -2.1942   -2.7450   -0.4081 O   0  0  0

+   -1.3333   -1.4833    1.7318 O   0  0  0

+   -2.9107   -0.0126   -0.1159 S   0  0  0

+    4.2749    0.0972   -0.0706 O   0  0  0

+    2.5015   -1.0132    0.6407 O   0  0  0

+   -1.4366    3.9333   -0.0669 C   0  0  0

+   -2.3315   -2.5948   -1.8225 C   0  0  0

+   -2.5441   -1.9269    2.3476 C   0  0  0

+    5.1665   -0.9672    0.3540 C   0  0  0

+   -1.4876    5.0168    1.0121 C   0  0  0

+    6.6109   -0.5838    0.0259 C   0  0  0

+   -0.4368    0.4816    0.0000 H   0  0  0

+    2.9128    1.6292    0.0000 H   0  0  0

+    1.6150    2.0407    0.0000 H   0  0  0

+   -2.4430    4.2008    0.0000 H   0  0  0

+   -1.9956    3.0547    0.0000 H   0  0  0

+   -1.5629   -1.8922    0.0000 H   0  0  0

+   -3.0341   -1.8262    0.0000 H   0  0  0

+   -3.1001   -3.2974    0.0000 H   0  0  0

+   -2.9023   -0.9491    0.0000 H   0  0  0

+   -3.5219   -2.2851    0.0000 H   0  0  0

+   -2.1859   -2.9047    0.0000 H   0  0  0

+    4.2794   -1.5127    0.0000 H   0  0  0

+    5.5772   -1.9242    0.0000 H   0  0  0

+   -0.4474    5.0658    0.0000 H   0  0  0

+   -1.5366    6.0570    0.0000 H   0  0  0

+   -2.5278    4.9678    0.0000 H   0  0  0

+    6.8781   -1.5903    0.0000 H   0  0  0

+    7.6174   -0.3166    0.0000 H   0  0  0

+    6.3437    0.4227    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  6 13  2  0

+  7 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 12 17  1  0

+ 14 18  1  0

+ 17 19  1  0

+  1 20  1  0

+  3 21  1  0

+  3 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80-15-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.4072    0.1151   -0.0009 C   0  0  0

+   -1.0819    0.3468    0.0002 C   0  0  0

+    1.2740    1.1916    0.0010 C   0  0  0

+    0.9061   -1.1743    0.0019 C   0  0  0

+   -1.7597   -0.9112   -0.0022 O   0  0  0

+   -1.4745    1.1353    1.2512 C   0  0  0

+   -1.4755    1.1405   -1.2472 C   0  0  0

+    2.6402    0.9790    0.0000 C   0  0  0

+    2.2718   -1.3868    0.0010 C   0  0  0

+   -3.1992   -0.6179   -0.0010 O   0  0  0

+    3.1390   -0.3100   -0.0030 C   0  0  0

+    0.8998    2.1586    0.0000 H   0  0  0

+    0.2557   -1.9819    0.0000 H   0  0  0

+   -0.5463    1.5975    0.0000 H   0  0  0

+   -1.9367    2.0635    0.0000 H   0  0  0

+   -2.4027    0.6731    0.0000 H   0  0  0

+   -0.5465    1.6012    0.0000 H   0  0  0

+   -1.9362    2.0695    0.0000 H   0  0  0

+   -2.4045    0.6798    0.0000 H   0  0  0

+    3.2906    1.7866    0.0000 H   0  0  0

+    2.6460   -2.3538    0.0000 H   0  0  0

+   -4.2152   -0.4109    0.0000 H   0  0  0

+    4.1636   -0.4695    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  8 11  2  0

+  9 11  1  0

+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+150-60-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    2.6074    0.5811    0.4296 C   0  0  0

+    1.3370    1.2665    0.8627 C   0  0  0

+    3.5430    1.2692   -0.3196 C   0  0  0

+    2.8394   -0.7343    0.7865 C   0  0  0

+    0.0579    1.0233   -0.4004 S   0  0  0

+    4.7084    0.6404   -0.7169 C   0  0  0

+    4.0045   -1.3629    0.3893 C   0  0  0

+   -0.0580   -1.0234   -0.4002 S   0  0  0

+    4.9378   -0.6763   -0.3650 C   0  0  0

+   -1.3369   -1.2663    0.8631 C   0  0  0

+   -2.6073   -0.5810    0.4301 C   0  0  0

+   -3.5431   -1.2693   -0.3188 C   0  0  0

+   -2.8393    0.7345    0.7868 C   0  0  0

+   -4.7086   -0.6405   -0.7161 C   0  0  0

+   -4.0044    1.3630    0.3897 C   0  0  0

+   -4.9379    0.6763   -0.3644 C   0  0  0

+    2.0431    1.9650    0.0000 H   0  0  0

+    0.8749    2.1456    0.0000 H   0  0  0

+    3.4739    2.2600    0.0000 H   0  0  0

+    2.0342   -1.3156    0.0000 H   0  0  0

+    5.5143    1.2209    0.0000 H   0  0  0

+    4.0737   -2.3536    0.0000 H   0  0  0

+    5.8594   -1.0465    0.0000 H   0  0  0

+   -2.0430   -1.9647    0.0000 H   0  0  0

+   -0.8749   -2.1455    0.0000 H   0  0  0

+   -3.4739   -2.2600    0.0000 H   0  0  0

+   -2.0341    1.3159    0.0000 H   0  0  0

+   -5.5145   -1.2210    0.0000 H   0  0  0

+   -4.0736    2.3537    0.0000 H   0  0  0

+   -5.8594    1.0466    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+ 10 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+  7  9  1  0

+ 15 16  1  0

+  2 17  1  0

+  2 18  1  0

+  3 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4437-51-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.7237   -0.1696    0.1070 C   0  0  0

+   -0.7238    0.1686    0.1079 C   0  0  0

+    1.7144    0.7605   -0.5444 C   0  0  0

+    1.1063   -1.1875    0.6328 O   0  0  0

+   -1.7148   -0.7596   -0.5458 C   0  0  0

+   -1.1056    1.1873    0.6325 O   0  0  0

+    3.1241    0.1823   -0.4058 C   0  0  0

+   -3.1245   -0.1818   -0.4048 C   0  0  0

+    2.2312    1.6389    0.0000 H   0  0  0

+    0.9183    1.3969    0.0000 H   0  0  0

+   -2.2318   -1.6379    0.0000 H   0  0  0

+   -0.9192   -1.3965    0.0000 H   0  0  0

+    2.7373   -0.7606    0.0000 H   0  0  0

+    4.0670   -0.2045    0.0000 H   0  0  0

+    3.5109    1.1252    0.0000 H   0  0  0

+   -2.7380    0.7612    0.0000 H   0  0  0

+   -4.0675    0.2047    0.0000 H   0  0  0

+   -3.5110   -1.1248    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  2  1  0

+  6  2  2  0

+  7  3  1  0

+  8  5  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+   -0.0129    0.0000   -0.1019 S   0  0  0

+   -1.8223    0.0000    0.0275 C   0  0  0

+    0.4386    0.0000    1.3516 O   0  0  0

+    0.4775   -1.2434   -0.5841 O   0  0  0

+    0.4775    1.2434   -0.5841 O   0  0  0

+   -1.8223    1.0025    0.0000 H   0  0  0

+   -2.8248    0.0000    0.0000 H   0  0  0

+   -1.8223   -1.0025    0.0000 H   0  0  0

+    1.4411    0.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4332-51-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    2.0518   -0.0023    0.4770 C   0  0  0

+    0.6195   -0.0046    0.9458 C   0  0  0

+    2.7085    1.1957    0.2679 C   0  0  0

+    2.7105   -1.1985    0.2615 C   0  0  0

+   -0.4871    0.0025   -0.4915 S   0  0  0

+    4.0225    1.1979   -0.1623 C   0  0  0

+    4.0241   -1.1964   -0.1684 C   0  0  0

+   -2.0948   -0.0017    0.3488 C   0  0  0

+    4.6792    0.0020   -0.3832 C   0  0  0

+   -3.2149    0.0034   -0.6934 C   0  0  0

+   -4.8128   -0.0007    0.1417 Cl  0  0  0

+    0.1041   -0.8896    0.0000 H   0  0  0

+    1.1306   -0.8921    0.0000 H   0  0  0

+    2.1859    2.0765    0.0000 H   0  0  0

+    2.1902   -2.0806    0.0000 H   0  0  0

+    4.5433    2.0798    0.0000 H   0  0  0

+    4.5472   -2.0769    0.0000 H   0  0  0

+   -2.6088   -0.8876    0.0000 H   0  0  0

+   -1.5825   -0.8885    0.0000 H   0  0  0

+    5.7034    0.0030    0.0000 H   0  0  0

+   -2.7009    0.8892    0.0000 H   0  0  0

+   -3.7272    0.8903    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+ 10 11  1  0

+  7  9  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2051-10-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.5265    0.2214    0.0853 C   0  0  0

+   -0.2636   -0.9344   -0.0121 C   0  0  0

+    1.9780    0.0995    0.0335 C   0  0  0

+   -0.1234    1.5323    0.2315 C   0  0  0

+   -1.7391   -0.8346    0.0410 C   0  0  0

+    0.3505   -2.1831   -0.1607 C   0  0  0

+    2.5466   -1.1912   -0.1199 C   0  0  0

+    2.8155    1.2156    0.1320 C   0  0  0

+   -1.5433    1.6288   -0.2666 C   0  0  0

+    0.4502    2.4824    0.7253 O   0  0  0

+   -2.3751    0.4162   -0.0814 C   0  0  0

+   -2.5134   -1.9771    0.2135 C   0  0  0

+    1.7042   -2.3122   -0.2137 C   0  0  0

+    3.9447   -1.3218   -0.1737 C   0  0  0

+    4.1686    1.0518    0.0777 C   0  0  0

+   -1.9781    2.6384   -0.7809 O   0  0  0

+   -3.7631    0.5025   -0.0338 C   0  0  0

+   -3.8931   -1.8759    0.2602 C   0  0  0

+    4.7300   -0.2134   -0.0754 C   0  0  0

+   -4.5150   -0.6464    0.1368 C   0  0  0

+   -0.2426   -3.0419    0.0000 H   0  0  0

+    2.4059    2.1755    0.0000 H   0  0  0

+   -2.0585   -2.9164    0.0000 H   0  0  0

+    2.1256   -3.2670    0.0000 H   0  0  0

+    4.3804   -2.2702    0.0000 H   0  0  0

+    4.7892    1.8909    0.0000 H   0  0  0

+   -4.2307    1.4355    0.0000 H   0  0  0

+   -4.4719   -2.7444    0.0000 H   0  0  0

+    5.7685   -0.3170    0.0000 H   0  0  0

+   -5.5570   -0.5884    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

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+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  7 14  1  0

+  8 15  2  0

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+  8 22  1  0

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+ 14 25  1  0

+ 15 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+38915-58-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 52                          1 V2000

+   -5.6770    0.0899    0.4473 C   0  0  0

+   -6.6366    0.8067   -0.3072 C   0  0  0

+   -4.5566    0.7713    0.9577 C   0  0  0

+   -5.8384   -1.2926    0.6940 C   0  0  0

+   -7.8043    0.0841   -0.8360 C   0  0  0

+   -6.4947    2.1042   -0.5377 N   0  0  0

+   -4.4441    2.1506    0.6892 C   0  0  0

+   -3.5979    0.1099    1.6986 N   0  0  0

+   -6.9043   -1.9726    0.2232 C   0  0  0

+   -7.9230   -1.2967   -0.5707 C   0  0  0

+   -8.7348    0.7091   -1.5500 N   0  0  0

+   -5.4512    2.7939   -0.0757 C   0  0  0

+   -3.3525    2.8944    1.1666 C   0  0  0

+   -2.5876   -0.3723    0.7474 C   0  0  0

+   -9.0343   -1.9923   -1.0719 C   0  0  0

+   -9.7792    0.0667   -2.0233 C   0  0  0

+   -5.3300    4.1724   -0.3384 C   0  0  0

+   -3.2711    4.2248    0.8907 C   0  0  0

+   -1.4886   -1.1192    1.5057 C   0  0  0

+   -9.9590   -1.2932   -1.8009 C   0  0  0

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+   -0.4363   -1.6214    0.5150 C   0  0  0

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+    2.7241   -3.5506    0.9331 C   0  0  0

+    3.9175   -4.1067   -0.2988 Cl  0  0  0

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+   22.9332    1.5620   -0.6427 Cl  0  0  0

+   -5.0275   -1.8005    0.0000 H   0  0  0

+   -4.0772   -0.7183    0.0000 H   0  0  0

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+   -2.5206    2.4215    0.0000 H   0  0  0

+   -1.7483    0.0871    0.0000 H   0  0  0

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+   -9.0764   -2.9482    0.0000 H   0  0  0

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+   -2.4175    4.6572    0.0000 H   0  0  0

+   -2.3279   -1.5786    0.0000 H   0  0  0

+   -1.4620   -2.0757    0.0000 H   0  0  0

+  -10.8418   -1.6623    0.0000 H   0  0  0

+   -4.2591    5.8177    0.0000 H   0  0  0

+    0.4030   -1.1620    0.0000 H   0  0  0

+   -0.4629   -0.6649    0.0000 H   0  0  0

+    0.1464   -3.1705    0.0000 H   0  0  0

+    2.4271   -2.3259    0.0000 H   0  0  0

+    1.5567   -1.8354    0.0000 H   0  0  0

+    1.8882   -4.0163    0.0000 H   0  0  0

+    2.7587   -4.5068    0.0000 H   0  0  0

+   15.3227    0.4120    0.0000 H   0  0  0

+   23.8901    1.5620    0.0000 H   0  0  0

+  1  2  2  0

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+ 25 48  1  0

+ 25 49  1  0

+ 27 50  1  0

+ 28 51  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10453-89-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    0.8714    0.0630   -0.8209 C   0  0  0

+   -0.2900   -0.2368    0.1291 C   0  0  0

+    0.4038    1.1261    0.1751 C   0  0  0

+    2.1256   -0.5929   -0.3035 C   0  0  0

+   -1.5937   -0.1119   -0.6163 C   0  0  0

+    1.3089    1.4181    1.3736 C   0  0  0

+   -0.3616    2.3281   -0.3821 C   0  0  0

+    2.0809   -1.8493    0.1670 O   0  0  0

+    3.1715    0.0121   -0.3122 O   0  0  0

+   -2.7215   -0.4035   -0.0170 C   0  0  0

+   -4.0252   -0.2786   -0.7624 C   0  0  0

+   -2.7150   -0.8639    1.4180 C   0  0  0

+    1.5468    0.6943    0.0000 H   0  0  0

+   -0.2174   -1.1585    0.0000 H   0  0  0

+   -1.6664    0.8098    0.0000 H   0  0  0

+    1.5928    0.5382    0.0000 H   0  0  0

+    2.1888    1.7020    0.0000 H   0  0  0

+    1.0250    2.2980    0.0000 H   0  0  0

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+    2.0480   -2.7733    0.0000 H   0  0  0

+   -3.9370    0.6417    0.0000 H   0  0  0

+   -4.9455   -0.1904    0.0000 H   0  0  0

+   -4.1134   -1.1989    0.0000 H   0  0  0

+   -3.6395   -0.8770    0.0000 H   0  0  0

+   -2.7019   -1.7884    0.0000 H   0  0  0

+   -1.7905   -0.8508    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  2  3  1  0

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+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+55256-53-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 54                          1 V2000

+   -2.8304    0.0117    0.1728 C   0  0  0

+   -4.3048    0.3108    0.0024 C   0  0  1

+   -2.1875    1.2188    0.4324 C   0  0  0

+   -2.1135   -1.1647    0.1077 C   0  0  0

+   -4.4056    1.7598    0.5744 C   0  0  1

+   -4.5914    0.5462   -1.4688 C   0  0  0

+   -5.1670   -0.6357    0.6372 O   0  0  0

+   -0.8148    1.2335    0.6573 C   0  0  0

+   -3.0682    2.2556    0.4097 O   0  0  0

+   -0.7282   -1.1387    0.3069 C   0  0  0

+   -2.7459   -2.3377   -0.1468 O   0  0  0

+   -5.2489    2.3950   -0.4056 O   0  0  0

+   -5.1136    1.7474   -1.5842 C   0  0  0

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+    0.0795   -2.3678    0.1796 C   0  0  0

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+    3.4152    3.8701    0.0000 H   0  0  0

+    4.2445    4.4644    0.0000 H   0  0  0

+    2.8192    4.2633    0.0000 H   0  0  0

+    3.0203    2.8380    0.0000 H   0  0  0

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+  1  2  1  0

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+  1  4  2  0

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+ 28 45  1  0

+ 28 46  1  0

+ 29 47  1  0

+ 29 48  1  0

+ 29 49  1  0

+ 30 50  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+461-58-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.1541   -0.7975    0.0000 N   0  0  0

+   -0.9455    0.0356    0.0000 C   0  0  0

+    1.4028   -0.2713    0.0000 C   0  0  0

+   -2.2123   -0.4982    0.0000 N   0  0  0

+   -0.7834    1.3279    0.0000 N   0  0  0

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+    0.0276   -1.8059    0.0000 H   0  0  0

+   -3.0223    0.1155    0.0000 H   0  0  0

+   -2.3388   -1.5066    0.0000 H   0  0  0

+   -0.6569    2.3363    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  3  0

+  1  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+580-15-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -3.4257    0.6501   -0.0011 N   0  0  0

+   -2.1043    0.1985   -0.0015 C   0  0  0

+   -1.0710    1.1099    0.0002 C   0  0  0

+   -1.8406   -1.1767    0.0022 C   0  0  0

+    0.2548    0.6502    0.0002 C   0  0  0

+   -0.5647   -1.6445    0.0023 C   0  0  0

+    0.5148   -0.7430   -0.0015 C   0  0  0

+    1.3400    1.5475    0.0014 C   0  0  0

+    1.7774   -1.1830   -0.0019 N   0  0  0

+    2.6040    1.0303    0.0009 C   0  0  0

+    2.7898   -0.3506   -0.0007 C   0  0  0

+   -3.6277    1.6766    0.0000 H   0  0  0

+   -4.2137   -0.0381    0.0000 H   0  0  0

+   -1.2732    2.1363    0.0000 H   0  0  0

+   -2.6378   -1.8542    0.0000 H   0  0  0

+   -0.3855   -2.6752    0.0000 H   0  0  0

+    1.1824    2.5817    0.0000 H   0  0  0

+    3.4317    1.6701    0.0000 H   0  0  0

+    3.7635   -0.7333    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

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+  7  5  2  0

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+ 10  8  2  0

+ 11  9  2  0

+  6  7  1  0

+ 10 11  1  0

+  1 12  1  0

+  1 13  1  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-51-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 65 64                          1 V2000

+    0.7023    0.3598   -1.0621 P   0  0  0

+    0.0237   -1.0938   -0.9254 O   0  0  0

+   -0.3325    1.4849   -0.5568 O   0  0  0

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+    1.0507    0.6104   -2.4785 O   0  0  0

+   -1.0043   -1.1644   -1.9155 C   0  0  0

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+    4.0051    1.7358    0.3098 C   0  0  0

+   -2.2682   -2.6997   -0.5422 O   0  0  0

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+   -2.8929   -3.9849   -0.5339 C   0  0  0

+   -3.6971    3.1754    1.1286 C   0  0  0

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+   -3.5320   -4.2324    0.8341 C   0  0  0

+   -5.0079    3.1954    0.3398 C   0  0  0

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+   -4.8399   -5.8559    2.2110 C   0  0  0

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+    9.1828   -1.3939    1.1896 C   0  0  0

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+    7.2835   -1.3337    0.0000 H   0  0  0

+   -4.1067   -6.5918    0.0000 H   0  0  0

+   -3.2286   -5.7838    0.0000 H   0  0  0

+   -5.0672    4.7054    0.0000 H   0  0  0

+   -6.1710    5.2117    0.0000 H   0  0  0

+    9.1006    0.2537    0.0000 H   0  0  0

+    7.9234    0.7184    0.0000 H   0  0  0

+   -5.1967   -4.9346    0.0000 H   0  0  0

+   -5.7612   -6.2127    0.0000 H   0  0  0

+   -4.4831   -6.7772    0.0000 H   0  0  0

+   -7.2399    5.2579    0.0000 H   0  0  0

+   -8.2427    4.2851    0.0000 H   0  0  0

+   -7.2699    3.2823    0.0000 H   0  0  0

+    8.4145   -2.0150    0.0000 H   0  0  0

+    9.8039   -2.1622    0.0000 H   0  0  0

+    9.9511   -0.7728    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  7 30  1  0

+  8 31  1  0

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+ 25 61  1  0

+ 25 62  1  0

+ 26 63  1  0

+ 26 64  1  0

+ 26 65  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2657-25-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.6216    1.1825   -0.0039 C   0  0  0

+   -0.6138    0.3993   -0.0033 C   0  0  0

+    0.5713    2.3990   -0.0003 O   0  0  0

+    1.9300    0.4977   -0.0027 C   0  0  0

+   -1.8101    1.0254    0.0012 C   0  0  0

+    3.1115    1.2441   -0.0033 C   0  0  0

+    1.9900   -0.8990    0.0048 C   0  0  0

+   -3.0527    0.2377    0.0018 C   0  0  0

+    4.3296    0.6016   -0.0017 C   0  0  0

+    3.2117   -1.5335    0.0064 C   0  0  0

+   -4.2939    0.8826    0.0065 C   0  0  0

+   -2.9991   -1.1603   -0.0082 C   0  0  0

+    4.3849   -0.7873    0.0005 C   0  0  0

+   -5.4540    0.1371    0.0065 C   0  0  0

+   -4.1679   -1.8912   -0.0081 C   0  0  0

+    5.5873   -1.4166    0.0016 O   0  0  0

+   -5.3924   -1.2455    0.0019 C   0  0  0

+   -0.5707   -0.6402    0.0000 H   0  0  0

+   -1.8532    2.0649    0.0000 H   0  0  0

+    3.0709    2.2837    0.0000 H   0  0  0

+    1.1126   -1.4581    0.0000 H   0  0  0

+    5.2096    1.1565    0.0000 H   0  0  0

+    3.2572   -2.5729    0.0000 H   0  0  0

+   -4.3417    1.9219    0.0000 H   0  0  0

+   -2.0796   -1.6470    0.0000 H   0  0  0

+   -6.3780    0.6153    0.0000 H   0  0  0

+   -4.1296   -2.9309    0.0000 H   0  0  0

+    6.5091   -1.8990    0.0000 H   0  0  0

+   -6.2711   -1.8026    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  2  0

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+  7  4  1  0

+  8  5  1  0

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+ 11  8  2  0

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+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+74-95-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  5  4                          1 V2000

+    0.0000   -1.0557    0.0000 C   0  0  0

+   -1.6052    0.0793    0.0000 Br  0  0  0

+    1.6052    0.0793    0.0000 Br  0  0  0

+   -0.9819   -2.1556    0.0000 H   0  0  0

+    0.9819   -2.1556    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+619-25-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.8568    0.1738   -0.0330 C   0  0  0

+   -0.2421   -0.6448   -0.2139 C   0  0  0

+    0.6893    1.5418    0.0765 C   0  0  0

+    2.2125   -0.4148    0.0494 N   0  3  0

+   -1.5089   -0.0956   -0.2851 C   0  0  0

+   -0.5771    2.0908    0.0053 C   0  0  0

+    3.1809    0.3066    0.2088 O   0  0  0

+    2.3596   -1.6204   -0.0421 O   0  5  0

+   -1.6764    1.2720   -0.1756 C   0  0  0

+   -2.7070   -0.9881   -0.4828 C   0  0  0

+   -3.6005   -0.8375    0.6222 O   0  0  0

+   -0.1229   -1.6713    0.0000 H   0  0  0

+    1.5171    2.1604    0.0000 H   0  0  0

+   -0.6963    3.1173    0.0000 H   0  0  0

+   -2.6264    1.6786    0.0000 H   0  0  0

+   -3.1298   -1.9310    0.0000 H   0  0  0

+   -1.9009   -1.6347    0.0000 H   0  0  0

+   -4.6195   -0.6657    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  6  9  1  0

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+  3 13  1  0

+  6 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+72-14-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    1.2407   -0.5533   -0.0681 C   0  0  0

+   -0.0842   -1.7070   -0.2031 S   0  0  0

+    2.1645   -0.6801    0.9527 C   0  0  0

+    1.3575    0.4739   -0.9870 C   0  0  0

+   -1.2806   -1.2097    0.8282 N   0  0  0

+   -0.6094   -1.5402   -1.5129 O   0  0  0

+    0.4087   -2.9257    0.3364 O   0  0  0

+    3.2044    0.2225    1.0614 C   0  0  0

+    2.3945    1.3797   -0.8842 C   0  0  0

+   -1.9686   -0.0333    0.5756 C   0  0  0

+    3.3213    1.2585    0.1438 C   0  0  0

+   -2.8617    0.5824    1.3267 N   0  0  0

+   -1.8707    1.0126   -0.8071 S   0  0  0

+    4.3713    2.1734    0.2510 N   0  0  0

+   -3.4271    1.7077    0.9314 C   0  0  0

+   -3.0686    2.2240   -0.2683 C   0  0  0

+    2.4339   -1.5854    0.0000 H   0  0  0

+    0.5210    0.9126    0.0000 H   0  0  0

+   -1.9018   -1.9212    0.0000 H   0  0  0

+    4.0404   -0.2171    0.0000 H   0  0  0

+    2.1208    2.2837    0.0000 H   0  0  0

+    5.2647    1.8669    0.0000 H   0  0  0

+    4.1900    3.1004    0.0000 H   0  0  0

+   -4.3693    1.7744    0.0000 H   0  0  0

+   -3.1501    3.1650    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7203-89-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    0.3571   -0.3271    0.0040 C   0  0  0

+    1.2681   -1.3843    0.0030 C   0  0  0

+    0.8236    0.9878    0.0022 C   0  0  0

+   -0.9915   -0.5797    0.0010 N   0  0  0

+    2.6227   -1.1236    0.0003 C   0  0  0

+    2.1811    1.2351   -0.0005 C   0  0  0

+   -1.8312    0.3996    0.0019 N   0  0  0

+    3.0789    0.1828   -0.0015 C   0  0  0

+   -3.2082    0.1417   -0.0011 N   0  0  0

+    4.5601    0.4602   -0.0044 C   0  0  0

+   -3.6946   -1.2402   -0.0053 C   0  0  0

+   -4.1618    1.2539   -0.0001 C   0  0  0

+    0.9258   -2.3686    0.0000 H   0  0  0

+    0.1483    1.7815    0.0000 H   0  0  0

+    3.3039   -1.9122    0.0000 H   0  0  0

+    2.5307    2.2168    0.0000 H   0  0  0

+    4.7519   -0.5641    0.0000 H   0  0  0

+    5.5844    0.6520    0.0000 H   0  0  0

+    4.3683    1.4845    0.0000 H   0  0  0

+   -4.6776   -0.8942    0.0000 H   0  0  0

+   -4.0406   -2.2232    0.0000 H   0  0  0

+   -2.7116   -1.5862    0.0000 H   0  0  0

+   -3.3707    1.9322    0.0000 H   0  0  0

+   -4.8401    2.0450    0.0000 H   0  0  0

+   -4.9529    0.5756    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112022-09-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+   -0.9578    0.5247    0.0410 C   0  0  0

+   -1.9501    1.4679   -0.0485 N   0  0  0

+    0.4399    0.9747    0.0984 C   0  0  0

+   -1.2127   -0.7697    0.0830 N   0  0  0

+   -3.2496    1.0911   -0.1035 C   0  0  0

+   -1.6436    2.7956   -0.0840 C   0  0  0

+    0.6998    2.3389    0.0595 C   0  0  0

+    1.5400    0.0018    0.1944 C   0  0  0

+   -2.4660   -1.2490    0.0400 C   0  0  0

+   -3.5488   -0.3428   -0.0634 C   0  0  0

+   -4.1405    1.9170   -0.1831 O   0  0  0

+   -0.3672    3.2357   -0.0328 C   0  0  0

+    2.8185    0.4197    0.1094 N   0  0  0

+    1.2953   -1.1795    0.3504 O   0  0  0

+   -2.7292   -2.6237    0.0854 C   0  0  0

+   -4.8571   -0.8257   -0.1142 C   0  0  0

+    3.9136   -0.5487    0.2049 C   0  0  0

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+    5.2523    0.1812    0.0788 C   0  0  0

+    6.3504   -0.7899    0.1747 N   0  0  0

+    6.2574   -1.6508   -1.0120 C   0  0  0

+    7.5999   -0.0282    0.0467 C   0  0  0

+   -2.4161    3.4909    0.0000 H   0  0  0

+    1.6790    2.6873    0.0000 H   0  0  0

+   -0.1776    4.2576    0.0000 H   0  0  0

+    3.0291    1.4375    0.0000 H   0  0  0

+   -1.9442   -3.3050    0.0000 H   0  0  0

+   -5.6584   -0.1638    0.0000 H   0  0  0

+    3.1397   -1.2425    0.0000 H   0  0  0

+    4.5133   -1.3976    0.0000 H   0  0  0

+   -4.2107   -4.0880    0.0000 H   0  0  0

+   -6.0547   -2.5334    0.0000 H   0  0  0

+    6.0262    0.8750    0.0000 H   0  0  0

+    4.6526    1.0301    0.0000 H   0  0  0

+    5.2241   -1.5392    0.0000 H   0  0  0

+    6.1458   -2.6841    0.0000 H   0  0  0

+    7.2907   -1.7624    0.0000 H   0  0  0

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+    8.4874    0.5128    0.0000 H   0  0  0

+    7.0589    0.8593    0.0000 H   0  0  0

+  1  2  1  0

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+  7 12  1  0

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+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 23 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51410-45-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.4939   -0.1134    0.5108 C   0  0  0

+   -1.9554   -0.3299    0.8077 C   0  0  0

+    0.0136    1.1712    0.4424 C   0  0  0

+    0.3384   -1.1993    0.3130 C   0  0  0

+   -2.7428   -0.3628   -0.5037 C   0  0  0

+    1.3528    1.3724    0.1709 C   0  0  0

+    1.6787   -1.0035    0.0411 C   0  0  0

+   -4.2266   -0.5826   -0.2023 C   0  0  0

+   -3.6924    0.7051   -0.5160 O   0  0  0

+    2.1892    0.2842   -0.0333 C   0  0  0

+    3.5072    0.4795   -0.3006 O   0  0  0

+    4.0927   -0.8144   -0.4587 C   0  0  0

+   -2.4029   -1.2641    0.0000 H   0  0  0

+   -1.3405   -1.1635    0.0000 H   0  0  0

+   -0.6312    1.9820    0.0000 H   0  0  0

+   -0.0515   -2.1590    0.0000 H   0  0  0

+   -2.6451   -1.3941    0.0000 H   0  0  0

+    1.7401    2.3332    0.0000 H   0  0  0

+    2.3213   -1.8160    0.0000 H   0  0  0

+   -5.2391   -0.3635    0.0000 H   0  0  0

+   -4.2608   -1.6179    0.0000 H   0  0  0

+    3.1489   -1.2415    0.0000 H   0  0  0

+    4.5198   -1.7582    0.0000 H   0  0  0

+    5.0365   -0.3873    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+ 10 11  1  0

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+  7 10  2  0

+  8  9  1  0

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+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1769-41-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    1.2372    0.3826   -0.2795 C   0  0  0

+   -0.0855    0.7751   -0.5049 N   0  0  0

+    1.6403   -0.9116   -0.5821 C   0  0  0

+    2.1528    1.2879    0.2422 C   0  0  0

+   -1.0989    0.0721    0.0385 C   0  0  0

+    2.9478   -1.2962   -0.3581 C   0  0  0

+    3.4584    0.8969    0.4636 C   0  0  0

+   -2.4950    0.4090   -0.2996 C   0  0  0

+   -0.8627   -0.8396    0.8073 O   0  0  0

+    3.8551   -0.3944    0.1666 C   0  0  0

+   -3.4672   -0.2653    0.2217 N   0  0  0

+   -4.8070    0.0581   -0.1028 O   0  0  0

+   -0.2462    1.7772    0.0000 H   0  0  0

+    0.9284   -1.6349    0.0000 H   0  0  0

+    1.9072    2.2726    0.0000 H   0  0  0

+    3.1971   -2.2800    0.0000 H   0  0  0

+    4.1735    1.6171    0.0000 H   0  0  0

+   -2.6815    1.4066    0.0000 H   0  0  0

+    4.8396   -0.6408    0.0000 H   0  0  0

+   -5.7936    0.2962    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  8 11  2  0

+ 11 12  1  0

+  7 10  1  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+142713-65-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+   -3.1110   -0.3123   -0.7434 C   0  0  0

+   -3.6594    0.3574    0.3468 C   0  0  0

+   -1.9160   -0.9984   -0.6012 C   0  0  0

+   -3.7498   -0.2977   -1.9438 O   0  0  0

+   -3.0078    0.3348    1.5690 C   0  0  0

+   -4.8321    1.0327    0.2121 O   0  0  0

+   -1.2707   -1.0170    0.6216 C   0  0  0

+   -2.9489   -1.0623   -2.8472 C   0  0  0

+   -1.8152   -0.3521    1.7040 C   0  0  0

+   -5.1279    1.6050    1.4877 C   0  0  0

+    0.0293   -1.7639    0.7744 C   0  0  0

+    1.1468   -0.8657    0.4737 N   0  0  0

+    2.4140   -1.3191    0.5456 C   0  0  0

+    3.5636   -0.3951    0.2363 C   0  0  0

+    2.6291   -2.4707    0.8592 O   0  0  0

+    4.3656   -0.9550   -0.9402 C   0  0  0

+    2.8675    1.3829   -0.2321 Br  0  0  0

+   -2.1546   -1.8440    0.0000 H   0  0  0

+   -2.7662    1.1796    0.0000 H   0  0  0

+   -3.5556   -1.6978    0.0000 H   0  0  0

+   -2.3134   -1.6690    0.0000 H   0  0  0

+   -2.3422   -0.4268    0.0000 H   0  0  0

+   -1.2468    0.3179    0.0000 H   0  0  0

+   -4.3474    2.0084    0.0000 H   0  0  0

+   -5.5313    2.3855    0.0000 H   0  0  0

+   -5.9084    1.2016    0.0000 H   0  0  0

+   -0.4993   -2.4657    0.0000 H   0  0  0

+    0.6603   -2.3753    0.0000 H   0  0  0

+    1.0010    0.0008    0.0000 H   0  0  0

+    4.2538    0.1486    0.0000 H   0  0  0

+    3.8626   -1.6754    0.0000 H   0  0  0

+    5.0860   -1.4580    0.0000 H   0  0  0

+    4.8686   -0.2346    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+ 14 16  1  0

+ 14 17  1  0

+  7  9  2  0

+  3 18  1  0

+  5 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

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+ 11 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13014-24-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    2.0046   -0.0007   -0.0004 C   0  0  0

+    0.5230    0.2749   -0.0011 C   0  0  0

+    2.9062    1.5607   -0.0022 Cl  0  0  0

+    2.4397   -0.9443    1.4731 Cl  0  0  0

+    2.4403   -0.9481   -1.4712 Cl  0  0  0

+   -0.3749   -0.7758    0.0001 C   0  0  0

+    0.0627    1.5787    0.0029 C   0  0  0

+   -1.7351   -0.5233    0.0000 C   0  0  0

+   -1.2958    1.8327    0.0028 C   0  0  0

+   -2.1960    0.7822   -0.0013 C   0  0  0

+   -2.8634   -1.8426    0.0009 Cl  0  0  0

+   -3.9025    1.1008   -0.0015 Cl  0  0  0

+   -0.0288   -1.7540    0.0000 H   0  0  0

+    0.7376    2.3668    0.0000 H   0  0  0

+   -1.6406    2.8113    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  7  9  2  0

+  8 10  2  0

+  8 11  1  0

+ 10 12  1  0

+  9 10  1  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1107-26-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 71 71                          1 V2000

+    8.0082    0.0222    0.1254 C   0  0  0

+    8.6626   -0.3528   -1.1724 C   0  0  0

+    8.5276   -0.2433    1.3128 C   0  0  0

+    6.7669    0.7041    0.0759 C   0  0  0

+   10.1415   -0.6713   -0.9437 C   0  0  0

+    7.9634   -1.5821   -1.7563 C   0  0  0

+    8.5409    0.8119   -2.1569 C   0  0  0

+    9.8402   -0.9443    1.5096 C   0  0  0

+    7.7583    0.1825    2.5367 C   0  0  0

+    5.6033    0.0012    0.1057 C   0  0  0

+   10.2523   -1.6614    0.2222 C   0  0  0

+    4.3727    0.6773    0.0566 C   0  0  0

+    3.2037   -0.0289    0.0864 C   0  0  0

+    4.3422    2.1815   -0.0291 C   0  0  0

+    1.9770    0.6449    0.0375 C   0  0  0

+    0.7972   -0.0678    0.0677 C   0  0  0

+   -0.4273    0.6049    0.0188 C   0  0  0

+   -1.6087   -0.1087    0.0490 C   0  0  0

+   -0.4578    2.1092   -0.0669 C   0  0  0

+   -2.8320    0.5633    0.0002 C   0  0  0

+   -4.0143   -0.1509    0.0304 C   0  0  0

+   -5.2369    0.5208   -0.0184 C   0  0  0

+   -6.4197   -0.1938    0.0119 C   0  0  0

+   -7.6419    0.4776   -0.0369 C   0  0  0

+   -6.3893   -1.6981    0.0975 C   0  0  0

+   -8.8251   -0.2373   -0.0067 C   0  0  0

+  -10.0469    0.4340   -0.0554 C   0  0  0

+  -11.2304   -0.2810   -0.0251 C   0  0  0

+  -12.4520    0.3901   -0.0739 C   0  0  0

+  -11.1999   -1.7853    0.0605 C   0  0  0

+  -13.4932   -0.2390   -0.0473 O   0  0  0

+    6.7454    1.7492    0.0000 H   0  0  0

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+   10.2503    0.3684    0.0000 H   0  0  0

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+    6.8437    0.6887    0.0000 H   0  0  0

+    7.2521   -0.7321    0.0000 H   0  0  0

+    5.6247   -1.0439    0.0000 H   0  0  0

+    9.6095   -2.4857    0.0000 H   0  0  0

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+    3.2252   -1.0740    0.0000 H   0  0  0

+    5.3873    2.2027    0.0000 H   0  0  0

+    4.3210    3.2266    0.0000 H   0  0  0

+    3.2971    2.1603    0.0000 H   0  0  0

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+   -5.3442   -1.6770    0.0000 H   0  0  0

+   -8.8036   -1.2824    0.0000 H   0  0  0

+  -10.0684    1.4791    0.0000 H   0  0  0

+  -12.4735    1.4352    0.0000 H   0  0  0

+  -12.2450   -1.8065    0.0000 H   0  0  0

+  -11.1787   -2.8304    0.0000 H   0  0  0

+  -10.1548   -1.7641    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

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+ 28 29  1  0

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+ 29 31  2  0

+  8 11  1  0

+  4 32  1  0

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+ 11 47  1  0

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+ 13 49  1  0

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+ 15 53  1  0

+ 16 54  1  0

+ 18 55  1  0

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+ 25 63  1  0

+ 25 64  1  0

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+ 26 66  1  0

+ 27 67  1  0

+ 29 68  1  0

+ 30 69  1  0

+ 30 70  1  0

+ 30 71  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1594-56-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.0206    0.8592    0.0030 C   0  0  0

+   -0.7928   -0.2667    0.0013 C   0  0  0

+    1.3943    0.7167    0.0027 C   0  0  0

+   -0.5843    2.2102   -0.0009 N   0  3  0

+   -0.2210   -1.5330   -0.0009 C   0  0  0

+   -2.5459   -0.0896    0.0023 S   0  0  0

+    1.9602   -0.5450    0.0005 C   0  0  0

+    0.1296    3.1971    0.0007 O   0  0  0

+   -1.7959    2.3350   -0.0056 O   0  5  0

+    1.1531   -1.6683   -0.0012 C   0  0  0

+   -3.6039   -1.5582    0.0000 C   0  0  0

+    3.4329   -0.6938   -0.0003 N   0  3  0

+   -4.2680   -2.4799   -0.0015 N   0  0  0

+    3.9328   -1.8045   -0.0022 O   0  0  0

+    4.1449    0.2944    0.0008 O   0  5  0

+    2.0022    1.5570    0.0000 H   0  0  0

+   -0.8256   -2.3756    0.0000 H   0  0  0

+    1.5805   -2.6132    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

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+  6 11  1  0

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+ 11 13  3  0

+ 12 14  2  0

+ 12 15  1  0

+  7 10  1  0

+  3 16  1  0

+  5 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+499-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    0.9496   -0.1166   -0.0025 C   0  0  0

+   -0.0431   -1.0770   -0.0004 C   0  0  0

+    0.6152    1.2252   -0.0038 C   0  0  0

+    2.3984   -0.5315    0.0028 C   0  0  0

+   -1.3768   -0.6944    0.0005 C   0  0  0

+   -0.7129    1.6090   -0.0029 C   0  0  0

+    3.0901    0.0157   -1.2474 C   0  0  0

+    3.0843    0.0274    1.2510 C   0  0  0

+   -1.7097    0.6522   -0.0008 C   0  0  0

+   -2.3555   -1.6374    0.0021 O   0  0  0

+   -3.1572    1.0713    0.0007 C   0  0  0

+    0.2081   -2.0829    0.0000 H   0  0  0

+    1.3618    1.9446    0.0000 H   0  0  0

+    2.5995   -1.5486    0.0000 H   0  0  0

+   -0.9612    2.6157    0.0000 H   0  0  0

+    3.7334   -0.7975    0.0000 H   0  0  0

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+    2.4468    0.8289    0.0000 H   0  0  0

+    3.7393   -0.7764    0.0000 H   0  0  0

+    3.8881    0.6824    0.0000 H   0  0  0

+    2.4293    0.8312    0.0000 H   0  0  0

+   -3.1021   -2.3568    0.0000 H   0  0  0

+   -2.8688    2.0672    0.0000 H   0  0  0

+   -4.1531    1.3597    0.0000 H   0  0  0

+   -3.4456    0.0754    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

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+  5  9  2  0

+  5 10  1  0

+  9 11  1  0

+  6  9  1  0

+  2 12  1  0

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+  4 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+553-26-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.7420   -0.0003   -0.0020 C   0  0  0

+   -0.7420    0.0001   -0.0019 C   0  0  0

+    1.4599    1.1271   -0.4094 C   0  0  0

+    1.4596   -1.1263    0.4109 C   0  0  0

+   -1.4600   -1.1273   -0.4091 C   0  0  0

+   -1.4595    1.1262    0.4111 C   0  0  0

+    2.8395    1.0843   -0.3936 C   0  0  0

+    2.8388   -1.0839    0.3956 C   0  0  0

+   -2.8396   -1.0842   -0.3936 C   0  0  0

+   -2.8387    1.0840    0.3956 C   0  0  0

+    3.4786   -0.0007   -0.0014 N   0  0  0

+   -3.4786    0.0009   -0.0016 N   0  0  0

+    0.9913    2.0133    0.0000 H   0  0  0

+    0.9911   -2.0125    0.0000 H   0  0  0

+   -0.9916   -2.0135    0.0000 H   0  0  0

+   -0.9909    2.0123    0.0000 H   0  0  0

+    3.3504    1.9468    0.0000 H   0  0  0

+    3.3490   -1.9468    0.0000 H   0  0  0

+   -3.3506   -1.9466    0.0000 H   0  0  0

+   -3.3488    1.9469    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+37364-66-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+162167                          1 V2000

+    4.4999    0.3389   -0.3961 C   0  0  1

+    3.0474    0.8082   -0.5003 C   0  0  2

+    4.5294   -1.0385   -0.0167 O   0  0  0

+    5.1790    0.5069   -1.7309 C   0  0  0

+    3.0173    2.2513   -0.7510 N   0  0  0

+    2.3285    0.5073    0.7896 C   0  0  0

+    5.6523   -1.2038    0.8515 C   0  0  2

+    6.3133    1.1956   -1.9605 C   0  0  0

+    4.7629   -0.0081   -2.8973 N   0  0  0

+    2.0020    2.7922   -1.4531 C   0  0  0

+    1.5621   -0.5965    0.8923 N   0  0  0

+    2.4397    1.2585    1.7352 O   0  0  0

+    5.9308   -2.6959    1.0468 C   0  0  1

+    5.3730   -0.5955    2.1110 O   0  0  0

+    6.5756    1.0913   -3.2999 N   0  0  0

+    5.5936    0.3393   -3.8419 C   0  0  0

+    1.9714    4.2544   -1.7071 C   0  0  0

+    1.1118    2.0832   -1.8781 O   0  0  0

+    0.8192   -0.8602    2.1271 C   0  0  1

+    6.1872   -3.3025   -0.2214 O   0  0  0

+    7.1585   -2.8608    1.9497 C   0  0  2

+    6.5750   -0.6209    2.8785 C   0  0  2

+    1.5350    5.0955   -0.7690 N   0  0  0

+    2.4028    4.7685   -2.9249 C   0  0  0

+   -0.5633   -1.4170    1.7815 C   0  0  2

+    1.5829   -1.8806    2.9736 C   0  0  0

+    5.3953   -4.4906   -0.2786 C   0  0  2

+    6.9290   -2.0653    3.2397 C   0  0  1

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+ 89162  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-13-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    1.9038    0.0175   -0.0014 C   0  0  0

+    0.5039    0.5756   -0.0002 C   0  0  0

+    3.0870    0.9508   -0.0007 C   0  0  0

+    2.0774   -1.1775    0.0020 O   0  0  0

+   -0.5039   -0.5756   -0.0013 C   0  0  0

+   -1.9038   -0.0175   -0.0001 C   0  0  0

+   -3.0870   -0.9508   -0.0009 C   0  0  0

+   -2.0774    1.1775    0.0015 O   0  0  0

+    1.0384    1.5715    0.0000 H   0  0  0

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+    3.7870    0.0634    0.0000 H   0  0  0

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+    2.3870    1.8382    0.0000 H   0  0  0

+   -1.0384   -1.5715    0.0000 H   0  0  0

+    0.4252   -1.2192    0.0000 H   0  0  0

+   -3.7870   -0.0634    0.0000 H   0  0  0

+   -3.9744   -1.6508    0.0000 H   0  0  0

+   -2.3870   -1.8382    0.0000 H   0  0  0

+  1  2  1  0

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+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-16-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.9524   -0.0261    0.0037 C   0  0  0

+   -0.3753   -1.2830    0.0033 C   0  0  0

+   -0.1556    1.1039    0.0024 C   0  0  0

+   -2.4262    0.1097   -0.0006 N   0  3  0

+    0.9994   -1.4133    0.0016 C   0  0  0

+    1.2202    0.9807    0.0007 C   0  0  0

+   -2.9358    1.2159   -0.0002 O   0  0  0

+   -3.1294   -0.8848   -0.0045 O   0  5  0

+    1.8030   -0.2800    0.0003 C   0  0  0

+    3.1938   -0.4081   -0.0015 N   0  0  0

+    3.9824    0.7072   -0.0028 N   0  0  0

+   -0.9757   -2.1285    0.0000 H   0  0  0

+   -0.5913    2.0449    0.0000 H   0  0  0

+    1.4315   -2.3560    0.0000 H   0  0  0

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+    3.6277   -1.3499    0.0000 H   0  0  0

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+  1  2  1  0

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+  6 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54-16-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.4551   -0.2326    0.2997 C   0  0  0

+   -1.2037   -1.3498   -0.1112 C   0  0  0

+    0.8955   -0.7285    0.5751 C   0  0  0

+   -1.0599    1.0242    0.3735 C   0  0  0

+   -0.3574   -2.4382   -0.0828 N   0  0  0

+   -2.5444   -1.1910   -0.4460 C   0  0  0

+    0.8876   -2.0480    0.3283 C   0  0  0

+    2.0712    0.0881    1.0464 C   0  0  0

+   -2.3928    1.1602    0.0414 C   0  0  0

+   -3.1292    0.0534   -0.3739 C   0  0  0

+    2.8302    0.6105   -0.1461 C   0  0  0

+   -2.9871    2.3813    0.1114 O   0  0  0

+    3.9231    1.3687    0.0336 O   0  0  0

+    2.4550    0.3468   -1.2639 O   0  0  0

+   -0.4805    1.8498    0.0000 H   0  0  0

+   -0.6584   -3.4008    0.0000 H   0  0  0

+   -3.1343   -2.0091    0.0000 H   0  0  0

+    1.6987   -2.6475    0.0000 H   0  0  0

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+   -4.1351    0.1279    0.0000 H   0  0  0

+   -3.4285    3.2882    0.0000 H   0  0  0

+    4.7518    1.9436    0.0000 H   0  0  0

+  1  2  2  0

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+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+125974-06-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.2346   -0.3833    0.2093 C   0  0  0

+   -1.0198   -1.1931    0.4403 C   0  0  0

+   -0.1512    0.8636   -0.0494 C   0  0  0

+    1.6527   -0.8898    0.2672 C   0  0  0

+   -2.1307   -0.2664    0.2826 O   0  0  0

+   -1.1124   -2.2204   -0.5487 O   0  0  0

+   -1.6138    0.9427   -0.0056 C   0  0  0

+    2.7896    0.4655   -0.0816 Cl  0  0  0

+   -2.2639    1.9510   -0.1999 O   0  0  0

+   -0.0913   -1.7544    0.0000 H   0  0  0

+    0.5161    1.7192    0.0000 H   0  0  0

+    1.1697   -1.8614    0.0000 H   0  0  0

+    2.5605   -1.4841    0.0000 H   0  0  0

+   -1.2098   -3.3010    0.0000 H   0  0  0

+  1  2  1  0

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+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6197-30-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 55                          1 V2000

+    2.0886    0.0145    0.0362 C   0  0  0

+    2.1828    1.4843   -0.0379 C   0  0  0

+    3.3070   -0.7936    0.2288 C   0  0  0

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+    4.3444   -0.7345   -0.7065 C   0  0  0

+    3.4329   -1.6185    1.3510 C   0  0  0

+   -0.3757    0.1960   -0.1256 C   0  0  0

+    0.7691   -2.0385   -0.1250 C   0  0  0

+    2.1830    3.6275    1.0488 C   0  0  0

+    2.4551    3.4898   -1.3333 C   0  0  0

+    5.4807   -1.4932   -0.5195 C   0  0  0

+    4.5750   -2.3711    1.5242 C   0  0  0

+   -1.5770   -0.4090   -0.2252 O   0  0  0

+   -0.3077    1.4093   -0.0820 O   0  0  0

+    0.7057   -3.1719   -0.1686 N   0  0  0

+    2.3606    4.2451   -0.1770 C   0  0  0

+    5.5956   -2.3116    0.5906 C   0  0  0

+   -2.7891    0.3886   -0.2802 C   0  0  0

+   -4.0032   -0.5359   -0.3909 C   0  0  0

+   -5.2804    0.3045   -0.4489 C   0  0  0

+   -3.8886   -1.3780   -1.6631 C   0  0  0

+   -6.1817   -0.0553    0.7340 C   0  0  0

+   -3.9688   -2.8624   -1.3010 C   0  0  0

+   -7.5042    0.7051    0.6172 C   0  0  0

+   -8.4055    0.3454    1.8000 C   0  0  0

+    1.0772    2.2280    0.0000 H   0  0  0

+    3.3689    1.9391    0.0000 H   0  0  0

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+    2.4396    5.2588    0.0000 H   0  0  0

+    6.3820   -2.9561    0.0000 H   0  0  0

+   -2.1382    1.1697    0.0000 H   0  0  0

+   -3.4921    1.1232    0.0000 H   0  0  0

+   -4.8636   -1.0777    0.0000 H   0  0  0

+   -4.5617    1.0238    0.0000 H   0  0  0

+   -5.8400    1.1534    0.0000 H   0  0  0

+   -3.0035   -1.8783    0.0000 H   0  0  0

+   -3.0470   -0.8074    0.0000 H   0  0  0

+   -6.8709   -0.8028    0.0000 H   0  0  0

+   -5.6052   -0.8928    0.0000 H   0  0  0

+   -4.9841   -2.8075    0.0000 H   0  0  0

+   -4.0237   -3.8777    0.0000 H   0  0  0

+   -2.9535   -2.9173    0.0000 H   0  0  0

+   -6.8149    1.4526    0.0000 H   0  0  0

+   -8.0807    1.5427    0.0000 H   0  0  0

+   -8.7824    1.2897    0.0000 H   0  0  0

+   -9.3498   -0.0315    0.0000 H   0  0  0

+   -8.0286   -0.5989    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+  4 10  1  0

+  5 11  1  0

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+  7 13  1  0

+  8 14  2  0

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+ 20 21  1  0

+ 21 22  1  0

+ 21 23  1  0

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+ 23 25  1  0

+ 24 26  1  0

+ 26 27  1  0

+ 12 18  1  0

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+  5 28  1  0

+  6 29  1  0

+  7 30  1  0

+  8 31  1  0

+ 11 32  1  0

+ 12 33  1  0

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+ 14 35  1  0

+ 18 36  1  0

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+ 24 45  1  0

+ 24 46  1  0

+ 25 47  1  0

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+ 25 49  1  0

+ 26 50  1  0

+ 26 51  1  0

+ 27 52  1  0

+ 27 53  1  0

+ 27 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2475-45-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -1.2705    0.7056    0.0514 C   0  0  0

+   -1.2705   -0.7056    0.0509 C   0  0  0

+    0.0001    1.4352    0.2043 C   0  0  0

+   -2.4755    1.3976   -0.0991 C   0  0  0

+    0.0000   -1.4354    0.2024 C   0  0  0

+   -2.4764   -1.3973   -0.0943 C   0  0  0

+    1.2704    0.7057    0.0502 C   0  0  0

+    0.0001    2.6263    0.4546 O   0  0  0

+   -3.6691    0.6879   -0.2487 C   0  0  0

+   -2.4860    2.7855   -0.0994 N   0  0  0

+    1.2704   -0.7059    0.0484 C   0  0  0

+    0.0001   -2.6266    0.4523 O   0  0  0

+   -3.6705   -0.6874   -0.2383 C   0  0  0

+   -2.4870   -2.7852   -0.0960 N   0  0  0

+    2.4757    1.3974   -0.0961 C   0  0  0

+    2.4757   -1.3975   -0.0983 C   0  0  0

+    3.6702    0.6874   -0.2413 C   0  0  0

+    2.4863    2.7852   -0.0966 N   0  0  0

+    3.6701   -0.6875   -0.2434 C   0  0  0

+    2.4863   -2.7853   -0.0993 N   0  0  0

+   -4.5747    1.2036    0.0000 H   0  0  0

+   -1.5874    3.3134    0.0000 H   0  0  0

+   -3.3924    3.2997    0.0000 H   0  0  0

+   -4.5766   -1.2022    0.0000 H   0  0  0

+   -3.3935   -3.2994    0.0000 H   0  0  0

+   -1.5885   -3.3132    0.0000 H   0  0  0

+    4.5760    1.2027    0.0000 H   0  0  0

+    3.3928    3.2994    0.0000 H   0  0  0

+    1.5878    3.3132    0.0000 H   0  0  0

+    4.5759   -1.2029    0.0000 H   0  0  0

+    1.5878   -3.3133    0.0000 H   0  0  0

+    3.3928   -3.2995    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  2  0

+  6 14  1  0

+  7 15  2  0

+ 11 16  2  0

+ 15 17  1  0

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+ 17 27  1  0

+ 18 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6237-24-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    0.8059    0.0187   -0.4208 C   0  0  0

+   -0.3484    0.8012   -0.6233 C   0  0  0

+    1.9753    0.6248    0.1088 C   0  0  0

+    0.8131   -1.3522   -0.7300 C   0  0  0

+   -0.2830    2.1672   -0.2847 C   0  0  0

+   -1.5025    0.2488   -1.1358 N   0  0  0

+    1.9914    1.9210    0.4153 N   0  0  0

+    3.1236   -0.1691    0.3067 C   0  0  0

+    1.9419   -2.0835   -0.5243 C   0  0  0

+    0.9245    2.6987    0.2403 C   0  0  0

+   -1.3945    3.0093   -0.4596 C   0  0  0

+   -2.2907   -0.2216    0.0111 C   0  0  0

+    3.0947   -1.4906   -0.0094 C   0  0  0

+    0.9769    4.0674    0.5751 C   0  0  0

+   -1.3027    4.3247   -0.1245 C   0  0  0

+   -3.5932   -0.8499   -0.4887 C   0  0  0

+    4.3052   -2.3160    0.2018 N   0  3  0

+   -0.1186    4.8506    0.3924 C   0  0  0

+   -4.4142   -1.3399    0.7058 C   0  0  0

+    4.2905   -3.5013   -0.0779 O   0  0  0

+    5.3159   -1.8097    0.6555 O   0  5  0

+   -5.6647   -1.9431    0.2260 N   0  0  0

+   -5.2913   -3.1531   -0.5186 C   0  0  0

+   -6.4015   -2.3902    1.4157 C   0  0  0

+   -0.0553   -1.8273    0.0000 H   0  0  0

+   -1.9703    1.1211    0.0000 H   0  0  0

+    4.0052    0.2810    0.0000 H   0  0  0

+    1.8925   -3.0721    0.0000 H   0  0  0

+   -2.2957    2.5999    0.0000 H   0  0  0

+   -2.3348   -1.2105    0.0000 H   0  0  0

+   -1.4410   -0.7294    0.0000 H   0  0  0

+    1.8656    4.5032    0.0000 H   0  0  0

+   -2.1133    4.8928    0.0000 H   0  0  0

+   -3.5491    0.1390    0.0000 H   0  0  0

+   -4.4429   -0.3421    0.0000 H   0  0  0

+   -0.0184    5.8354    0.0000 H   0  0  0

+   -4.4583   -2.3288    0.0000 H   0  0  0

+   -3.5645   -1.8477    0.0000 H   0  0  0

+   -6.2371   -3.4450    0.0000 H   0  0  0

+   -4.9994   -4.0989    0.0000 H   0  0  0

+   -4.3455   -2.8612    0.0000 H   0  0  0

+   -6.9150   -1.5440    0.0000 H   0  0  0

+   -7.2477   -2.9037    0.0000 H   0  0  0

+   -5.8880   -3.2364    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+  5 10  1  0

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+  7 10  2  0

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+ 23 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1162-65-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    1.4939    0.2307    0.3202 C   0  0  0

+    0.1209    0.3767    0.3248 C   0  0  0

+    2.6132    1.2351    0.5055 C   0  0  0

+    2.0817   -1.0161    0.1406 C   0  0  0

+   -0.6922   -0.7630    0.1048 C   0  0  0

+   -0.4357    1.5895    0.5662 O   0  0  0

+    3.8378    0.3043    0.7717 C   0  0  0

+    2.9687    1.8219   -0.8477 C   0  0  0

+    1.2740   -2.1457   -0.0246 C   0  0  0

+    3.4382   -0.9239    0.1445 O   0  0  0

+   -2.0834   -0.5701    0.0214 C   0  0  0

+   -0.1002   -2.0292   -0.0379 C   0  0  0

+   -1.6786    1.8782    0.0935 C   0  0  0

+    4.8482    0.9214   -0.0489 O   0  0  0

+    4.2443    1.5838   -1.0605 C   0  0  0

+   -2.6058    0.7302    0.0250 C   0  0  0

+   -3.2002   -1.5595   -0.0748 C   0  0  0

+   -0.8761   -3.1312   -0.1874 O   0  0  0

+   -2.0026    3.0001   -0.2482 O   0  0  0

+   -4.0491    0.7137   -0.0532 C   0  0  0

+   -4.4977   -0.7314   -0.1220 C   0  0  0

+    0.0092   -4.2467   -0.3060 C   0  0  0

+   -4.7743    1.6870   -0.0617 O   0  0  0

+    1.8159    1.8959    0.0000 H   0  0  0

+    4.6504   -0.3376    0.0000 H   0  0  0

+    2.5457    2.7671    0.0000 H   0  0  0

+    1.7083   -3.0858    0.0000 H   0  0  0

+    4.7481    2.4886    0.0000 H   0  0  0

+   -3.8356   -2.3772    0.0000 H   0  0  0

+   -2.4448   -2.2678    0.0000 H   0  0  0

+   -5.4555   -0.3377    0.0000 H   0  0  0

+   -4.9750   -1.6504    0.0000 H   0  0  0

+   -0.8019   -4.8905    0.0000 H   0  0  0

+    0.6530   -5.0578    0.0000 H   0  0  0

+    0.8203   -3.6029    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+ 16 20  1  0

+ 17 21  1  0

+ 18 22  1  0

+ 20 23  2  0

+  7 10  1  0

+  9 12  1  0

+ 13 16  1  0

+ 14 15  1  0

+ 20 21  1  0

+  3 24  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 21 31  1  0

+ 21 32  1  0

+ 22 33  1  0

+ 22 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+148193-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.0714    0.5008   -0.0017 C   0  0  0

+   -0.5563   -0.7665   -0.0007 C   0  0  0

+    1.5227    0.4097   -0.0008 C   0  0  0

+   -0.7709    1.6354    0.0020 C   0  0  0

+    0.8170   -1.8868    0.0013 S   0  0  0

+   -1.9275   -0.9026   -0.0010 C   0  0  0

+    2.0979   -0.7567    0.0008 N   0  0  0

+    2.2760    1.5404   -0.0020 O   0  0  0

+   -2.1217    1.4939    0.0064 C   0  0  0

+   -2.7226    0.2334   -0.0022 C   0  0  0

+    3.6435    1.1257   -0.0007 C   0  0  0

+   -4.1141    0.1178   -0.0025 N   0  0  0

+   -0.3497    2.5943    0.0000 H   0  0  0

+   -2.3647   -1.8543    0.0000 H   0  0  0

+   -2.7261    2.3492    0.0000 H   0  0  0

+    3.3396    0.1235    0.0000 H   0  0  0

+    4.6457    0.8218    0.0000 H   0  0  0

+    3.9474    2.1279    0.0000 H   0  0  0

+   -4.7110    0.9783    0.0000 H   0  0  0

+   -4.5609   -0.8294    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

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+ 10 12  1  0

+  5  7  1  0

+  9 10  1  0

+  4 13  1  0

+  6 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-09-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  5  4                          1 V2000

+    0.0000   -0.8902    0.0000 C   0  0  0

+   -1.4721    0.1508    0.0000 Cl  0  0  0

+    1.4721    0.1508    0.0000 Cl  0  0  0

+   -0.9005   -1.8990    0.0000 H   0  0  0

+    0.9005   -1.8990    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+577-71-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.1939    0.7888    0.0495 C   0  0  0

+    0.2112   -0.5310   -0.0301 C   0  0  0

+    0.7464    1.8004    0.1107 C   0  0  0

+   -1.6366    1.1193    0.0632 N   0  3  0

+    1.5569   -0.8417   -0.0488 C   0  0  0

+   -0.7982   -1.6117   -0.0950 N   0  3  0

+    2.0937    1.4949    0.0923 C   0  0  0

+   -2.0849    1.9228   -0.7349 O   0  0  0

+   -2.3755    0.5879    0.8726 O   0  5  0

+    2.5026    0.1718    0.0125 C   0  0  0

+   -0.4477   -2.7767   -0.0357 O   0  0  0

+   -1.9792   -1.3359   -0.2075 O   0  5  0

+    3.8273   -0.1313   -0.0062 O   0  0  0

+    0.4408    2.7901    0.0000 H   0  0  0

+    1.8596   -1.8323    0.0000 H   0  0  0

+    2.7975    2.2549    0.0000 H   0  0  0

+    4.8370   -0.3623    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+ 10 13  1  0

+  7 10  2  0

+  3 14  1  0

+  5 15  1  0

+  7 16  1  0

+ 13 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51568-18-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.6916    0.0621   -0.0005 C   0  0  0

+   -0.7051    0.6280    0.0001 C   0  0  0

+    1.8800    0.9887    0.0002 C   0  0  0

+    0.8585   -1.1339    0.0034 O   0  0  0

+   -1.7195   -0.5174   -0.0009 C   0  0  0

+    3.1498    0.1771   -0.0006 C   0  0  0

+   -3.1162    0.0485   -0.0003 C   0  0  0

+    4.4876    0.8710    0.0000 C   0  0  0

+    3.0953   -1.0292   -0.0016 O   0  0  0

+   -3.2832    1.2451    0.0008 O   0  0  0

+   -4.1747   -0.7769   -0.0010 O   0  0  0

+   -0.1650    1.6208    0.0000 H   0  0  0

+   -1.6305    1.2769    0.0000 H   0  0  0

+    2.5924    1.8661    0.0000 H   0  0  0

+    1.0887    1.7957    0.0000 H   0  0  0

+   -2.2596   -1.5102    0.0000 H   0  0  0

+   -0.7941   -1.1663    0.0000 H   0  0  0

+    5.0080   -0.1323    0.0000 H   0  0  0

+    5.4909    1.3914    0.0000 H   0  0  0

+    3.9672    1.8743    0.0000 H   0  0  0

+   -5.0660   -1.4719    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  2  1  0

+  6  3  1  0

+  7  5  1  0

+  8  6  1  0

+  9  6  2  0

+ 10  7  2  0

+ 11  7  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  3 15  1  0

+  5 16  1  0

+  5 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+420-12-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  7                          1 V2000

+   -0.9403    0.7650    0.0000 C   0  0  0

+   -0.9403   -0.7650    0.0000 C   0  0  0

+    0.7045    0.0000    0.0000 S   0  0  0

+   -0.5510    2.0686    0.0000 H   0  0  0

+   -2.2865    0.9617    0.0000 H   0  0  0

+   -2.2865   -0.9617    0.0000 H   0  0  0

+   -0.5510   -2.0686    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+496-14-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    0.1401    0.6929   -0.0703 C   0  0  0

+    0.1401   -0.6930   -0.0681 C   0  0  0

+    1.5809    1.1413   -0.1463 C   0  0  0

+   -1.0523    1.3837   -0.0040 C   0  0  0

+    1.5808   -1.1419   -0.1429 C   0  0  0

+   -1.0526   -1.3836   -0.0042 C   0  0  0

+    2.3711    0.0002    0.2352 O   0  0  0

+   -2.2476    0.6915    0.0648 C   0  0  0

+   -2.2481   -0.6912    0.0577 C   0  0  0

+    2.4899    1.6430    0.0000 H   0  0  0

+    1.1737    2.0963    0.0000 H   0  0  0

+   -1.0522    2.4219    0.0000 H   0  0  0

+    1.1735   -2.0969    0.0000 H   0  0  0

+    2.4898   -1.6435    0.0000 H   0  0  0

+   -1.0527   -2.4218    0.0000 H   0  0  0

+   -3.1470    1.2102    0.0000 H   0  0  0

+   -3.1477   -1.2095    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  6  9  2  0

+  5  7  1  0

+  8  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+65271-80-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 62                          1 V2000

+    0.7048   -0.5348   -0.0242 C   0  0  0

+   -0.7045   -0.5346    0.0307 C   0  0  0

+    1.3956    0.6811   -0.0528 C   0  0  0

+    1.4411   -1.8085   -0.0570 C   0  0  0

+   -1.3952    0.6815    0.0558 C   0  0  0

+   -1.4413   -1.8081    0.0607 C   0  0  0

+    0.6872    1.8846   -0.0271 C   0  0  0

+    2.7821    0.6917   -0.1063 N   0  0  0

+    0.7034   -3.0838   -0.0329 C   0  0  0

+    2.6570   -1.8086   -0.1045 O   0  0  0

+   -0.6866    1.8848    0.0264 C   0  0  0

+   -2.7816    0.6925    0.1102 N   0  0  0

+   -0.7041   -3.0836    0.0331 C   0  0  0

+   -2.6571   -1.8078    0.1087 O   0  0  0

+    3.5042    1.9660   -0.1363 C   0  0  0

+    1.3932   -4.2982   -0.0645 C   0  0  0

+   -3.5036    1.9669    0.1364 C   0  0  0

+   -1.3946   -4.2977    0.0615 C   0  0  0

+    5.0095    1.6979   -0.1939 C   0  0  0

+    0.6868   -5.4982   -0.0418 C   0  0  0

+    2.7486   -4.3085   -0.1169 O   0  0  0

+   -5.0088    1.6992    0.1960 C   0  0  0

+   -0.6888   -5.4980    0.0355 C   0  0  0

+   -2.7500   -4.3074    0.1147 O   0  0  0

+    5.7336    2.9756   -0.2240 N   0  0  0

+   -5.7327    2.9772    0.2223 N   0  0  0

+    7.1647    2.6486   -0.2786 C   0  0  0

+   -7.1638    2.6505    0.2791 C   0  0  0

+    7.9823    3.9414   -0.3123 C   0  0  0

+   -7.9813    3.9435    0.3090 C   0  0  0

+    7.7130    4.7061    0.8644 O   0  0  0

+   -7.7127    4.7042   -0.8705 O   0  0  0

+    1.2079    2.7951    0.0000 H   0  0  0

+    3.3136   -0.2125    0.0000 H   0  0  0

+   -1.2071    2.7954    0.0000 H   0  0  0

+   -3.3133   -0.2116    0.0000 H   0  0  0

+    3.8035    2.9713    0.0000 H   0  0  0

+    2.5391    2.3768    0.0000 H   0  0  0

+   -2.5385    2.3776    0.0000 H   0  0  0

+   -3.8027    2.9722    0.0000 H   0  0  0

+    4.7102    0.6926    0.0000 H   0  0  0

+    5.9746    1.2871    0.0000 H   0  0  0

+    1.2073   -6.4088    0.0000 H   0  0  0

+    3.7974   -4.3165    0.0000 H   0  0  0

+   -5.9740    1.2886    0.0000 H   0  0  0

+   -4.7097    0.6939    0.0000 H   0  0  0

+   -1.2097   -6.4084    0.0000 H   0  0  0

+   -3.7988   -4.3149    0.0000 H   0  0  0

+    5.3104    3.9353    0.0000 H   0  0  0

+   -5.3093    3.9368    0.0000 H   0  0  0

+    6.8172    1.6590    0.0000 H   0  0  0

+    8.1088    2.1916    0.0000 H   0  0  0

+   -8.1079    2.1936    0.0000 H   0  0  0

+   -6.8164    1.6608    0.0000 H   0  0  0

+    8.7230    3.1988    0.0000 H   0  0  0

+    8.8702    4.4998    0.0000 H   0  0  0

+   -8.8689    4.5024    0.0000 H   0  0  0

+   -8.7223    3.2012    0.0000 H   0  0  0

+    7.3646    5.6954    0.0000 H   0  0  0

+   -7.3635    5.6932    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  5 11  2  0

+  5 12  1  0

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+  6 14  2  0

+  8 15  1  0

+  9 16  1  0

+ 12 17  1  0

+ 13 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 16 21  1  0

+ 17 22  1  0

+ 18 23  2  0

+ 18 24  1  0

+ 19 25  1  0

+ 22 26  1  0

+ 25 27  1  0

+ 26 28  1  0

+ 27 29  1  0

+ 28 30  1  0

+ 29 31  1  0

+ 30 32  1  0

+  7 11  1  0

+  9 13  2  0

+ 20 23  1  0

+  7 33  1  0

+  8 34  1  0

+ 11 35  1  0

+ 12 36  1  0

+ 15 37  1  0

+ 15 38  1  0

+ 17 39  1  0

+ 17 40  1  0

+ 19 41  1  0

+ 19 42  1  0

+ 20 43  1  0

+ 21 44  1  0

+ 22 45  1  0

+ 22 46  1  0

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+ 24 48  1  0

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+ 27 52  1  0

+ 28 53  1  0

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+ 29 55  1  0

+ 29 56  1  0

+ 30 57  1  0

+ 30 58  1  0

+ 31 59  1  0

+ 32 60  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96563-08-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.7786   -0.4800   -0.0359 C   0  0  0

+   -0.6987   -0.3400   -0.0419 C   0  0  0

+    1.3638    0.7741   -0.1852 C   0  0  0

+    1.5943   -1.6056    0.0941 C   0  0  0

+   -1.0366    1.0017   -0.1950 C   0  0  0

+   -1.7124   -1.2928    0.0754 C   0  0  0

+    0.2491    1.7855   -0.2947 C   0  0  0

+    2.7366    0.9020   -0.2091 C   0  0  0

+    2.9664   -1.4685    0.0674 C   0  0  0

+   -2.3607    1.3851   -0.2303 C   0  0  0

+   -3.0340   -0.9002    0.0390 C   0  0  0

+   -1.3627   -2.7493    0.2412 C   0  0  0

+    0.3377    2.7705    0.8728 C   0  0  0

+    3.5389   -0.2182   -0.0844 C   0  0  0

+   -3.3601    0.4356   -0.1134 C   0  0  0

+    1.1707   -2.5490    0.0000 H   0  0  0

+    1.2125    2.1615    0.0000 H   0  0  0

+    3.1660    1.8428    0.0000 H   0  0  0

+    3.5677   -2.3099    0.0000 H   0  0  0

+   -2.6055    2.3899    0.0000 H   0  0  0

+   -3.7831   -1.6132    0.0000 H   0  0  0

+   -2.3683   -2.9907    0.0000 H   0  0  0

+   -1.1213   -3.7549    0.0000 H   0  0  0

+   -0.3571   -2.5079    0.0000 H   0  0  0

+    1.3677    2.6778    0.0000 H   0  0  0

+    0.4304    3.8005    0.0000 H   0  0  0

+   -0.6923    2.8632    0.0000 H   0  0  0

+    4.5683   -0.1190    0.0000 H   0  0  0

+   -4.3524    0.7271    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  2  0

+  5  7  1  0

+  9 14  1  0

+ 11 15  1  0

+  4 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+331-39-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.1038   -0.1492   -0.0043 C   0  0  0

+   -1.1108   -1.1216   -0.0032 C   0  0  0

+   -0.4470    1.2079   -0.0026 C   0  0  0

+    1.3095   -0.5519   -0.0011 C   0  0  0

+   -2.4370   -0.7369   -0.0004 C   0  0  0

+   -1.7725    1.5825    0.0002 C   0  0  0

+    2.2797    0.3883   -0.0022 C   0  0  0

+   -2.7707    0.6170    0.0013 C   0  0  0

+   -3.4179   -1.6788    0.0002 O   0  0  0

+    3.6432   -0.0002    0.0009 C   0  0  0

+   -4.0759    0.9926    0.0040 O   0  0  0

+    4.6123    0.9387   -0.0002 O   0  0  0

+    3.9395   -1.1801    0.0045 O   0  0  0

+   -0.8618   -2.1269    0.0000 H   0  0  0

+    0.2954    1.9300    0.0000 H   0  0  0

+    1.5618   -1.5564    0.0000 H   0  0  0

+   -2.0254    2.5868    0.0000 H   0  0  0

+    2.0274    1.3928    0.0000 H   0  0  0

+   -4.1649   -2.3961    0.0000 H   0  0  0

+   -5.0712    1.2790    0.0000 H   0  0  0

+    5.3561    1.6593    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  5  8  2  0

+  5  9  1  0

+  7 10  1  0

+  8 11  1  0

+ 10 12  1  0

+ 10 13  2  0

+  6  8  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+130-26-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -1.6267    1.1776   -0.0023 C   0  0  0

+   -2.3389   -0.0472   -0.0018 C   0  0  0

+   -0.2167    1.1502   -0.0015 C   0  0  0

+   -2.2938    2.3350    0.0022 N   0  0  0

+   -1.6321   -1.2621   -0.0002 C   0  0  0

+   -3.7455   -0.0181   -0.0026 C   0  0  0

+    0.4361   -0.0498   -0.0003 C   0  0  0

+    0.4889    2.3115   -0.0014 O   0  0  0

+   -3.6046    2.3663    0.0069 C   0  0  0

+   -0.2695   -1.2507    0.0010 C   0  0  0

+   -2.4913   -2.7706    0.0009 Cl  0  0  0

+   -4.3652    1.1995   -0.0037 C   0  0  0

+    2.5308   -0.0843    0.0001 I   0  0  0

+   -4.3007   -0.9030    0.0000 H   0  0  0

+    1.0313    3.2043    0.0000 H   0  0  0

+   -4.0913    3.2906    0.0000 H   0  0  0

+    0.2531   -2.1552    0.0000 H   0  0  0

+   -5.4083    1.2553    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 10  1  0

+  9 12  2  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146795-46-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -2.4959   -0.5235   -0.4251 C   0  0  0

+   -3.5542    0.2040    0.1045 C   0  0  0

+   -1.2294    0.0598   -0.5337 N   0  0  0

+   -2.6969   -1.8330   -0.8411 C   0  0  0

+   -4.8033   -0.3749    0.2107 C   0  0  0

+   -3.3430    1.5982    0.5548 N   0  3  0

+   -0.1548   -0.5596   -0.0064 C   0  0  0

+   -3.9477   -2.4080   -0.7272 C   0  0  0

+   -5.0014   -1.6777   -0.2094 C   0  0  0

+   -3.8122    1.9736    1.6142 O   0  0  0

+   -2.7000    2.3699   -0.1341 O   0  5  0

+    1.1931   -0.0127   -0.2300 C   0  0  0

+   -0.2990   -1.5707    0.6545 O   0  0  0

+    2.3642   -0.6491    0.3189 C   0  0  0

+    1.3923    1.1286   -0.9791 C   0  0  0

+    3.5540   -0.0728    0.0584 C   0  0  0

+    3.1107    1.3373   -0.9352 S   0  0  0

+    4.9015   -0.5072    0.4908 N   0  3  0

+    5.8828    0.1358    0.1636 O   0  0  0

+    5.0289   -1.5077    1.1736 O   0  5  0

+   -1.1842    1.0503    0.0000 H   0  0  0

+   -1.9052   -2.4300    0.0000 H   0  0  0

+   -5.5963    0.2203    0.0000 H   0  0  0

+   -4.0344   -3.3957    0.0000 H   0  0  0

+   -5.9120   -2.0701    0.0000 H   0  0  0

+    2.3410   -1.6403    0.0000 H   0  0  0

+    0.7096    1.8477    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+  7 13  2  0

+ 12 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+ 18 19  2  0

+ 18 20  1  0

+  8  9  2  0

+ 16 17  1  0

+  3 21  1  0

+  4 22  1  0

+  5 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-54-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.5307    0.2118    0.0037 C   0  0  0

+   -0.6201   -0.8279    0.0029 C   0  0  0

+   -1.0864    1.5211    0.0027 C   0  0  0

+   -2.9824   -0.0766   -0.0007 N   0  3  0

+    0.7369   -0.5588    0.0012 C   0  0  0

+    0.2689    1.7917    0.0011 C   0  0  0

+   -3.7853    0.8393    0.0000 O   0  0  0

+   -3.3742   -1.2299   -0.0050 O   0  5  0

+    1.1819    0.7522    0.0003 C   0  0  0

+    1.8812   -1.8643    0.0008 Cl  0  0  0

+    2.8844    1.0916   -0.0023 Cl  0  0  0

+   -0.9542   -1.8102    0.0000 H   0  0  0

+   -1.7708    2.3009    0.0000 H   0  0  0

+    0.6017    2.7745    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  9 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+135086-92-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -2.1400   -0.5861   -0.0007 C   0  0  0

+   -3.6102   -0.6019   -0.0010 C   0  0  0

+   -1.7612    0.7554    0.0005 C   0  0  0

+   -1.2066   -1.5508    0.0035 N   0  0  0

+   -4.0221    0.7418    0.0002 C   0  0  0

+   -4.5617   -1.6223   -0.0024 C   0  0  0

+   -2.8965    1.5374    0.0010 N   0  0  0

+   -0.3808    1.0680    0.0010 C   0  0  0

+    0.0489   -1.2733    0.0026 N   0  0  0

+   -5.3838    1.0356    0.0002 C   0  0  0

+   -5.8926   -1.3119   -0.0028 C   0  0  0

+    0.5067    0.0490    0.0003 N   0  0  0

+   -0.0020    2.2276    0.0017 O   0  0  0

+   -6.3061    0.0129   -0.0009 C   0  0  0

+    1.8820    0.3158    0.0007 N   0  0  0

+    2.7341   -0.6652    0.0000 C   0  0  0

+    4.1811   -0.3844    0.0005 C   0  0  0

+    5.1003   -1.4367   -0.0003 C   0  0  0

+    4.6402    0.9355   -0.0041 C   0  0  0

+    6.4529   -1.1663    0.0002 C   0  0  0

+    5.9954    1.1905   -0.0036 C   0  0  0

+    6.9001    0.1431    0.0014 C   0  0  0

+   -4.2593   -2.6153    0.0000 H   0  0  0

+   -2.9028    2.5754    0.0000 H   0  0  0

+   -5.7027    2.0234    0.0000 H   0  0  0

+   -6.5992   -2.0723    0.0000 H   0  0  0

+   -7.3201    0.2350    0.0000 H   0  0  0

+    2.3958   -1.6465    0.0000 H   0  0  0

+    4.7661   -2.4195    0.0000 H   0  0  0

+    3.9628    1.7220    0.0000 H   0  0  0

+    7.1370   -1.9470    0.0000 H   0  0  0

+    6.3378    2.1704    0.0000 H   0  0  0

+    7.9191    0.3408    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+ 16 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+ 22 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+38083-17-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 38                          1 V2000

+   -1.2050    0.0393   -0.0413 C   0  0  0

+   -1.4057   -1.4033    0.1163 N   0  0  0

+   -0.4068    0.2853   -1.2008 O   0  0  0

+   -2.5413    0.7182   -0.1983 C   0  0  0

+   -1.5452   -2.0796    1.2982 C   0  0  0

+   -1.4937   -2.3134   -0.8775 C   0  0  0

+    0.8898    0.2825   -0.7929 C   0  0  0

+   -2.7856    2.0587    0.4454 C   0  0  0

+   -3.4163    0.1880   -0.8398 O   0  0  0

+   -1.7080   -3.3795    0.9864 C   0  0  0

+   -1.6724   -3.4934   -0.3495 N   0  0  0

+    1.9070    0.4977   -1.7109 C   0  0  0

+    1.1971    0.0701    0.5433 C   0  0  0

+   -4.2032    2.5315    0.1168 C   0  0  0

+   -2.6289    1.9324    1.9621 C   0  0  0

+   -1.7728    3.0733   -0.0892 C   0  0  0

+    3.2244    0.4949   -1.2942 C   0  0  0

+    2.5153    0.0681    0.9560 C   0  0  0

+    3.5291    0.2778    0.0376 C   0  0  0

+    5.1851    0.2743    0.5586 Cl  0  0  0

+   -1.1285    0.9311    0.0000 H   0  0  0

+   -2.4283   -1.9335    0.0000 H   0  0  0

+   -0.6054   -2.4235    0.0000 H   0  0  0

+   -2.5995   -3.4592    0.0000 H   0  0  0

+    1.8148    1.3880    0.0000 H   0  0  0

+    0.9299   -0.7842    0.0000 H   0  0  0

+   -3.9200    3.3806    0.0000 H   0  0  0

+   -5.0523    2.8147    0.0000 H   0  0  0

+   -4.4864    1.6824    0.0000 H   0  0  0

+   -3.1906    1.2355    0.0000 H   0  0  0

+   -1.9320    1.3707    0.0000 H   0  0  0

+   -2.0672    2.6293    0.0000 H   0  0  0

+   -1.1393    2.4409    0.0000 H   0  0  0

+   -1.1404    3.7068    0.0000 H   0  0  0

+   -2.4063    3.7057    0.0000 H   0  0  0

+    3.4980    1.3472    0.0000 H   0  0  0

+    2.6058   -0.8224    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+963-89-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    0.6942    0.1587    0.0028 C   0  0  0

+    0.2708   -1.1956    0.0000 C   0  0  0

+    2.1372    0.4475    0.0024 C   0  0  0

+   -0.1770    1.1556    0.0003 N   0  0  0

+   -1.0913   -1.5002    0.0001 C   0  0  0

+    1.2594   -2.2714   -0.0036 C   0  0  0

+    3.0583   -0.6202   -0.0007 C   0  0  0

+    2.6034    1.7640    0.0046 C   0  0  0

+   -1.4888    0.9354   -0.0046 C   0  0  0

+   -2.0011   -0.4376    0.0031 C   0  0  0

+   -1.5672   -2.9301   -0.0024 C   0  0  0

+    2.5790   -1.9994   -0.0040 C   0  0  0

+    4.4318   -0.3422   -0.0012 C   0  0  0

+    3.9584    2.0057    0.0036 C   0  0  0

+   -2.4136    1.9976   -0.0078 C   0  0  0

+   -3.3920   -0.6496    0.0040 C   0  0  0

+    4.8640    0.9523    0.0014 C   0  0  0

+   -3.7458    1.7275   -0.0133 C   0  0  0

+   -4.2306    0.4209    0.0075 C   0  0  0

+   -5.7197    0.1888    0.0078 C   0  0  0

+    0.9372   -3.2699    0.0000 H   0  0  0

+    1.9247    2.5641    0.0000 H   0  0  0

+   -2.5627   -2.5988    0.0000 H   0  0  0

+   -1.8985   -3.9256    0.0000 H   0  0  0

+   -0.5717   -3.2614    0.0000 H   0  0  0

+    3.2706   -2.7883    0.0000 H   0  0  0

+    5.1269   -1.1281    0.0000 H   0  0  0

+    4.3103    2.9941    0.0000 H   0  0  0

+   -2.0764    2.9911    0.0000 H   0  0  0

+   -3.7787   -1.6249    0.0000 H   0  0  0

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+   -4.4279    2.5247    0.0000 H   0  0  0

+   -5.8813    1.2254    0.0000 H   0  0  0

+   -6.7563    0.0272    0.0000 H   0  0  0

+   -5.5581   -0.8478    0.0000 H   0  0  0

+  1  2  2  0

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+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+610-48-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -2.5907   -2.4639    0.0001 C   0  0  0

+   -2.3924   -0.9700    0.0012 C   0  0  0

+   -1.0901   -0.4264    0.0010 C   0  0  0

+   -3.4655   -0.1382   -0.0031 C   0  0  0

+   -0.9354    1.0321    0.0016 C   0  0  0

+    0.0339   -1.2508    0.0006 C   0  0  0

+   -3.3184    1.2489   -0.0027 C   0  0  0

+    0.3364    1.6025    0.0009 C   0  0  0

+   -2.0946    1.8370    0.0025 C   0  0  0

+    1.3053   -0.6803    0.0008 C   0  0  0

+    1.4599    0.7782   -0.0004 C   0  0  0

+    2.4651   -1.4851   -0.0001 C   0  0  0

+    2.7625    1.3222   -0.0006 C   0  0  0

+    3.6884   -0.8969   -0.0003 C   0  0  0

+    3.8355    0.4907   -0.0014 C   0  0  0

+   -3.6278   -2.3262    0.0000 H   0  0  0

+   -2.7284   -3.5010    0.0000 H   0  0  0

+   -1.5536   -2.6016    0.0000 H   0  0  0

+   -4.4279   -0.5484    0.0000 H   0  0  0

+   -0.0763   -2.2911    0.0000 H   0  0  0

+   -4.1733    1.8518    0.0000 H   0  0  0

+    0.4468    2.6428    0.0000 H   0  0  0

+   -2.0115    2.8799    0.0000 H   0  0  0

+    2.3823   -2.5280    0.0000 H   0  0  0

+    2.9000    2.3593    0.0000 H   0  0  0

+    4.5434   -1.4997    0.0000 H   0  0  0

+    4.7979    0.9009    0.0000 H   0  0  0

+  2  1  1  0

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+ 10  6  2  0

+ 11  8  2  0

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+  8 22  1  0

+  9 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+149-29-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    0.2420    0.8955   -0.1149 C   0  0  0

+   -0.0448   -0.5246    0.1920 C   0  0  0

+    1.5725    1.0284   -0.1769 O   0  0  0

+   -0.7844    1.7473   -0.2891 C   0  0  0

+    1.1340   -1.1475    0.2636 C   0  0  0

+   -1.4625   -0.9994    0.3771 C   0  0  0

+    2.1443   -0.1777    0.0320 C   0  0  0

+   -2.1737    1.1549   -0.1750 C   0  0  0

+   -2.2317    0.1315    0.8098 O   0  0  0

+   -1.9729   -1.4732   -0.8707 O   0  0  0

+    3.3414   -0.3986    0.0234 O   0  0  0

+   -0.6398    2.7388    0.0000 H   0  0  0

+    1.2732   -2.1397    0.0000 H   0  0  0

+   -0.9511   -1.8610    0.0000 H   0  0  0

+   -2.4214    2.1258    0.0000 H   0  0  0

+   -3.1710    1.0583    0.0000 H   0  0  0

+   -2.7072   -2.1549    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  5  7  1  0

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+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+215-58-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.2641    0.7070   -0.0036 C   0  0  0

+   -0.2635   -0.7096   -0.0030 C   0  0  0

+    1.0154    1.4416   -0.0021 C   0  0  0

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+   -1.4592   -1.4080   -0.0039 C   0  0  0

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+    0.1291   -3.3703    0.0000 H   0  0  0

+    4.3465    0.9265    0.0000 H   0  0  0

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+   -3.9184    2.4439    0.0000 H   0  0  0

+    4.3478   -0.9205    0.0000 H   0  0  0

+    2.2379   -4.5600    0.0000 H   0  0  0

+   -3.9189   -2.4457    0.0000 H   0  0  0

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+   -5.9793    1.2121    0.0000 H   0  0  0

+    4.3359   -3.3417    0.0000 H   0  0  0

+   -5.9793   -1.2135    0.0000 H   0  0  0

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+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58086-32-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 45                          1 V2000

+    2.2528    0.2193    0.1226 C   0  0  0

+    0.8866    0.3740   -0.0911 C   0  0  0

+    3.3621    1.2439    0.2440 C   0  0  1

+    2.8275   -1.0340    0.2598 C   0  0  0

+    0.0892   -0.7828   -0.1189 C   0  0  0

+    0.4046    1.6056   -0.2875 O   0  0  0

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+    3.9025    1.5474   -1.1408 C   0  0  0

+    4.1732   -0.9424    0.4376 O   0  0  0

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+    0.6615   -2.0537    0.0074 C   0  0  0

+   -0.8942    1.7974   -0.0351 C   0  0  0

+    5.6415    0.8300    0.0602 O   0  0  0

+    5.1887    1.2741   -1.1333 C   0  0  0

+   -1.8406    0.7687   -0.0261 C   0  0  0

+   -2.1158   -1.5303   -0.5651 O   0  0  0

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+    0.7468   -4.2869    0.1024 C   0  0  0

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+   -5.2933    0.0425   -0.5766 O   0  0  0

+   -4.0053   -1.0611    0.8552 O   0  0  0

+   -6.2655   -1.0357   -0.6002 C   0  0  0

+    2.7553    2.0783    0.0000 H   0  0  0

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+    1.5646   -3.6578    0.0000 H   0  0  0

+   -2.9857    4.3378    0.0000 H   0  0  0

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+  1  2  1  0

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+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  2  0

+ 11 16  1  0

+ 11 17  2  0

+ 12 18  1  0

+ 13 19  1  0

+ 16 20  1  0

+ 18 21  1  0

+ 19 22  2  0

+ 20 23  2  0

+ 20 24  1  0

+ 24 25  1  0

+ 24 26  2  0

+ 25 27  1  0

+  7  9  1  0

+ 10 12  2  0

+ 13 16  2  0

+ 14 15  1  0

+ 22 23  1  0

+  3 28  1  0

+  7 29  1  0

+  8 30  1  0

+ 10 31  1  0

+ 15 32  1  0

+ 19 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+ 27 39  1  0

+ 27 40  1  0

+ 27 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+641-38-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.9135   -0.3737    0.0313 C   0  0  0

+   -0.5593   -0.4700    0.0406 C   0  0  0

+    1.5076    0.8828    0.2329 C   0  0  0

+    1.7098   -1.4971   -0.1777 C   0  0  0

+   -1.2947    0.7396   -0.0041 C   0  0  0

+   -1.2274   -1.6810    0.0910 C   0  0  0

+    0.7298    1.9764    0.4407 O   0  0  0

+    2.8882    0.9952    0.2213 C   0  0  0

+    3.0819   -1.3721   -0.1847 C   0  0  0

+    1.0725   -2.8454   -0.3951 C   0  0  0

+   -0.5341    1.9957   -0.0531 C   0  0  0

+   -2.6911    0.7076   -0.0010 C   0  0  0

+   -2.6165   -1.6989    0.0958 C   0  0  0

+    3.6723   -0.1286    0.0155 C   0  0  0

+   -1.0174    3.0112   -0.5167 O   0  0  0

+   -3.3419   -0.5144    0.0486 C   0  0  0

+   -3.4029    1.8616   -0.0456 O   0  0  0

+   -3.2724   -2.8862    0.1459 O   0  0  0

+    5.0258   -0.0145    0.0048 O   0  0  0

+   -0.6943   -2.5708    0.0000 H   0  0  0

+    3.3302    1.9336    0.0000 H   0  0  0

+    3.6754   -2.2228    0.0000 H   0  0  0

+    0.1347   -2.4021    0.0000 H   0  0  0

+    0.6292   -3.7832    0.0000 H   0  0  0

+    2.0103   -3.2887    0.0000 H   0  0  0

+   -4.3787   -0.5456    0.0000 H   0  0  0

+   -3.9475    2.7445    0.0000 H   0  0  0

+   -3.7740   -3.7942    0.0000 H   0  0  0

+    6.0594    0.0726    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  8 14  2  0

+ 11 15  2  0

+ 12 16  1  0

+ 12 17  1  0

+ 13 18  1  0

+ 14 19  1  0

+  7 11  1  0

+  9 14  1  0

+ 13 16  2  0

+  6 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+27532-75-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.9280    0.3942   -0.0039 C   0  0  0

+   -0.8223   -1.0686   -0.0024 C   0  0  0

+    0.2225    1.1804   -0.0031 C   0  0  0

+   -2.2118    0.9814   -0.0001 C   0  0  0

+    0.4292   -1.6813   -0.0003 C   0  0  0

+   -2.0083   -1.8343   -0.0027 C   0  0  0

+    1.4744    0.5677   -0.0010 C   0  0  0

+    0.1139    2.6835   -0.0052 C   0  0  0

+   -3.3119    0.1862    0.0047 C   0  0  0

+    1.5801   -0.8949    0.0005 C   0  0  0

+   -3.2113   -1.2056   -0.0044 C   0  0  0

+    2.6604    1.3332    0.0008 C   0  0  0

+   -4.6776    0.8232    0.0087 C   0  0  0

+    2.8636   -1.4822    0.0021 C   0  0  0

+    3.8634    0.7045    0.0039 C   0  0  0

+    3.9639   -0.6872    0.0024 C   0  0  0

+   -2.3147    2.0229    0.0000 H   0  0  0

+    0.5046   -2.7251    0.0000 H   0  0  0

+   -1.9603   -2.8797    0.0000 H   0  0  0

+    1.1577    2.7589    0.0000 H   0  0  0

+    0.0385    3.7273    0.0000 H   0  0  0

+   -0.9299    2.6081    0.0000 H   0  0  0

+   -4.0863   -1.7797    0.0000 H   0  0  0

+    2.6125    2.3786    0.0000 H   0  0  0

+   -4.2352    1.7716    0.0000 H   0  0  0

+   -5.6260    1.2656    0.0000 H   0  0  0

+   -5.1200   -0.1252    0.0000 H   0  0  0

+    2.9663   -2.5237    0.0000 H   0  0  0

+    4.7384    1.2786    0.0000 H   0  0  0

+    4.9123   -1.1297    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+  7 10  2  0

+  9 11  1  0

+ 15 16  1  0

+  4 17  1  0

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+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+ 11 23  1  0

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+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2358-84-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 34                          1 V2000

+   -2.7082   -0.5124    0.0791 O   0  0  0

+   -3.7205    0.3295    0.3680 C   0  0  0

+   -2.1412   -1.3504    1.1206 C   0  0  0

+   -4.2943    1.1776   -0.6860 C   0  0  0

+   -4.1586    0.3872    1.5001 O   0  0  0

+   -1.0164   -2.2044    0.5321 C   0  0  0

+   -3.7510    1.1061   -2.0899 C   0  0  0

+   -5.2937    2.0089   -0.4008 C   0  0  0

+    0.0000   -1.3525    0.0001 O   0  0  0

+    1.0165   -2.2045   -0.5317 C   0  0  0

+    2.1413   -1.3505   -1.1204 C   0  0  0

+    2.7082   -0.5123   -0.0790 O   0  0  0

+    3.7205    0.3296   -0.3680 C   0  0  0

+    4.2942    1.1779    0.6859 C   0  0  0

+    4.1586    0.3871   -1.5002 O   0  0  0

+    3.7510    1.1065    2.0897 C   0  0  0

+    5.2936    2.0091    0.4006 C   0  0  0

+   -2.9986   -1.5065    0.0000 H   0  0  0

+   -2.3438   -2.1980    0.0000 H   0  0  0

+   -1.5937   -2.8573    0.0000 H   0  0  0

+   -0.4084   -2.8287    0.0000 H   0  0  0

+   -3.8647    0.2421    0.0000 H   0  0  0

+   -2.8870    0.9924    0.0000 H   0  0  0

+   -3.6373    1.9701    0.0000 H   0  0  0

+   -5.1461    2.8678    0.0000 H   0  0  0

+   -6.1113    1.7073    0.0000 H   0  0  0

+    0.4085   -2.8288    0.0000 H   0  0  0

+    1.5938   -2.8574    0.0000 H   0  0  0

+    2.3440   -2.1981    0.0000 H   0  0  0

+    2.9987   -1.5065    0.0000 H   0  0  0

+    3.6374    1.9706    0.0000 H   0  0  0

+    2.8869    0.9929    0.0000 H   0  0  0

+    3.8646    0.2424    0.0000 H   0  0  0

+    6.1112    1.7075    0.0000 H   0  0  0

+    5.1460    2.8680    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  6  9  1  0

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+ 11 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-05-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+    0.9620   -0.2012    0.0648 C   0  0  0

+   -0.3542   -0.8732   -0.3316 C   0  0  0

+    2.1360   -1.0281   -0.4632 C   0  0  0

+    1.0169    1.1838   -0.5265 C   0  0  0

+   -1.5282   -0.0463    0.1964 C   0  0  0

+    3.1310   -1.2831    0.6707 C   0  0  0

+    1.1254    2.1451    0.1963 O   0  0  0

+   -2.8443   -0.7183   -0.2000 C   0  0  0

+   -4.0184    0.1086    0.3280 C   0  0  0

+    1.9276    0.2757    0.0000 H   0  0  0

+   -1.1080   -1.6424    0.0000 H   0  0  0

+    0.2836   -1.7410    0.0000 H   0  0  0

+    1.2204   -1.5951    0.0000 H   0  0  0

+    2.2989   -2.0927    0.0000 H   0  0  0

+   -0.0570    1.2656    0.0000 H   0  0  0

+   -0.7744    0.7229    0.0000 H   0  0  0

+   -2.1660    0.8215    0.0000 H   0  0  0

+    2.8636   -2.3264    0.0000 H   0  0  0

+    4.1743   -1.5505    0.0000 H   0  0  0

+    3.3984   -0.2398    0.0000 H   0  0  0

+   -3.5981   -1.4875    0.0000 H   0  0  0

+   -2.2065   -1.5861    0.0000 H   0  0  0

+   -3.3983    0.9891    0.0000 H   0  0  0

+   -4.8989    0.7287    0.0000 H   0  0  0

+   -4.6385   -0.7719    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  8  9  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+  9 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15176-29-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    0.9482   -0.7910    0.4304 C   0  0  2

+   -0.4926   -0.5495    0.3206 N   0  0  0

+    1.6281    0.4585    0.6799 O   0  0  0

+    1.4949   -1.2726   -0.9318 C   0  0  0

+   -0.9547    0.7270    0.1498 C   0  0  0

+   -1.3486   -1.5856    0.3832 C   0  0  0

+    2.9905    0.2425    0.2519 C   0  0  1

+    2.8693   -0.5771   -1.0519 C   0  0  1

+   -2.2826    0.9495    0.0486 C   0  0  0

+   -2.6770   -1.3924    0.2852 N   0  0  0

+   -0.9160   -2.7124    0.5300 O   0  0  0

+    3.6493    1.5895   -0.0519 C   0  0  0

+    3.9012   -1.5649   -1.0913 O   0  0  0

+   -3.1727   -0.1491    0.1219 C   0  0  0

+   -2.8103    2.3485   -0.1393 C   0  0  0

+    3.6802    2.3833    1.1360 O   0  0  0

+   -4.3745    0.0267    0.0336 O   0  0  0

+   -2.9069    2.6606   -1.6340 C   0  0  0

+    0.5143   -1.7028    0.0000 H   0  0  0

+    0.7370   -1.9399    0.0000 H   0  0  0

+    2.0611   -2.1088    0.0000 H   0  0  0

+   -0.3082    1.5028    0.0000 H   0  0  0

+    3.9550   -0.0567    0.0000 H   0  0  0

+    3.8246   -0.2497    0.0000 H   0  0  0

+   -3.3024   -2.1852    0.0000 H   0  0  0

+    4.3234    0.8377    0.0000 H   0  0  0

+    4.5993    1.9320    0.0000 H   0  0  0

+    4.6307   -2.2632    0.0000 H   0  0  0

+   -3.7993    2.5523    0.0000 H   0  0  0

+   -3.4660    1.5805    0.0000 H   0  0  0

+    3.7195    3.3923    0.0000 H   0  0  0

+   -1.9422    2.9592    0.0000 H   0  0  0

+   -3.2055    3.6253    0.0000 H   0  0  0

+   -3.8716    2.3620    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  7  8  1  0

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+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58-93-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -1.2743    0.0217   -0.0288 C   0  0  0

+   -1.2038   -1.3607   -0.0294 C   0  0  0

+   -0.1084    0.7712   -0.0350 C   0  0  0

+   -2.8201    0.8696   -0.0061 S   0  0  0

+    0.0447   -1.9843   -0.0185 C   0  0  0

+   -2.3354   -2.1757   -0.0580 N   0  0  0

+    1.1244    0.1504   -0.0301 C   0  0  0

+   -3.8375   -0.3749   -0.4141 N   0  0  0

+   -3.0912    1.1950    1.3503 O   0  0  0

+   -2.8113    1.7710   -1.1046 O   0  0  0

+    1.2006   -1.2318   -0.0188 C   0  0  0

+   -3.6614   -1.6601    0.2836 C   0  0  0

+    2.5985    1.1156   -0.0382 S   0  0  0

+    2.7489   -2.0168   -0.0045 Cl  0  0  0

+    3.4457    0.7369    1.3334 N   0  0  0

+    3.3764    0.6233   -1.1207 O   0  0  0

+    2.1787    2.4630    0.1270 O   0  0  0

+   -0.1628    1.8086    0.0000 H   0  0  0

+    0.1038   -3.0215    0.0000 H   0  0  0

+   -2.2042   -3.2063    0.0000 H   0  0  0

+   -4.8375   -0.0932    0.0000 H   0  0  0

+   -4.6997   -1.6260    0.0000 H   0  0  0

+   -3.8697   -2.6779    0.0000 H   0  0  0

+    3.5528   -0.2964    0.0000 H   0  0  0

+    4.2871    1.3463    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  4 10  2  0

+  5 11  2  0

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+ 13 17  2  0

+  7 11  1  0

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+  3 18  1  0

+  5 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89-83-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.6324    0.1098    0.0024 C   0  0  0

+    0.1419   -1.0416   -0.0003 C   0  0  0

+   -0.0240    1.3498    0.0040 C   0  0  0

+   -2.1359    0.0075   -0.0025 C   0  0  0

+    1.5256   -0.9441   -0.0015 C   0  0  0

+   -0.4543   -2.2628   -0.0014 O   0  0  0

+    1.3556    1.4443    0.0028 C   0  0  0

+   -2.6975    0.6869    1.2480 C   0  0  0

+   -2.6899    0.6980   -1.2504 C   0  0  0

+    2.1293    0.2987    0.0001 C   0  0  0

+    3.6326    0.4054   -0.0007 C   0  0  0

+   -0.6021    2.2104    0.0000 H   0  0  0

+   -2.5454   -0.9450    0.0000 H   0  0  0

+    2.1063   -1.8030    0.0000 H   0  0  0

+   -0.9092   -3.1945    0.0000 H   0  0  0

+    1.8105    2.3760    0.0000 H   0  0  0

+   -1.8984    1.3475    0.0000 H   0  0  0

+   -3.3581    1.4860    0.0000 H   0  0  0

+   -3.4966    0.0263    0.0000 H   0  0  0

+   -1.8812    1.3468    0.0000 H   0  0  0

+   -3.3387    1.5067    0.0000 H   0  0  0

+   -3.4986    0.0492    0.0000 H   0  0  0

+    3.7060   -0.6288    0.0000 H   0  0  0

+    4.6668    0.4788    0.0000 H   0  0  0

+    3.5592    1.4396    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+ 10 11  1  0

+  7 10  2  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2457-47-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    0.0002   -0.6676   -0.0004 C   0  0  0

+   -1.1917    0.0428   -0.0003 C   0  0  0

+    1.1917    0.0427   -0.0003 C   0  0  0

+   -1.1520    1.4254    0.0000 C   0  0  0

+   -2.7133   -0.7929    0.0001 Cl  0  0  0

+    1.1517    1.4257    0.0000 C   0  0  0

+    2.7134   -0.7928    0.0001 Cl  0  0  0

+    0.0000    2.0673    0.0001 N   0  0  0

+    0.0002   -1.7066    0.0000 H   0  0  0

+   -2.0402    1.9646    0.0000 H   0  0  0

+    2.0398    1.9650    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  8  2  0

+  1  9  1  0

+  4 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129018-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.6946    0.1939   -0.0468 C   0  0  0

+    1.0036   -1.1506    0.2310 C   0  0  0

+    1.9038    0.8467   -0.1805 N   0  0  0

+   -0.6320    0.5891   -0.1245 C   0  0  0

+    2.3568   -1.2435    0.2513 N   0  0  0

+    0.0271   -2.0377    0.4128 N   0  0  0

+    2.8823   -0.0766    0.0109 C   0  0  0

+    2.0960    2.2690   -0.4743 C   0  0  0

+   -1.6190   -0.3766    0.0790 C   0  0  0

+   -1.2389   -1.6951    0.3406 C   0  0  0

+    4.3347    0.2034   -0.0460 N   0  3  0

+   -3.0546   -0.0093    0.0080 C   0  0  0

+    4.8069    1.1086    0.6182 O   0  0  0

+    5.0576   -0.4713   -0.7572 O   0  5  0

+   -3.9679   -0.8707   -0.5973 C   0  0  0

+   -3.4957    1.1957    0.5511 C   0  0  0

+   -5.3020   -0.5239   -0.6606 C   0  0  0

+   -4.8326    1.5324    0.4821 C   0  0  0

+   -5.7336    0.6763   -0.1247 C   0  0  0

+   -0.8763    1.5766    0.0000 H   0  0  0

+    3.1041    2.1328    0.0000 H   0  0  0

+    2.2322    3.2771    0.0000 H   0  0  0

+    1.0879    2.4052    0.0000 H   0  0  0

+   -1.9523   -2.4203    0.0000 H   0  0  0

+   -3.7153   -1.8561    0.0000 H   0  0  0

+   -2.8148    1.9515    0.0000 H   0  0  0

+   -5.9879   -1.2752    0.0000 H   0  0  0

+   -5.0907    2.5164    0.0000 H   0  0  0

+   -6.7234    0.9111    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  6 10  1  0

+  7 11  1  0

+  9 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+ 12 15  1  0

+ 12 16  2  0

+ 15 17  2  0

+ 16 18  1  0

+ 17 19  1  0

+  5  7  2  0

+  9 10  2  0

+ 18 19  2  0

+  4 20  1  0

+  8 21  1  0

+  8 22  1  0

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+ 10 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+73-49-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.3087    0.8595   -0.1619 C   0  0  0

+    1.1242   -0.5348   -0.1304 C   0  0  0

+    2.6099    1.3461   -0.2160 N   0  0  0

+    0.2120    1.7024   -0.1332 C   0  0  0

+   -0.1636   -1.0617   -0.0657 C   0  0  0

+    2.3155   -1.4010   -0.1720 C   0  0  0

+    3.6813    0.5522    0.3978 C   0  0  0

+   -1.0616    1.1662   -0.0692 C   0  0  0

+   -1.2467   -0.2087   -0.0374 C   0  0  0

+    3.5321   -0.8594    0.0446 N   0  0  0

+    2.2034   -2.5905   -0.3987 O   0  0  0

+    5.0382    1.0603   -0.0939 C   0  0  0

+   -2.4394    2.2216   -0.0324 Cl  0  0  0

+   -2.8780   -0.8695    0.0445 S   0  0  0

+    6.1549    0.2328    0.5458 C   0  0  0

+   -3.5757   -0.2953    1.4323 N   0  0  0

+   -3.5930   -0.2664   -1.0252 O   0  0  0

+   -2.7188   -2.2676    0.2424 O   0  0  0

+    2.7552    2.3778    0.0000 H   0  0  0

+    0.3454    2.7357    0.0000 H   0  0  0

+   -0.3083   -2.0935    0.0000 H   0  0  0

+    3.8264    1.5840    0.0000 H   0  0  0

+    4.3748   -1.4721    0.0000 H   0  0  0

+    5.8066    1.7640    0.0000 H   0  0  0

+    4.4937    1.9486    0.0000 H   0  0  0

+    5.5346   -0.6043    0.0000 H   0  0  0

+    6.9920   -0.3875    0.0000 H   0  0  0

+    6.7752    1.0699    0.0000 H   0  0  0

+   -3.4046    0.7325    0.0000 H   0  0  0

+   -4.5513   -0.6610    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 12 15  1  0

+ 14 16  1  0

+ 14 17  2  0

+ 14 18  2  0

+  7 10  1  0

+  8  9  1  0

+  3 19  1  0

+  4 20  1  0

+  5 21  1  0

+  7 22  1  0

+ 10 23  1  0

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+ 12 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+655-86-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.4820    0.7350   -0.0044 C   0  0  0

+   -0.4820   -0.7350   -0.0014 C   0  0  0

+    0.6661    1.4030   -0.0046 N   0  0  0

+   -1.7169    1.4163   -0.0013 C   0  0  0

+    0.6661   -1.4029    0.0012 N   0  0  0

+   -1.7169   -1.4163   -0.0009 C   0  0  0

+    1.8157    0.7333   -0.0019 C   0  0  0

+   -2.8788    0.7057    0.0045 C   0  0  0

+    1.8156   -0.7332    0.0010 C   0  0  0

+   -2.8788   -0.7057   -0.0031 C   0  0  0

+    3.0528    1.4109   -0.0016 C   0  0  0

+   -4.0942    1.3871    0.0076 N   0  0  0

+    3.0527   -1.4109    0.0034 C   0  0  0

+   -4.0943   -1.3871   -0.0030 N   0  0  0

+    4.2083    0.6975    0.0014 C   0  0  0

+    4.2083   -0.6975    0.0028 C   0  0  0

+   -1.7403    2.4611    0.0000 H   0  0  0

+   -1.7403   -2.4611    0.0000 H   0  0  0

+    3.0800    2.4556    0.0000 H   0  0  0

+   -4.1074    2.4321    0.0000 H   0  0  0

+   -4.9926    0.8532    0.0000 H   0  0  0

+    3.0798   -2.4556    0.0000 H   0  0  0

+   -4.9927   -0.8532    0.0000 H   0  0  0

+   -4.1075   -2.4321    0.0000 H   0  0  0

+    5.1210    1.2066    0.0000 H   0  0  0

+    5.1210   -1.2066    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 11 15  2  0

+ 13 16  2  0

+  7  9  2  0

+  8 10  1  0

+ 15 16  1  0

+  4 17  1  0

+  6 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109143-18-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -0.6520   -0.0569    0.0856 C   0  0  0

+   -1.6499   -0.3263    1.0332 C   0  0  0

+    0.6878   -0.0969    0.4737 C   0  0  0

+   -1.2697    0.1962   -1.0866 O   0  0  0

+   -1.3020   -0.6313    2.3538 C   0  0  0

+   -2.9217   -0.2027    0.3111 C   0  0  0

+    1.6970    0.1703   -0.4611 N   0  0  0

+    1.0188   -0.4001    1.7824 C   0  0  0

+   -2.6048    0.1068   -0.9534 C   0  0  0

+    0.0298   -0.6656    2.7188 C   0  0  0

+   -2.2697   -0.8921    3.2729 O   0  0  0

+    2.4405    1.3333    0.0413 C   0  0  0

+    2.6213   -0.9707   -0.4221 C   0  0  0

+   -3.5824    0.3248   -2.0437 N   0  3  0

+   -1.6039   -1.1637    4.5079 C   0  0  0

+    1.7646    2.6182   -0.4415 C   0  0  0

+    2.1387   -2.0514   -1.3916 C   0  0  0

+   -4.7754    0.2203   -1.8218 O   0  0  0

+   -3.1936    0.6086   -3.1625 O   0  5  0

+    2.6772    4.0457    0.1751 Cl  0  0  0

+    3.2732   -3.4519   -1.3438 Cl  0  0  0

+   -3.7097   -0.4800    0.0000 H   0  0  0

+    1.8303   -0.5984    0.0000 H   0  0  0

+    0.1284   -1.4951    0.0000 H   0  0  0

+    3.0566    0.7692    0.0000 H   0  0  0

+    3.1020    1.8434    0.0000 H   0  0  0

+    3.3216   -1.4261    0.0000 H   0  0  0

+    3.1804   -0.3501    0.0000 H   0  0  0

+   -1.9194   -1.9371    0.0000 H   0  0  0

+   -0.8305   -1.4792    0.0000 H   0  0  0

+   -1.2884   -0.3903    0.0000 H   0  0  0

+    1.1485    3.1823    0.0000 H   0  0  0

+    1.1031    2.1081    0.0000 H   0  0  0

+    1.4384   -1.5960    0.0000 H   0  0  0

+    1.5796   -2.6720    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  5 10  2  0

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+  6  9  2  0

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+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6203-18-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+    3.4037   -0.3220    0.0022 N   0  0  0

+    3.8560   -1.7154    0.0030 C   0  0  0

+    4.3843    0.7664   -0.0046 C   0  0  0

+    2.0441   -0.0325    0.0021 C   0  0  0

+    1.6165    1.2930    0.0013 C   0  0  0

+    1.1134   -1.0693   -0.0031 C   0  0  0

+    0.2817    1.5822    0.0007 C   0  0  0

+   -0.2231   -0.7898   -0.0037 C   0  0  0

+   -0.6582    0.5428    0.0009 C   0  0  0

+   -2.0929    0.8482    0.0003 C   0  0  0

+   -3.0008   -0.1594    0.0005 C   0  0  0

+   -4.3770    0.1336   -0.0001 C   0  0  0

+   -5.1902   -0.7689    0.0001 O   0  0  0

+    2.8621   -2.0380    0.0000 H   0  0  0

+    4.1786   -2.7093    0.0000 H   0  0  0

+    4.8499   -1.3928    0.0000 H   0  0  0

+    5.1606    0.0670    0.0000 H   0  0  0

+    5.0837    1.5427    0.0000 H   0  0  0

+    3.6080    1.4658    0.0000 H   0  0  0

+    2.3180    2.0674    0.0000 H   0  0  0

+    1.4387   -2.0623    0.0000 H   0  0  0

+   -0.0382    2.5770    0.0000 H   0  0  0

+   -0.9205   -1.5680    0.0000 H   0  0  0

+   -2.4155    1.8421    0.0000 H   0  0  0

+   -2.6782   -1.1533    0.0000 H   0  0  0

+   -4.6996    1.1275    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  2  0

+  9  7  2  0

+ 10  9  1  0

+ 11 10  2  0

+ 12 11  1  0

+ 13 12  2  0

+  8  9  1  0

+  2 14  1  0

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+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+318-98-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 41                          1 V2000

+    2.7050   -0.2098    0.0778 C   0  0  0

+    1.3987    0.3149   -0.0012 C   0  0  0

+    3.8126    0.6645   -0.0479 C   0  0  0

+    2.9291   -1.5805    0.2843 C   0  0  0

+    0.3237   -0.5065    0.1164 O   0  0  0

+    1.2219    1.6555   -0.1973 C   0  0  0

+    3.5882    2.0374   -0.2493 C   0  0  0

+    5.1150    0.1422    0.0307 C   0  0  0

+    4.2044   -2.0514    0.3557 C   0  0  0

+   -0.8392    0.3151   -0.0055 C   0  0  0

+    2.3137    2.5108   -0.3203 C   0  0  0

+    5.2944   -1.1928    0.2261 C   0  0  0

+   -2.0926   -0.5535    0.1186 C   0  0  0

+   -3.3376    0.3261   -0.0120 C   0  0  0

+   -2.0943   -1.5381   -0.9171 O   0  0  0

+   -4.5410   -0.5078    0.1072 N   0  0  0

+   -5.6938    0.3929   -0.0263 C   0  0  0

+   -6.8669   -0.3686   -0.6465 C   0  0  0

+   -6.0968    0.9135    1.3548 C   0  0  0

+    2.1248   -2.2437    0.0000 H   0  0  0

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+    4.3932    2.6999    0.0000 H   0  0  0

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+    4.3671   -3.0811    0.0000 H   0  0  0

+   -0.1427    1.0908    0.0000 H   0  0  0

+   -1.5286    1.0971    0.0000 H   0  0  0

+    2.1533    3.5409    0.0000 H   0  0  0

+    6.2606   -1.5843    0.0000 H   0  0  0

+   -3.0187   -1.0321    0.0000 H   0  0  0

+   -2.6411    1.1018    0.0000 H   0  0  0

+   -4.0270    1.1081    0.0000 H   0  0  0

+   -2.0961   -2.5806    0.0000 H   0  0  0

+   -4.5708   -1.5499    0.0000 H   0  0  0

+   -4.9550    1.1284    0.0000 H   0  0  0

+   -7.4345    0.5058    0.0000 H   0  0  0

+   -7.7413   -0.9362    0.0000 H   0  0  0

+   -6.2993   -1.2430    0.0000 H   0  0  0

+   -5.2724    1.5516    0.0000 H   0  0  0

+   -6.7349    1.7379    0.0000 H   0  0  0

+   -6.9212    0.2754    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 19 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+286-20-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.8691    0.8330    0.4048 C   0  0  0

+   -0.9545   -0.6495    0.5350 C   0  0  0

+   -1.3865    0.0140   -0.6504 O   0  0  0

+    0.4229    1.4736   -0.0251 C   0  0  0

+    0.2718   -1.4834    0.2947 C   0  0  0

+    1.6348    0.5725    0.1752 C   0  0  0

+    1.3413   -0.7649   -0.5181 C   0  0  0

+   -1.5751    1.6159    0.0000 H   0  0  0

+   -1.7074   -1.3875    0.0000 H   0  0  0

+    1.1765    2.2108    0.0000 H   0  0  0

+   -0.1874    2.3333    0.0000 H   0  0  0

+   -0.4269   -2.2728    0.0000 H   0  0  0

+    0.9661   -2.2767    0.0000 H   0  0  0

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+    2.1386    1.4986    0.0000 H   0  0  0

+    1.6753   -1.7648    0.0000 H   0  0  0

+    2.3941   -0.7089    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  4  6  1  0

+  5  7  1  0

+  2  3  1  0

+  6  7  1  0

+  1  8  1  0

+  2  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-52-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.4464   -0.2664    0.0024 C   0  0  0

+    0.4918   -1.3032    0.0012 C   0  0  0

+   -0.0096    1.0624    0.0016 C   0  0  0

+   -1.8861   -0.5717   -0.0017 C   0  0  0

+    1.8392   -1.0089   -0.0007 C   0  0  0

+    1.3408    1.3402   -0.0003 C   0  0  0

+   -2.6970    0.3298   -0.0007 O   0  0  0

+    2.2634    0.3083   -0.0015 C   0  0  0

+    0.1750   -2.2917    0.0000 H   0  0  0

+   -0.7003    1.8372    0.0000 H   0  0  0

+   -2.2073   -1.5587    0.0000 H   0  0  0

+    2.5369   -1.7774    0.0000 H   0  0  0

+    1.6665    2.3258    0.0000 H   0  0  0

+    3.2788    0.5237    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  5  8  2  0

+  6  8  1  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56355-17-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.6884   -1.0583    0.1060 C   0  0  0

+   -1.9040   -1.6524   -0.0202 O   0  0  0

+   -0.1948   -0.7457    1.3648 C   0  0  0

+    0.0639   -0.7684   -1.0231 C   0  0  0

+   -2.8238   -0.6577   -0.0613 C   0  0  0

+    1.0412   -0.1423    1.4903 C   0  0  0

+    1.2997   -0.1647   -0.8919 C   0  0  0

+   -4.1387   -0.7457   -0.0714 N   0  0  0

+   -2.5721    1.0599   -0.1062 S   0  0  0

+    1.7868    0.1504    0.3630 C   0  0  0

+   -4.8960    0.3336   -0.1131 C   0  0  0

+   -4.2912    1.5459   -0.1435 C   0  0  0

+    3.1351    0.8088    0.5030 C   0  0  0

+    4.1941   -0.0838   -0.0911 C   0  0  0

+    3.1267    2.1499   -0.2334 C   0  0  0

+    5.4801    0.3007   -0.0791 O   0  0  0

+    3.8856   -1.1457   -0.5782 O   0  0  0

+   -0.6876    0.1367    0.0000 H   0  0  0

+    0.4678   -1.6949    0.0000 H   0  0  0

+    0.6345    0.7830    0.0000 H   0  0  0

+    1.7969   -1.0447    0.0000 H   0  0  0

+   -5.9039    0.2583    0.0000 H   0  0  0

+   -4.6999    2.4703    0.0000 H   0  0  0

+    4.0503    1.2378    0.0000 H   0  0  0

+    4.1374    2.1562    0.0000 H   0  0  0

+    3.1204    3.1606    0.0000 H   0  0  0

+    2.1160    2.1436    0.0000 H   0  0  0

+    6.4485    0.5902    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 13 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+ 14 17  2  0

+  7 10  2  0

+ 11 12  2  0

+  3 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

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+ 12 23  1  0

+ 13 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20020-02-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+    0.1438   -3.1346    0.0027 Cl  0  0  0

+    0.1691   -1.3988    0.0032 C   0  0  0

+    1.3948   -0.7101    0.0005 C   0  0  0

+   -0.9995   -0.6965    0.0006 C   0  0  0

+    1.3960    0.7074    0.0004 C   0  0  0

+    2.6191   -1.3999   -0.0018 C   0  0  0

+   -2.5108   -1.5507   -0.0020 Cl  0  0  0

+   -0.9983    0.6983    0.0005 C   0  0  0

+    0.1716    1.3984    0.0032 C   0  0  0

+    2.6214    1.3953   -0.0019 C   0  0  0

+    3.7864   -0.7000   -0.0040 C   0  0  0

+   -2.5081    1.5552   -0.0029 Cl  0  0  0

+    0.1495    3.1342    0.0032 Cl  0  0  0

+    3.7876    0.6937   -0.0040 C   0  0  0

+    2.6333   -2.4538    0.0000 H   0  0  0

+    2.6372    2.4491    0.0000 H   0  0  0

+    4.7033   -1.2198    0.0000 H   0  0  0

+    4.7053    1.2120    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

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+ 11  6  2  0

+ 12  8  1  0

+ 13  9  1  0

+ 14 10  2  0

+  8  9  1  0

+ 11 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 14 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+151378-34-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 42                          1 V2000

+    0.1601    0.1440   -0.1559 C   0  0  0

+   -1.2248    0.0045   -0.2650 C   0  0  0

+    0.7195    1.4358    0.0356 C   0  0  0

+    1.2618   -0.8227   -0.1918 C   0  0  0

+   -1.8070   -1.3630   -0.4798 C   0  0  2

+   -2.0370    1.1145   -0.1832 C   0  0  0

+    2.1762    1.2879    0.1130 C   0  0  0

+   -0.1279    2.5378    0.1105 C   0  0  0

+    2.4509   -0.0859   -0.0299 C   0  0  0

+    1.3588   -2.1973   -0.3406 C   0  0  0

+   -3.2643   -1.5331   -0.0989 C   0  0  1

+   -2.2020   -2.0008    0.7357 O   0  0  0

+   -3.5317    0.9564   -0.2883 C   0  0  2

+   -1.4918    2.3752    0.0006 C   0  0  0

+    3.2443    2.1542    0.2854 C   0  0  0

+    3.7493   -0.6515   -0.0094 C   0  0  0

+    2.6426   -2.7583   -0.3203 C   0  0  0

+   -3.9614   -0.3031    0.4562 C   0  0  2

+   -3.9035    0.8469   -1.6637 O   0  0  0

+    4.5296    1.5966    0.3023 C   0  0  0

+    3.7971   -2.0411   -0.1634 C   0  0  0

+    4.7950    0.2617    0.1623 C   0  0  0

+   -3.6508   -0.1654    1.8442 O   0  0  0

+   -0.8814   -1.8431    0.0000 H   0  0  0

+    0.2765    3.4989    0.0000 H   0  0  0

+    0.5069   -2.7986    0.0000 H   0  0  0

+   -3.9635   -2.3066    0.0000 H   0  0  0

+   -3.7347    1.9792    0.0000 H   0  0  0

+   -2.1150    3.2112    0.0000 H   0  0  0

+    3.1029    3.1873    0.0000 H   0  0  0

+    2.7176   -3.7983    0.0000 H   0  0  0

+   -4.9996   -0.4004    0.0000 H   0  0  0

+   -4.9037    0.5523    0.0000 H   0  0  0

+    5.3411    2.2513    0.0000 H   0  0  0

+    4.7170   -2.5321    0.0000 H   0  0  0

+    5.7820   -0.0745    0.0000 H   0  0  0

+   -2.6976    0.2572    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+ 13 19  1  0

+ 15 20  1  0

+ 16 21  1  0

+ 16 22  1  0

+ 18 23  1  0

+  7  9  1  0

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+ 11 12  1  0

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+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+129927-37-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 59 59                          1 V2000

+    0.0634   -1.8918    0.6520 C   0  0  0

+   -0.6640   -2.7903   -0.3148 C   0  0  0

+    1.0386   -0.9983   -0.1172 C   0  0  0

+   -0.9333   -1.0322    1.3860 C   0  0  0

+    0.7874   -2.6893    1.5910 O   0  0  0

+   -0.4575   -4.1565   -0.2776 C   0  0  0

+   -1.5421   -2.2487   -1.2351 C   0  0  0

+    1.7396   -0.0505    0.8580 C   0  0  0

+    2.0816   -1.8691   -0.8207 C   0  0  0

+   -1.7300   -0.1957    0.7024 O   0  0  0

+   -1.0152   -1.0960    2.5898 O   0  0  0

+   -1.1248   -4.9808   -1.1645 C   0  0  0

+   -2.2092   -3.0728   -2.1217 C   0  0  0

+    2.7148    0.8429    0.0888 C   0  0  0

+    3.0568   -0.9756   -1.5899 C   0  0  0

+   -2.6027    0.7203    1.4149 C   0  0  0

+   -1.9983   -4.4388   -2.0883 C   0  0  0

+    3.7578   -0.0278   -0.6146 C   0  0  0

+   -3.3255    1.5620    0.4475 C   0  0  0

+   -3.6080   -0.0772    2.2482 C   0  0  0

+   -1.7657    1.6081    2.3380 C   0  0  0

+   -3.9020    2.2333   -0.3241 C   0  0  0

+   -4.6248    3.0749   -1.2915 C   0  0  0

+   -5.5077    4.0017   -0.5706 N   0  0  0

+   -6.1952    4.8075   -1.5884 C   0  0  0

+   -7.1365    5.7999   -0.9028 C   0  0  0

+   12.4233    2.9126   -0.2785 Cl  0  0  0

+    0.3815   -0.4067    0.0000 H   0  0  0

+    1.3817   -3.3439    0.0000 H   0  0  0

+    0.3957   -4.3883    0.0000 H   0  0  0

+   -1.6906   -1.3771    0.0000 H   0  0  0

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+    1.4853   -2.5219    0.0000 H   0  0  0

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+   -3.0628   -2.8424    0.0000 H   0  0  0

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+    3.3030   -1.8248    0.0000 H   0  0  0

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+   -2.7358   -4.9265    0.0000 H   0  0  0

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+   -4.1575    0.6155    0.0000 H   0  0  0

+   -4.3007   -0.6267    0.0000 H   0  0  0

+   -3.0585   -0.7699    0.0000 H   0  0  0

+   -1.1224    1.0016    0.0000 H   0  0  0

+   -1.1592    2.2514    0.0000 H   0  0  0

+   -2.4090    2.2146    0.0000 H   0  0  0

+   -3.7588    3.2533    0.0000 H   0  0  0

+   -4.3608    3.9187    0.0000 H   0  0  0

+   -6.1643    3.4096    0.0000 H   0  0  0

+   -5.3287    4.9834    0.0000 H   0  0  0

+   -5.9291    5.6506    0.0000 H   0  0  0

+   -6.4950    6.4084    0.0000 H   0  0  0

+   -7.7450    6.4414    0.0000 H   0  0  0

+   -7.7780    5.1914    0.0000 H   0  0  0

+   13.3074    2.9126    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  1  5  1  0

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+ 13 17  1  0

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+ 12 36  1  0

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+ 25 54  1  0

+ 25 55  1  0

+ 26 56  1  0

+ 26 57  1  0

+ 26 58  1  0

+ 27 59  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2403-28-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+   -1.0411   -1.4603   -0.1165 C   0  0  0

+   -2.0315   -0.5429   -0.0407 C   0  0  0

+    0.3632   -1.0295   -0.0844 C   0  0  0

+   -3.4283   -0.9713   -0.0726 C   0  0  0

+    1.3898   -1.9786   -0.1628 C   0  0  0

+    0.6773    0.3316    0.0191 C   0  0  0

+   -3.7002   -2.1542   -0.1676 O   0  0  0

+   -4.5118    0.0323    0.0103 C   0  0  0

+    2.6949   -1.5756   -0.1327 C   0  0  0

+    1.9836    0.7294    0.0488 C   0  0  0

+   -5.8470   -0.3736   -0.0200 C   0  0  0

+   -4.2034    1.3892    0.1251 C   0  0  0

+    3.0053   -0.2192   -0.0238 C   0  0  0

+   -6.8527    0.5676    0.0583 C   0  0  0

+   -5.2184    2.3197    0.2024 C   0  0  0

+    4.4220    0.2153    0.0087 C   0  0  0

+   -6.5402    1.9110    0.1666 C   0  0  0

+    4.8169    1.3660   -0.6723 C   0  0  0

+    5.3641   -0.5221    0.7253 C   0  0  0

+    6.1373    1.7658   -0.6380 C   0  0  0

+    6.6813   -0.1125    0.7523 C   0  0  0

+    7.0683    1.0275    0.0701 C   0  0  0

+   -1.2717   -2.4689    0.0000 H   0  0  0

+   -1.8009    0.4657    0.0000 H   0  0  0

+    1.1606   -2.9875    0.0000 H   0  0  0

+   -0.0790    1.0376    0.0000 H   0  0  0

+    3.4532   -2.2794    0.0000 H   0  0  0

+    2.2158    1.7376    0.0000 H   0  0  0

+   -6.0814   -1.3813    0.0000 H   0  0  0

+   -3.2158    1.6976    0.0000 H   0  0  0

+   -7.8426    0.2668    0.0000 H   0  0  0

+   -4.9915    3.3292    0.0000 H   0  0  0

+   -7.2974    2.6160    0.0000 H   0  0  0

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+    5.1775   -1.5398    0.0000 H   0  0  0

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+    7.4034   -0.8535    0.0000 H   0  0  0

+    8.0607    1.3199    0.0000 H   0  0  0

+  2  1  2  0

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+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60-93-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 53                          1 V2000

+   -3.4868   -1.8298    0.3715 C   0  0  0

+   -2.9833   -0.6372    0.9252 C   0  0  0

+   -2.5777   -2.8478   -0.0097 C   0  0  0

+   -4.8645   -2.0238    0.1866 C   0  0  0

+   -3.9111    0.4733    1.3461 C   0  0  2

+   -1.6309   -0.5149    1.0708 C   0  0  0

+   -3.0769   -4.0405   -0.5632 C   0  0  0

+   -1.2644   -2.6637    0.1596 N   0  0  0

+   -5.3140   -3.1948   -0.3543 C   0  0  0

+   -3.3550    1.8137    0.8612 C   0  0  1

+   -4.0188    0.4897    2.7709 O   0  0  0

+   -0.7923   -1.5549    0.6752 C   0  0  0

+   -4.4173   -4.2018   -0.7250 C   0  0  0

+   -6.6478   -3.3838   -0.5333 O   0  0  0

+   -2.9267    1.6794   -0.5251 N   0  0  0

+   -4.4347    2.8855    1.0061 C   0  0  0

+   -6.8075   -4.6821   -1.1085 C   0  0  0

+   -2.3749    2.9429   -0.9943 C   0  0  0

+   -4.0596    1.2933   -1.3548 C   0  0  0

+   -4.7261    3.4848   -0.3770 C   0  0  1

+   -3.4148    4.0612   -0.9295 C   0  0  1

+   -5.1686    2.3439   -1.3042 C   0  0  0

+   -2.9217    5.1533   -0.0156 C   0  0  0

+   -2.7520    6.3673   -0.4777 C   0  0  0

+   11.4219    0.2380   -0.4300 Cl  0  0  0

+   20.0309   -0.5159    0.1314 Cl  0  0  0

+   -5.4884   -1.2397    0.0000 H   0  0  0

+   -4.4028   -0.3997    0.0000 H   0  0  0

+   -1.2398    0.4076    0.0000 H   0  0  0

+   -2.4728   -4.8399    0.0000 H   0  0  0

+   -2.8374    2.6717    0.0000 H   0  0  0

+   -5.0094    0.6405    0.0000 H   0  0  0

+    0.2002   -1.4170    0.0000 H   0  0  0

+   -4.7719   -5.1389    0.0000 H   0  0  0

+   -5.4358    2.8443    0.0000 H   0  0  0

+   -4.7973    1.9514    0.0000 H   0  0  0

+   -7.8020   -4.5598    0.0000 H   0  0  0

+   -6.9298   -5.6766    0.0000 H   0  0  0

+   -5.8130   -4.8044    0.0000 H   0  0  0

+   -1.5198    2.4205    0.0000 H   0  0  0

+   -1.7409    3.7188    0.0000 H   0  0  0

+   -4.8566    0.6860    0.0000 H   0  0  0

+   -3.5882    0.4091    0.0000 H   0  0  0

+   -5.4501    4.1775    0.0000 H   0  0  0

+   -4.1198    4.7732    0.0000 H   0  0  0

+   -6.0482    2.8238    0.0000 H   0  0  0

+   -5.7580    1.5336    0.0000 H   0  0  0

+   -1.9592    4.8750    0.0000 H   0  0  0

+   -1.8233    6.7433    0.0000 H   0  0  0

+   -3.5420    6.9836    0.0000 H   0  0  0

+   12.4239    0.2380    0.0000 H   0  0  0

+   21.0329   -0.5159    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  2  0

+  9 14  1  0

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+ 15 18  1  0

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+ 18 21  1  0

+ 19 22  1  0

+ 21 23  1  0

+ 23 24  2  0

+  8 12  2  0

+  9 13  1  0

+ 20 21  1  0

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+  4 27  1  0

+  5 28  1  0

+  6 29  1  0

+  7 30  1  0

+ 10 31  1  0

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+ 12 33  1  0

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+ 16 35  1  0

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+ 22 47  1  0

+ 23 48  1  0

+ 24 49  1  0

+ 24 50  1  0

+ 25 51  1  0

+ 26 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+626-16-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.0002   -0.4333   -0.0001 C   0  0  0

+   -1.0948    0.2578   -0.4842 C   0  0  0

+    1.0949    0.2580    0.4841 C   0  0  0

+   -1.0948    1.6403   -0.4843 C   0  0  0

+   -2.2883   -0.4957   -1.0124 C   0  0  0

+    1.0950    1.6401    0.4840 C   0  0  0

+    2.2883   -0.4955    1.0125 C   0  0  0

+   -0.0003    2.3314    0.0002 C   0  0  0

+   -3.4520   -0.7967    0.3315 Cl  0  0  0

+    3.4520   -0.7967   -0.3314 Cl  0  0  0

+   -0.0002   -1.4046    0.0000 H   0  0  0

+   -1.9455    2.1092    0.0000 H   0  0  0

+   -2.4499   -1.4535    0.0000 H   0  0  0

+   -1.4798   -1.0340    0.0000 H   0  0  0

+    1.9456    2.1091    0.0000 H   0  0  0

+    1.4797   -1.0338    0.0000 H   0  0  0

+    2.4498   -1.4533    0.0000 H   0  0  0

+   -0.0004    3.3027    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

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+  6  8  1  0

+  1 11  1  0

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+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+542-85-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+   -0.7473   -0.6709   -0.2125 N   0  0  0

+   -1.7955   -0.0593    0.6082 C   0  0  0

+    0.4353   -0.2794   -0.1094 C   0  0  0

+   -2.8538    0.5686   -0.3010 C   0  0  0

+    1.9052    0.2071    0.0188 S   0  0  0

+   -2.6040   -0.5160    0.0000 H   0  0  0

+   -1.8020   -0.9879    0.0000 H   0  0  0

+   -2.3800    1.3672    0.0000 H   0  0  0

+   -3.6524    1.0424    0.0000 H   0  0  0

+   -3.3276   -0.2300    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  3  5  2  0

+  2  6  1  0

+  2  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3114-70-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -1.4235    0.0000    0.3455 C   0  0  0

+   -0.7359   -1.2492   -0.2090 C   0  0  0

+   -0.7359    1.2492   -0.2090 C   0  0  0

+   -2.8366    0.0000   -0.0558 N   0  0  0

+    0.7359   -1.2492    0.2090 C   0  0  0

+    0.7359    1.2492    0.2090 C   0  0  0

+    1.4235    0.0000   -0.3455 C   0  0  0

+    2.8366    0.0000    0.0558 N   0  0  0

+   -0.3540    0.0000    0.0000 H   0  0  0

+   -1.7457   -1.6013    0.0000 H   0  0  0

+   -0.5574   -2.3036    0.0000 H   0  0  0

+   -0.5574    2.3036    0.0000 H   0  0  0

+   -1.7457    1.6013    0.0000 H   0  0  0

+   -3.3713    0.9262    0.0000 H   0  0  0

+   -3.3713   -0.9262    0.0000 H   0  0  0

+    0.5574   -2.3036    0.0000 H   0  0  0

+    1.7457   -1.6013    0.0000 H   0  0  0

+    1.7457    1.6013    0.0000 H   0  0  0

+    0.5574    2.3036    0.0000 H   0  0  0

+    0.3540    0.0000    0.0000 H   0  0  0

+    3.3713   -0.9262    0.0000 H   0  0  0

+    3.3713    0.9262    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

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+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120404-26-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+    1.7050    0.5030   -0.1347 C   0  0  0

+    0.3407    0.5478   -0.1345 N   0  0  0

+    2.4455    1.6896   -0.1347 C   0  0  0

+    2.3662   -0.7300   -0.1292 C   0  0  0

+   -0.3406   -0.5476   -0.1346 N   0  0  0

+    3.8214    1.6403   -0.1345 C   0  0  0

+    3.7420   -0.7710   -0.1291 C   0  0  0

+   -1.7049   -0.5028   -0.1343 C   0  0  0

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+   -2.4456   -1.6897   -0.1344 C   0  0  0

+   -2.3660    0.7298   -0.1282 C   0  0  0

+    5.8677    0.3663   -0.1341 N   0  0  0

+   -3.8211   -1.6404   -0.1342 C   0  0  0

+   -3.7422    0.7708   -0.1280 C   0  0  0

+    6.5582   -0.9258   -0.1340 C   0  0  0

+   -4.4753   -0.4119   -0.1338 C   0  0  0

+    8.0708   -0.6957   -0.1337 C   0  0  0

+   -5.8676   -0.3662   -0.1341 N   0  0  0

+    8.4402    0.0420    1.0331 O   0  0  0

+   -6.5581    0.9259   -0.1338 C   0  0  0

+   -8.0707    0.6958   -0.1341 C   0  0  0

+   -8.4405   -0.0422    1.0323 O   0  0  0

+    1.9556    2.6114    0.0000 H   0  0  0

+    1.8169   -1.6176    0.0000 H   0  0  0

+    4.3747    2.5255    0.0000 H   0  0  0

+    4.2361   -1.6906    0.0000 H   0  0  0

+   -1.9557   -2.6115    0.0000 H   0  0  0

+   -1.8167    1.6175    0.0000 H   0  0  0

+    6.4190    1.2527    0.0000 H   0  0  0

+   -4.3744   -2.5256    0.0000 H   0  0  0

+   -4.2363    1.6903    0.0000 H   0  0  0

+    5.5878   -1.3106    0.0000 H   0  0  0

+    6.8308   -1.9334    0.0000 H   0  0  0

+    8.0143   -1.7380    0.0000 H   0  0  0

+    9.0798   -0.9632    0.0000 H   0  0  0

+   -6.4189   -1.2526    0.0000 H   0  0  0

+    8.9076    0.9754    0.0000 H   0  0  0

+   -5.5877    1.3107    0.0000 H   0  0  0

+   -6.8307    1.9335    0.0000 H   0  0  0

+   -8.0142    1.7381    0.0000 H   0  0  0

+   -9.0797    0.9635    0.0000 H   0  0  0

+   -8.9081   -0.9755    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  7  9  1  0

+ 14 16  2  0

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+ 20 38  1  0

+ 20 39  1  0

+ 21 40  1  0

+ 21 41  1  0

+ 22 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1806-29-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.7403   -0.3356   -0.0411 C   0  0  0

+   -0.7403   -0.3357    0.0408 C   0  0  0

+    1.4837    0.6011    0.6834 C   0  0  0

+    1.3973   -1.2725   -0.8357 C   0  0  0

+   -1.4838    0.6010   -0.6834 C   0  0  0

+   -1.3971   -1.2729    0.8354 C   0  0  0

+    2.8668    0.5937    0.6013 C   0  0  0

+    0.8520    1.5156    1.4647 O   0  0  0

+    2.7755   -1.2686   -0.9082 C   0  0  0

+   -2.8669    0.5937   -0.6010 C   0  0  0

+   -0.8523    1.5155   -1.4650 O   0  0  0

+   -2.7753   -1.2688    0.9083 C   0  0  0

+    3.5082   -0.3368   -0.1941 C   0  0  0

+   -3.5081   -0.3368    0.1947 C   0  0  0

+    0.9881   -2.0619    0.0000 H   0  0  0

+   -0.9879   -2.0623    0.0000 H   0  0  0

+    3.2824    1.3798    0.0000 H   0  0  0

+    0.3466    2.2472    0.0000 H   0  0  0

+    3.1652   -2.0679    0.0000 H   0  0  0

+   -3.2825    1.3798    0.0000 H   0  0  0

+   -0.3470    2.2472    0.0000 H   0  0  0

+   -3.1651   -2.0680    0.0000 H   0  0  0

+    4.3970   -0.3647    0.0000 H   0  0  0

+   -4.3969   -0.3648    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  4 15  1  0

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+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3671-78-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+   -2.3506   -0.3219   -0.2830 C   0  0  0

+   -3.8283   -0.3545   -0.1548 C   0  0  0

+   -1.8776    0.9238    0.1223 C   0  0  0

+   -1.4450   -1.2943   -0.7146 C   0  0  0

+   -4.2792    0.8700    0.3304 C   0  0  0

+   -4.7526   -1.3638   -0.4325 C   0  0  0

+   -3.0710    1.7509    0.5343 C   0  0  0

+   -0.5282    1.1989    0.0935 C   0  0  0

+   -0.0961   -1.0167   -0.7429 C   0  0  0

+   -5.6261    1.0831    0.5350 C   0  0  0

+   -6.0979   -1.1415   -0.2251 C   0  0  0

+    0.3692    0.2305   -0.3419 C   0  0  0

+   -6.5362    0.0785    0.2582 C   0  0  0

+    1.7383    0.5088   -0.3720 N   0  0  0

+    2.6054   -0.3045    0.2629 C   0  0  0

+    4.0607   -0.0877    0.1218 C   0  0  0

+    2.1906   -1.2164    0.9514 O   0  0  0

+    4.9614   -0.9281    0.7779 C   0  0  0

+    4.5404    0.9552   -0.6728 C   0  0  0

+    6.3186   -0.7205    0.6416 C   0  0  0

+    5.8997    1.1517   -0.8005 C   0  0  0

+    6.7872    0.3180   -0.1431 C   0  0  0

+   -1.7542   -2.2628    0.0000 H   0  0  0

+   -4.4205   -2.3247    0.0000 H   0  0  0

+   -2.4024    2.5168    0.0000 H   0  0  0

+   -3.7577    2.5006    0.0000 H   0  0  0

+   -0.2169    2.1667    0.0000 H   0  0  0

+    0.5653   -1.7888    0.0000 H   0  0  0

+   -5.9641    2.0419    0.0000 H   0  0  0

+   -6.7488   -1.9225    0.0000 H   0  0  0

+   -7.5335    0.2761    0.0000 H   0  0  0

+    2.0158    1.4869    0.0000 H   0  0  0

+    4.6614   -1.8995    0.0000 H   0  0  0

+    3.9319    1.7697    0.0000 H   0  0  0

+    6.9333   -1.5302    0.0000 H   0  0  0

+    6.2053    2.1213    0.0000 H   0  0  0

+    7.7843    0.5164    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58-27-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.3811    0.7361   -0.0023 C   0  0  0

+   -0.7754   -0.6139   -0.0016 C   0  0  0

+    1.0595    1.0702   -0.0012 C   0  0  0

+   -1.3454    1.7368    0.0018 C   0  0  0

+    0.2591   -1.6707    0.0001 C   0  0  0

+   -2.1267   -0.9383   -0.0021 C   0  0  0

+    2.0620   -0.0120    0.0006 C   0  0  0

+    1.4160    2.2316   -0.0022 O   0  0  0

+   -2.6896    1.3974    0.0066 C   0  0  0

+    1.6865   -1.2980    0.0012 C   0  0  0

+   -0.0654   -2.8414    0.0011 O   0  0  0

+   -3.0769    0.0712   -0.0033 C   0  0  0

+    3.5288    0.3338    0.0017 C   0  0  0

+   -1.0591    2.7390    0.0000 H   0  0  0

+   -2.4248   -1.9370    0.0000 H   0  0  0

+   -3.4129    2.1478    0.0000 H   0  0  0

+    2.4129   -2.0455    0.0000 H   0  0  0

+   -4.0904   -0.1720    0.0000 H   0  0  0

+    3.7680   -0.6807    0.0000 H   0  0  0

+    4.5433    0.5730    0.0000 H   0  0  0

+    3.2896    1.3483    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  5 10  1  0

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+  4 14  1  0

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+  9 16  1  0

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+ 12 18  1  0

+ 13 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+811-97-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.3871    0.0000    0.0349 C   0  0  0

+   -0.8663    0.0005    0.9122 C   0  0  0

+    0.3910    1.1418   -0.7735 F   0  0  0

+    1.5255    0.0005    0.8481 F   0  0  0

+    0.3910   -1.1427   -0.7722 F   0  0  0

+   -2.0047    0.0001    0.0989 F   0  0  0

+   -0.4380    0.7421    0.0000 H   0  0  0

+   -1.2946    0.7421    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+26002-80-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 54                          1 V2000

+    4.7692    0.4581   -0.0189 C   0  0  0

+    3.6417   -0.5014   -0.4049 C   0  0  0

+    4.0299   -0.3291    1.0649 C   0  0  0

+    6.0997   -0.1938   -0.2939 C   0  0  0

+    2.3879    0.2851   -0.6888 C   0  0  0

+    4.7798   -1.4809    1.7372 C   0  0  0

+    3.0642    0.4441    1.9652 C   0  0  0

+    7.2089    0.4790   -0.1118 C   0  0  0

+    1.1864   -0.3015   -0.5707 O   0  0  0

+    2.4643    1.4438   -1.0228 O   0  0  0

+    7.1543    1.9049    0.3727 C   0  0  0

+    8.5395   -0.1729   -0.3868 C   0  0  0

+   -0.0215    0.4563   -0.8442 C   0  0  0

+   -1.2255   -0.4267   -0.6399 C   0  0  0

+   -2.1795   -0.0864    0.2997 C   0  0  0

+   -1.3773   -1.5736   -1.3968 C   0  0  0

+   -3.2877   -0.8998    0.4873 C   0  0  0

+   -2.4810   -2.3861   -1.2118 C   0  0  0

+   -4.2277   -0.5671    1.4105 O   0  0  0

+   -3.4348   -2.0535   -0.2699 C   0  0  0

+   -5.1801    0.1513    0.7599 C   0  0  0

+   -6.3511    0.5056    1.4141 C   0  0  0

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+    9.3621   -0.5759    0.0000 H   0  0  0

+    8.9425    0.6497    0.0000 H   0  0  0

+    0.5589    1.1650    0.0000 H   0  0  0

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+   -2.3121    0.8200    0.0000 H   0  0  0

+   -0.5888   -2.0398    0.0000 H   0  0  0

+   -2.3445   -3.2919    0.0000 H   0  0  0

+   -4.2137   -2.5356    0.0000 H   0  0  0

+   -6.7663   -0.3109    0.0000 H   0  0  0

+   -4.0875    0.7404    0.0000 H   0  0  0

+   -8.2119    1.0362    0.0000 H   0  0  0

+   -5.5379    2.0850    0.0000 H   0  0  0

+   -7.4752    2.4580    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 21 22  2  0

+ 21 23  1  0

+ 22 24  1  0

+ 23 25  2  0

+ 24 26  2  0

+  2  3  1  0

+ 18 20  2  0

+ 25 26  1  0

+  1 27  1  0

+  2 28  1  0

+  4 29  1  0

+  6 30  1  0

+  6 31  1  0

+  6 32  1  0

+  7 33  1  0

+  7 34  1  0

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+ 20 47  1  0

+ 22 48  1  0

+ 23 49  1  0

+ 24 50  1  0

+ 25 51  1  0

+ 26 52  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+113393-59-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    0.6715    0.1341   -0.0035 C   0  0  0

+    0.8156   -1.3416   -0.0007 C   0  0  0

+    1.9668    0.6570   -0.0007 C   0  0  0

+   -0.5032    0.8837   -0.0029 C   0  0  0

+   -0.1933   -2.3076   -0.0020 C   0  0  0

+    2.1859   -1.6033    0.0036 C   0  0  0

+    2.8627   -0.3960    0.0036 C   0  0  0

+    2.3266    2.1204   -0.0024 C   0  0  0

+   -1.8183    0.4052    0.0006 C   0  0  0

+   -1.5650   -2.1033   -0.0061 C   0  0  0

+    0.2633   -3.7437    0.0010 C   0  0  0

+    3.7486    2.2613    0.0015 O   0  0  0

+   -2.2722   -0.9170    0.0041 C   0  0  0

+   -2.8714    1.4392    0.0009 C   0  0  0

+   -4.3234    1.0359    0.0044 C   0  0  0

+   -2.5395    2.7245   -0.0020 C   0  0  0

+   -0.3887    1.9251    0.0000 H   0  0  0

+    2.6279   -2.5531    0.0000 H   0  0  0

+    3.9054   -0.2945    0.0000 H   0  0  0

+    2.3418    3.1679    0.0000 H   0  0  0

+    1.2875    2.2539    0.0000 H   0  0  0

+   -2.1483   -2.9735    0.0000 H   0  0  0

+   -0.7351   -4.0611    0.0000 H   0  0  0

+    0.5807   -4.7421    0.0000 H   0  0  0

+    1.2617   -3.4263    0.0000 H   0  0  0

+    4.7911    2.3646    0.0000 H   0  0  0

+   -3.3142   -1.0252    0.0000 H   0  0  0

+   -4.6038    2.0453    0.0000 H   0  0  0

+   -5.3328    0.7555    0.0000 H   0  0  0

+   -4.0430    0.0265    0.0000 H   0  0  0

+   -1.5301    3.0048    0.0000 H   0  0  0

+   -3.2870    3.4585    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

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+  6  7  1  0

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+ 13 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6051-98-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.1013    0.0899   -0.0035 C   0  0  0

+   -1.1748   -0.6682   -0.0024 C   0  0  0

+   -0.1834    1.4555   -0.0010 C   0  0  0

+    1.4469   -0.3329   -0.0013 C   0  0  0

+   -2.2403    0.2477    0.0009 C   0  0  0

+   -1.4436   -2.0304   -0.0044 C   0  0  0

+   -1.6588    1.6121    0.0019 C   0  0  0

+    0.8548    2.3969   -0.0018 C   0  0  0

+    2.4833    0.6363   -0.0027 C   0  0  0

+    1.7785   -1.6984    0.0027 C   0  0  0

+   -3.5498   -0.2131    0.0026 C   0  0  0

+   -2.7564   -2.4780   -0.0031 C   0  0  0

+   -2.2737    2.6589    0.0052 O   0  0  0

+    2.1582    2.0032   -0.0052 C   0  0  0

+    3.8228    0.2093    0.0000 C   0  0  0

+    3.0867   -2.0736    0.0053 C   0  0  0

+   -3.8024   -1.5767    0.0010 C   0  0  0

+    4.1060   -1.1219    0.0039 C   0  0  0

+   -0.6560   -2.7191    0.0000 H   0  0  0

+    0.6249    3.4175    0.0000 H   0  0  0

+    1.0237   -2.4228    0.0000 H   0  0  0

+   -4.3447    0.4671    0.0000 H   0  0  0

+   -2.9553   -3.5051    0.0000 H   0  0  0

+    2.9198    2.7205    0.0000 H   0  0  0

+    4.5983    0.9116    0.0000 H   0  0  0

+    3.3312   -3.0908    0.0000 H   0  0  0

+   -4.7894   -1.9238    0.0000 H   0  0  0

+    5.1039   -1.4361    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+  6 12  2  0

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+ 15 18  2  0

+  5  7  1  0

+  9 14  1  0

+ 12 17  1  0

+ 16 18  1  0

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+  8 20  1  0

+ 10 21  1  0

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+ 12 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66194-68-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    1.0516   -0.1019   -0.0804 S   0  0  0

+   -0.1978    0.1185    0.7604 O   0  0  0

+    2.2118   -0.8552    1.0931 C   0  0  0

+    0.6134   -1.0368   -1.0567 O   0  0  0

+    1.4386    1.2218   -0.4227 O   0  0  0

+   -1.2240    0.5575   -0.1320 C   0  0  1

+   -2.5205   -0.1961    0.1716 C   0  0  0

+   -1.4519    2.0592    0.0521 C   0  0  0

+   -2.2926   -1.6977   -0.0124 C   0  0  0

+    1.6477   -1.7240    0.0000 H   0  0  0

+    3.0806   -1.4193    0.0000 H   0  0  0

+    2.7759    0.0136    0.0000 H   0  0  0

+   -1.1607   -0.4765    0.0000 H   0  0  0

+   -2.9251    0.7575    0.0000 H   0  0  0

+   -3.5172   -0.4783    0.0000 H   0  0  0

+   -0.4277    2.2146    0.0000 H   0  0  0

+   -1.6073    3.0834    0.0000 H   0  0  0

+   -2.4761    1.9038    0.0000 H   0  0  0

+   -3.3168   -1.8531    0.0000 H   0  0  0

+   -2.1372   -2.7219    0.0000 H   0  0  0

+   -1.2684   -1.5423    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

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+  6  7  1  0

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+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-08-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.2195   -0.0001    0.0035 C   0  0  0

+    0.9105   -1.1971    0.0022 C   0  0  0

+    0.9109    1.1972    0.0023 C   0  0  0

+   -1.2875    0.0000   -0.0001 C   0  0  0

+    2.2931   -1.1971   -0.0002 C   0  0  0

+    2.2930    1.1972   -0.0002 C   0  0  0

+   -1.7538    1.3190    0.0019 F   0  0  0

+   -1.7511   -0.6567   -1.1451 F   0  0  0

+   -1.7566   -0.6623    1.1394 F   0  0  0

+    2.9842   -0.0002   -0.0015 C   0  0  0

+    0.3921   -2.0950    0.0000 H   0  0  0

+    0.3926    2.0951    0.0000 H   0  0  0

+    2.8115   -2.0950    0.0000 H   0  0  0

+    2.8114    2.0950    0.0000 H   0  0  0

+    4.0210   -0.0003    0.0000 H   0  0  0

+  1  2  2  0

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+  6 10  1  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75464-11-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+   -1.0038   -0.0019    0.7813 C   0  0  0

+   -0.1957   -1.2568    0.6479 C   0  0  0

+   -0.1987    1.2550    0.6494 C   0  0  0

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+   -3.5471   -0.0033    0.1943 C   0  0  0

+   -1.8344   -0.0027   -1.4231 O   0  0  0

+    1.6651    0.0020   -0.4094 C   0  0  0

+    1.7935   -2.4603   -0.0450 C   0  0  0

+   -0.0186   -3.6296    0.9943 C   0  0  0

+    1.7845    2.4652   -0.0488 C   0  0  0

+   -0.0255    3.6271    1.0022 C   0  0  0

+   -4.4566   -0.0039   -1.0361 C   0  0  0

+    2.6094    0.0029   -1.1760 O   0  0  0

+    1.2373   -3.6428    0.4198 C   0  0  0

+    3.0265   -2.4626   -0.6105 O   0  0  0

+    1.2276    3.6451    0.4218 C   0  0  0

+    3.0148    2.4722   -0.6203 O   0  0  0

+   -5.9197   -0.0046   -0.5887 C   0  0  0

+   -1.4723   -0.8614    0.0000 H   0  0  0

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+   -4.9456   -0.8519    0.0000 H   0  0  0

+   -3.9667   -0.8513    0.0000 H   0  0  0

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+   -6.8986   -0.0051    0.0000 H   0  0  0

+   -5.9192   -0.9835    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66267-19-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 44                          1 V2000

+   -0.8066   -0.1915   -0.1399 C   0  0  0

+   -2.2613   -0.3095   -0.2003 C   0  0  0

+   -0.2288    1.1472    0.0067 C   0  0  0

+    0.0201   -1.3085   -0.2123 C   0  0  0

+   -3.0358    0.8369   -0.1159 C   0  0  0

+   -2.9145   -1.6207   -0.3481 C   0  0  0

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+    1.4013   -1.1471   -0.1516 C   0  0  0

+   -2.4433    2.0864    0.0247 C   0  0  0

+   -4.5370    0.7105   -0.1799 C   0  0  2

+   -4.1957   -1.7533   -0.0219 C   0  0  0

+    1.9789    0.1905   -0.0123 C   0  0  0

+    2.2895   -2.3053   -0.2252 C   0  0  0

+   -4.9792   -0.5818    0.5030 C   0  0  1

+   -4.9558    0.6946   -1.5461 O   0  0  0

+    3.4420    0.3222    0.0468 C   0  0  0

+    3.6263   -2.1529   -0.1685 C   0  0  0

+   -4.7784   -0.4680    1.9133 O   0  0  0

+    4.2423   -0.8367   -0.0348 C   0  0  0

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+    5.6375   -0.7097    0.0217 C   0  0  0

+    5.4183    1.6656    0.2325 C   0  0  0

+    6.2054    0.5238    0.1538 C   0  0  0

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+ 23 39  1  0

+ 24 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35287-69-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 81                          1 V2000

+   -5.5028   -0.3795    0.3918 C   0  0  0

+   -5.3588    1.0293   -0.1237 C   0  0  0

+   -4.8033   -0.5431    1.6188 O   0  0  0

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+ 46 76  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2783-94-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 41                          1 V2000

+   -4.0975    0.9701    0.2765 C   0  0  0

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+   -4.9532    3.2226    0.6539 C   0  0  0

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+    4.9382   -2.4182   -0.5637 O   0  0  0

+   14.0948    0.6663   -0.5075 Na  0  3  0

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+   -3.5531   -1.0098    0.0000 H   0  0  0

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+ 18 40  1  0

+ 27 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16048-37-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -2.2391    0.8047    0.0675 C   0  0  0

+   -3.0853   -0.1806    0.6042 C   0  0  0

+   -0.8799    0.4382   -0.3834 C   0  0  0

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+   -1.8892    3.0867   -0.5556 N   0  3  0

+   -1.3818   -1.9783   -0.0134 C   0  0  0

+   -3.2116   -2.3832    1.3906 O   0  0  0

+   -4.8050    1.4726    0.9218 C   0  0  0

+    0.6156   -1.3664   -1.2352 C   0  0  0

+   -1.2745    3.8189   -0.9485 N   0  0  0

+   -1.0600   -3.3222   -0.1702 C   0  0  0

+    0.9213   -2.7086   -1.3824 C   0  0  0

+    0.0900   -3.6791   -0.8538 C   0  0  0

+   11.5381    0.5885    0.5514 Cl  0  0  0

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+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 19 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2461-43-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    0.4910   -1.3316    0.6359 C   0  0  0

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+  1  2  2  0

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+ 16 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2693-46-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -0.5272    0.1939    0.0033 C   0  0  0

+    0.1156   -1.1209    0.0030 C   0  0  0

+    0.3076    1.1841    0.0020 C   0  0  0

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+   -1.5754    2.6980    0.0021 C   0  0  0

+   -4.1220   -0.8818   -0.0074 N   0  0  0

+    3.9690   -0.9532   -0.0036 C   0  0  0

+    4.0745    0.3587   -0.0027 C   0  0  0

+   -0.1971   -3.1776    0.0000 H   0  0  0

+    0.3943    3.4233    0.0000 H   0  0  0

+   -3.5815    1.6880    0.0000 H   0  0  0

+    2.5473   -2.6775    0.0000 H   0  0  0

+   -2.7142   -2.9919    0.0000 H   0  0  0

+    2.9552    2.2913    0.0000 H   0  0  0

+   -1.9950    3.7122    0.0000 H   0  0  0

+   -4.6466    0.0823    0.0000 H   0  0  0

+   -4.6946   -1.8182    0.0000 H   0  0  0

+    4.8720   -1.5771    0.0000 H   0  0  0

+    5.0664    0.8285    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  5 11  2  0

+  6 12  1  0

+  7 13  2  0

+  8 14  2  0

+  9 15  1  0

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+  5  7  1  0

+  9 12  2  0

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+ 10 20  1  0

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+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5422-34-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -0.6783   -0.3366    0.0316 C   0  0  0

+   -1.8110    0.6056    0.3478 C   0  0  0

+    0.5754    0.1388   -0.1054 N   0  0  0

+   -0.8939   -1.5234   -0.0947 O   0  0  0

+   -1.9311    1.6500   -0.7639 C   0  0  0

+   -3.0315   -0.1316    0.4426 O   0  0  0

+    1.6766   -0.7772   -0.4128 C   0  0  0

+    2.9833    0.0121   -0.5144 C   0  0  0

+    3.2418    0.6675    0.7290 O   0  0  0

+   -0.8984    1.0991    0.0000 H   0  0  0

+    0.7465    1.1621    0.0000 H   0  0  0

+   -0.9004    1.7685    0.0000 H   0  0  0

+   -2.0496    2.6807    0.0000 H   0  0  0

+   -2.9618    1.5315    0.0000 H   0  0  0

+   -3.9196   -0.6680    0.0000 H   0  0  0

+    0.9287   -1.4963    0.0000 H   0  0  0

+    2.3083   -1.6003    0.0000 H   0  0  0

+    3.2269   -0.9964    0.0000 H   0  0  0

+    4.0183   -0.0598    0.0000 H   0  0  0

+    3.6225    1.6326    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-23-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    1.3196    0.3027    0.0391 C   0  0  0

+    0.0137   -0.1399   -0.6240 C   0  0  0

+    2.4893   -0.4726   -0.5706 C   0  0  0

+    1.5260    1.8012   -0.1908 C   0  0  0

+   -1.1560    0.6354   -0.0143 C   0  0  0

+    3.7756   -0.0367    0.0825 C   0  0  0

+   -2.4423    0.1995   -0.6674 C   0  0  0

+    4.4570   -0.8415    0.6709 O   0  0  0

+   -3.4390   -0.2262    0.0684 C   0  0  0

+   -4.0857    0.6974    1.0683 C   0  0  0

+   -3.9390   -1.6396   -0.0850 C   0  0  0

+    1.1873   -0.7151    0.0000 H   0  0  0

+   -0.7261   -0.8514    0.0000 H   0  0  0

+    0.5470   -1.0169    0.0000 H   0  0  0

+    1.7495   -1.1841    0.0000 H   0  0  0

+    3.0225   -1.3496    0.0000 H   0  0  0

+    2.5428    1.6612    0.0000 H   0  0  0

+    1.6660    2.8180    0.0000 H   0  0  0

+    0.5092    1.9412    0.0000 H   0  0  0

+   -0.4162    1.3469    0.0000 H   0  0  0

+   -1.6892    1.5124    0.0000 H   0  0  0

+    4.0501    0.9523    0.0000 H   0  0  0

+   -2.8089    1.1582    0.0000 H   0  0  0

+   -3.2449    1.2861    0.0000 H   0  0  0

+   -4.6744    1.5382    0.0000 H   0  0  0

+   -4.9265    0.1087    0.0000 H   0  0  0

+   -4.9066   -1.2973    0.0000 H   0  0  0

+   -4.2813   -2.6072    0.0000 H   0  0  0

+   -2.9714   -1.9819    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94055-76-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 67                          1 V2000

+   -8.4556   -0.3071   -0.7336 C   0  0  0

+   -8.9532   -1.2303    0.1766 C   0  0  0

+   -7.1747   -0.4600   -1.2467 C   0  0  0

+   -9.2481    0.7752   -1.1383 N   0  0  0

+   -8.1738   -2.2997    0.5706 C   0  0  0

+   -6.3962   -1.5302   -0.8516 C   0  0  0

+   -9.7793    1.6032   -0.2171 C   0  0  0

+   -6.8938   -2.4520    0.0575 C   0  0  0

+  -10.7341    2.6892   -0.6413 C   0  0  0

+   -9.4888    1.4742    0.9535 O   0  0  0

+   -6.1266   -3.5051    0.4464 O   0  0  0

+  -11.1860    3.4798    0.5882 C   0  0  0

+   -4.8818   -3.3870   -0.2454 C   0  0  0

+  -12.3353    4.7870    0.0775 S   0  3  0

+   -3.9668   -4.5479    0.1495 C   0  0  0

+  -13.8436    3.8067   -0.1563 C   0  0  0

+  -12.6945    5.5380    1.6892 C   0  0  0

+   -2.6340   -4.4215   -0.5911 C   0  0  0

+   -3.7337   -4.5125    1.5589 O   0  0  0

+   -1.7794   -5.5057   -0.2223 O   0  0  0

+   -0.5577   -5.3322   -0.9429 C   0  0  0

+    0.4071   -6.4665   -0.5916 C   0  0  0

+   13.8084    1.2708    0.0436 C   0  0  0

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+   15.8732    0.0650   -0.0810 C   0  0  0

+   13.0715    3.6742    0.4495 O   0  0  0

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+   15.3914   -0.8545    0.8316 C   0  0  0

+   16.2541   -2.0132    1.2607 C   0  0  0

+   -9.9185   -1.2958    0.0000 H   0  0  0

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+ 27 62  1  0

+ 28 63  1  0

+ 33 64  1  0

+ 33 65  1  0

+ 33 66  1  0

+ 31 67  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+555-77-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+   -0.0517    0.4261    0.6405 N   0  0  0

+   -1.2448    0.6429   -0.1887 C   0  0  0

+    0.0288   -1.0185    0.8949 C   0  0  0

+    1.1087    0.7737   -0.1904 C   0  0  0

+   -2.4078    1.0914    0.6985 C   0  0  0

+    0.1540   -1.7643   -0.4351 C   0  0  0

+    2.2523    1.2533    0.7058 C   0  0  0

+   -3.8721    1.3574   -0.3192 Cl  0  0  0

+    0.2528   -3.5373   -0.1229 Cl  0  0  0

+    3.6766    1.6800   -0.3141 Cl  0  0  0

+   -1.9340    0.0112    0.0000 H   0  0  0

+   -0.9855   -0.2553    0.0000 H   0  0  0

+   -0.8205   -0.6279    0.0000 H   0  0  0

+   -0.7137   -1.5865    0.0000 H   0  0  0

+    0.9255   -0.1430    0.0000 H   0  0  0

+    1.8324    0.1819    0.0000 H   0  0  0

+   -1.7186    1.7231    0.0000 H   0  0  0

+   -2.6672    1.9896    0.0000 H   0  0  0

+    1.0033   -2.1549    0.0000 H   0  0  0

+    0.8965   -1.1963    0.0000 H   0  0  0

+    2.4354    2.1700    0.0000 H   0  0  0

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+  1  2  1  0

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+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13345-62-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+    0.8191    0.3844   -0.0833 C   0  0  0

+    0.0399   -0.8212   -0.3701 C   0  0  0

+    2.2816    0.2716    0.0118 C   0  0  0

+    0.1871    1.6050    0.0884 C   0  0  0

+   -1.3454   -0.7504   -0.4674 C   0  0  0

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+   -3.3913    0.5857   -0.3812 C   0  0  0

+   -2.6017   -2.7956    0.7865 Cl  0  0  0

+    5.0367    0.0137    0.1825 C   0  0  0

+   -3.2353    2.9459    0.0483 C   0  0  0

+   -3.9824    1.7958   -0.2024 C   0  0  0

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+   -2.6423   -1.0724    0.0000 H   0  0  0

+   -3.1914   -1.9808    0.0000 H   0  0  0

+    2.5367   -3.1019    0.0000 H   0  0  0

+    4.7377   -2.0328    0.0000 H   0  0  0

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+   -1.3385    3.7985    0.0000 H   0  0  0

+   -3.9776   -0.2769    0.0000 H   0  0  0

+    6.0768   -0.0632    0.0000 H   0  0  0

+   -3.7200    3.8694    0.0000 H   0  0  0

+   -5.0235    1.8592    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

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+  7 13  2  0

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+ 15 19  1  0

+ 20 21  1  0

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+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+589-17-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.8174    0.0060   -0.6249 C   0  0  0

+   -1.1375   -1.1923   -0.5138 C   0  0  0

+   -1.1362    1.2023   -0.4966 C   0  0  0

+   -3.3005    0.0085   -0.8923 C   0  0  0

+    0.2240   -1.1951   -0.2742 C   0  0  0

+    0.2248    1.2004   -0.2571 C   0  0  0

+   -4.1935   -0.0064    0.6739 Cl  0  0  0

+    0.9058    0.0013   -0.1457 C   0  0  0

+    2.7680   -0.0018    0.1827 Br  0  0  0

+   -1.6582   -2.0842    0.0000 H   0  0  0

+   -1.6546    2.0955    0.0000 H   0  0  0

+   -2.7881    0.9052    0.0000 H   0  0  0

+   -3.8263    0.8974    0.0000 H   0  0  0

+    0.7420   -2.0886    0.0000 H   0  0  0

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+  1  2  2  0

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+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+522-06-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 34                          1 V2000

+    0.1610    0.7421   -0.1533 C   0  0  0

+   -0.0488   -0.6597   -0.1441 C   0  0  0

+    1.4814    1.2376   -0.1407 C   0  0  0

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+   -1.3693   -1.1523   -0.1531 C   0  0  0

+    0.9895   -1.5023   -0.1261 N   0  0  0

+    2.5199    0.3114   -0.1195 C   0  0  0

+    1.7304    2.5702   -0.1485 O   0  0  0

+   -2.2090    1.1142   -0.1721 C   0  0  0

+   -2.4300   -0.2717   -0.1707 C   0  0  0

+   -1.5968   -2.4934   -0.1449 O   0  0  0

+    2.2368   -1.0718   -0.1132 C   0  0  0

+    3.9848    0.4157   -0.1001 C   0  0  0

+    1.9189    2.9632    1.2124 C   0  0  0

+   -3.4211    1.7450   -0.1856 O   0  0  0

+   -3.7788   -0.4935   -0.1813 O   0  0  0

+   -1.6792   -2.8900    1.2255 C   0  0  0

+    3.4240   -1.7146   -0.0934 O   0  0  0

+    4.4468   -0.8401   -0.0854 C   0  0  0

+   -4.3761    0.7534    0.2342 C   0  0  0

+   -0.7884    2.6293    0.0000 H   0  0  0

+    4.5411    1.2768    0.0000 H   0  0  0

+    2.8433    2.5198    0.0000 H   0  0  0

+    2.3623    3.8876    0.0000 H   0  0  0

+    0.9945    3.4066    0.0000 H   0  0  0

+   -2.6830   -2.6815    0.0000 H   0  0  0

+   -1.8877   -3.8938    0.0000 H   0  0  0

+   -0.6754   -3.0985    0.0000 H   0  0  0

+    5.4387   -1.0991    0.0000 H   0  0  0

+   -5.0247    1.5473    0.0000 H   0  0  0

+   -5.2415    0.2037    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 13 19  2  0

+ 15 20  1  0

+  7 12  1  0

+  9 10  2  0

+ 16 20  1  0

+ 18 19  1  0

+  4 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+ 20 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1768-31-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.2375   -0.8344    0.2264 C   0  0  0

+   -1.0537   -0.0885    0.0085 C   0  0  0

+    1.4845   -0.0838    0.6173 C   0  0  0

+    0.2718   -2.0340    0.0926 O   0  0  0

+   -2.3519   -1.2544   -0.4456 Cl  0  0  0

+   -1.5176    0.7662    1.5268 Cl  0  0  0

+   -0.8364    1.1150   -1.3163 Cl  0  0  0

+    2.9316   -0.9485   -0.0223 Cl  0  0  0

+    1.4253    1.5808   -0.0730 Cl  0  0  0

+    2.4357    0.4785    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+153954-29-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.2252   -0.8780    0.0028 C   0  0  0

+   -1.2768    0.0421    0.0024 C   0  0  0

+    1.1468   -0.3764    0.0011 C   0  0  0

+   -0.7693   -2.1162   -0.0004 N   0  0  0

+   -1.0152    1.4145    0.0006 C   0  0  0

+   -2.4410   -0.7065    0.0043 N   0  0  0

+    1.3594    1.0249   -0.0010 C   0  0  0

+    2.1898   -1.2049    0.0020 N   0  0  0

+   -2.0773   -2.0207   -0.0028 C   0  0  0

+    0.2535    1.8959   -0.0006 C   0  0  0

+   -2.1695    2.3833   -0.0003 C   0  0  0

+   -3.8097   -0.1840    0.0046 C   0  0  0

+    2.6099    1.4982   -0.0027 N   0  0  0

+    3.4112   -0.7158    0.0008 C   0  0  0

+   -2.9522   -3.0875   -0.0068 N   0  0  0

+   -1.6683    3.7215   -0.0021 O   0  0  0

+    3.6241    0.6618   -0.0022 C   0  0  0

+    4.5910   -1.6534    0.0017 C   0  0  0

+    0.4115    2.9256    0.0000 H   0  0  0

+   -3.0975    2.8566    0.0000 H   0  0  0

+   -2.7447    1.5147    0.0000 H   0  0  0

+   -3.4382    0.7893    0.0000 H   0  0  0

+   -4.7830    0.1875    0.0000 H   0  0  0

+   -4.1812   -1.1573    0.0000 H   0  0  0

+   -3.9801   -2.9181    0.0000 H   0  0  0

+   -2.5849   -4.0624    0.0000 H   0  0  0

+   -1.3029    4.6971    0.0000 H   0  0  0

+    4.5976    1.0326    0.0000 H   0  0  0

+    3.9428   -2.4690    0.0000 H   0  0  0

+    5.4066   -2.3016    0.0000 H   0  0  0

+    5.2392   -0.8378    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 11 16  1  0

+ 13 17  2  0

+ 14 18  1  0

+  6  9  1  0

+  7 10  1  0

+ 14 17  1  0

+ 10 19  1  0

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+ 12 22  1  0

+ 12 23  1  0

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+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2404-44-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    2.5154   -0.5027    0.0607 C   0  0  0

+    1.2586    0.3207    0.3495 C   0  0  0

+    3.7544    0.2998    0.4629 C   0  0  0

+    0.0196   -0.4818   -0.0526 C   0  0  0

+    5.0112   -0.5237    0.1741 C   0  0  0

+    4.5696    0.5263   -0.6887 O   0  0  0

+   -1.2372    0.3416    0.2361 C   0  0  0

+   -2.4762   -0.4609   -0.1660 C   0  0  0

+   -3.7330    0.3625    0.1228 C   0  0  0

+   -4.9720   -0.4400   -0.2794 C   0  0  0

+   -6.2288    0.3834    0.0094 C   0  0  0

+    1.7865   -1.3360    0.0000 H   0  0  0

+    3.2400   -1.3398    0.0000 H   0  0  0

+    1.9875    1.1540    0.0000 H   0  0  0

+    0.5340    1.1578    0.0000 H   0  0  0

+    3.3000    1.3094    0.0000 H   0  0  0

+   -0.7093   -1.3151    0.0000 H   0  0  0

+    0.7442   -1.3189    0.0000 H   0  0  0

+    4.7330   -1.5953    0.0000 H   0  0  0

+    6.1155   -0.4440    0.0000 H   0  0  0

+   -0.5083    1.1749    0.0000 H   0  0  0

+   -1.9618    1.1787    0.0000 H   0  0  0

+   -3.2051   -1.2942    0.0000 H   0  0  0

+   -1.7516   -1.2980    0.0000 H   0  0  0

+   -3.0041    1.1958    0.0000 H   0  0  0

+   -4.4576    1.1996    0.0000 H   0  0  0

+   -5.7009   -1.2733    0.0000 H   0  0  0

+   -4.2474   -1.2771    0.0000 H   0  0  0

+   -5.6221    1.3095    0.0000 H   0  0  0

+   -7.1549    0.9901    0.0000 H   0  0  0

+   -6.8355   -0.5427    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  1  0

+  8  7  1  0

+  9  8  1  0

+ 10  9  1  0

+ 11 10  1  0

+  5  6  1  0

+  1 12  1  0

+  1 13  1  0

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+  8 23  1  0

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+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-93-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    0.7074    0.0218   -0.0017 C   0  0  0

+   -0.7074   -0.0218   -0.0017 C   0  0  0

+    1.3566    1.2696   -0.0015 C   0  0  0

+    1.4353   -1.1886    0.0040 C   0  0  0

+   -1.3566   -1.2696   -0.0018 C   0  0  0

+   -1.4353    1.1886    0.0044 C   0  0  0

+    2.7131    1.3446   -0.0010 C   0  0  0

+    2.7864   -1.1840    0.0046 C   0  0  0

+   -2.7131   -1.3446   -0.0014 C   0  0  0

+   -2.7864    1.1840    0.0050 C   0  0  0

+    3.5002    0.0990   -0.0007 C   0  0  0

+    3.3348    2.5504   -0.0013 O   0  0  0

+   -3.5002   -0.0990   -0.0007 C   0  0  0

+   -3.3348   -2.5504   -0.0011 O   0  0  0

+    4.8159    0.1358   -0.0003 N   0  0  0

+    2.3081    3.5444   -0.0021 C   0  0  0

+   -4.8159   -0.1358   -0.0008 N   0  0  0

+   -2.3081   -3.5444   -0.0014 C   0  0  0

+    5.4709   -0.9289   -0.0001 C   0  0  0

+   -5.4709    0.9289   -0.0002 C   0  0  0

+    6.1039   -1.9577    0.0002 O   0  0  0

+   -6.1039    1.9577    0.0004 O   0  0  0

+    0.8041    2.1257    0.0000 H   0  0  0

+    0.9352   -2.0764    0.0000 H   0  0  0

+   -0.8041   -2.1257    0.0000 H   0  0  0

+   -0.9352    2.0764    0.0000 H   0  0  0

+    3.3044   -2.0615    0.0000 H   0  0  0

+   -3.3044    2.0615    0.0000 H   0  0  0

+    3.0168    4.2765    0.0000 H   0  0  0

+    1.5760    4.2531    0.0000 H   0  0  0

+    1.5994    2.8123    0.0000 H   0  0  0

+   -3.0168   -4.2765    0.0000 H   0  0  0

+   -1.5760   -4.2531    0.0000 H   0  0  0

+   -1.5994   -2.8123    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  8 27  1  0

+ 10 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+40568-90-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.0813   -0.3718   -0.0016 C   0  0  0

+   -1.4814   -0.2419   -0.0015 C   0  0  0

+    0.7274    0.7787    0.0000 C   0  0  0

+    0.5243   -1.7042    0.0026 C   0  0  0

+   -2.0597    1.0484   -0.0002 C   0  0  0

+   -2.3004   -1.3930   -0.0022 C   0  0  0

+    2.1791    0.6082   -0.0002 C   0  0  0

+    0.1288    2.0525    0.0022 C   0  0  0

+    1.9033   -1.8319    0.0020 C   0  0  0

+   -0.3518   -2.8764    0.0069 C   0  0  0

+   -1.2213    2.1857    0.0005 C   0  0  0

+   -3.4548    1.1656    0.0000 C   0  0  0

+   -1.6936   -2.7217   -0.0026 C   0  0  0

+   -3.6877   -1.2330   -0.0020 C   0  0  0

+    2.7312   -0.6974   -0.0020 C   0  0  0

+    3.0316    1.7192    0.0009 C   0  0  0

+   -4.2430    0.0337   -0.0007 C   0  0  0

+   -4.0958    2.5294    0.0014 C   0  0  0

+    4.1326   -0.8450   -0.0026 C   0  0  0

+    4.3825    1.5377    0.0003 C   0  0  0

+    4.9301    0.2571   -0.0014 C   0  0  0

+    0.7372    2.9139    0.0000 H   0  0  0

+    2.3372   -2.7931    0.0000 H   0  0  0

+    0.0657   -3.8448    0.0000 H   0  0  0

+   -1.6500    3.1492    0.0000 H   0  0  0

+   -2.3137   -3.5747    0.0000 H   0  0  0

+   -4.3143   -2.0812    0.0000 H   0  0  0

+    2.6293    2.6940    0.0000 H   0  0  0

+   -5.2926    0.1364    0.0000 H   0  0  0

+   -3.1414    2.9780    0.0000 H   0  0  0

+   -4.5444    3.4838    0.0000 H   0  0  0

+   -5.0502    2.0808    0.0000 H   0  0  0

+    4.5624   -1.8080    0.0000 H   0  0  0

+    5.0208    2.3772    0.0000 H   0  0  0

+    5.9782    0.1401    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  5 11  1  0

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+ 15 19  1  0

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+  8 11  2  0

+  9 15  1  0

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+ 14 17  2  0

+ 20 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-48-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.7097   -0.0625   -0.0202 C   0  0  0

+    0.1883   -1.2802    0.0060 C   0  0  0

+    0.0309    1.0452   -0.1683 O   0  0  0

+   -1.9141   -0.0854    0.0732 O   0  0  0

+    1.6230   -0.7156   -0.0931 C   0  0  0

+    1.4073    0.7797    0.2340 C   0  0  0

+   -0.7436   -1.8498    0.0000 H   0  0  0

+    0.6749   -2.2580    0.0000 H   0  0  0

+    1.9434   -1.7598    0.0000 H   0  0  0

+    2.6888   -0.4767    0.0000 H   0  0  0

+    2.4989    0.8146    0.0000 H   0  0  0

+    1.4938    1.8685    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  6  1  0

+  2  7  1  0

+  2  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3268-87-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    1.1782    0.6953   -0.0059 C   0  0  0

+    1.1782   -0.6953   -0.0031 C   0  0  0

+    2.3796    1.3866   -0.0047 C   0  0  0

+    0.0000    1.3759   -0.0040 O   0  0  0

+    2.3796   -1.3867    0.0009 C   0  0  0

+    0.0000   -1.3759   -0.0037 O   0  0  0

+    3.5777    0.6920   -0.0008 C   0  0  0

+    2.3824    3.1226   -0.0088 Cl  0  0  0

+   -1.1782    0.6953    0.0012 C   0  0  0

+    3.5777   -0.6920    0.0020 C   0  0  0

+    2.3823   -3.1226    0.0049 Cl  0  0  0

+   -1.1782   -0.6953   -0.0064 C   0  0  0

+    5.0819    1.5587    0.0007 Cl  0  0  0

+   -2.3796    1.3867    0.0043 C   0  0  0

+    5.0819   -1.5587    0.0075 Cl  0  0  0

+   -2.3796   -1.3867   -0.0059 C   0  0  0

+   -3.5777    0.6920    0.0101 C   0  0  0

+   -2.3824    3.1227    0.0014 Cl  0  0  0

+   -3.5777   -0.6921   -0.0082 C   0  0  0

+   -2.3823   -3.1226   -0.0030 Cl  0  0  0

+   -5.0819    1.5587    0.0139 Cl  0  0  0

+   -5.0819   -1.5587   -0.0075 Cl  0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+ 16 19  2  0

+ 16 20  1  0

+ 17 21  1  0

+ 19 22  1  0

+  7 10  1  0

+  9 12  2  0

+ 17 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82486-82-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+   -0.8024   -0.1966   -0.2912 N   0  0  0

+   -0.0500    0.4752   -1.3537 C   0  0  0

+   -1.7691    0.5572    0.5109 C   0  0  0

+   -0.6016   -1.5613   -0.0460 N   0  3  0

+    1.2517    1.0378   -0.7793 C   0  0  0

+   -3.1455    0.4908   -0.1540 C   0  0  0

+   -1.2271   -2.1199    0.8373 O   0  0  0

+    0.1985   -2.1892   -0.7162 O   0  5  0

+    2.0357   -0.0293   -0.2420 O   0  0  0

+   -4.1551    1.2781    0.6837 C   0  0  0

+    3.2205    0.5517    0.2714 N   0  3  0

+   -5.5314    1.2117    0.0187 C   0  0  0

+    3.3921    1.7551    0.1934 O   0  0  0

+    4.0682   -0.1519    0.7910 O   0  5  0

+   -0.0417    1.4354    0.0000 H   0  0  0

+   -0.9247    0.8714    0.0000 H   0  0  0

+   -0.9886    1.1165    0.0000 H   0  0  0

+   -2.0848    1.4640    0.0000 H   0  0  0

+    2.0661    1.5466    0.0000 H   0  0  0

+    0.8056    1.8881    0.0000 H   0  0  0

+   -3.9260   -0.0685    0.0000 H   0  0  0

+   -2.8298   -0.4160    0.0000 H   0  0  0

+   -3.3746    1.8374    0.0000 H   0  0  0

+   -4.4708    2.1849    0.0000 H   0  0  0

+   -5.5777    2.1708    0.0000 H   0  0  0

+   -6.4905    1.1654    0.0000 H   0  0  0

+   -5.4851    0.2526    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+  2 15  1  0

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+  3 17  1  0

+  3 18  1  0

+  5 19  1  0

+  5 20  1  0

+  6 21  1  0

+  6 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+617-35-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.2042   -0.3970   -0.0013 C   0  0  0

+   -0.9383    0.3145   -0.0003 O   0  0  0

+    1.5193    0.3048   -0.0004 C   0  0  0

+    0.1636   -1.6090    0.0020 O   0  0  0

+   -2.2193   -0.3690   -0.0012 C   0  0  0

+    2.7985   -0.4919   -0.0015 C   0  0  0

+    1.5596    1.5119    0.0013 O   0  0  0

+   -3.3483    0.6635    0.0003 C   0  0  0

+   -3.0403   -1.0844    0.0000 H   0  0  0

+   -1.6013   -1.2656    0.0000 H   0  0  0

+    2.2228   -1.4162    0.0000 H   0  0  0

+    3.7228   -1.0676    0.0000 H   0  0  0

+    3.3742    0.4324    0.0000 H   0  0  0

+   -2.6134    1.4671    0.0000 H   0  0  0

+   -4.1519    1.3984    0.0000 H   0  0  0

+   -4.0832   -0.1401    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  2  1  0

+  6  3  1  0

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+  8  5  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+  8 14  1  0

+  8 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+683-51-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.0070    0.6569   -0.0015 C   0  0  0

+   -1.4280    0.3687    0.0012 C   0  0  0

+    0.4339    1.9221    0.0003 C   0  0  0

+    1.1540   -0.6462    0.0002 Cl  0  0  0

+   -1.8159   -0.7809   -0.0004 O   0  0  0

+   -2.1215    1.1566    0.0000 H   0  0  0

+    1.4630    2.1287    0.0000 H   0  0  0

+   -0.2596    2.7100    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-84-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    0.0000   -0.3926    0.0000 C   0  0  0

+   -1.2492    0.4908    0.0000 C   0  0  0

+    1.2492    0.4908    0.0000 C   0  0  0

+   -2.4985   -0.3926    0.0000 C   0  0  0

+    2.4985   -0.3926    0.0000 C   0  0  0

+   -3.7477    0.4908    0.0000 C   0  0  0

+    3.7477    0.4908    0.0000 C   0  0  0

+   -4.9969   -0.3926    0.0000 C   0  0  0

+    4.9969   -0.3926    0.0000 C   0  0  0

+   -0.7642   -1.2486    0.0000 H   0  0  0

+    0.7642   -1.2486    0.0000 H   0  0  0

+   -0.4850    1.3468    0.0000 H   0  0  0

+   -2.0134    1.3468    0.0000 H   0  0  0

+    2.0134    1.3468    0.0000 H   0  0  0

+    0.4850    1.3468    0.0000 H   0  0  0

+   -3.2627   -1.2486    0.0000 H   0  0  0

+   -1.7343   -1.2486    0.0000 H   0  0  0

+    1.7343   -1.2486    0.0000 H   0  0  0

+    3.2627   -1.2486    0.0000 H   0  0  0

+   -2.9835    1.3468    0.0000 H   0  0  0

+   -4.5119    1.3468    0.0000 H   0  0  0

+    4.5119    1.3468    0.0000 H   0  0  0

+    2.9835    1.3468    0.0000 H   0  0  0

+   -5.6595    0.5443    0.0000 H   0  0  0

+   -5.9338   -1.0551    0.0000 H   0  0  0

+   -4.3344   -1.3295    0.0000 H   0  0  0

+    4.3344   -1.3295    0.0000 H   0  0  0

+    5.9338   -1.0551    0.0000 H   0  0  0

+    5.6595    0.5443    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  3  5  1  0

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+  1 10  1  0

+  1 11  1  0

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+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  8 26  1  0

+  9 27  1  0

+  9 28  1  0

+  9 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+517-66-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 50                          1 V2000

+   -0.7500    0.4236    0.0328 C   0  0  0

+   -1.7205   -0.5691   -0.1205 C   0  0  0

+    0.6825    0.0416    0.0397 C   0  0  0

+   -1.1244    1.7572    0.1833 C   0  0  0

+   -1.2986   -2.0077   -0.2543 C   0  0  0

+   -3.0545   -0.2215   -0.1526 C   0  0  0

+    1.0255   -1.2852    0.2989 C   0  0  0

+    1.6738    0.9857   -0.2070 C   0  0  0

+   -2.4745    2.0946    0.1756 C   0  0  0

+   -0.3903    2.8948    0.3509 O   0  0  0

+   -0.0549   -2.2909    0.5855 C   0  0  0

+   -2.3885   -2.8807    0.2035 N   0  0  0

+   -3.4279    1.1060    0.0063 C   0  0  0

+   -4.1278   -1.2479   -0.3874 C   0  0  0

+    2.3524   -1.6641    0.2999 C   0  0  0

+    3.0038    0.6013   -0.2005 C   0  0  0

+   -2.5873    3.4446    0.3458 O   0  0  0

+   -1.2855    3.9796    0.0425 C   0  0  0

+   -3.5389   -2.6231   -0.6624 C   0  0  0

+   -1.9624   -4.2616   -0.0603 C   0  0  0

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+    3.9785    1.5190   -0.4400 O   0  0  0

+    4.6492   -1.1024    0.0532 O   0  0  0

+    3.3233    2.7698   -0.6593 C   0  0  0

+    4.6747   -2.5024    0.3387 C   0  0  0

+   -1.0662   -3.0197    0.0000 H   0  0  0

+    1.4272    1.9943    0.0000 H   0  0  0

+   -0.4811   -3.2377    0.0000 H   0  0  0

+    0.7889   -2.8960    0.0000 H   0  0  0

+   -4.4348    1.3594    0.0000 H   0  0  0

+   -4.7509   -0.4173    0.0000 H   0  0  0

+   -5.0268   -1.7675    0.0000 H   0  0  0

+    2.5994   -2.6726    0.0000 H   0  0  0

+   -0.4227    4.5572    0.0000 H   0  0  0

+   -1.7741    4.8958    0.0000 H   0  0  0

+   -4.5573   -2.8256    0.0000 H   0  0  0

+   -3.5514   -3.6614    0.0000 H   0  0  0

+   -2.9546   -4.5677    0.0000 H   0  0  0

+   -1.6563   -5.2538    0.0000 H   0  0  0

+   -0.9702   -3.9555    0.0000 H   0  0  0

+    4.2431    3.2516    0.0000 H   0  0  0

+    2.8415    3.6896    0.0000 H   0  0  0

+    2.4035    2.2880    0.0000 H   0  0  0

+    3.6365   -2.5213    0.0000 H   0  0  0

+    4.6936   -3.5406    0.0000 H   0  0  0

+    5.7129   -2.4835    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  8 16  1  0

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+ 10 18  1  0

+ 12 19  1  0

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+ 15 21  1  0

+ 16 22  1  0

+ 21 23  1  0

+ 22 24  1  0

+ 23 25  1  0

+  7 11  1  0

+  9 13  2  0

+ 14 19  1  0

+ 16 21  2  0

+ 17 18  1  0

+  5 26  1  0

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+ 11 28  1  0

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+ 24 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+ 25 44  1  0

+ 25 45  1  0

+ 25 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13676-54-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 44                          1 V2000

+    4.6337   -0.5064   -0.0896 N   0  0  0

+    3.4895    0.3030   -0.0669 C   0  0  0

+    5.6886   -0.3812    0.7356 C   0  0  0

+    4.8422   -1.5308   -0.9361 C   0  0  0

+    2.8986    0.7054   -1.2568 C   0  0  0

+    2.9416    0.6992    1.1458 C   0  0  0

+    6.6808   -1.4219    0.3870 C   0  0  0

+    5.8068    0.4458    1.6165 O   0  0  0

+    6.1635   -2.1245   -0.6348 C   0  0  0

+    4.0761   -1.9049   -1.8004 O   0  0  0

+    1.7707    1.5027   -1.2312 C   0  0  0

+    1.8140    1.4963    1.1650 C   0  0  0

+    1.2305    1.8999   -0.0222 C   0  0  0

+    0.0001    2.7697    0.0022 C   0  0  0

+   -1.2299    1.8993    0.0252 C   0  0  0

+   -1.7699    1.4999    1.2336 C   0  0  0

+   -1.8196    1.5064   -1.1625 C   0  0  0

+   -2.8977    0.7024    1.2579 C   0  0  0

+   -2.9471    0.7092   -1.1446 C   0  0  0

+   -3.4887    0.3021    0.0674 C   0  0  0

+   -4.6328   -0.5074    0.0888 N   0  0  0

+   -5.6876   -0.3812   -0.7364 C   0  0  0

+   -4.8414   -1.5330    0.9339 C   0  0  0

+   -6.6797   -1.4225   -0.3893 C   0  0  0

+   -5.8054    0.4466   -1.6166 O   0  0  0

+   -6.1626   -2.1264    0.6316 C   0  0  0

+   -4.0753   -1.9083    1.7977 O   0  0  0

+    2.4514    0.0609    0.0000 H   0  0  0

+    3.3979    1.3374    0.0000 H   0  0  0

+    7.4637   -1.3722    0.0000 H   0  0  0

+    6.3628   -2.8833    0.0000 H   0  0  0

+    1.3119    0.8663    0.0000 H   0  0  0

+    2.2636    2.1392    0.0000 H   0  0  0

+    0.5224    3.3550    0.0000 H   0  0  0

+   -0.5225    3.3548    0.0000 H   0  0  0

+   -1.3102    0.8642    0.0000 H   0  0  0

+   -2.2636    2.1532    0.0000 H   0  0  0

+   -2.4512    0.0573    0.0000 H   0  0  0

+   -3.4093    1.3431    0.0000 H   0  0  0

+   -7.4626   -1.3725    0.0000 H   0  0  0

+   -6.3624   -2.8850    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+  7  9  2  0

+ 12 13  1  0

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+ 11 32  1  0

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+ 16 36  1  0

+ 17 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+ 24 40  1  0

+ 26 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71708-92-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    1.7612   -0.0546    0.2784 C   0  0  0

+    3.0531    0.4721    0.4061 N   0  0  0

+    1.0878   -0.5223    1.3992 C   0  0  0

+    1.1514   -0.1039   -0.9679 C   0  0  0

+    4.0132    0.1226   -0.4729 C   0  0  0

+    3.3501    1.3716    1.4586 O   0  0  0

+   -0.1853   -1.0412    1.2728 C   0  0  0

+   -0.1220   -0.6232   -1.0932 C   0  0  0

+    5.0797   -0.8635   -0.0712 C   0  0  0

+    4.0189    0.6018   -1.5871 O   0  0  0

+   -0.7920   -1.0956    0.0260 C   0  0  0

+   -2.0457   -1.6067   -0.0980 O   0  0  0

+   -2.9020   -0.5517   -0.0952 C   0  0  0

+   -4.2701   -0.7674   -0.0147 C   0  0  0

+   -2.4092    0.7437   -0.1672 C   0  0  0

+   -5.1386    0.3071   -0.0121 C   0  0  0

+   -3.2818    1.8143   -0.1642 C   0  0  0

+   -4.6454    1.5963   -0.0896 C   0  0  0

+    1.5795   -1.4286    0.0000 H   0  0  0

+    0.9124    0.8991    0.0000 H   0  0  0

+    3.6734    2.3507    0.0000 H   0  0  0

+    0.0580   -2.0432    0.0000 H   0  0  0

+   -0.6169    0.2813    0.0000 H   0  0  0

+    4.3797   -1.6206    0.0000 H   0  0  0

+    5.8368   -1.5635    0.0000 H   0  0  0

+    5.7797   -0.1064    0.0000 H   0  0  0

+   -4.6404   -1.7297    0.0000 H   0  0  0

+   -1.3913    0.9081    0.0000 H   0  0  0

+   -6.1570    0.1457    0.0000 H   0  0  0

+   -2.9145    2.7778    0.0000 H   0  0  0

+   -5.2953    2.3968    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

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+  7 11  1  0

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+  8 11  2  0

+ 17 18  1  0

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+  9 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+552-16-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.3190    0.7488   -0.0314 C   0  0  0

+    0.4559   -0.6378    0.0561 C   0  0  0

+    1.4583    1.5552   -0.0737 C   0  0  0

+   -1.0249    1.3597   -0.0852 C   0  0  0

+    1.7141   -1.2022    0.1003 C   0  0  0

+   -0.7460   -1.5005    0.1020 N   0  3  0

+    2.7100    0.9779   -0.0288 C   0  0  0

+   -1.7281    1.3403   -1.2340 O   0  0  0

+   -1.4959    1.8796    0.9065 O   0  0  0

+    2.8385   -0.3973    0.0580 C   0  0  0

+   -0.7624   -2.5549   -0.5074 O   0  0  0

+   -1.7187   -1.1558    0.7491 O   0  5  0

+    1.3633    2.5859    0.0000 H   0  0  0

+    1.8172   -2.2321    0.0000 H   0  0  0

+    3.5549    1.5759    0.0000 H   0  0  0

+   -2.7628    1.3118    0.0000 H   0  0  0

+    3.7801   -0.8271    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134998-79-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -0.1735    0.4133    0.0085 C   0  0  0

+    0.1641   -0.9506   -0.0097 C   0  0  0

+    0.8510    1.3807    0.0214 C   0  0  0

+   -1.5332    0.7986    0.0079 C   0  0  0

+    1.5219   -1.3283   -0.0124 C   0  0  0

+   -0.8584   -1.9256   -0.0246 C   0  0  0

+    2.2175    0.9756    0.0153 C   0  0  0

+    0.4993    2.7337    0.0398 C   0  0  0

+   -2.5380   -0.1991   -0.0118 C   0  0  0

+   -1.8443    2.1604    0.0263 C   0  0  0

+    2.5414   -0.3324    0.0057 C   0  0  0

+    1.8424   -2.6887   -0.0320 C   0  0  0

+   -2.2128   -1.5121   -0.0203 C   0  0  0

+   -0.4978   -3.2754   -0.0438 C   0  0  0

+    3.2530    2.0714    0.0133 C   0  0  0

+   -0.8324    3.1014    0.0446 C   0  0  0

+   -3.9636    0.2001   -0.0121 N   0  3  0

+    3.9684   -0.8188    0.0199 C   0  0  0

+    0.8360   -3.6356   -0.0473 C   0  0  0

+    4.6153    1.5348    0.4442 C   0  0  0

+   -4.7468   -0.3378    0.7499 O   0  0  0

+   -4.3533    1.0665   -0.7744 O   0  5  0

+    4.9273    0.2925   -0.3984 C   0  0  0

+    1.2500    3.4732    0.0000 H   0  0  0

+   -2.8515    2.4704    0.0000 H   0  0  0

+    2.8515   -2.9923    0.0000 H   0  0  0

+   -2.9776   -2.2370    0.0000 H   0  0  0

+   -1.2440   -4.0195    0.0000 H   0  0  0

+    3.7605    2.9949    0.0000 H   0  0  0

+    2.4014    2.6921    0.0000 H   0  0  0

+   -1.0827    4.1250    0.0000 H   0  0  0

+    3.5041   -1.7648    0.0000 H   0  0  0

+    4.8475   -1.3999    0.0000 H   0  0  0

+    1.0922   -4.6578    0.0000 H   0  0  0

+    5.6683    1.5758    0.0000 H   0  0  0

+    4.7916    2.5737    0.0000 H   0  0  0

+    5.5689   -0.5435    0.0000 H   0  0  0

+    5.8760    0.7512    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  2  0

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+ 11 18  1  0

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+ 15 20  1  0

+ 17 21  2  0

+ 17 22  1  0

+ 18 23  1  0

+  7 11  2  0

+  9 13  2  0

+ 10 16  1  0

+ 14 19  2  0

+ 20 23  1  0

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+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 23 37  1  0

+ 23 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90147-21-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+   -0.9588    0.0674    0.0039 C   0  0  0

+   -2.1045   -0.6454   -0.0112 O   0  0  0

+   -1.2952    1.4056    0.0263 C   0  0  0

+    0.3534   -0.4628    0.0032 C   0  0  0

+   -3.1508    0.1918    0.0008 C   0  0  0

+   -2.6967    1.4649    0.0239 C   0  0  0

+    1.4232    0.3729    0.0196 C   0  0  0

+   -4.5749   -0.2124   -0.0092 N   0  3  0

+    2.7332   -0.1565    0.0189 C   0  0  0

+   -5.4489    0.6359    0.0033 O   0  0  0

+   -4.8726   -1.3933   -0.0300 O   0  5  0

+    3.7970    0.6745    0.0352 O   0  0  0

+    2.9026   -1.3616    0.0036 O   0  0  0

+    4.9641   -0.1474   -0.0296 C   0  0  0

+    5.7743    0.2148   -1.2760 C   0  0  0

+    5.8189    0.0813    1.2185 C   0  0  0

+   -0.6555    2.1912    0.0000 H   0  0  0

+    0.4943   -1.4660    0.0000 H   0  0  0

+   -3.2628    2.3051    0.0000 H   0  0  0

+    1.2823    1.3761    0.0000 H   0  0  0

+    4.7867   -1.1448    0.0000 H   0  0  0

+    6.1878   -0.7101    0.0000 H   0  0  0

+    6.6992    0.6283    0.0000 H   0  0  0

+    5.3608    1.1397    0.0000 H   0  0  0

+    6.0807   -0.8974    0.0000 H   0  0  0

+    6.7976    0.3431    0.0000 H   0  0  0

+    5.5571    1.0600    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  2  0

+  8 11  1  0

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+ 12 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+  5  6  2  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+ 14 21  1  0

+ 15 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1732-29-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.0104   -0.6968    0.0103 C   0  0  0

+   -1.2384   -0.3185   -0.0042 C   0  0  0

+    1.0959    0.3003    0.0014 C   0  0  0

+    0.3517   -2.1314    0.0419 C   0  0  0

+   -1.5878    1.1132   -0.0306 C   0  0  0

+   -2.3189   -1.3225    0.0053 C   0  0  0

+    2.3414   -0.1132    0.0170 C   0  0  0

+    0.7543    1.7324   -0.0241 C   0  0  0

+   -0.6057   -3.0280    0.0553 C   0  0  0

+    1.7799   -2.4933    0.0576 C   0  0  0

+   -0.5085    2.1149   -0.0407 C   0  0  0

+   -2.8534    1.4603   -0.0449 C   0  0  0

+   -2.0204   -2.5997    0.0283 C   0  0  0

+   -3.7078   -0.8311   -0.0122 C   0  0  0

+    2.6871   -1.5402    0.0425 C   0  0  0

+    3.3385    0.8043    0.0089 N   0  3  0

+   -3.9332    0.4652   -0.0350 C   0  0  0

+   -3.1751    2.7836   -0.0693 O   0  0  0

+    4.1817    0.7795   -0.8697 O   0  0  0

+    3.3915    1.6538    0.8802 O   0  5  0

+    1.4978    2.4327    0.0000 H   0  0  0

+   -0.3735   -4.0226    0.0000 H   0  0  0

+    2.0631   -3.4746    0.0000 H   0  0  0

+   -0.7384    3.1101    0.0000 H   0  0  0

+   -2.7655   -3.2983    0.0000 H   0  0  0

+   -4.4880   -1.4902    0.0000 H   0  0  0

+    3.6738   -1.8043    0.0000 H   0  0  0

+   -4.9005    0.7933    0.0000 H   0  0  0

+   -3.4164    3.7761    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

+  3  8  1  0

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+  4 10  1  0

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+  6 13  2  0

+  6 14  1  0

+  7 15  1  0

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+ 12 17  1  0

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+ 16 19  2  0

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+  8 11  2  0

+  9 13  1  0

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+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-68-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.6819    0.8002    0.0018 C   0  0  0

+   -1.1026   -0.5234    0.0004 C   0  0  0

+    0.6677    1.0943    0.0017 C   0  0  0

+   -1.6966    1.9144   -0.0028 C   0  0  0

+   -0.1637   -1.5475   -0.0011 C   0  0  0

+   -2.4666   -0.8243    0.0010 N   0  0  0

+    1.5994    0.0727    0.0001 C   0  0  0

+    1.1839   -1.2465   -0.0013 C   0  0  0

+    3.0711    0.3973    0.0000 C   0  0  0

+    0.9839    2.0868    0.0000 H   0  0  0

+   -0.9265    2.6158    0.0000 H   0  0  0

+   -2.3980    2.6845    0.0000 H   0  0  0

+   -2.4667    1.2130    0.0000 H   0  0  0

+   -0.4760   -2.5412    0.0000 H   0  0  0

+   -3.1695   -0.0556    0.0000 H   0  0  0

+   -2.7809   -1.8174    0.0000 H   0  0  0

+    1.8883   -2.0138    0.0000 H   0  0  0

+    3.2955   -0.6199    0.0000 H   0  0  0

+    4.0883    0.6217    0.0000 H   0  0  0

+    2.8467    1.4145    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

+  5  8  2  0

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+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+27729-98-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.3498    1.0622   -0.7152 C   0  0  2

+   -0.4495    1.1647    0.5854 C   0  0  1

+    1.6872    0.4271   -0.4342 C   0  0  0

+    0.2381    2.2825    0.0199 O   0  0  0

+   -1.9187    1.2646    0.2655 C   0  0  0

+    1.8292   -0.9462   -0.5096 C   0  0  0

+    2.7723    1.2182   -0.1069 C   0  0  0

+   -2.7315    0.0431    0.1508 C   0  0  0

+   -2.4313    2.3513    0.1026 O   0  0  0

+    3.0550   -1.5297   -0.2521 C   0  0  0

+    3.9994    0.6368    0.1511 C   0  0  0

+   -4.0955    0.1316   -0.1459 C   0  0  0

+   -2.1430   -1.2123    0.3323 C   0  0  0

+    4.1415   -0.7385    0.0815 C   0  0  0

+   -4.8502   -1.0173   -0.2516 C   0  0  0

+   -2.9114   -2.3523    0.2233 C   0  0  0

+    5.3404   -1.3079    0.3334 F   0  0  0

+   -4.2614   -2.2561   -0.0649 C   0  0  0

+    0.0621    0.0818    0.0000 H   0  0  0

+   -0.5492    0.1478    0.0000 H   0  0  0

+    0.9945   -1.5355    0.0000 H   0  0  0

+    2.6767    2.2355    0.0000 H   0  0  0

+    3.1494   -2.5471    0.0000 H   0  0  0

+    4.8336    1.2269    0.0000 H   0  0  0

+   -4.5513    1.0461    0.0000 H   0  0  0

+   -1.1243   -1.2913    0.0000 H   0  0  0

+   -5.8696   -0.9471    0.0000 H   0  0  0

+   -2.4639   -3.2709    0.0000 H   0  0  0

+   -4.8376   -3.0999    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

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+  2  4  1  0

+ 11 14  2  0

+ 16 18  2  0

+  1 19  1  0

+  2 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119-15-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.8529   -0.7652   -0.2703 C   0  0  0

+    0.3881    0.2491   -1.0979 C   0  0  0

+    2.1221   -0.6873    0.2689 C   0  0  0

+   -0.0133   -1.9253    0.0381 N   0  3  0

+   -0.8948    0.1733   -1.6453 N   0  0  0

+    1.2025    1.3391   -1.3802 C   0  0  0

+    2.9298    0.3988   -0.0142 C   0  0  0

+   -0.1010   -2.3325    1.1827 O   0  0  0

+   -0.6383   -2.4726   -0.8526 O   0  5  0

+   -2.0160    0.3660   -0.8301 C   0  0  0

+    2.4702    1.4105   -0.8377 C   0  0  0

+    4.2892    0.4791    0.5659 N   0  3  0

+   -3.2313   -0.2134   -1.1716 C   0  0  0

+   -1.9128    1.1320    0.3235 C   0  0  0

+    5.0019    1.4351    0.3176 O   0  0  0

+    4.6952   -0.4109    1.2917 O   0  5  0

+   -4.3369   -0.0227   -0.3668 C   0  0  0

+   -3.0198    1.3217    1.1274 C   0  0  0

+   -4.2342    0.7474    0.7826 C   0  0  0

+   -5.3238    0.9351    1.5744 O   0  0  0

+    2.5284   -1.4376    0.0000 H   0  0  0

+   -0.9422   -0.6786    0.0000 H   0  0  0

+    0.7989    2.0908    0.0000 H   0  0  0

+    2.9118    2.1405    0.0000 H   0  0  0

+   -3.1147   -1.0586    0.0000 H   0  0  0

+   -1.2252    1.6371    0.0000 H   0  0  0

+   -5.0245   -0.5279    0.0000 H   0  0  0

+   -3.1355    2.1670    0.0000 H   0  0  0

+   -6.1646    1.0799    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 10 13  1  0

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+ 17 19  1  0

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+  7 11  1  0

+ 18 19  2  0

+  3 21  1  0

+  5 22  1  0

+  6 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 20 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+622-96-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.9731    0.0010   -0.2937 C   0  0  0

+   -0.2887   -1.1966   -0.2004 C   0  0  0

+   -0.2880    1.1977   -0.1989 C   0  0  0

+   -2.4652    0.0017   -0.5050 C   0  0  0

+    1.0806   -1.1973   -0.0123 C   0  0  0

+    1.0817    1.1970   -0.0108 C   0  0  0

+   -3.1724   -0.0023    0.8517 C   0  0  0

+    1.7659   -0.0003    0.0825 C   0  0  0

+    3.2590   -0.0010    0.2870 C   0  0  0

+   -0.8080   -2.0910    0.0000 H   0  0  0

+   -0.8065    2.0926    0.0000 H   0  0  0

+   -1.9495    0.8982    0.0000 H   0  0  0

+   -2.9856    0.8955    0.0000 H   0  0  0

+    1.5991   -2.0922    0.0000 H   0  0  0

+    1.6010    2.0914    0.0000 H   0  0  0

+   -3.1782    1.0319    0.0000 H   0  0  0

+   -4.2066   -0.0081    0.0000 H   0  0  0

+   -3.1666   -1.0365    0.0000 H   0  0  0

+    3.2585   -1.0353    0.0000 H   0  0  0

+    4.2933   -0.0015    0.0000 H   0  0  0

+    3.2595    1.0333    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  6  8  2  0

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+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+286-75-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+   -1.8024    0.7628    0.1527 C   0  0  0

+   -1.7478   -0.6880   -0.3067 C   0  0  0

+   -1.1718    0.3462   -1.0654 O   0  0  0

+   -0.6757    1.0525    1.1862 C   0  0  0

+   -0.8766   -1.6928    0.3143 C   0  0  0

+    0.5382    1.5460    0.3732 C   0  0  0

+    0.5223   -1.3013    0.8330 C   0  0  0

+    1.1573    0.6409   -0.6254 C   0  0  0

+    1.3193   -0.8554   -0.4213 C   0  0  0

+    2.3469    0.0556   -0.0650 O   0  0  0

+   -2.5949    1.3538    0.0000 H   0  0  0

+   -2.6673   -1.0510    0.0000 H   0  0  0

+   -0.8983    0.0893    0.0000 H   0  0  0

+    0.0766    0.4112    0.0000 H   0  0  0

+   -1.7104   -2.2239    0.0000 H   0  0  0

+   -0.4735   -2.5954    0.0000 H   0  0  0

+    1.3918    2.0446    0.0000 H   0  0  0

+    0.1016    2.4329    0.0000 H   0  0  0

+    0.3534   -2.2753    0.0000 H   0  0  0

+    1.3291   -1.8726    0.0000 H   0  0  0

+    0.2300    0.2983    0.0000 H   0  0  0

+    1.8918   -1.6613    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

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+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+881-03-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.5850    0.2101   -0.0019 C   0  0  0

+   -1.5440   -0.8337   -0.0014 C   0  0  0

+    0.7828   -0.1111   -0.0009 C   0  0  0

+   -1.0209    1.5462    0.0023 C   0  0  0

+   -1.1082   -2.1694    0.0008 C   0  0  0

+   -2.9122   -0.5121   -0.0025 C   0  0  0

+    1.1680   -1.4168    0.0007 C   0  0  0

+    1.7997    0.9646   -0.0010 N   0  3  0

+   -2.3540    1.8196    0.0068 C   0  0  0

+    0.2253   -2.4428    0.0023 C   0  0  0

+   -3.2970    0.7932   -0.0041 C   0  0  0

+    2.6360   -1.7575    0.0018 C   0  0  0

+    2.2174    1.4078    1.0538 O   0  0  0

+    2.2187    1.4064   -1.0558 O   0  5  0

+   -0.3247    2.3260    0.0000 H   0  0  0

+   -1.8044   -2.9492    0.0000 H   0  0  0

+   -3.6305   -1.2716    0.0000 H   0  0  0

+   -2.6756    2.8143    0.0000 H   0  0  0

+    0.5469   -3.4375    0.0000 H   0  0  0

+   -4.3153    1.0297    0.0000 H   0  0  0

+    2.3997   -2.7758    0.0000 H   0  0  0

+    3.6543   -1.9938    0.0000 H   0  0  0

+    2.8723   -0.7392    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  2  0

+  8 14  1  0

+  7 10  2  0

+  9 11  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100310-95-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -2.6188   -0.0532   -0.0270 C   0  0  0

+   -1.7390   -1.1410   -0.0676 C   0  0  0

+   -1.9376    1.1668    0.0381 C   0  0  0

+   -4.0110   -0.1719   -0.0436 C   0  0  0

+   -0.3776   -0.5743   -0.0228 C   0  0  0

+   -2.3075   -2.4021   -0.1344 C   0  0  0

+   -0.4986    0.8365    0.0415 C   0  0  0

+   -2.7117    2.3135    0.0818 C   0  0  0

+   -4.5483   -1.4692   -0.1052 C   0  0  0

+   -4.7612    1.0156    0.0022 C   0  0  0

+    0.8877   -1.1585   -0.0330 C   0  0  0

+   -3.6949   -2.5372   -0.1567 C   0  0  0

+    0.6465    1.6209    0.0935 C   0  0  0

+   -4.1022    2.2128    0.0609 C   0  0  0

+    2.0154   -0.3738    0.0191 C   0  0  0

+    1.9009    1.0202    0.0835 C   0  0  0

+    3.3855   -1.0006    0.0098 C   0  0  0

+    3.1300    1.8388    0.1383 C   0  0  0

+    4.3593   -0.1041   -0.7524 C   0  0  0

+    3.8426   -1.1664    1.3535 O   0  0  0

+    4.2833    1.3107   -0.2477 C   0  0  0

+    5.6902   -0.5973   -0.5865 O   0  0  0

+   -1.6974   -3.2527    0.0000 H   0  0  0

+   -2.2542    3.2550    0.0000 H   0  0  0

+   -5.5847   -1.6161    0.0000 H   0  0  0

+   -5.8075    0.9841    0.0000 H   0  0  0

+    0.9794   -2.2013    0.0000 H   0  0  0

+   -4.1023   -3.5014    0.0000 H   0  0  0

+    0.5660    2.6646    0.0000 H   0  0  0

+   -4.6670    3.0941    0.0000 H   0  0  0

+    2.9890   -1.9694    0.0000 H   0  0  0

+    3.0473    2.8823    0.0000 H   0  0  0

+    3.3898    0.2905    0.0000 H   0  0  0

+    4.8266   -1.5233    0.0000 H   0  0  0

+    5.1487    1.8996    0.0000 H   0  0  0

+    6.6717   -0.9610    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+ 11 15  2  0

+ 13 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+ 17 20  1  0

+ 18 21  2  0

+ 19 22  1  0

+  5  7  2  0

+  9 12  2  0

+ 10 14  2  0

+ 15 16  1  0

+ 19 21  1  0

+  6 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+591-17-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.9735   -0.8478    0.0002 C   0  0  0

+   -2.3315   -0.5896   -0.0001 C   0  0  0

+   -0.0706    0.1999    0.0002 C   0  0  0

+   -2.7871    0.7153    0.0000 C   0  0  0

+   -3.3154   -1.7311   -0.0001 C   0  0  0

+   -0.5271    1.5059   -0.0001 C   0  0  0

+    1.7872   -0.1526    0.0000 Br  0  0  0

+   -1.8849    1.7630    0.0000 C   0  0  0

+   -0.6317   -1.8270    0.0000 H   0  0  0

+   -3.8061    0.9086    0.0000 H   0  0  0

+   -4.1010   -1.0540    0.0000 H   0  0  0

+   -3.9925   -2.5167    0.0000 H   0  0  0

+   -2.5298   -2.4082    0.0000 H   0  0  0

+    0.1496    2.2919    0.0000 H   0  0  0

+   -2.2272    2.7420    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  8  2  0

+  1  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1466-88-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.1285   -0.2938    0.0254 C   0  0  0

+   -2.3512    0.2864    0.0486 C   0  0  0

+    0.0811    0.5416   -0.0026 C   0  0  0

+   -3.5114   -0.5148    0.0754 C   0  0  0

+    1.3469   -0.0542   -0.0267 C   0  0  0

+   -0.0274    1.9368   -0.0111 C   0  0  0

+   -4.6084    0.0057    0.0962 O   0  0  0

+    1.4731   -1.5290   -0.0246 N   0  3  0

+    2.4763    0.7363   -0.0528 C   0  0  0

+    1.1115    2.7128   -0.0373 C   0  0  0

+    2.2494   -2.0727    0.7405 O   0  0  0

+    0.8007   -2.1988   -0.7879 O   0  5  0

+    2.3604    2.1154   -0.0552 C   0  0  0

+   -1.0448   -1.3284    0.0000 H   0  0  0

+   -2.4348    1.3210    0.0000 H   0  0  0

+   -3.4278   -1.5494    0.0000 H   0  0  0

+   -0.9631    2.3860    0.0000 H   0  0  0

+    3.4162    0.2959    0.0000 H   0  0  0

+    1.0327    3.7478    0.0000 H   0  0  0

+    3.2146    2.7051    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  2  0

+  8  5  1  0

+  9  5  1  0

+ 10  6  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 10 13  1  0

+  1 14  1  0

+  2 15  1  0

+  4 16  1  0

+  6 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2212-67-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    0.6788    0.4412    0.3801 N   0  0  0

+   -0.5804    0.8124    0.0751 C   0  0  0

+    1.7471    1.4201    0.3351 C   0  0  0

+    0.9556   -0.9515    0.7615 C   0  0  0

+   -1.8849   -0.3710    0.1274 S   0  0  0

+   -0.8164    1.9641   -0.2362 O   0  0  0

+    2.8696    0.9281   -0.5920 C   0  0  0

+    1.6299   -1.6593   -0.4149 C   0  0  0

+   -3.5760    0.1275   -0.2823 C   0  0  0

+    3.6484   -0.1827    0.1184 C   0  0  0

+    3.1404   -1.5556   -0.3100 C   0  0  0

+   -4.5074   -1.0801   -0.1598 C   0  0  0

+    2.3110    2.3363    0.0000 H   0  0  0

+    0.9176    2.1052    0.0000 H   0  0  0

+   -0.1099   -0.8024    0.0000 H   0  0  0

+    0.4642   -1.9086    0.0000 H   0  0  0

+    3.9065    1.2150    0.0000 H   0  0  0

+    2.9465    2.0012    0.0000 H   0  0  0

+    0.7018   -2.2034    0.0000 H   0  0  0

+    1.9472   -2.6873    0.0000 H   0  0  0

+   -3.1471    1.1141    0.0000 H   0  0  0

+   -4.5023    0.6747    0.0000 H   0  0  0

+    4.5622   -0.7506    0.0000 H   0  0  0

+    4.3878    0.5988    0.0000 H   0  0  0

+    3.0625   -2.6286    0.0000 H   0  0  0

+    4.1918   -1.7835    0.0000 H   0  0  0

+   -5.3593   -0.4231    0.0000 H   0  0  0

+   -5.1644   -1.9320    0.0000 H   0  0  0

+   -3.6555   -1.7371    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 10 11  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103-83-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.2421    0.1092   -0.3976 C   0  0  0

+    0.7177   -1.1368   -0.0350 C   0  0  0

+    1.0899    1.2014   -0.3913 C   0  0  0

+   -1.1989    0.2762   -0.8057 C   0  0  0

+    2.0412   -1.2911    0.3339 C   0  0  0

+    2.4129    1.0472   -0.0225 C   0  0  0

+   -2.0723   -0.2022    0.2742 N   0  0  0

+    2.8887   -0.1993    0.3402 C   0  0  0

+   -2.5036    0.9843    1.0253 C   0  0  0

+   -3.2726   -0.7551   -0.3672 C   0  0  0

+    0.1038   -1.9260    0.0000 H   0  0  0

+    0.7030    2.1233    0.0000 H   0  0  0

+   -0.7790    1.1835    0.0000 H   0  0  0

+   -1.9294    0.9589    0.0000 H   0  0  0

+    2.4281   -2.2130    0.0000 H   0  0  0

+    3.0268    1.8364    0.0000 H   0  0  0

+    3.8776   -0.3465    0.0000 H   0  0  0

+   -1.5640    1.3259    0.0000 H   0  0  0

+   -2.8452    1.9239    0.0000 H   0  0  0

+   -3.4432    0.6427    0.0000 H   0  0  0

+   -3.6909    0.1530    0.0000 H   0  0  0

+   -4.1807   -1.1734    0.0000 H   0  0  0

+   -2.8543   -1.6632    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  7  9  1  0

+  7 10  1  0

+  6  8  1  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108618-29-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    1.4466    0.3562   -0.0014 C   0  0  0

+   -0.0113    0.5553   -0.0015 C   0  0  0

+    2.3043    1.4625   -0.0014 C   0  0  0

+    1.9761   -0.9392    0.0046 C   0  0  0

+   -0.8351   -0.5077   -0.0015 C   0  0  0

+    3.6569    1.2772   -0.0013 C   0  0  0

+    3.3292   -1.1235    0.0047 C   0  0  0

+   -2.2938   -0.3084   -0.0017 C   0  0  0

+    4.1857   -0.0179   -0.0011 C   0  0  0

+   -3.1522   -1.4125   -0.0017 C   0  0  0

+   -2.8248    0.9857    0.0040 C   0  0  0

+    5.6046   -0.2117   -0.0010 C   0  0  0

+   -4.5161   -1.2219   -0.0014 C   0  0  0

+   -4.1896    1.1677    0.0043 C   0  0  0

+    6.7301   -0.3654   -0.0009 N   0  0  0

+   -5.0403    0.0666   -0.0011 C   0  0  0

+   -6.4217    0.2553   -0.0012 N   0  0  0

+   -0.4074    1.5248    0.0000 H   0  0  0

+    1.9085    2.4321    0.0000 H   0  0  0

+    1.3348   -1.7671    0.0000 H   0  0  0

+   -0.4390   -1.4772    0.0000 H   0  0  0

+    4.2987    2.1048    0.0000 H   0  0  0

+    3.7256   -2.0929    0.0000 H   0  0  0

+   -2.7583   -2.3829    0.0000 H   0  0  0

+   -2.1852    1.8150    0.0000 H   0  0  0

+   -5.1596   -2.0482    0.0000 H   0  0  0

+   -4.5880    2.1363    0.0000 H   0  0  0

+   -6.8178    1.2248    0.0000 H   0  0  0

+   -7.0633   -0.5725    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  2  0

+ 12 15  3  0

+ 13 16  2  0

+ 16 17  1  0

+  7  9  2  0

+ 14 16  1  0

+  2 18  1  0

+  3 19  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+62-23-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.4163    0.0231   -0.0008 C   0  0  0

+   -2.8935    0.0355   -0.0008 C   0  0  0

+   -0.7049    1.2248    0.0006 C   0  0  0

+   -0.7253   -1.1899    0.0036 C   0  0  0

+   -3.5768   -1.1255   -0.0022 O   0  0  0

+   -3.4921    1.0925    0.0003 O   0  0  0

+    0.6742    1.2060    0.0005 C   0  0  0

+    0.6544   -1.1942    0.0036 C   0  0  0

+    1.3529   -0.0001   -0.0009 C   0  0  0

+    2.8330   -0.0124   -0.0009 N   0  3  0

+    3.4332   -1.0723   -0.0021 O   0  0  0

+    3.4508    1.0373    0.0003 O   0  5  0

+   -1.2119    2.1284    0.0000 H   0  0  0

+   -1.2474   -2.0849    0.0000 H   0  0  0

+   -4.1024   -2.0185    0.0000 H   0  0  0

+    1.2033    2.0969    0.0000 H   0  0  0

+    1.1685   -2.0938    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  7  9  1  0

+  9 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  8  9  2  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  7 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98736-49-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.0562   -0.9913    0.4768 C   0  0  0

+   -0.6609    0.1868    0.4657 C   0  0  0

+    1.4736   -1.0039    0.9885 C   0  0  0

+   -0.5249   -2.1630    0.0245 C   0  0  0

+   -1.9743    0.1966   -0.0089 C   0  0  0

+    2.3114   -0.1664    0.1266 N   0  0  0

+   -1.8274   -2.1616   -0.4415 C   0  0  0

+   -2.5523   -0.9880   -0.4690 C   0  0  0

+   -2.7249    1.4161   -0.0229 C   0  0  0

+    2.3547    1.1094    0.3120 N   0  0  0

+    3.1000   -0.7779   -0.9460 C   0  0  0

+   -3.3203    2.3834   -0.0341 N   0  0  0

+    3.0512    1.8057   -0.4046 O   0  0  0

+   -0.1771    1.0401    0.0000 H   0  0  0

+    1.2141   -1.9499    0.0000 H   0  0  0

+    2.3216   -1.4970    0.0000 H   0  0  0

+   -0.0083   -2.9969    0.0000 H   0  0  0

+   -2.3056   -3.0180    0.0000 H   0  0  0

+   -3.5320   -1.0367    0.0000 H   0  0  0

+    2.4989   -1.5531    0.0000 H   0  0  0

+    3.8752   -1.3790    0.0000 H   0  0  0

+    3.7011   -0.0027    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  6 11  1  0

+  9 12  3  0

+ 10 13  2  0

+  7  8  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  7 18  1  0

+  8 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-38-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.0002   -1.0212    0.0000 C   0  0  0

+   -1.1971   -0.3301    0.0001 C   0  0  0

+    1.1972   -0.3299   -0.0002 C   0  0  0

+   -1.1971    1.0525    0.0000 C   0  0  0

+   -2.5023   -1.0835   -0.0001 C   0  0  0

+    1.1972    1.0522   -0.0003 C   0  0  0

+    2.5023   -1.0835    0.0002 C   0  0  0

+   -0.0001    1.7435    0.0002 C   0  0  0

+   -0.0002   -2.0581    0.0000 H   0  0  0

+   -2.0951    1.5710    0.0000 H   0  0  0

+   -3.0207   -0.1854    0.0000 H   0  0  0

+   -3.4004   -1.6019    0.0000 H   0  0  0

+   -1.9839   -1.9816    0.0000 H   0  0  0

+    2.0952    1.5707    0.0000 H   0  0  0

+    1.9838   -1.9815    0.0000 H   0  0  0

+    3.4003   -1.6020    0.0000 H   0  0  0

+    3.0208   -0.1855    0.0000 H   0  0  0

+   -0.0001    2.7804    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  4  8  2  0

+  6  8  1  0

+  1  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-02-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 39                          1 V2000

+    0.0450   -0.1440   -0.1867 P   0  0  0

+    0.9804   -1.1846   -0.9831 O   0  0  0

+    0.5673    1.1533   -0.9845 O   0  0  0

+   -1.2463   -0.3727   -1.1207 O   0  0  0

+    2.1899   -1.1793   -0.3635 C   0  0  0

+    0.0095    2.2360   -0.3817 C   0  0  0

+   -2.0901   -1.1855   -0.4321 C   0  0  0

+    2.4410   -2.0611    0.6775 C   0  0  0

+    3.1776   -0.2959   -0.7748 C   0  0  0

+    0.6174    2.8031    0.7287 C   0  0  0

+   -1.1661    2.7797   -0.8794 C   0  0  0

+   -3.0104   -0.6424    0.4523 C   0  0  0

+   -2.0365   -2.5596   -0.6169 C   0  0  0

+    3.6714   -2.0538    1.3058 C   0  0  0

+    4.4061   -0.2926   -0.1433 C   0  0  0

+    0.0483    3.9038    1.3397 C   0  0  0

+   -1.7311    3.8801   -0.2649 C   0  0  0

+   -3.8672   -1.4709    1.1512 C   0  0  0

+   -2.8952   -3.3836    0.0842 C   0  0  0

+    4.6519   -1.1687    0.8980 C   0  0  0

+   -1.1261    4.4401    0.8454 C   0  0  0

+   -3.8079   -2.8401    0.9696 C   0  0  0

+    1.8876   -2.7987    0.0000 H   0  0  0

+    2.8474    0.5651    0.0000 H   0  0  0

+    1.5260    2.6458    0.0000 H   0  0  0

+   -1.8046    2.1144    0.0000 H   0  0  0

+   -3.1187    0.2733    0.0000 H   0  0  0

+   -1.1814   -2.9046    0.0000 H   0  0  0

+    4.0049   -2.9135    0.0000 H   0  0  0

+    4.9621    0.4430    0.0000 H   0  0  0

+    0.6842    4.5715    0.0000 H   0  0  0

+   -2.6391    4.0405    0.0000 H   0  0  0

+   -4.7237   -1.1293    0.0000 H   0  0  0

+   -2.7905   -4.2997    0.0000 H   0  0  0

+    5.5377   -1.4248    0.0000 H   0  0  0

+   -1.2723    5.3505    0.0000 H   0  0  0

+   -4.5995   -3.3130    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

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+ 18 22  2  0

+ 15 20  1  0

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+ 19 22  1  0

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+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+156-59-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+    0.6565   -1.1230    0.0000 C   0  0  0

+   -0.6565   -1.1230    0.0000 C   0  0  0

+    1.5245    0.3804    0.0000 Cl  0  0  0

+   -1.5245    0.3804    0.0000 Cl  0  0  0

+    1.3075   -2.2506    0.0000 H   0  0  0

+   -1.3075   -2.2506    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  2  6  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+155379-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.5154    0.2489    0.0157 C   0  0  0

+    0.0454   -1.0191   -0.0570 C   0  0  0

+    0.2998    1.3618    0.0819 C   0  0  0

+   -1.9869    0.4084    0.0160 N   0  3  0

+    1.4261   -1.1684   -0.0627 C   0  0  0

+   -0.7810   -2.1472   -0.1242 N   0  0  0

+    1.6801    1.2125    0.0758 C   0  0  0

+   -2.5227    1.1180   -0.8163 O   0  0  0

+   -2.6619   -0.1700    0.8487 O   0  5  0

+    2.2411   -0.0558    0.0031 C   0  0  0

+    2.0349   -2.5448   -0.1411 C   0  0  0

+    2.5065    2.3406    0.1434 N   0  0  0

+   -0.1202    2.3140    0.0000 H   0  0  0

+   -1.8156   -2.0344    0.0000 H   0  0  0

+   -0.3614   -3.0996    0.0000 H   0  0  0

+    3.2757   -0.1679    0.0000 H   0  0  0

+    1.0832   -2.9658    0.0000 H   0  0  0

+    2.4559   -3.4965    0.0000 H   0  0  0

+    2.9866   -2.1238    0.0000 H   0  0  0

+    3.5411    2.2278    0.0000 H   0  0  0

+    2.0869    3.2930    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

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+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5908-27-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -2.3027   -0.1937   -0.0693 S   0  0  0

+   -2.8700   -1.4963   -0.0897 O   0  0  0

+   -2.5377    0.8210   -1.0359 O   0  0  0

+   -2.7018    0.4102    1.2696 O   0  0  0

+   -0.5572   -0.4321   -0.0403 C   0  0  0

+    0.3229    0.7421   -0.0153 C   0  0  0

+   -0.0681   -1.6862   -0.0360 C   0  0  0

+    1.7227    0.5772    0.0086 C   0  0  0

+   -0.2134    2.0293   -0.0155 C   0  0  0

+    1.3236   -1.9415   -0.0126 C   0  0  0

+    2.2818   -0.7904    0.0086 C   0  0  0

+    2.5548    1.6906    0.0313 C   0  0  0

+    0.6298    3.1277    0.0077 C   0  0  0

+    1.7375   -3.0840   -0.0090 O   0  0  0

+    3.4806   -0.9755    0.0287 O   0  0  0

+    2.0021    2.9617    0.0303 C   0  0  0

+   -3.2766    1.2799    0.0000 H   0  0  0

+   -0.7318   -2.4901    0.0000 H   0  0  0

+   -1.2471    2.1644    0.0000 H   0  0  0

+    3.5903    1.5701    0.0000 H   0  0  0

+    0.2259    4.0888    0.0000 H   0  0  0

+    2.6251    3.7976    0.0000 H   0  0  0

+  2  1  2  0

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+  5  1  1  0

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+  8  6  2  0

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+ 10 11  1  0

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+  4 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 16 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14064-58-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    1.3217   -0.5201    0.0073 C   0  0  0

+    2.2700   -1.5467    0.0078 C   0  0  0

+    1.7440    0.8117    0.0032 C   0  0  0

+   -0.1169   -0.8408    0.0050 C   0  0  0

+    3.6142   -1.2390    0.0042 C   0  0  0

+    3.0920    1.1042   -0.0003 C   0  0  0

+   -1.0250    0.1478    0.0046 C   0  0  0

+    4.0250    0.0826    0.0002 C   0  0  0

+   -2.4636   -0.1730    0.0023 C   0  0  0

+    5.4699    0.4047   -0.0037 N   0  3  0

+   -3.4109    0.8535    0.0018 C   0  0  0

+   -2.8853   -1.5052   -0.0052 C   0  0  0

+    5.8347    1.5668   -0.0072 O   0  0  0

+    6.2938   -0.4923   -0.0032 O   0  5  0

+   -4.7599    0.5439   -0.0003 C   0  0  0

+   -4.2329   -1.8010   -0.0073 C   0  0  0

+   -5.1689   -0.7833   -0.0020 C   0  0  0

+   -5.6850    1.5395   -0.0003 O   0  0  0

+   -6.9683    0.9109   -0.0027 C   0  0  0

+    1.9632   -2.5384    0.0000 H   0  0  0

+    1.0451    1.5791    0.0000 H   0  0  0

+   -0.4279   -1.8311    0.0000 H   0  0  0

+    4.3196   -2.0005    0.0000 H   0  0  0

+    3.4072    2.0932    0.0000 H   0  0  0

+   -0.7141    1.1382    0.0000 H   0  0  0

+   -3.1042    1.8452    0.0000 H   0  0  0

+   -2.1853   -2.2716    0.0000 H   0  0  0

+   -4.5452   -2.7909    0.0000 H   0  0  0

+   -6.1814   -1.0122    0.0000 H   0  0  0

+   -7.4249    1.8431    0.0000 H   0  0  0

+   -7.9005    0.4543    0.0000 H   0  0  0

+   -6.5117   -0.0213    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  6  8  2  0

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+  2 20  1  0

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+ 12 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2687-41-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -0.0800   -1.1113    0.0924 C   0  0  0

+   -1.2477   -1.7984   -0.0186 O   0  0  0

+    0.3986   -0.7550    1.3448 C   0  0  0

+    0.6358   -0.7715   -1.0470 C   0  0  0

+   -2.2457   -0.8753   -0.0476 C   0  0  0

+    1.5850   -0.0574    1.4581 C   0  0  0

+    1.8220   -0.0741   -0.9348 C   0  0  0

+   -3.5707   -1.2851   -0.0066 C   0  0  0

+   -1.9385    0.4758   -0.1125 C   0  0  0

+    2.2988    0.2874    0.3184 C   0  0  0

+   -4.5846   -0.3483   -0.0359 C   0  0  0

+   -2.9517    1.4140   -0.1419 C   0  0  0

+    3.5022    0.9956    0.4327 N   0  0  0

+   -4.2779    1.0045   -0.1066 C   0  0  0

+    4.6267    0.5085   -0.1283 C   0  0  0

+   -5.3049    1.9544   -0.1369 N   0  0  0

+    5.8909    1.3287   -0.1168 C   0  0  0

+    4.6212   -0.5901   -0.6425 O   0  0  0

+   -0.1720    0.1051    0.0000 H   0  0  0

+    1.1192   -1.6835    0.0000 H   0  0  0

+    1.0985    0.8530    0.0000 H   0  0  0

+    2.3964   -0.9318    0.0000 H   0  0  0

+   -3.7990   -2.2918    0.0000 H   0  0  0

+   -0.9524    0.7810    0.0000 H   0  0  0

+   -5.5704   -0.6543    0.0000 H   0  0  0

+   -2.7227    2.4205    0.0000 H   0  0  0

+    3.4387    2.0259    0.0000 H   0  0  0

+   -5.0768    2.9611    0.0000 H   0  0  0

+   -6.2908    1.6486    0.0000 H   0  0  0

+    6.4527    0.4628    0.0000 H   0  0  0

+    6.7568    1.8905    0.0000 H   0  0  0

+    5.3291    2.1946    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  7 10  1  0

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+ 13 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+518-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.3506    0.4907    0.0745 C   0  0  0

+   -1.3273   -0.9171    0.0906 C   0  0  0

+   -0.0910    1.2457    0.2238 C   0  0  0

+   -2.5656    1.1598   -0.0883 C   0  0  0

+   -0.0394   -1.6250    0.2562 C   0  0  0

+   -2.5130   -1.6288   -0.0502 C   0  0  0

+    1.1942    0.5396    0.0805 C   0  0  0

+   -0.1138    2.4383    0.4622 O   0  0  0

+   -3.7410    0.4276   -0.2331 C   0  0  0

+   -2.6005    2.5153   -0.1050 O   0  0  0

+    1.2228   -0.8699    0.0963 C   0  0  0

+   -0.0182   -2.8109    0.5204 O   0  0  0

+   -3.7121   -0.9518   -0.2063 C   0  0  0

+    2.3857    1.2560   -0.0715 C   0  0  0

+    2.4317   -1.5371   -0.0391 C   0  0  0

+   -4.9943   -1.7289   -0.3592 C   0  0  0

+    3.5885    0.5727   -0.2054 C   0  0  0

+    2.3674    2.6117   -0.0887 O   0  0  0

+    3.6122   -0.8122   -0.1905 C   0  0  0

+    4.7934   -1.4676   -0.3222 O   0  0  0

+   -2.4992   -2.6674    0.0000 H   0  0  0

+   -4.6544    0.9223    0.0000 H   0  0  0

+   -2.6272    3.5537    0.0000 H   0  0  0

+    2.4558   -2.5755    0.0000 H   0  0  0

+   -5.5327   -0.8406    0.0000 H   0  0  0

+   -5.8826   -2.2673    0.0000 H   0  0  0

+   -4.4559   -2.6172    0.0000 H   0  0  0

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+    2.3534    3.6503    0.0000 H   0  0  0

+    5.7017   -1.9716    0.0000 H   0  0  0

+  1  2  2  0

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+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+624-92-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.9349   -0.3442   -0.4203 S   0  0  0

+   -0.9349   -0.3443    0.4203 S   0  0  0

+    1.7401    0.9190    0.6027 C   0  0  0

+   -1.7401    0.9189   -0.6027 C   0  0  0

+    2.6875    0.3151    0.0000 H   0  0  0

+    2.3440    1.8664    0.0000 H   0  0  0

+    0.7927    1.5229    0.0000 H   0  0  0

+   -0.7927    1.5228    0.0000 H   0  0  0

+   -2.3440    1.8663    0.0000 H   0  0  0

+   -2.6875    0.3150    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5667-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -0.3939    0.4734    0.0022 C   0  0  0

+   -1.3608   -0.5462    0.0016 C   0  0  0

+    0.9613    0.1024    0.0010 C   0  0  0

+   -1.0586    1.6539   -0.0013 N   0  0  0

+   -2.5780    0.0869    0.0031 N   0  0  0

+   -0.9626   -1.8140   -0.0006 N   0  0  0

+    1.2636   -1.1919   -0.0008 N   0  0  0

+    1.9582    1.0623    0.0011 N   0  0  0

+   -2.3404    1.4292   -0.0040 C   0  0  0

+    0.3191   -2.1147   -0.0021 C   0  0  0

+    3.3188    0.6699   -0.0002 O   0  0  0

+   -3.4922   -0.3637    0.0000 H   0  0  0

+    1.7131    2.0516    0.0000 H   0  0  0

+   -3.0605    2.1505    0.0000 H   0  0  0

+    0.5926   -3.0965    0.0000 H   0  0  0

+    4.2981    0.3875    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  6 10  1  0

+  8 11  1  0

+  5  9  1  0

+  7 10  2  0

+  5 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+159092-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    1.7330    0.2476    0.0081 C   0  0  0

+    0.3711   -0.2945   -0.0046 C   0  0  0

+    1.9050    1.6501    0.0256 C   0  0  0

+    2.8522   -0.5869    0.0089 C   0  0  0

+   -0.7181    0.6063    0.0013 C   0  0  0

+    0.1316   -1.6694   -0.0225 C   0  0  0

+    0.7735    2.4987    0.0311 C   0  0  0

+    3.2033    2.1794    0.0377 C   0  0  0

+    4.1039   -0.0405    0.0213 C   0  0  0

+    2.6831   -2.0574   -0.0031 N   0  3  0

+   -0.4792    2.0003    0.0195 C   0  0  0

+   -2.0246    0.0989   -0.0106 C   0  0  0

+   -1.1536   -2.1326   -0.0343 C   0  0  0

+    4.2773    1.3385    0.0325 C   0  0  0

+    2.6032   -2.6698    1.0467 O   0  0  0

+    2.6238   -2.6550   -1.0628 O   0  5  0

+   -1.6294    2.9321    0.0255 N   0  3  0

+   -2.2269   -1.2503   -0.0277 C   0  0  0

+   -1.6560    3.8716   -0.7492 O   0  0  0

+   -2.5491    2.7593    0.8051 O   0  5  0

+   -3.6086   -1.7813   -0.0397 N   0  3  0

+   -3.7986   -2.9843   -0.0550 O   0  0  0

+   -4.5555   -1.0152   -0.0344 O   0  5  0

+    0.9298   -2.3399    0.0000 H   0  0  0

+    0.9111    3.5320    0.0000 H   0  0  0

+    3.3473    3.2118    0.0000 H   0  0  0

+    4.9387   -0.6648    0.0000 H   0  0  0

+   -2.8387    0.7500    0.0000 H   0  0  0

+   -1.3310   -3.1598    0.0000 H   0  0  0

+    5.2411    1.7355    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  8 14  2  0

+ 10 15  2  0

+ 10 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 17 19  2  0

+ 17 20  1  0

+ 18 21  1  0

+ 21 22  2  0

+ 21 23  1  0

+  7 11  2  0

+  9 14  1  0

+ 13 18  2  0

+  6 24  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+764-42-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.4690    0.4846    0.0000 C   0  0  0

+   -0.4690   -0.4846    0.0000 C   0  0  0

+    1.8581    0.1368    0.0000 C   0  0  0

+   -1.8581   -0.1368    0.0000 C   0  0  0

+    2.9600   -0.1392    0.0000 N   0  0  0

+   -2.9600    0.1392    0.0000 N   0  0  0

+    0.1912    1.4573    0.0000 H   0  0  0

+   -0.1912   -1.4573    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  3  5  3  0

+  4  6  3  0

+  1  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+28657-80-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -0.4036    0.7132   -0.1642 C   0  0  0

+   -0.2375   -0.6800   -0.0245 C   0  0  0

+    0.7057    1.5220   -0.2356 N   0  0  0

+   -1.6876    1.2426   -0.2214 C   0  0  0

+   -1.3464   -1.5202    0.0518 C   0  0  0

+    1.1403   -1.1970    0.0366 C   0  0  0

+    1.9046    1.0776   -0.1822 N   0  0  0

+    0.5052    2.9659   -0.3808 C   0  0  0

+   -2.7846    0.4046   -0.1405 C   0  0  0

+   -2.6143   -0.9795   -0.0107 C   0  0  0

+    2.2174   -0.1932   -0.0547 C   0  0  0

+    1.3772   -2.3867    0.1561 O   0  0  0

+    0.7330    3.6505    0.9684 C   0  0  0

+   -4.1217    0.6740   -0.1726 O   0  0  0

+   -3.8463   -1.5657    0.0405 O   0  0  0

+    3.6290   -0.6102   -0.0030 C   0  0  0

+   -4.7647   -0.4984    0.3604 C   0  0  0

+    4.6078    0.3126   -0.0870 O   0  0  0

+    3.9113   -1.7863    0.1154 O   0  0  0

+   -1.8223    2.2676    0.0000 H   0  0  0

+   -1.2199   -2.5462    0.0000 H   0  0  0

+   -0.2909    3.6253    0.0000 H   0  0  0

+   -0.3978    2.4626    0.0000 H   0  0  0

+    1.7139    3.3241    0.0000 H   0  0  0

+    1.0594    4.6314    0.0000 H   0  0  0

+   -0.2479    3.9769    0.0000 H   0  0  0

+   -5.6054    0.1033    0.0000 H   0  0  0

+   -5.4623   -1.2613    0.0000 H   0  0  0

+    5.3600    1.0218    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  6 12  2  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 14 17  1  0

+ 16 18  1  0

+ 16 19  2  0

+  7 11  2  0

+  9 10  2  0

+ 15 17  1  0

+  4 20  1  0

+  5 21  1  0

+  8 22  1  0

+  8 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-22-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -1.3848    0.0001   -0.0012 C   0  0  0

+   -2.7848    0.0001   -0.0008 N   0  0  0

+   -0.6906    1.2024    0.0001 C   0  0  0

+   -0.6904   -1.2027    0.0030 C   0  0  0

+   -3.5173   -1.2687   -0.0021 C   0  0  0

+   -3.5173    1.2688    0.0009 C   0  0  0

+    0.6906    1.2024    0.0002 C   0  0  0

+    0.6903   -1.2027    0.0032 C   0  0  0

+    1.3848    0.0001   -0.0009 C   0  0  0

+    2.7848    0.0001   -0.0008 N   0  0  0

+    3.5173   -1.2687   -0.0020 C   0  0  0

+    3.5173    1.2688    0.0005 C   0  0  0

+   -1.2135    2.1081    0.0000 H   0  0  0

+   -1.2133   -2.1084    0.0000 H   0  0  0

+   -4.4230   -0.7458    0.0000 H   0  0  0

+   -4.0402   -2.1744    0.0000 H   0  0  0

+   -2.6116   -1.7916    0.0000 H   0  0  0

+   -2.6116    1.7917    0.0000 H   0  0  0

+   -4.0402    2.1745    0.0000 H   0  0  0

+   -4.4230    0.7459    0.0000 H   0  0  0

+    1.2135    2.1081    0.0000 H   0  0  0

+    1.2132   -2.1084    0.0000 H   0  0  0

+    2.6116   -1.7916    0.0000 H   0  0  0

+    4.0402   -2.1744    0.0000 H   0  0  0

+    4.4230   -0.7458    0.0000 H   0  0  0

+    4.4230    0.7459    0.0000 H   0  0  0

+    4.0402    2.1745    0.0000 H   0  0  0

+    2.6116    1.7917    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  7  9  2  0

+  9 10  1  0

+ 10 11  1  0

+ 10 12  1  0

+  8  9  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67-99-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    0.0948    1.2544    0.0076 C   0  0  1

+    0.4517   -0.1383   -0.3575 N   0  0  0

+    1.3388    2.1075   -0.2009 C   0  0  0

+   -1.0603    1.6419   -0.8859 C   0  0  0

+   -0.4528    1.2771    1.7338 S   0  0  0

+    1.8707   -0.2010   -0.6494 C   0  0  1

+   -0.5262   -1.0759   -0.4100 C   0  0  0

+    2.4724    1.1075   -0.1607 C   0  0  0

+   -2.0683    0.7178   -0.9462 N   0  0  0

+   -1.0918    2.6870   -1.5003 O   0  0  0

+   -2.0060   -0.0589    1.6214 S   0  0  0

+    2.5487   -1.3416    0.1097 C   0  0  2

+   -1.9172   -0.5074   -0.1370 C   0  0  2

+   -0.3177   -2.2464   -0.6497 O   0  0  0

+    3.7294    1.2597    0.2168 C   0  0  0

+   -3.2514    0.9361   -1.7821 C   0  0  0

+    4.0405   -1.1452    0.1121 C   0  0  0

+    2.2331   -2.5857   -0.5185 O   0  0  0

+   -2.9972   -1.5286   -0.4997 C   0  0  0

+    4.5935    0.0596    0.1651 C   0  0  0

+   -2.8180   -2.7100    0.2840 O   0  0  0

+    2.0638    2.8044    0.0000 H   0  0  0

+    0.7038    2.8873    0.0000 H   0  0  0

+    2.8749   -0.1481    0.0000 H   0  0  0

+    1.5535   -1.4858    0.0000 H   0  0  0

+    4.1331    2.1807    0.0000 H   0  0  0

+   -3.0689    1.9250    0.0000 H   0  0  0

+   -4.2403    1.1186    0.0000 H   0  0  0

+   -3.4339   -0.0528    0.0000 H   0  0  0

+    4.6376   -1.9544    0.0000 H   0  0  0

+    1.9858   -3.5604    0.0000 H   0  0  0

+   -3.5272   -0.6740    0.0000 H   0  0  0

+   -3.9409   -1.8761    0.0000 H   0  0  0

+    5.5944    0.1569    0.0000 H   0  0  0

+   -2.6672   -3.7042    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  2  0

+  8 15  2  0

+  9 16  1  0

+ 12 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+ 15 20  1  0

+ 19 21  1  0

+  6  8  1  0

+  9 13  1  0

+ 13 11  1  0

+ 17 20  2  0

+  3 22  1  0

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+ 12 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+102873-32-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.4757   -0.3785    0.4851 C   0  0  0

+   -0.9778   -0.2922    0.7709 C   0  0  0

+    1.1704    0.7476    0.0476 C   0  0  0

+    1.1520   -1.5841    0.6585 C   0  0  0

+   -1.9046   -0.4985   -0.2491 C   0  0  0

+   -1.4210   -0.0103    2.0613 C   0  0  0

+    2.5221    0.6617   -0.2168 C   0  0  0

+    0.4597    2.0333   -0.1335 N   0  3  0

+    2.5042   -1.6586    0.3911 C   0  0  0

+   -3.2552   -0.4171    0.0223 C   0  0  0

+   -2.7744    0.0688    2.3216 C   0  0  0

+    3.1875   -0.5394   -0.0484 C   0  0  0

+    1.0380    2.9845   -0.6279 O   0  0  0

+   -0.7035    2.1401    0.2117 O   0  5  0

+   -3.6897   -0.1316    1.3044 C   0  0  0

+   -4.2408   -0.6360   -1.0601 N   0  3  0

+    4.6375   -0.6255   -0.3336 N   0  3  0

+   -5.4331   -0.5644   -0.8218 O   0  0  0

+   -3.8595   -0.8878   -2.1892 O   0  5  0

+    5.2255   -1.6818   -0.1860 O   0  0  0

+    5.2425    0.3601   -0.7158 O   0  5  0

+    0.6521   -2.3862    0.0000 H   0  0  0

+   -1.8296   -1.4406    0.0000 H   0  0  0

+   -1.1305    0.8890    0.0000 H   0  0  0

+    3.0275    1.4603    0.0000 H   0  0  0

+    2.9438   -2.4952    0.0000 H   0  0  0

+   -2.8486    1.0110    0.0000 H   0  0  0

+   -4.6190    0.0403    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+  8 13  2  0

+  8 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 12 17  1  0

+ 16 18  2  0

+ 16 19  1  0

+ 17 20  2  0

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+  9 12  2  0

+ 11 15  2  0

+  4 22  1  0

+  5 23  1  0

+  6 24  1  0

+  7 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+505-70-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    3.1038   -0.0085   -0.0013 C   0  0  0

+    1.7458    0.5486   -0.0003 C   0  0  0

+    4.1709    0.8161   -0.0005 O   0  0  0

+    3.2665   -1.2130    0.0022 O   0  0  0

+    0.6765   -0.2776   -0.0011 C   0  0  0

+   -0.6765    0.2775   -0.0001 C   0  0  0

+   -1.7457   -0.5486   -0.0009 C   0  0  0

+   -3.1038    0.0085    0.0001 C   0  0  0

+   -4.1709   -0.8161   -0.0007 O   0  0  0

+   -3.2665    1.2130    0.0016 O   0  0  0

+    1.6101    1.5528    0.0000 H   0  0  0

+    4.9728    1.4357    0.0000 H   0  0  0

+    0.8121   -1.2818    0.0000 H   0  0  0

+   -0.8121    1.2818    0.0000 H   0  0  0

+   -1.6100   -1.5528    0.0000 H   0  0  0

+   -4.9728   -1.4357    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  5  6  1  0

+  6  7  2  0

+  7  8  1  0

+  8  9  1  0

+  8 10  2  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+126-72-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 34                          1 V2000

+   -0.4504   -0.9129   -0.8187 P   0  0  0

+   -1.8028   -0.9579    0.0538 O   0  0  0

+   -0.0948    0.6154   -1.1790 O   0  0  0

+    0.7565   -1.5594    0.0283 O   0  0  0

+   -0.6437   -1.6822   -2.0682 O   0  0  0

+   -2.8723   -0.5991   -0.8234 C   0  0  0

+    0.0667    1.3055    0.0619 C   0  0  0

+    1.8543   -1.7187   -0.8724 C   0  0  0

+   -4.1937   -0.6225   -0.0525 C   0  0  0

+    0.4080    2.7718   -0.2107 C   0  0  0

+    3.0411   -2.3321   -0.1266 C   0  0  0

+   -5.3389   -0.2383   -0.9916 C   0  0  0

+   -4.5064   -2.4290    0.6573 Br  0  0  0

+    0.5809    3.5106    1.1179 C   0  0  0

+    2.0796    2.8751   -1.2403 Br  0  0  0

+    4.2165   -2.5026   -1.0910 C   0  0  0

+    3.5711   -1.1464    1.3494 Br  0  0  0

+   -7.0368   -0.2683   -0.0011 Br  0  0  0

+    1.0194    5.3948    0.7677 Br  0  0  0

+    5.7415   -3.2907   -0.1326 Br  0  0  0

+   -2.2015    0.1452    0.0000 H   0  0  0

+   -3.2877    0.3127    0.0000 H   0  0  0

+    0.7977    0.6203    0.0000 H   0  0  0

+    1.0255    1.5963    0.0000 H   0  0  0

+    2.6327   -1.0878    0.0000 H   0  0  0

+    1.5885   -0.7526    0.0000 H   0  0  0

+   -4.0410    0.3678    0.0000 H   0  0  0

+   -0.5677    2.9995    0.0000 H   0  0  0

+    2.7349   -3.2861    0.0000 H   0  0  0

+   -4.6681    0.5060    0.0000 H   0  0  0

+   -5.7543    0.6735    0.0000 H   0  0  0

+    1.3119    2.8254    0.0000 H   0  0  0

+    1.5397    3.8015    0.0000 H   0  0  0

+    4.9948   -1.8716    0.0000 H   0  0  0

+    3.9506   -1.5366    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

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+ 12 30  1  0

+ 12 31  1  0

+ 14 32  1  0

+ 14 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+621-31-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.4385   -0.0881   -0.0032 C   0  0  0

+   -0.6605   -0.9365   -0.0021 C   0  0  0

+    0.2508    1.2885   -0.0016 C   0  0  0

+    1.7308   -0.6177    0.0001 N   0  0  0

+   -1.9411   -0.4072    0.0005 C   0  0  0

+   -1.0277    1.8121    0.0010 C   0  0  0

+    2.8897    0.2785   -0.0010 C   0  0  0

+   -2.1225    0.9691    0.0020 C   0  0  0

+   -3.0189   -1.2349    0.0010 O   0  0  0

+    4.1756   -0.5506    0.0031 C   0  0  0

+   -0.5227   -1.9686    0.0000 H   0  0  0

+    1.0741    1.9259    0.0000 H   0  0  0

+    1.8706   -1.6495    0.0000 H   0  0  0

+   -1.1665    2.8440    0.0000 H   0  0  0

+    3.5492    1.0842    0.0000 H   0  0  0

+    2.1637    1.0249    0.0000 H   0  0  0

+   -3.0848    1.3667    0.0000 H   0  0  0

+   -3.8447   -1.8691    0.0000 H   0  0  0

+    3.6114   -1.4257    0.0000 H   0  0  0

+    5.0507   -1.1148    0.0000 H   0  0  0

+    4.7398    0.3245    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26946-33-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+   -1.1742    0.3886   -0.5835 C   0  0  0

+   -2.0610   -0.5897   -0.1721 C   0  0  0

+   -0.0007    0.0213   -1.4547 C   0  0  0

+   -1.3652    1.7038   -0.2021 C   0  0  0

+   -3.1376   -0.2565    0.6258 C   0  0  0

+   -1.8561   -1.9953   -0.5878 N   0  3  0

+    1.1670   -0.3696   -0.5858 C   0  0  0

+   -2.4429    2.0449    0.5916 C   0  0  0

+   -3.3295    1.0632    1.0152 C   0  0  0

+   -1.8696   -2.2889   -1.7698 O   0  0  0

+   -1.6740   -2.8584    0.2520 O   0  5  0

+    2.0670    0.5929   -0.1657 C   0  0  0

+    1.3329   -1.6885   -0.2058 C   0  0  0

+   -4.4174    1.4038    1.8223 N   0  0  0

+    3.1377    0.2383    0.6308 C   0  0  0

+    1.8826    2.0044   -0.5708 N   0  3  0

+    2.4017   -2.0502    0.5909 C   0  0  0

+    3.3104   -1.0871    1.0102 C   0  0  0

+    1.8794    2.3038   -1.7514 O   0  0  0

+    1.7339    2.8667    0.2765 O   0  5  0

+    4.3923   -1.4492    1.8158 N   0  0  0

+    0.6866    0.6372    0.0000 H   0  0  0

+   -0.1964    0.9232    0.0000 H   0  0  0

+   -0.6619    2.3013    0.0000 H   0  0  0

+   -3.8390   -0.8563    0.0000 H   0  0  0

+   -2.6845    2.9356    0.0000 H   0  0  0

+    0.6181   -2.2722    0.0000 H   0  0  0

+   -4.6190    2.3044    0.0000 H   0  0  0

+   -5.0966    0.7789    0.0000 H   0  0  0

+    3.8493    0.8259    0.0000 H   0  0  0

+    2.6247   -2.9457    0.0000 H   0  0  0

+    4.5762   -2.3536    0.0000 H   0  0  0

+    5.0836   -0.8377    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 17 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+611-34-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.4231    0.8824   -0.0025 C   0  0  0

+    0.0177   -0.4641   -0.0010 C   0  0  0

+    0.5291    1.9160   -0.0018 C   0  0  0

+   -1.7326    1.1527    0.0010 N   0  0  0

+    1.4008   -0.7439    0.0007 C   0  0  0

+   -0.9367   -1.4947   -0.0017 C   0  0  0

+    1.8581    1.6192    0.0003 C   0  0  0

+   -2.6267    0.1932    0.0058 C   0  0  0

+    2.3017    0.3007    0.0009 C   0  0  0

+    1.8516   -2.0608    0.0018 N   0  0  0

+   -2.2597   -1.1494   -0.0038 C   0  0  0

+    0.2174    2.9120    0.0000 H   0  0  0

+   -0.6440   -2.4964    0.0000 H   0  0  0

+    2.5564    2.3948    0.0000 H   0  0  0

+   -3.6400    0.4429    0.0000 H   0  0  0

+    3.3258    0.1000    0.0000 H   0  0  0

+    1.1655   -2.8472    0.0000 H   0  0  0

+    2.8757   -2.2618    0.0000 H   0  0  0

+   -2.9934   -1.8916    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16650-32-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    0.6793   -0.3927    0.0020 C   0  0  0

+   -0.7234   -0.1944    0.0011 C   0  0  0

+    1.5386    0.7207    0.0009 C   0  0  0

+    1.1827   -1.7066   -0.0018 C   0  0  0

+   -1.2287    1.1195   -0.0006 C   0  0  0

+   -1.5444   -1.2493    0.0021 N   0  0  0

+    1.0116    1.9784   -0.0012 C   0  0  0

+    2.8781    0.5452    0.0013 F   0  0  0

+    0.2887   -2.7394   -0.0062 C   0  0  0

+   -0.3671    2.1755   -0.0012 C   0  0  0

+   -2.5627    1.3329   -0.0010 F   0  0  0

+   -1.0790   -2.4749    0.0041 C   0  0  0

+    2.1918   -1.8838    0.0000 H   0  0  0

+    1.6381    2.7890    0.0000 H   0  0  0

+    0.6237   -3.7076    0.0000 H   0  0  0

+   -0.7397    3.1298    0.0000 H   0  0  0

+   -1.7386   -3.2588    0.0000 H   0  0  0

+  1  2  2  0

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+  4 13  1  0

+  7 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 12 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1214-32-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.0966   -0.5340   -0.0009 C   0  0  0

+   -1.5796   -0.4889   -0.0010 C   0  0  0

+    0.4072    0.7638    0.0000 C   0  0  0

+    0.7897   -1.6132    0.0036 C   0  0  0

+   -2.0028    0.8381   -0.0001 C   0  0  0

+   -2.5289   -1.5139   -0.0018 C   0  0  0

+   -0.7697    1.7083    0.0006 C   0  0  0

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+    2.1501   -1.3868    0.0025 C   0  0  0

+   -3.3468    1.1397    0.0004 C   0  0  0

+   -3.8724   -1.2099   -0.0017 C   0  0  0

+    2.6413   -0.0934   -0.0004 C   0  0  0

+   -4.2886    0.1168    0.0000 C   0  0  0

+    4.1027    0.1419   -0.0006 N   0  3  0

+   -5.6505    0.4214    0.0010 N   0  0  0

+    4.8717   -0.8027   -0.0012 O   0  0  0

+    4.5363    1.2801   -0.0002 O   0  5  0

+    0.4232   -2.5895    0.0000 H   0  0  0

+   -2.2201   -2.5100    0.0000 H   0  0  0

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+   -3.6579    2.1350    0.0000 H   0  0  0

+   -4.5792   -1.9767    0.0000 H   0  0  0

+   -5.9622    1.4166    0.0000 H   0  0  0

+   -6.3565   -0.3461    0.0000 H   0  0  0

+  1  2  1  0

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+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78111-17-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+125131                          1 V2000

+    7.5090    0.2541   -1.7466 C   0  0  1

+    7.4983   -0.3688   -0.4618 O   0  0  0

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107673-63-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.6447    0.6262   -0.0054 C   0  0  0

+   -1.1193   -0.6856   -0.0029 C   0  0  0

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+   -4.3382    1.1813    0.0016 N   0  3  0

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+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50935-04-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 68                          1 V2000

+    2.0198    0.3269   -1.0873 O   0  0  0

+    1.6956   -0.7566   -0.2138 C   0  0  0

+    3.2738    0.8517   -0.6466 C   0  0  0

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+ 37 64  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+129401-88-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -0.8393   -0.0694    0.7787 N   0  0  0

+   -2.1360   -0.0470    0.2602 C   0  0  0

+   -0.2111    1.2009    0.3983 C   0  0  0

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+ 16 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-11-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.3214   -0.2698    0.0024 C   0  0  0

+   -0.6058   -1.4735    0.0011 C   0  0  0

+   -0.6319    0.9491    0.0024 C   0  0  0

+   -2.7899   -0.2856   -0.0024 C   0  0  0

+    0.7599   -1.4563   -0.0001 C   0  0  0

+    0.7446    0.9553    0.0012 C   0  0  0

+   -3.4076    0.7582   -0.0013 O   0  0  0

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+    3.2062    1.1332   -0.0009 C   0  0  0

+   -1.1159   -2.3834    0.0000 H   0  0  0

+   -1.1595    1.8490    0.0000 H   0  0  0

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+ 10 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103-17-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.9701   -0.4412    0.0027 C   0  0  0

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+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 13 15  1  0

+ 15 16  1  0

+  7  9  1  0

+ 14 15  2  0

+  2 17  1  0

+  2 18  1  0

+  3 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+319-84-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.2492   -0.4636   -0.6086 C   0  0  0

+   -1.2492    0.4636    0.6086 C   0  0  0

+    0.0000   -1.3464   -0.5772 C   0  0  0

+   -2.7214   -1.5039   -0.5716 Cl  0  0  0

+    0.0000    1.3464    0.5772 C   0  0  0

+   -2.7214    1.5039    0.5716 Cl  0  0  0

+    1.2492   -0.4636   -0.6086 C   0  0  0

+    0.0000   -2.3343    0.9311 Cl  0  0  0

+    1.2492    0.4636    0.6086 C   0  0  0

+    0.0000    2.3343   -0.9311 Cl  0  0  0

+    2.7214   -1.5039   -0.5716 Cl  0  0  0

+    2.7214    1.5039    0.5716 Cl  0  0  0

+   -0.2304    0.0639    0.0000 H   0  0  0

+   -0.2304   -0.0639    0.0000 H   0  0  0

+   -1.0188   -1.8739    0.0000 H   0  0  0

+   -1.0188    1.8739    0.0000 H   0  0  0

+    0.2304    0.0639    0.0000 H   0  0  0

+    0.2304   -0.0639    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+  7  9  1  0

+  1 13  1  0

+  2 14  1  0

+  3 15  1  0

+  5 16  1  0

+  7 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5234-68-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    1.4308   -0.0250    0.1318 C   0  0  0

+   -0.0104    0.0177    0.3892 C   0  0  0

+    2.0613    1.0949   -0.2044 C   0  0  0

+    2.2857   -1.5617    0.2835 S   0  0  0

+   -0.8779   -0.3596   -0.5709 N   0  0  0

+   -0.4248    0.3940    1.4702 O   0  0  0

+    3.3332    1.2906   -0.5241 O   0  0  0

+    1.1997    2.3312   -0.2263 C   0  0  0

+    3.8602   -1.0669   -0.4864 C   0  0  0

+   -2.2533   -0.2071   -0.3696 C   0  0  0

+    4.2011    0.3300    0.0547 C   0  0  0

+   -3.1023   -1.2970   -0.5108 C   0  0  0

+   -2.7727    1.0337   -0.0224 C   0  0  0

+   -4.4604   -1.1430   -0.3113 C   0  0  0

+   -4.1313    1.1808    0.1756 C   0  0  0

+   -4.9748    0.0946    0.0286 C   0  0  0

+   -0.7248   -1.3732    0.0000 H   0  0  0

+    2.0407    2.9173    0.0000 H   0  0  0

+    0.6136    3.1722    0.0000 H   0  0  0

+    0.3587    1.7451    0.0000 H   0  0  0

+    3.9862   -2.0842    0.0000 H   0  0  0

+    4.8836   -1.1264    0.0000 H   0  0  0

+    5.1293   -0.1050    0.0000 H   0  0  0

+    4.8109    1.1540    0.0000 H   0  0  0

+   -2.7049   -2.2420    0.0000 H   0  0  0

+   -2.1596    1.8553    0.0000 H   0  0  0

+   -5.0766   -1.9622    0.0000 H   0  0  0

+   -4.5317    2.1245    0.0000 H   0  0  0

+   -5.9908    0.2307    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  7 11  1  0

+ 10 12  2  0

+ 10 13  1  0

+ 12 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+  9 11  1  0

+ 15 16  1  0

+  5 17  1  0

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+  9 21  1  0

+  9 22  1  0

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+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2597-03-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+   -0.8788   -0.0339    0.2230 C   0  0  0

+   -2.3292   -0.4403    0.1759 C   0  0  0

+    0.1015   -1.1725   -0.7934 S   0  0  0

+   -0.7325    1.3681   -0.3100 C   0  0  0

+   -3.0186   -0.6790    1.3498 C   0  0  0

+   -2.9719   -0.5689   -1.0415 C   0  0  0

+    2.0349   -0.7927   -0.0110 P   0  0  0

+   -0.2268    2.3343    0.4727 O   0  0  0

+   -1.0703    1.6225   -1.4418 O   0  0  0

+   -4.3492   -1.0519    1.3065 C   0  0  0

+   -4.3021   -0.9416   -1.0848 C   0  0  0

+    2.1310   -1.3730    1.4877 O   0  0  0

+    3.1390   -1.5113   -0.9366 O   0  0  0

+    2.3453    1.0447    0.0132 S   0  0  0

+   -0.0858    3.6851   -0.0408 C   0  0  0

+   -4.9901   -1.1860    0.0893 C   0  0  0

+    1.6597   -2.7212    1.4395 C   0  0  0

+    4.4162   -1.0577   -0.4837 C   0  0  0

+    0.5104    4.5836    1.0446 C   0  0  0

+    0.0913    0.2698    0.0000 H   0  0  0

+   -2.7150   -1.6491    0.0000 H   0  0  0

+   -3.2089    0.4196    0.0000 H   0  0  0

+   -4.1078   -2.0393    0.0000 H   0  0  0

+   -4.6095    0.0273    0.0000 H   0  0  0

+   -0.6781    4.5113    0.0000 H   0  0  0

+   -1.0684    3.4248    0.0000 H   0  0  0

+   -5.9688   -1.4609    0.0000 H   0  0  0

+    0.7001   -2.3858    0.0000 H   0  0  0

+    1.3243   -3.6808    0.0000 H   0  0  0

+    2.6193   -3.0566    0.0000 H   0  0  0

+    4.7564   -2.0156    0.0000 H   0  0  0

+    5.3741   -0.7175    0.0000 H   0  0  0

+    4.0760   -0.0998    0.0000 H   0  0  0

+    1.3574    4.0216    0.0000 H   0  0  0

+    1.0724    5.4306    0.0000 H   0  0  0

+   -0.3366    5.1456    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  7 13  1  0

+  7 14  2  0

+  8 15  1  0

+ 10 16  2  0

+ 12 17  1  0

+ 13 18  1  0

+ 15 19  1  0

+ 11 16  1  0

+  1 20  1  0

+  5 21  1  0

+  6 22  1  0

+ 10 23  1  0

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+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+333-41-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 40                          1 V2000

+    0.4739   -1.1052    0.6455 O   0  0  0

+   -0.6818   -0.4700    0.3334 C   0  0  0

+    1.6752   -0.1683    0.1247 P   0  0  0

+   -1.8512   -1.0759    0.5030 N   0  0  0

+   -0.6616    0.8317   -0.1654 C   0  0  0

+    1.6186    1.2494    0.8856 O   0  0  0

+    3.0847   -0.8846    0.4284 O   0  0  0

+    1.4996    0.1042   -1.7104 S   0  0  0

+   -2.9776   -0.4618    0.2013 C   0  0  0

+   -1.8663    1.4371   -0.4684 C   0  0  0

+    2.7924    1.9698    0.5045 C   0  0  0

+    3.0295   -2.1782   -0.1762 C   0  0  0

+   -2.9928    0.7659   -0.2769 N   0  0  0

+   -4.2841   -1.1838    0.4083 C   0  0  0

+   -1.8987    2.8433   -1.0093 C   0  0  0

+    2.8006    3.3342    1.1968 C   0  0  0

+    4.3458   -2.9159    0.0766 C   0  0  0

+   -5.1490   -0.3996    1.3972 C   0  0  0

+   -5.0184   -1.3029   -0.9286 C   0  0  0

+    0.1843    1.3443    0.0000 H   0  0  0

+    3.1454    1.0459    0.0000 H   0  0  0

+    3.7656    2.1464    0.0000 H   0  0  0

+    2.0599   -1.9830    0.0000 H   0  0  0

+    2.6859   -3.1057    0.0000 H   0  0  0

+   -3.9610   -2.1186    0.0000 H   0  0  0

+   -0.9099    2.8661    0.0000 H   0  0  0

+   -1.9215    3.8321    0.0000 H   0  0  0

+   -2.8875    2.8205    0.0000 H   0  0  0

+    3.7897    3.3283    0.0000 H   0  0  0

+    2.8065    4.3233    0.0000 H   0  0  0

+    1.8115    3.3401    0.0000 H   0  0  0

+    3.8623   -3.7787    0.0000 H   0  0  0

+    5.2086   -3.3994    0.0000 H   0  0  0

+    4.8293   -2.0531    0.0000 H   0  0  0

+   -4.4846    0.3331    0.0000 H   0  0  0

+   -5.8817    0.2648    0.0000 H   0  0  0

+   -5.8134   -1.1323    0.0000 H   0  0  0

+   -5.1768   -0.3266    0.0000 H   0  0  0

+   -5.9947   -1.4613    0.0000 H   0  0  0

+   -4.8600   -2.2792    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  3  8  2  0

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+ 14 18  1  0

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+ 10 13  1  0

+  5 20  1  0

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+ 17 33  1  0

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+ 18 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 19 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59804-37-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -2.1884    1.0437    0.0857 C   0  0  0

+   -2.8918   -0.1590    0.2123 C   0  0  0

+   -0.7542    1.1603   -0.0771 C   0  0  0

+   -3.4520    2.2763    0.1670 S   0  0  0

+   -1.9854   -1.6894    0.1824 S   0  0  0

+   -4.2603   -0.0458    0.3542 C   0  0  0

+   -0.0380    0.0372   -0.4486 C   0  0  0

+   -0.1276    2.3442    0.1297 O   0  0  0

+   -4.8499    1.1792    0.3600 C   0  0  0

+   -0.6760   -1.1877   -0.7012 N   0  0  0

+   -1.5279   -1.9288    1.5062 O   0  0  0

+   -2.7184   -2.5920   -0.6345 O   0  0  0

+    1.3657    0.1240   -0.5763 C   0  0  0

+   -0.1702   -2.0459   -1.7754 C   0  0  0

+    2.1597   -0.2487    0.4469 N   0  0  0

+    1.8591    0.5361   -1.6117 O   0  0  0

+    3.5330   -0.0287    0.3784 C   0  0  0

+    4.0254    1.0191   -0.3923 C   0  0  0

+    4.3577   -0.8154    1.0519 N   0  0  0

+    5.3919    1.2267   -0.4511 C   0  0  0

+    5.6650   -0.6411    1.0146 C   0  0  0

+    6.2227    0.3759    0.2657 C   0  0  0

+   -4.8338   -0.8798    0.0000 H   0  0  0

+    0.3459    3.2388    0.0000 H   0  0  0

+   -5.8357    1.4084    0.0000 H   0  0  0

+   -1.0422   -2.5598    0.0000 H   0  0  0

+    0.3437   -2.9179    0.0000 H   0  0  0

+    0.7018   -1.5320    0.0000 H   0  0  0

+    2.0185   -1.2509    0.0000 H   0  0  0

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+    5.7134    2.1864    0.0000 H   0  0  0

+    6.2372   -1.4759    0.0000 H   0  0  0

+    7.2255    0.5131    0.0000 H   0  0  0

+  1  2  2  0

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+  5 10  1  0

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+  6  9  2  0

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+ 14 28  1  0

+ 15 29  1  0

+ 18 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+ 22 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56438-59-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    3.7632    0.2874   -0.1550 C   0  0  0

+    2.2912    0.1814    0.2485 C   0  0  0

+    4.6470    0.0095    1.0626 C   0  0  0

+    4.4058   -0.9720    0.0524 O   0  0  0

+    1.4073    0.4593   -0.9690 C   0  0  0

+   -0.0425    0.3548   -0.5716 C   0  0  0

+   -0.7157    1.4734   -0.1167 C   0  0  0

+   -0.6990   -0.8585   -0.6679 C   0  0  0

+   -2.0451    1.3803    0.2479 C   0  0  0

+   -2.0280   -0.9567   -0.3047 C   0  0  0

+   -2.7044    0.1633    0.1571 C   0  0  0

+   -4.0119    0.0691    0.5155 O   0  0  0

+   -4.3989   -1.2914    0.3123 C   0  0  0

+    3.8793    1.2801    0.0000 H   0  0  0

+    1.6452   -0.5813    0.0000 H   0  0  0

+    2.7438   -0.7097    0.0000 H   0  0  0

+    5.6123   -0.2496    0.0000 H   0  0  0

+    4.9265    0.9691    0.0000 H   0  0  0

+    2.0532    1.2220    0.0000 H   0  0  0

+    0.9546    1.3504    0.0000 H   0  0  0

+   -0.2546    2.3601    0.0000 H   0  0  0

+   -0.1560   -1.6976    0.0000 H   0  0  0

+   -2.5862    2.2206    0.0000 H   0  0  0

+   -2.4868   -1.8447    0.0000 H   0  0  0

+   -5.3602   -1.0179    0.0000 H   0  0  0

+   -4.6724   -2.2527    0.0000 H   0  0  0

+   -3.4376   -1.5649    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  6  7  2  0

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+  7  9  1  0

+  8 10  2  0

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+  3  4  1  0

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+  5 19  1  0

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+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+298-02-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+    1.2318    0.1645   -0.0608 P   0  0  0

+   -0.5089    0.0124    1.1397 S   0  0  0

+    2.5193    0.3682    0.8841 O   0  0  0

+    1.4076   -1.1829   -0.9243 O   0  0  0

+    1.0681    1.6221   -1.2103 S   0  0  0

+   -1.7871    0.1417   -0.1409 C   0  0  0

+    3.6148    0.6916    0.0254 C   0  0  0

+    1.4001   -2.2710    0.0019 C   0  0  0

+   -3.4266    0.0387    0.6286 S   0  0  0

+    4.8769    0.8991    0.8651 C   0  0  0

+    1.5643   -3.5888   -0.7580 C   0  0  0

+   -4.4756    0.1918   -0.8434 C   0  0  0

+   -5.9472    0.1301   -0.4294 C   0  0  0

+   -1.2547    0.9726    0.0000 H   0  0  0

+   -2.2875    0.9922    0.0000 H   0  0  0

+    3.9245    1.6285    0.0000 H   0  0  0

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+    5.0370   -0.0746    0.0000 H   0  0  0

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+    2.5435   -3.4668    0.0000 H   0  0  0

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+   -4.9515    1.0563    0.0000 H   0  0  0

+   -5.9885    1.1160    0.0000 H   0  0  0

+   -6.9331    0.0888    0.0000 H   0  0  0

+   -5.9059   -0.8558    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 12 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

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+ 10 20  1  0

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+ 10 22  1  0

+ 11 23  1  0

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+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96014-36-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.0772    0.4201   -0.0029 C   0  0  0

+   -1.2783   -0.1605   -0.0019 C   0  0  0

+   -0.0861    1.8129    0.0003 C   0  0  0

+    1.3556   -0.1334   -0.0010 C   0  0  0

+   -2.1744    0.9187    0.0018 C   0  0  0

+   -1.7608   -1.4673   -0.0042 C   0  0  0

+   -1.4436    2.0930    0.0030 N   0  0  0

+    1.0378    2.6335    0.0001 C   0  0  0

+    2.4630    0.6968   -0.0022 C   0  0  0

+    1.5289   -1.6035    0.0017 N   0  3  0

+   -3.5435    0.6679    0.0028 C   0  0  0

+   -3.1198   -1.6954   -0.0029 C   0  0  0

+    2.2990    2.0794   -0.0030 C   0  0  0

+    3.7498    0.1456    0.0002 N   0  0  0

+    1.6009   -2.2102   -1.0520 O   0  0  0

+    1.5995   -2.2064    1.0576 O   0  5  0

+   -4.0070   -0.6298    0.0001 C   0  0  0

+   -1.0951   -2.2711    0.0000 H   0  0  0

+   -1.8551    3.0521    0.0000 H   0  0  0

+    0.9249    3.6711    0.0000 H   0  0  0

+   -4.2194    1.4632    0.0000 H   0  0  0

+   -3.4827   -2.6740    0.0000 H   0  0  0

+    3.1377    2.7006    0.0000 H   0  0  0

+    3.8736   -0.8907    0.0000 H   0  0  0

+    4.5854    0.7710    0.0000 H   0  0  0

+   -5.0346   -0.8122    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+  9 14  1  0

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+  5  7  1  0

+  9 13  1  0

+ 12 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112-34-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    0.0638   -1.5107   -0.5039 C   0  0  0

+   -1.3336   -1.5422    0.1185 C   0  0  0

+    0.8811   -0.5790    0.2074 O   0  0  0

+   -1.9183   -0.2405    0.0424 O   0  0  0

+    2.1659   -0.5951   -0.4180 C   0  0  0

+   -3.2146   -0.3347    0.6364 C   0  0  0

+    3.0947    0.3865    0.2995 C   0  0  0

+   -3.8987    1.0330    0.5871 C   0  0  0

+    4.4703    0.3691   -0.3701 C   0  0  0

+   -4.0272    1.4525   -0.7729 O   0  0  0

+    5.3991    1.3507    0.3474 C   0  0  0

+   -0.1623   -2.4987    0.0000 H   0  0  0

+    0.9663   -1.9720    0.0000 H   0  0  0

+   -2.3051   -1.8310    0.0000 H   0  0  0

+   -1.1764   -2.5435    0.0000 H   0  0  0

+    1.9044   -1.5743    0.0000 H   0  0  0

+    3.0508   -1.0893    0.0000 H   0  0  0

+   -4.1723   -0.6664    0.0000 H   0  0  0

+   -3.0103   -1.3274    0.0000 H   0  0  0

+    3.3563    1.3657    0.0000 H   0  0  0

+    2.2098    0.8807    0.0000 H   0  0  0

+   -4.8975    1.2053    0.0000 H   0  0  0

+   -4.5031    0.2194    0.0000 H   0  0  0

+    4.2087   -0.6101    0.0000 H   0  0  0

+    5.3552   -0.1251    0.0000 H   0  0  0

+   -4.3240    2.4216    0.0000 H   0  0  0

+    6.1353    0.6541    0.0000 H   0  0  0

+    6.0957    2.0869    0.0000 H   0  0  0

+    4.6629    2.0473    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

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+  7  9  1  0

+  8 10  1  0

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+  1 12  1  0

+  1 13  1  0

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+  5 16  1  0

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+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1319-77-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 48                          1 V2000

+  -13.5263    0.6485    0.0528 C   0  0  0

+  -14.3872   -0.3578    0.4452 C   0  0  0

+  -12.2732    0.3306   -0.4511 C   0  0  0

+  -14.0014   -1.6812    0.3357 C   0  0  0

+  -15.7484   -0.0132    0.9926 C   0  0  0

+  -11.8884   -0.9977   -0.5594 C   0  0  0

+  -11.4241    1.3189   -0.8374 O   0  0  0

+  -12.7535   -2.0006   -0.1660 C   0  0  0

+    0.0634    1.4019   -0.0897 C   0  0  0

+   -0.8015    0.3910    0.3044 C   0  0  0

+    1.3108    1.0854   -0.5913 C   0  0  0

+   -0.3603    2.8437    0.0235 C   0  0  0

+   -0.4107   -0.9353    0.1936 C   0  0  0

+   -2.0291    0.6999    0.7987 O   0  0  0

+    1.6980   -0.2376   -0.7009 C   0  0  0

+    0.8381   -1.2466   -0.3088 C   0  0  0

+   12.8076    1.1790    0.1864 C   0  0  0

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+   12.3820    2.6201    0.3005 C   0  0  0

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+   13.9665   -2.7667   -0.1413 O   0  0  0

+  -13.8276    1.5979    0.0000 H   0  0  0

+  -14.6940   -2.3971    0.0000 H   0  0  0

+  -15.5040    0.9524    0.0000 H   0  0  0

+  -16.7140    0.2312    0.0000 H   0  0  0

+  -15.9928   -0.9788    0.0000 H   0  0  0

+  -10.9153   -1.2101    0.0000 H   0  0  0

+  -10.7750    2.0744    0.0000 H   0  0  0

+  -12.4551   -2.9509    0.0000 H   0  0  0

+    2.0022    1.8024    0.0000 H   0  0  0

+    0.5953    3.1245    0.0000 H   0  0  0

+   -0.6411    3.7993    0.0000 H   0  0  0

+   -1.3159    2.5629    0.0000 H   0  0  0

+   -1.1000   -1.6543    0.0000 H   0  0  0

+   -2.9950    0.9430    0.0000 H   0  0  0

+    2.6720   -0.4458    0.0000 H   0  0  0

+    1.1423   -2.1951    0.0000 H   0  0  0

+   10.9721    0.3813    0.0000 H   0  0  0

+   14.7466    1.5851    0.0000 H   0  0  0

+   13.3373    2.9022    0.0000 H   0  0  0

+   12.0999    3.5754    0.0000 H   0  0  0

+   11.4267    2.3380    0.0000 H   0  0  0

+   11.6402   -1.8674    0.0000 H   0  0  0

+   15.4219   -0.6610    0.0000 H   0  0  0

+   14.2473   -3.7223    0.0000 H   0  0  0

+  1  2  2  0

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+  6  8  1  0

+ 15 16  2  0

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+ 20 44  1  0

+ 20 45  1  0

+ 21 46  1  0

+ 22 47  1  0

+ 24 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129117-54-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    0.8091   -0.1964   -0.0022 C   0  0  0

+   -0.6545   -0.0158   -0.0007 C   0  0  0

+    1.3698    1.0889   -0.0007 C   0  0  0

+    1.6347   -1.3186    0.0004 C   0  0  0

+   -0.8861    1.3672    0.0017 C   0  0  0

+   -1.7284   -0.9036   -0.0020 C   0  0  0

+    0.3386    2.0149    0.0017 N   0  0  0

+    2.7542    1.2316   -0.0012 C   0  0  0

+    3.0095   -1.1594   -0.0012 C   0  0  0

+    1.0332   -2.7003    0.0054 C   0  0  0

+   -2.1945    1.8413    0.0026 C   0  0  0

+   -3.0217   -0.4156   -0.0008 C   0  0  0

+    3.5643    0.1176   -0.0037 C   0  0  0

+    3.3682    2.6079    0.0005 C   0  0  0

+    3.8434   -2.2838    0.0014 N   0  0  0

+   -3.2504    0.9562    0.0012 C   0  0  0

+   -4.0727   -1.2788   -0.0020 O   0  0  0

+   -5.2601   -0.4837   -0.0003 C   0  0  0

+   -1.5569   -1.9334    0.0000 H   0  0  0

+    0.4663    3.0511    0.0000 H   0  0  0

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+    4.3216    2.1825    0.0000 H   0  0  0

+    3.7936    3.5613    0.0000 H   0  0  0

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+    3.4281   -3.2417    0.0000 H   0  0  0

+    4.8806   -2.1645    0.0000 H   0  0  0

+   -4.2297    1.3181    0.0000 H   0  0  0

+   -4.6792    0.3838    0.0000 H   0  0  0

+   -6.1276    0.0972    0.0000 H   0  0  0

+   -5.8410   -1.3512    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21711-71-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    0.4249   -0.6017   -0.0707 C   0  0  0

+   -1.0308   -0.3444   -0.0493 C   0  0  0

+    1.3799    0.5009    0.0679 C   0  0  0

+    0.9141   -1.8969   -0.2172 C   0  0  0

+   -1.8337   -0.9373    0.9278 C   0  0  0

+   -1.6083    0.4971   -1.0024 C   0  0  0

+    2.7609    0.2099    0.0425 C   0  0  0

+    0.9527    1.7549    0.2148 N   0  0  0

+    2.2758   -2.1218   -0.2349 C   0  0  0

+   -3.1909   -0.6930    0.9419 C   0  0  0

+   -2.9673    0.7328   -0.9766 C   0  0  0

+    3.1812   -1.0777   -0.1089 C   0  0  0

+    1.7567    2.6627    0.3291 O   0  0  0

+   -3.7577    0.1376   -0.0093 C   0  0  0

+    0.2584   -2.6968    0.0000 H   0  0  0

+   -1.5989   -1.9446    0.0000 H   0  0  0

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+    2.6269   -3.0946    0.0000 H   0  0  0

+   -3.7534   -1.5609    0.0000 H   0  0  0

+   -3.2100    1.7382    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91-63-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.2178    0.5966   -0.0027 C   0  0  0

+   -0.4798   -0.7961   -0.0004 C   0  0  0

+    1.0445    1.0359   -0.0022 N   0  0  0

+   -1.2990    1.4954    0.0005 C   0  0  0

+    0.6037   -1.6942    0.0018 C   0  0  0

+   -1.8080   -1.2523   -0.0009 C   0  0  0

+    2.0563    0.2020    0.0003 C   0  0  0

+   -2.5734    1.0185    0.0056 C   0  0  0

+    1.8686   -1.1781    0.0017 C   0  0  0

+   -2.8287   -0.3516   -0.0035 C   0  0  0

+    3.4596    0.7515    0.0002 C   0  0  0

+   -1.1246    2.5257    0.0000 H   0  0  0

+    0.4451   -2.7270    0.0000 H   0  0  0

+   -2.0116   -2.2772    0.0000 H   0  0  0

+   -3.3736    1.6904    0.0000 H   0  0  0

+    2.6945   -1.8182    0.0000 H   0  0  0

+   -3.8166   -0.6920    0.0000 H   0  0  0

+    3.8406   -0.2215    0.0000 H   0  0  0

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+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+113163-22-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -0.0773   -0.1369   -0.2884 C   0  0  0

+   -0.8596   -1.3585   -0.6731 C   0  0  2

+    1.3233   -0.2275   -0.1609 C   0  0  0

+   -0.6930    1.0548   -0.0665 C   0  0  0

+   -2.3316   -1.3487   -0.3090 C   0  0  1

+   -1.3664   -2.0759    0.4539 O   0  0  0

+    2.0637    0.9255    0.1948 C   0  0  0

+    1.9565   -1.3859   -0.3728 N   0  0  0

+   -2.1918    1.1546   -0.1934 C   0  0  2

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+   -2.5462    1.2729   -1.5727 O   0  0  0

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+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-18-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.0000    0.3952   -0.1173 C   0  0  0

+   -1.2492    1.0062    0.5207 C   0  0  0

+    1.2492    1.0062    0.5207 C   0  0  0

+    0.0000   -1.3880    0.1491 Cl  0  0  0

+   -2.7214    0.2862   -0.2311 Cl  0  0  0

+    2.7214    0.2862   -0.2311 Cl  0  0  0

+    0.0000    1.6243    0.0000 H   0  0  0

+   -0.4809    1.9656    0.0000 H   0  0  0

+   -2.0175    1.9656    0.0000 H   0  0  0

+    2.0175    1.9656    0.0000 H   0  0  0

+    0.4809    1.9656    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105-13-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.3122   -0.2042   -0.2594 C   0  0  0

+   -0.6644   -1.4052   -0.0347 C   0  0  0

+   -0.5880    0.9709   -0.3348 C   0  0  0

+   -2.8094   -0.1773   -0.4286 C   0  0  0

+    0.7084   -1.4332    0.1150 C   0  0  0

+    0.7854    0.9482   -0.1857 C   0  0  0

+   -3.3887    0.6460    0.5857 O   0  0  0

+    1.4375   -0.2551    0.0398 C   0  0  0

+    2.7883   -0.2802    0.1864 O   0  0  0

+    3.2426    1.0687    0.0599 C   0  0  0

+   -1.2012   -2.2842    0.0000 H   0  0  0

+   -1.0827    1.8743    0.0000 H   0  0  0

+   -3.7570   -0.5810    0.0000 H   0  0  0

+   -2.6124   -1.1883    0.0000 H   0  0  0

+    1.2005   -2.3380    0.0000 H   0  0  0

+    1.3197    1.8288    0.0000 H   0  0  0

+   -3.9814    1.4884    0.0000 H   0  0  0

+    4.2187    0.7399    0.0000 H   0  0  0

+    3.5714    2.0448    0.0000 H   0  0  0

+    2.2665    1.3975    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  9 10  1  0

+  6  8  2  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97055-38-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.1427   -0.3000   -0.0822 C   0  0  0

+   -1.4483   -1.0229    0.1532 C   0  0  0

+   -0.3863    0.9999    0.0694 C   0  0  0

+    1.1841   -0.9309   -0.4182 C   0  0  0

+   -2.4313    0.0086    0.4487 O   0  0  0

+   -1.8294   -1.7174   -1.0361 O   0  0  0

+   -1.8017    1.1973    0.3982 C   0  0  0

+    0.7900    2.2659   -0.0961 Cl  0  0  0

+    2.4327    0.3569   -0.6011 Cl  0  0  0

+    1.6684   -2.0536    0.9068 Cl  0  0  0

+   -3.0645   -2.3773   -0.7512 C   0  0  0

+   -2.3281    2.2746    0.5965 O   0  0  0

+   -0.6977   -1.7706    0.0000 H   0  0  0

+    0.4214   -1.6662    0.0000 H   0  0  0

+   -3.5638   -1.4429    0.0000 H   0  0  0

+   -3.9989   -2.8766    0.0000 H   0  0  0

+   -2.5652   -3.3117    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  6 11  1  0

+  7 12  2  0

+  5  7  1  0

+  2 13  1  0

+  4 14  1  0

+ 11 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1711-06-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.0035    0.4510    0.0038 C   0  0  0

+    0.6912   -0.7658    0.0038 C   0  0  0

+    0.7205    1.6512    0.0004 C   0  0  0

+   -1.4696    0.4687    0.0011 C   0  0  0

+    2.0704   -0.7744    0.0006 C   0  0  0

+    2.0991    1.6266   -0.0028 C   0  0  0

+   -2.0635    1.5264    0.0010 O   0  0  0

+   -2.3556   -1.0242   -0.0019 Cl  0  0  0

+    2.7731    0.4176   -0.0032 C   0  0  0

+    2.8140   -2.0852    0.0007 C   0  0  0

+    0.1627   -1.6652    0.0000 H   0  0  0

+    0.2138    2.5631    0.0000 H   0  0  0

+    2.6355    2.5213    0.0000 H   0  0  0

+    3.8162    0.4050    0.0000 H   0  0  0

+    1.9066   -2.5999    0.0000 H   0  0  0

+    3.3287   -2.9926    0.0000 H   0  0  0

+    3.7214   -1.5705    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6  9  1  0

+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106636-46-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.3419    0.2645    0.0396 C   0  0  0

+   -1.2462   -0.8785   -0.1183 C   0  0  0

+    1.1353    0.2291    0.0339 C   0  0  0

+   -1.1075    1.3361    0.1826 N   0  0  0

+   -2.5512   -0.3427   -0.0443 N   0  0  0

+   -0.9136   -2.1343   -0.2915 N   0  0  0

+    1.8590    1.2383   -0.6061 C   0  0  0

+    1.8146   -0.8105    0.6732 C   0  0  0

+   -2.3812    0.9974    0.1327 C   0  0  0

+   -3.8418   -0.8105   -0.1092 C   0  0  0

+   -1.7794   -2.9830   -0.4087 O   0  0  0

+    3.2374    1.1989   -0.6075 C   0  0  0

+    3.1937   -0.8372    0.6639 C   0  0  0

+   -4.0010    1.6017    0.2096 S   0  0  0

+   -4.8566    0.0490    0.0092 C   0  0  0

+    3.9040    0.1626    0.0232 C   0  0  0

+   -6.3388   -0.2205   -0.0291 C   0  0  0

+    5.3838    0.1269    0.0170 N   0  3  0

+    5.9733   -0.7836    0.5711 O   0  0  0

+    6.0119    1.0079   -0.5422 O   0  5  0

+    1.4127    2.1390    0.0000 H   0  0  0

+    1.3276   -1.6899    0.0000 H   0  0  0

+   -4.0193   -1.8000    0.0000 H   0  0  0

+    3.7315    2.0743    0.0000 H   0  0  0

+    3.6462   -1.7349    0.0000 H   0  0  0

+   -6.5186    0.7686    0.0000 H   0  0  0

+   -7.3279   -0.4003    0.0000 H   0  0  0

+   -6.1590   -1.2096    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  2  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  2  0

+ 12 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 18 19  2  0

+ 18 20  1  0

+  5  9  1  0

+ 13 16  2  0

+ 14 15  1  0

+  7 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120-71-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.8661    0.0864    0.0018 C   0  0  0

+   -0.0956   -1.0748    0.0006 C   0  0  0

+   -0.2463    1.3245    0.0018 C   0  0  0

+   -2.2237    0.0036   -0.0027 O   0  0  0

+    1.2883   -0.9842   -0.0006 C   0  0  0

+   -0.7166   -2.3291    0.0010 N   0  0  0

+    1.1345    1.4072    0.0007 C   0  0  0

+   -2.7192    1.3439   -0.0001 C   0  0  0

+    1.8995    0.2561   -0.0005 C   0  0  0

+    3.4033    0.3530   -0.0013 C   0  0  0

+   -0.8187    2.1920    0.0000 H   0  0  0

+    1.8658   -1.8483    0.0000 H   0  0  0

+   -1.7538   -2.3954    0.0000 H   0  0  0

+   -0.1406   -3.1941    0.0000 H   0  0  0

+    1.5979    2.3374    0.0000 H   0  0  0

+   -1.7444    1.7043    0.0000 H   0  0  0

+   -3.0796    2.3187    0.0000 H   0  0  0

+   -3.6940    0.9835    0.0000 H   0  0  0

+    3.4701   -0.6841    0.0000 H   0  0  0

+    4.4404    0.4198    0.0000 H   0  0  0

+    3.3365    1.3901    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+  7  9  2  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7570-37-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    1.4511    0.4670   -0.0019 C   0  0  0

+   -0.0137    0.6261   -0.0018 C   0  0  0

+    2.2789    1.5936   -0.0019 C   0  0  0

+    2.0175   -0.8107    0.0040 C   0  0  0

+   -0.8069   -0.4578   -0.0018 C   0  0  0

+    3.6481    1.4398   -0.0014 C   0  0  0

+    3.3883   -0.9544    0.0044 C   0  0  0

+   -2.2715   -0.2987   -0.0018 C   0  0  0

+    4.2063    0.1678   -0.0009 C   0  0  0

+   -3.0988   -1.4256   -0.0018 C   0  0  0

+   -2.8377    0.9798    0.0040 C   0  0  0

+    5.5571    0.0211   -0.0005 O   0  0  0

+   -4.4679   -1.2727   -0.0013 C   0  0  0

+   -4.2073    1.1243    0.0045 C   0  0  0

+    5.8200   -1.3835    0.0000 C   0  0  0

+   -5.0272    0.0006   -0.0008 C   0  0  0

+   -6.4143    0.1512   -0.0008 N   0  0  0

+   -0.4347    1.5805    0.0000 H   0  0  0

+    1.8606    2.5492    0.0000 H   0  0  0

+    1.4038   -1.6542    0.0000 H   0  0  0

+   -0.3859   -1.4122    0.0000 H   0  0  0

+    4.2665    2.2799    0.0000 H   0  0  0

+    3.8120   -1.9076    0.0000 H   0  0  0

+   -2.6800   -2.3810    0.0000 H   0  0  0

+   -2.2235    1.8230    0.0000 H   0  0  0

+   -5.0859   -2.1131    0.0000 H   0  0  0

+   -4.6304    2.0778    0.0000 H   0  0  0

+    4.7947   -1.5754    0.0000 H   0  0  0

+    6.0119   -2.4088    0.0000 H   0  0  0

+    6.8453   -1.1916    0.0000 H   0  0  0

+   -6.8353    1.1056    0.0000 H   0  0  0

+   -7.0303   -0.6906    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  2  0

+ 12 15  1  0

+ 13 16  2  0

+ 16 17  1  0

+  7  9  2  0

+ 14 16  1  0

+  2 18  1  0

+  3 19  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+22788-18-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 30                          1 V2000

+    1.4736   -0.3353   -0.3348 N   0  0  0

+    0.1235    0.5686    0.1040 P   0  0  0

+    2.6405    0.3363    0.2529 C   0  0  0

+    1.3497   -1.6341    0.3405 C   0  0  0

+   -1.2091   -0.1697   -0.4168 O   0  0  0

+    0.0659    0.7138    1.7797 N   0  0  0

+    0.2118    1.9146   -0.5051 O   0  0  0

+    3.1879    1.3666   -0.7369 C   0  0  0

+    0.9438   -2.7015   -0.6777 C   0  0  0

+   -2.3146    0.6420   -0.0157 C   0  0  0

+    4.6200    2.1910   -0.0157 Cl  0  0  0

+    0.7917   -4.2955    0.1510 Cl  0  0  0

+   -3.6194   -0.0067   -0.4822 C   0  0  0

+   -4.7853    0.8493   -0.0593 C   0  0  0

+   -6.0380    0.4744   -0.3622 O   0  0  0

+   -4.5924    1.8732    0.5526 O   0  0  0

+    2.8270   -0.6580    0.0000 H   0  0  0

+    3.6406    0.1836    0.0000 H   0  0  0

+    2.0563   -2.3581    0.0000 H   0  0  0

+    2.3038   -1.2976    0.0000 H   0  0  0

+    0.6938    1.5071    0.0000 H   0  0  0

+   -0.9350    0.8609    0.0000 H   0  0  0

+    3.0014    2.3609    0.0000 H   0  0  0

+    2.1878    1.5193    0.0000 H   0  0  0

+    0.2372   -1.9775    0.0000 H   0  0  0

+   -0.0103   -3.0380    0.0000 H   0  0  0

+   -1.5945    1.3526    0.0000 H   0  0  0

+   -2.9025    1.4653    0.0000 H   0  0  0

+   -4.3395   -0.7173    0.0000 H   0  0  0

+   -3.0315   -0.8300    0.0000 H   0  0  0

+   -7.0072    0.1843    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+  3 17  1  0

+  3 18  1  0

+  4 19  1  0

+  4 20  1  0

+  6 21  1  0

+  6 22  1  0

+  8 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+551-06-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -1.0276    0.3041   -0.0020 C   0  0  0

+   -1.9713   -0.7494   -0.0012 C   0  0  0

+    0.4091   -0.0274   -0.0009 C   0  0  0

+   -1.4662    1.6247    0.0019 C   0  0  0

+   -1.5228   -2.0838    0.0011 C   0  0  0

+   -3.3426   -0.4448   -0.0022 C   0  0  0

+    0.7867   -1.3936    0.0010 C   0  0  0

+    1.3220    0.9257   -0.0020 N   0  0  0

+   -2.8203    1.8932    0.0065 C   0  0  0

+   -0.1739   -2.3799    0.0026 C   0  0  0

+   -3.7474    0.8591   -0.0040 C   0  0  0

+    2.5361    0.6282   -0.0010 C   0  0  0

+    4.0450    0.2584    0.0002 S   0  0  0

+   -0.7764    2.4065    0.0000 H   0  0  0

+   -2.2191   -2.8598    0.0000 H   0  0  0

+   -4.0488   -1.2118    0.0000 H   0  0  0

+    1.7966   -1.6528    0.0000 H   0  0  0

+   -3.1503    2.8822    0.0000 H   0  0  0

+    0.1255   -3.3786    0.0000 H   0  0  0

+   -4.7660    1.0815    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  8 12  2  0

+ 12 13  2  0

+  7 10  1  0

+  9 11  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+480-22-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -1.2079    0.1176   -0.0025 C   0  0  0

+   -1.2057   -1.3479   -0.0019 C   0  0  0

+   -0.0001    0.8227   -0.0020 C   0  0  0

+   -2.4486    0.7954    0.0023 C   0  0  0

+    0.0000   -2.0483   -0.0003 C   0  0  0

+   -2.4425   -2.0283   -0.0024 C   0  0  0

+    1.2082    0.1177   -0.0010 C   0  0  0

+   -0.0003    2.1789   -0.0022 O   0  0  0

+   -3.6071    0.0747    0.0074 C   0  0  0

+   -2.4870    2.1525    0.0014 O   0  0  0

+    1.2061   -1.3478    0.0007 C   0  0  0

+   -3.6007   -1.3183   -0.0035 C   0  0  0

+    2.4485    0.7955    0.0000 C   0  0  0

+    2.4424   -2.0280    0.0018 C   0  0  0

+    3.6073    0.0747    0.0014 C   0  0  0

+    2.4867    2.1525   -0.0010 O   0  0  0

+    3.6010   -1.3178    0.0023 C   0  0  0

+    0.0000   -3.0941    0.0000 H   0  0  0

+   -2.4671   -3.0738    0.0000 H   0  0  0

+   -0.0005    3.2247    0.0000 H   0  0  0

+   -4.5224    0.5805    0.0000 H   0  0  0

+   -2.5166    3.1979    0.0000 H   0  0  0

+   -4.5120   -1.8313    0.0000 H   0  0  0

+    2.4669   -3.0735    0.0000 H   0  0  0

+    4.5226    0.5806    0.0000 H   0  0  0

+    2.5161    3.1979    0.0000 H   0  0  0

+    4.5123   -1.8308    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+ 11 14  2  0

+ 13 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+  7 11  1  0

+  9 12  1  0

+ 15 17  2  0

+  5 18  1  0

+  6 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21739-91-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+   -0.9919   -0.2834    0.0059 C   0  0  0

+   -2.1011    0.6717    0.0906 C   0  0  0

+   -0.0347   -0.3428    1.0288 C   0  0  0

+   -0.8876   -1.1446   -1.0951 C   0  0  0

+   -1.9269    1.9586   -0.3288 C   0  0  0

+   -3.7730    0.1204    0.7810 Br  0  0  0

+    0.9961   -1.2349    0.9448 C   0  0  0

+    0.1478   -2.0329   -1.1684 C   0  0  0

+   -0.7354    2.3349   -0.9483 C   0  0  0

+    1.0974   -2.0837   -0.1532 C   0  0  0

+    0.1898    1.4069   -1.2448 O   0  0  0

+   -0.5128    3.6255   -1.2486 O   0  0  0

+    2.1234   -2.9677   -0.2313 O   0  0  0

+    1.9564   -3.6872   -1.4547 C   0  0  0

+   13.1552    1.1978    0.7900 Na  0  3  0

+    0.3351    0.5627    0.0000 H   0  0  0

+   -1.7501   -1.6059    0.0000 H   0  0  0

+   -2.6752    2.5885    0.0000 H   0  0  0

+    1.8600   -0.7762    0.0000 H   0  0  0

+   -0.2161   -2.9408    0.0000 H   0  0  0

+    1.0036   -3.4661    0.0000 H   0  0  0

+    1.7353   -4.6400    0.0000 H   0  0  0

+    2.9092   -3.9083    0.0000 H   0  0  0

+   -0.3466    4.5894    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 13 14  1  0

+  8 10  2  0

+  3 16  1  0

+  4 17  1  0

+  5 18  1  0

+  7 19  1  0

+  8 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5862-77-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -0.5295   -0.1048    0.0025 C   0  0  0

+    0.3916   -1.1504    0.0009 C   0  0  0

+   -0.0871    1.2069    0.0025 C   0  0  0

+   -1.8638   -0.3732   -0.0015 O   0  0  0

+    1.7502   -0.8745   -0.0007 C   0  0  0

+   -0.0541   -2.4770    0.0005 N   0  0  0

+    1.2682    1.4816    0.0008 C   0  0  0

+   -2.5385    0.8865    0.0014 C   0  0  0

+    2.1892    0.4427   -0.0008 C   0  0  0

+   -4.0509    0.6550   -0.0029 C   0  0  0

+    3.5600    0.7232   -0.0020 N   0  0  0

+   -0.7759    1.9879    0.0000 H   0  0  0

+    2.4405   -1.6541    0.0000 H   0  0  0

+   -1.0748   -2.6833    0.0000 H   0  0  0

+    0.6349   -3.2578    0.0000 H   0  0  0

+    1.5985    2.4692    0.0000 H   0  0  0

+   -1.5709    1.2712    0.0000 H   0  0  0

+   -2.8114    1.8914    0.0000 H   0  0  0

+   -4.2085    1.6843    0.0000 H   0  0  0

+   -5.0802    0.4974    0.0000 H   0  0  0

+   -3.8933   -0.3743    0.0000 H   0  0  0

+    4.2509   -0.0559    0.0000 H   0  0  0

+    3.8893    1.7111    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  8 10  1  0

+  9 11  1  0

+  7  9  2  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1591-56-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+   -4.0285    0.3049   -0.3967 C   0  0  0

+   -3.5324   -0.9860   -0.5452 C   0  0  0

+   -3.1566    1.3707   -0.1977 C   0  0  0

+   -5.4049    0.5326   -0.4532 N   0  0  0

+   -2.1752   -1.2140   -0.4958 C   0  0  0

+   -1.7984    1.1512   -0.1471 C   0  0  0

+   -6.2341   -0.1439    0.3661 C   0  0  0

+   -1.2954   -0.1455   -0.2960 C   0  0  0

+   -7.7264    0.0058    0.2189 C   0  0  0

+   -5.7793   -0.8731    1.2218 O   0  0  0

+    0.0509   -0.3675   -0.2460 N   0  0  0

+    0.8609    0.6194   -0.0616 N   0  0  0

+    2.2066    0.3975   -0.0115 C   0  0  0

+    3.0866    1.4663    0.1883 C   0  0  0

+    2.7093   -0.9004   -0.1542 C   0  0  0

+    4.4434    1.2384    0.2386 C   0  0  0

+    4.0670   -1.1202   -0.1027 C   0  0  0

+    4.9397   -0.0532    0.0910 C   0  0  0

+    6.3131   -0.2796    0.1421 N   0  0  0

+    6.8377   -1.6387   -0.0131 C   0  0  0

+    7.2331    0.8412    0.3510 C   0  0  0

+   -4.1877   -1.7878    0.0000 H   0  0  0

+   -3.5238    2.3389    0.0000 H   0  0  0

+   -5.6713    1.5333    0.0000 H   0  0  0

+   -1.8126   -2.1840    0.0000 H   0  0  0

+   -1.1469    1.9561    0.0000 H   0  0  0

+   -7.6230    1.0361    0.0000 H   0  0  0

+   -8.7567    0.1092    0.0000 H   0  0  0

+   -7.8298   -1.0245    0.0000 H   0  0  0

+    2.7240    2.4362    0.0000 H   0  0  0

+    2.0575   -1.7050    0.0000 H   0  0  0

+    5.0987    2.0402    0.0000 H   0  0  0

+    4.4341   -2.0885    0.0000 H   0  0  0

+    5.8716   -2.0116    0.0000 H   0  0  0

+    7.2106   -2.6048    0.0000 H   0  0  0

+    7.8038   -1.2658    0.0000 H   0  0  0

+    8.0335    0.1842    0.0000 H   0  0  0

+    7.8901    1.6416    0.0000 H   0  0  0

+    6.4327    1.4982    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  7  9  1  0

+  7 10  2  0

+  8 11  1  0

+ 11 12  2  0

+ 12 13  1  0

+ 13 14  2  0

+ 13 15  1  0

+ 14 16  1  0

+ 15 17  2  0

+ 16 18  2  0

+ 18 19  1  0

+ 19 20  1  0

+ 19 21  1  0

+  6  8  1  0

+ 17 18  1  0

+  2 22  1  0

+  3 23  1  0

+  4 24  1  0

+  5 25  1  0

+  6 26  1  0

+  9 27  1  0

+  9 28  1  0

+  9 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98911-08-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    1.7636    1.2029    0.4433 C   0  0  0

+    0.7918    2.1523    0.4838 O   0  0  0

+    2.0652    0.5672   -0.7535 C   0  0  0

+    2.4596    0.8717    1.5968 C   0  0  0

+   -0.3988    1.4961    0.4844 C   0  0  0

+    3.0544   -0.3978   -0.7920 C   0  0  0

+    1.2005    0.9832   -2.2002 Cl  0  0  0

+    3.4473   -0.0931    1.5537 C   0  0  0

+   -1.5839    2.2096    0.3794 C   0  0  0

+   -0.4280    0.1122    0.5845 C   0  0  0

+    3.7432   -0.7296    0.3611 C   0  0  0

+   -2.7936    1.5435    0.3795 C   0  0  0

+   -1.6368   -0.5547    0.5848 C   0  0  0

+    4.9850   -1.9417    0.3103 Cl  0  0  0

+   -2.8236    0.1595    0.4849 C   0  0  0

+   -4.0506   -0.5168    0.4857 N   0  0  0

+   -4.3685   -1.3371   -0.5354 C   0  0  0

+   -4.9566   -0.3385    1.5591 O   0  0  0

+   -5.5492   -2.2659   -0.4161 C   0  0  0

+   -3.7044   -1.3276   -1.5503 O   0  0  0

+    3.0518    1.7210    0.0000 H   0  0  0

+    2.4604   -1.2459    0.0000 H   0  0  0

+    4.2923    0.5053    0.0000 H   0  0  0

+   -1.5639    3.2448    0.0000 H   0  0  0

+    0.4580   -0.4236    0.0000 H   0  0  0

+   -3.6792    2.0799    0.0000 H   0  0  0

+   -1.6563   -1.5899    0.0000 H   0  0  0

+   -5.9725   -0.1386    0.0000 H   0  0  0

+   -6.1894   -1.4521    0.0000 H   0  0  0

+   -6.3630   -2.9061    0.0000 H   0  0  0

+   -4.9090   -3.0797    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 12 15  2  0

+ 15 16  1  0

+ 16 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+ 17 20  2  0

+  8 11  1  0

+ 13 15  1  0

+  4 21  1  0

+  6 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108354-48-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.2779   -0.6285   -0.0017 C   0  0  0

+   -1.1805   -0.5448   -0.0008 C   0  0  0

+    1.0186    0.5563   -0.0012 C   0  0  0

+    1.1570   -1.6564    0.0025 N   0  0  0

+   -1.7889    0.7353    0.0005 C   0  0  0

+   -1.9401   -1.6391   -0.0017 N   0  0  0

+    0.3717    1.7946    0.0001 C   0  0  0

+    2.3496    0.1764   -0.0018 N   0  0  0

+    2.3815   -1.1868   -0.0003 C   0  0  0

+   -0.9820    1.8888    0.0014 C   0  0  0

+   -3.1228    0.8276    0.0013 N   0  0  0

+   -3.2508   -1.5233   -0.0013 C   0  0  0

+    1.1968    3.0556    0.0006 C   0  0  0

+    3.5087    1.0724   -0.0015 C   0  0  0

+    3.5274   -1.9550    0.0025 N   0  0  0

+   -3.8524   -0.2659    0.0009 C   0  0  0

+   -1.4286    2.8241    0.0000 H   0  0  0

+   -3.8414   -2.3750    0.0000 H   0  0  0

+    2.0640    2.4881    0.0000 H   0  0  0

+    1.7643    3.9228    0.0000 H   0  0  0

+    0.3296    3.6231    0.0000 H   0  0  0

+    4.1425    0.2524    0.0000 H   0  0  0

+    4.3287    1.7062    0.0000 H   0  0  0

+    2.8749    1.8924    0.0000 H   0  0  0

+    3.4580   -2.9891    0.0000 H   0  0  0

+    4.4576   -1.4980    0.0000 H   0  0  0

+   -4.8862   -0.1923    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  2  0

+  7 10  2  0

+  8  9  1  0

+ 12 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+145-39-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 37                          1 V2000

+    0.0000   -0.4193    0.0085 C   0  0  0

+   -1.1971    0.2723   -0.0077 C   0  0  0

+    1.1972    0.2711   -0.0086 C   0  0  0

+   -0.0006   -1.9257    0.0512 C   0  0  0

+   -1.1966    1.6540   -0.0410 C   0  0  0

+   -2.4792   -0.4671    0.0102 N   0  3  0

+    1.1977    1.6533   -0.0419 C   0  0  0

+    2.4788   -0.4692    0.0091 N   0  3  0

+    0.0031   -2.4763   -1.3763 C   0  0  0

+    1.2465   -2.4154    0.7899 C   0  0  0

+   -1.2520   -2.4147    0.7831 C   0  0  0

+    0.0010    2.3446   -0.0576 C   0  0  0

+   -2.5014    2.4078   -0.0586 C   0  0  0

+   -3.1499   -0.4988    1.0264 O   0  0  0

+   -2.8637   -1.0437   -0.9914 O   0  5  0

+    2.5031    2.4061   -0.0607 C   0  0  0

+    2.8549   -1.0596   -0.9876 O   0  0  0

+    3.1572   -0.4882    1.0205 O   0  5  0

+    0.0016    3.8512   -0.0934 C   0  0  0

+   -1.0334   -2.4833    0.0000 H   0  0  0

+    0.0101   -3.5128    0.0000 H   0  0  0

+    1.0396   -2.4693    0.0000 H   0  0  0

+    0.8677   -3.3802    0.0000 H   0  0  0

+    2.2113   -2.7942    0.0000 H   0  0  0

+    1.6253   -1.4506    0.0000 H   0  0  0

+   -1.6293   -1.4493    0.0000 H   0  0  0

+   -2.2174   -2.7920    0.0000 H   0  0  0

+   -0.8747   -3.3801    0.0000 H   0  0  0

+   -1.9829    3.3053    0.0000 H   0  0  0

+   -3.3989    2.9263    0.0000 H   0  0  0

+   -3.0199    1.5103    0.0000 H   0  0  0

+    3.0209    1.5082    0.0000 H   0  0  0

+    3.4010    2.9239    0.0000 H   0  0  0

+    1.9853    3.3040    0.0000 H   0  0  0

+    1.0381    3.8508    0.0000 H   0  0  0

+    0.0020    4.8877    0.0000 H   0  0  0

+   -1.0349    3.8516    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  2  0

+  6 15  1  0

+  7 16  1  0

+  8 17  2  0

+  8 18  1  0

+ 12 19  1  0

+  7 12  2  0

+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+464-10-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    0.0000    0.0000   -0.2358 C   0  0  0

+    0.0000    0.0000   -1.7008 N   0  3  0

+   -0.9268    1.6052    0.4196 Br  0  0  0

+   -0.9268   -1.6052    0.4196 Br  0  0  0

+    1.8536    0.0000    0.4195 Br  0  0  0

+   -1.0549    0.0000   -2.3097 O   0  0  0

+    1.0548    0.0000   -2.3098 O   0  5  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33372-39-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+    1.9197    0.4041   -0.0019 C   0  0  0

+    2.3037   -0.9593    0.0703 C   0  0  0

+    2.8683    1.4030   -0.0626 N   0  0  0

+    0.6283    0.6937   -0.0151 N   0  0  0

+    1.2860   -1.9429    0.1302 C   0  0  0

+    3.6463   -1.3506    0.0833 C   0  0  0

+    2.5924    2.1735   -1.2825 C   0  0  0

+    2.6094    2.3004    1.0712 C   0  0  0

+   -0.2991   -0.2642    0.0377 C   0  0  0

+    0.0054   -1.5492    0.1163 N   0  0  0

+    1.6438   -3.2969    0.2015 C   0  0  0

+    3.9599   -2.6767    0.1534 C   0  0  0

+    3.6329    1.8285   -2.3498 C   0  0  0

+    3.3673    1.7989    2.3020 C   0  0  0

+   -1.7211    0.1260    0.0198 C   0  0  0

+    2.9619   -3.6451    0.2123 C   0  0  0

+    3.4495    0.4764   -2.7743 O   0  0  0

+    4.7734    1.9190    2.0773 O   0  0  0

+   -3.1733   -0.9111    0.0779 S   0  0  0

+   -2.2723    1.3803   -0.0397 C   0  0  0

+   -4.4066    0.3781    0.0129 C   0  0  0

+   -3.6421    1.5010   -0.0440 C   0  0  0

+   -5.8819    0.2561    0.0229 N   0  3  0

+   -6.5761    1.2556   -0.0281 O   0  0  0

+   -6.4017   -0.8439    0.0821 O   0  5  0

+    4.3883   -0.6458    0.0000 H   0  0  0

+    2.6934    3.1919    0.0000 H   0  0  0

+    1.5767    2.0484    0.0000 H   0  0  0

+    2.9080    3.2792    0.0000 H   0  0  0

+    1.5861    2.3082    0.0000 H   0  0  0

+    0.9202   -4.0206    0.0000 H   0  0  0

+    4.9422   -2.9636    0.0000 H   0  0  0

+    4.6365    1.6286    0.0000 H   0  0  0

+    3.8944    2.8179    0.0000 H   0  0  0

+    2.5754    1.1507    0.0000 H   0  0  0

+    3.7522    0.8507    0.0000 H   0  0  0

+    3.2211   -4.6351    0.0000 H   0  0  0

+    3.3120   -0.5377    0.0000 H   0  0  0

+    5.7930    2.0061    0.0000 H   0  0  0

+   -1.6758    2.2118    0.0000 H   0  0  0

+   -4.0804    2.4258    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

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+ 13 17  1  0

+ 14 18  1  0

+ 15 19  1  0

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+ 19 21  1  0

+ 20 22  1  0

+ 21 23  1  0

+ 23 24  2  0

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+  9 10  2  0

+ 12 16  1  0

+ 21 22  2  0

+  6 26  1  0

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+ 14 36  1  0

+ 16 37  1  0

+ 17 38  1  0

+ 18 39  1  0

+ 20 40  1  0

+ 22 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109883-99-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -0.4024    1.0135    0.0000 C   0  0  1

+   -1.7364    0.2348    0.0000 C   0  0  2

+    0.9316    0.2348    0.0000 C   0  0  1

+   -0.4024   -0.5291    0.0000 C   0  0  0

+   -0.7415    2.5413    0.0000 C   0  0  0

+   -1.7364   -1.3079    0.0000 C   0  0  0

+   -2.8879    1.3042    0.0000 C   0  0  1

+    0.9316   -1.3079    0.0000 C   0  0  1

+    2.4295    0.6968    0.0000 C   0  0  0

+   -2.2395    2.6755    0.0000 O   0  0  0

+    0.2199    3.7039    0.0000 O   0  0  0

+   -0.4024   -2.0830    0.0000 C   0  0  0

+   -3.0630   -2.0830    0.0000 C   0  0  0

+   -4.3970    1.0583    0.0000 O   0  0  0

+    2.4295   -1.7663    0.0000 C   0  0  0

+    0.7005   -2.7798    0.0000 O   0  0  0

+    3.2791   -0.5291    0.0000 C   0  0  0

+   -3.0630   -3.6033    0.0000 O   0  0  0

+    4.5908   -1.3079    0.0000 C   0  0  0

+    4.5908    0.2348    0.0000 C   0  0  0

+    1.0634    1.3802    0.0000 H   0  0  0

+   -0.7942   -1.6134    0.0000 H   0  0  0

+    0.7332   -0.7280    0.0000 H   0  0  0

+   -3.2214    0.2006    0.0000 H   0  0  0

+    3.4392    1.2533    0.0000 H   0  0  0

+    1.9790    1.7581    0.0000 H   0  0  0

+   -0.4024   -3.2359    0.0000 H   0  0  0

+   -4.0630   -1.5091    0.0000 H   0  0  0

+   -5.5349    0.8729    0.0000 H   0  0  0

+    1.9820   -2.8289    0.0000 H   0  0  0

+    3.4412   -2.3192    0.0000 H   0  0  0

+    0.5217   -3.9188    0.0000 H   0  0  0

+    4.0022   -2.2993    0.0000 H   0  0  0

+    5.5822   -1.8965    0.0000 H   0  0  0

+    5.1794   -0.3165    0.0000 H   0  0  0

+    5.1710   -0.7615    0.0000 H   0  0  0

+    5.5871    0.8150    0.0000 H   0  0  0

+    4.0106    1.2311    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  6

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

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+  5 10  1  0

+  5 11  2  0

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+  8 15  1  0

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+ 17 20  1  0

+  2  4  1  1

+  7 10  1  0

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+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+123-66-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.2247   -0.6659    0.0000 C   0  0  0

+   -1.0506    0.1369    0.0000 C   0  0  0

+    1.4248    0.2832    0.0000 C   0  0  0

+   -2.2379   -0.4893    0.0000 O   0  0  0

+   -1.0044    1.3443    0.0000 O   0  0  0

+    2.7196   -0.5319    0.0000 C   0  0  0

+   -3.4666    0.2843    0.0000 C   0  0  0

+    3.9197    0.4171    0.0000 C   0  0  0

+   -4.6667   -0.6648    0.0000 C   0  0  0

+    5.2145   -0.3980    0.0000 C   0  0  0

+   -0.4925   -1.5617    0.0000 H   0  0  0

+    1.0337   -1.4797    0.0000 H   0  0  0

+    2.1420    1.1790    0.0000 H   0  0  0

+    0.6158    1.0970    0.0000 H   0  0  0

+    2.0024   -1.4277    0.0000 H   0  0  0

+    3.5285   -1.3457    0.0000 H   0  0  0

+   -2.7494    1.1800    0.0000 H   0  0  0

+   -4.2755    1.0981    0.0000 H   0  0  0

+    4.6369    1.3129    0.0000 H   0  0  0

+    3.1108    1.2309    0.0000 H   0  0  0

+   -5.3785    0.2352    0.0000 H   0  0  0

+   -5.5667   -1.3766    0.0000 H   0  0  0

+   -3.9549   -1.5648    0.0000 H   0  0  0

+    4.6032   -1.3691    0.0000 H   0  0  0

+    6.1856   -1.0093    0.0000 H   0  0  0

+    5.8258    0.5731    0.0000 H   0  0  0

+  1  2  1  0

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+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16582-03-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    1.2951    0.4222    0.0033 C   0  0  0

+    0.9270   -0.9981   -0.0003 C   0  0  0

+    2.6710    0.7679    0.0025 C   0  0  0

+    0.3534    1.3572    0.0017 N   0  0  0

+   -0.3535   -1.3571   -0.0002 N   0  0  0

+    1.9539   -1.9648   -0.0044 C   0  0  0

+    3.6109   -0.2220   -0.0016 C   0  0  0

+    3.0592    2.1048    0.0054 N   0  0  0

+   -0.9268    0.9983   -0.0032 C   0  0  0

+   -1.2950   -0.4223    0.0033 C   0  0  0

+    3.2535   -1.5683   -0.0050 C   0  0  0

+   -1.9540    1.9649   -0.0054 C   0  0  0

+   -2.6710   -0.7680    0.0041 C   0  0  0

+   -3.2535    1.5682   -0.0109 C   0  0  0

+   -3.6109    0.2219    0.0081 C   0  0  0

+   -3.0592   -2.1049    0.0012 N   0  0  0

+    1.7163   -2.9815    0.0000 H   0  0  0

+    4.6225    0.0363    0.0000 H   0  0  0

+    4.0731    2.3540    0.0000 H   0  0  0

+    2.3364    2.8583    0.0000 H   0  0  0

+    4.0052   -2.2929    0.0000 H   0  0  0

+   -1.7166    2.9816    0.0000 H   0  0  0

+   -4.0052    2.2928    0.0000 H   0  0  0

+   -4.6225   -0.0364    0.0000 H   0  0  0

+   -4.0731   -2.3541    0.0000 H   0  0  0

+   -2.3364   -2.8584    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  2  0

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+ 11 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134109-03-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.1413   -0.4300   -0.1354 C   0  0  0

+   -1.6005   -0.4959   -0.2053 C   0  0  0

+    0.4846    0.8919   -0.0188 C   0  0  0

+    0.6397   -1.5771   -0.1715 C   0  0  0

+   -2.3321    0.6790   -0.1582 C   0  0  0

+   -2.3000   -1.7859   -0.3237 C   0  0  0

+    1.8732    1.0042    0.0498 C   0  0  0

+   -0.3448    2.0320    0.0221 C   0  0  0

+    2.0293   -1.4670   -0.1024 C   0  0  0

+   -1.6950    1.9108   -0.0460 C   0  0  0

+   -3.8366    0.6062   -0.2321 C   0  0  2

+   -3.5879   -1.8630   -0.0052 C   0  0  0

+    2.6594   -0.1480    0.0076 C   0  0  0

+    2.6181    2.5664    0.1861 Cl  0  0  0

+    2.8530   -2.6119   -0.1360 C   0  0  0

+   -4.3316   -0.6497    0.4817 C   0  0  1

+   -4.2450    0.5684   -1.6009 O   0  0  0

+    4.0669   -0.0726    0.0745 C   0  0  0

+    4.2015   -2.4690   -0.0676 C   0  0  0

+   -4.1374   -0.5051    1.8900 O   0  0  0

+    4.8016   -1.2136    0.0320 C   0  0  0

+    0.1879   -2.5196    0.0000 H   0  0  0

+   -1.7388   -2.6676    0.0000 H   0  0  0

+    0.0873    2.9837    0.0000 H   0  0  0

+   -2.2778    2.7784    0.0000 H   0  0  0

+   -3.9100    1.6488    0.0000 H   0  0  0

+   -4.0710   -2.7898    0.0000 H   0  0  0

+    2.4261   -3.5659    0.0000 H   0  0  0

+   -5.3728   -0.7407    0.0000 H   0  0  0

+   -5.2857    0.4721    0.0000 H   0  0  0

+    4.5427    0.8580    0.0000 H   0  0  0

+    4.8047   -3.3225    0.0000 H   0  0  0

+   -3.2991    0.1191    0.0000 H   0  0  0

+    5.8447   -1.1477    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  3  7  2  0

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+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60768-66-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -0.8091    0.6649   -0.0025 C   0  0  0

+   -1.2097   -0.6920   -0.0011 C   0  0  0

+    0.5809    0.9196   -0.0019 C   0  0  0

+   -1.9324    1.5824    0.0014 C   0  0  0

+   -0.2944   -1.7224    0.0014 C   0  0  0

+   -2.9782   -0.5781   -0.0024 S   0  0  0

+    1.4681   -0.1112   -0.0001 C   0  0  0

+   -3.1457    1.1220    0.0057 N   0  0  0

+    1.0452   -1.4347    0.0026 C   0  0  0

+    2.9186    0.1838    0.0000 N   0  3  0

+    3.7256   -0.7284    0.0016 O   0  0  0

+    3.3051    1.3389   -0.0016 O   0  5  0

+    0.9279    1.9022    0.0000 H   0  0  0

+   -1.7652    2.6110    0.0000 H   0  0  0

+   -0.6187   -2.7127    0.0000 H   0  0  0

+    1.7452   -2.2067    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+ 10 11  2  0

+ 10 12  1  0

+  6  8  1  0

+  7  9  2  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57404-88-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.8107   -0.2008    0.0504 C   0  0  0

+   -2.1967    0.0319   -0.0029 C   0  0  0

+    0.0767    0.8913    0.1642 C   0  0  0

+   -0.3191   -1.5248   -0.0164 C   0  0  0

+   -2.6874    1.3554    0.0557 C   0  0  0

+   -3.0865   -1.0601   -0.1150 C   0  0  0

+    1.4596    0.6340    0.2182 C   0  0  0

+   -0.4398    2.2045    0.2203 C   0  0  0

+    1.0624   -1.7426    0.0372 C   0  0  0

+   -1.2332   -2.5988   -0.1348 C   0  0  0

+   -1.7737    2.4306    0.1673 C   0  0  0

+   -4.0684    1.5656    0.0018 C   0  0  0

+   -2.5672   -2.3760   -0.1742 C   0  0  0

+   -4.4599   -0.8079   -0.1654 C   0  0  0

+    1.9315   -0.6810    0.1555 C   0  0  0

+    2.4259    1.7399    0.3414 C   0  0  0

+   -4.9290    0.4906   -0.1066 C   0  0  0

+    3.4178   -0.9285    0.2150 C   0  0  1

+    3.6969    1.5394    0.0111 C   0  0  0

+    4.1606    0.2014   -0.4945 C   0  0  2

+    3.8362   -0.9901    1.5800 O   0  0  0

+    3.9254    0.1163   -1.9015 O   0  0  0

+    0.2230    3.0208    0.0000 H   0  0  0

+    1.4369   -2.7251    0.0000 H   0  0  0

+   -0.8726   -3.5865    0.0000 H   0  0  0

+   -2.1335    3.4186    0.0000 H   0  0  0

+   -4.4509    2.5450    0.0000 H   0  0  0

+   -3.2285   -3.1935    0.0000 H   0  0  0

+   -5.1396   -1.6102    0.0000 H   0  0  0

+    2.0672    2.7283    0.0000 H   0  0  0

+   -5.9663    0.6625    0.0000 H   0  0  0

+    3.2549   -1.9673    0.0000 H   0  0  0

+    4.3717    2.3458    0.0000 H   0  0  0

+    5.2040    0.0714    0.0000 H   0  0  0

+    4.8765   -1.1433    0.0000 H   0  0  0

+    2.9366   -0.2415    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  4  9  2  0

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+  8 11  2  0

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+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-54-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.6950    0.0000    0.0018 N   0  0  0

+    0.0994   -1.1081    0.0008 C   0  0  0

+    0.0994    1.1081    0.0008 C   0  0  0

+   -2.1600    0.0000   -0.0018 C   0  0  0

+    1.3860   -0.7045   -0.0009 C   0  0  0

+    1.3860    0.7045   -0.0009 C   0  0  0

+   -0.2246   -2.0780    0.0000 H   0  0  0

+   -0.2246    2.0780    0.0000 H   0  0  0

+   -2.1600    1.0226    0.0000 H   0  0  0

+   -3.1826    0.0000    0.0000 H   0  0  0

+   -2.1600   -1.0226    0.0000 H   0  0  0

+    2.2102   -1.3098    0.0000 H   0  0  0

+    2.2102    1.3098    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  3  6  2  0

+  5  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+159092-69-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.4920    0.1201    0.0009 C   0  0  0

+   -0.9379    0.4428    0.0008 C   0  0  0

+    1.4270    1.1801    0.0001 C   0  0  0

+    0.9435   -1.2006   -0.0040 C   0  0  0

+   -1.3269    1.8013    0.0000 C   0  0  0

+   -1.9130   -0.5563    0.0011 C   0  0  0

+    2.7969    0.8829    0.0001 C   0  0  0

+    0.9732    2.5197   -0.0002 C   0  0  0

+    2.2852   -1.4574   -0.0043 C   0  0  0

+   -0.3419    2.8163   -0.0012 C   0  0  0

+   -2.6920    2.1213   -0.0001 C   0  0  0

+   -3.2347   -0.2121    0.0005 C   0  0  0

+    3.2076   -0.4182    0.0009 C   0  0  0

+   -3.6214    1.1229    0.0006 C   0  0  0

+   -4.2670   -1.2730    0.0003 N   0  3  0

+    4.6552   -0.7269    0.0010 N   0  3  0

+   -5.4477   -0.9738   -0.0002 O   0  0  0

+   -3.9358   -2.4451    0.0007 O   0  5  0

+    5.0309   -1.8855    0.0017 O   0  0  0

+    5.4708    0.1778    0.0003 O   0  5  0

+    0.2584   -1.9892    0.0000 H   0  0  0

+   -1.6330   -1.5627    0.0000 H   0  0  0

+    3.5008    1.6548    0.0000 H   0  0  0

+    1.6721    3.2960    0.0000 H   0  0  0

+    2.6216   -2.4464    0.0000 H   0  0  0

+   -0.6399    3.8175    0.0000 H   0  0  0

+   -2.9962    3.1206    0.0000 H   0  0  0

+   -4.6376    1.3649    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+ 11 14  2  0

+ 12 15  1  0

+ 13 16  1  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  8 10  2  0

+  9 13  2  0

+ 12 14  1  0

+  4 21  1  0

+  6 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+70021-99-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+    0.5775   -0.6557   -0.0039 C   0  0  0

+   -0.8196   -0.8198   -0.0113 C   0  0  0

+    1.1275    0.6485    0.0254 C   0  0  0

+    1.4170   -1.7932   -0.0317 C   0  0  0

+   -1.6642    0.3121    0.0099 C   0  0  0

+   -1.3763   -2.1206   -0.0407 C   0  0  0

+    2.5945    0.8103    0.0330 C   0  0  0

+    0.2837    1.7540    0.0471 C   0  0  0

+    2.8695   -1.6217   -0.0234 C   0  0  0

+    0.8484   -3.0715   -0.0663 C   0  0  0

+   -3.0630    0.1357    0.0018 C   0  0  0

+   -1.0943    1.5960    0.0385 C   0  0  0

+   -0.5331   -3.2339   -0.0616 C   0  0  0

+   -2.8325   -2.2615   -0.0478 C   0  0  0

+    3.4285   -0.3357    0.0110 C   0  0  0

+    3.1644    2.0751    0.0611 C   0  0  0

+   -3.6212   -1.1325   -0.0273 C   0  0  0

+   -3.9488    1.3228    0.0242 N   0  3  0

+    4.8285   -0.1703    0.0181 C   0  0  0

+    4.5475    2.2142    0.0675 C   0  0  0

+   -4.8915    1.3648    0.7942 O   0  0  0

+   -3.6994    2.4088   -0.8497 O   0  5  0

+    5.3686    1.0998    0.0462 C   0  0  0

+    0.6955    2.7217    0.0000 H   0  0  0

+    3.4968   -2.4658    0.0000 H   0  0  0

+    1.4719   -3.9184    0.0000 H   0  0  0

+   -1.7169    2.4435    0.0000 H   0  0  0

+   -0.9453   -4.2014    0.0000 H   0  0  0

+   -3.2731   -3.2164    0.0000 H   0  0  0

+    2.5501    2.9287    0.0000 H   0  0  0

+   -4.6679   -1.2350    0.0000 H   0  0  0

+    5.4592   -1.0119    0.0000 H   0  0  0

+    4.9742    3.1754    0.0000 H   0  0  0

+    6.4132    1.2220    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

+  7 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 18 21  2  0

+ 18 22  1  0

+ 19 23  2  0

+  8 12  2  0

+  9 15  1  0

+ 10 13  2  0

+ 14 17  2  0

+ 20 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+532-28-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.1492   -0.0908    0.3108 C   0  0  0

+   -1.3047   -0.2482    0.6745 C   0  0  0

+    0.9153    0.8800    0.9290 C   0  0  0

+    0.7183   -0.9207   -0.6367 C   0  0  0

+   -2.1245    0.6063   -0.2000 C   0  0  0

+   -1.6927   -1.6132    0.5062 O   0  0  0

+    2.2488    1.0243    0.5955 C   0  0  0

+    2.0522   -0.7763   -0.9704 C   0  0  0

+   -2.7571    1.2657   -0.8749 N   0  0  0

+    2.8166    0.1980   -0.3565 C   0  0  0

+   -0.9872    0.6239    0.0000 H   0  0  0

+    0.4661    1.6922    0.0000 H   0  0  0

+    0.3306   -1.7640    0.0000 H   0  0  0

+   -1.9465   -2.5060    0.0000 H   0  0  0

+    2.6361    1.8678    0.0000 H   0  0  0

+    2.5026   -1.5878    0.0000 H   0  0  0

+    3.7443    0.1687    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  3  0

+  7 10  1  0

+  8 10  2  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14191-22-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.4944   -0.5870   -0.0007 C   0  0  0

+   -1.9655   -0.4874   -0.0006 C   0  0  0

+   -0.0066    0.7281    0.0003 C   0  0  0

+    0.3939   -1.6600    0.0034 C   0  0  0

+   -2.2716    0.8814    0.0005 C   0  0  0

+   -2.9902   -1.4310   -0.0014 C   0  0  0

+   -1.0857    1.5938    0.0010 N   0  0  0

+    1.3681    0.9453    0.0004 C   0  0  0

+    1.7518   -1.4249    0.0019 C   0  0  0

+   -3.6045    1.2818    0.0004 C   0  0  0

+   -4.3040   -1.0150   -0.0010 C   0  0  0

+    2.2356   -0.1255   -0.0004 C   0  0  0

+   -4.6084    0.3378   -0.0007 C   0  0  0

+    3.6964    0.1136   -0.0008 N   0  3  0

+    4.4678   -0.8290   -0.0015 O   0  0  0

+    4.1271    1.2529   -0.0003 O   0  5  0

+    0.0335   -2.6355    0.0000 H   0  0  0

+   -2.7645   -2.4461    0.0000 H   0  0  0

+   -1.0155    2.6314    0.0000 H   0  0  0

+    1.7409    1.9161    0.0000 H   0  0  0

+    2.4161   -2.2250    0.0000 H   0  0  0

+   -3.8430    2.2940    0.0000 H   0  0  0

+   -5.0700   -1.7183    0.0000 H   0  0  0

+   -5.6027    0.6425    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+ 10 13  2  0

+ 12 14  1  0

+ 14 15  2  0

+ 14 16  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122547-49-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -1.6313    1.0882    0.5912 N   0  0  0

+   -2.4057   -0.0480    1.1234 C   0  0  1

+   -0.3858    0.7456    0.0710 C   0  0  0

+   -2.6454    1.3706   -0.2581 C   0  0  0

+   -3.4722    0.1520    0.0524 C   0  0  2

+   -1.3185   -1.4560    0.6912 S   0  0  0

+    0.0006   -0.5703   -0.0007 C   0  0  0

+    0.4742    1.7444   -0.3792 C   0  0  0

+   -2.8280    2.2985   -1.0178 O   0  0  0

+   -4.8678    0.4579    0.5997 C   0  0  1

+    1.2874   -1.1221   -0.5582 C   0  0  1

+    1.7234    1.4316   -0.7678 O   0  0  0

+    0.0554    3.0220   -0.4254 O   0  0  0

+   -5.8442    0.6368   -0.5645 C   0  0  0

+   -5.3036   -0.6244    1.4249 O   0  0  0

+    2.0387   -1.8894    0.5470 C   0  0  0

+    0.9920   -2.0615   -1.6053 O   0  0  0

+    2.1748   -3.3260   -0.0138 C   0  0  0

+    1.9940   -3.0986   -1.5363 C   0  0  0

+   12.9224    1.1477    0.7566 Na  0  3  0

+   -2.9218   -0.8911    0.0000 H   0  0  0

+   -3.6691   -0.8167    0.0000 H   0  0  0

+   -4.6729    1.4270    0.0000 H   0  0  0

+    1.8460   -0.3065    0.0000 H   0  0  0

+   -5.6660    1.6091    0.0000 H   0  0  0

+   -6.8165    0.8150    0.0000 H   0  0  0

+   -6.0224   -0.3355    0.0000 H   0  0  0

+   -5.6728   -1.5414    0.0000 H   0  0  0

+    3.0071   -2.0881    0.0000 H   0  0  0

+    2.5119   -1.0215    0.0000 H   0  0  0

+    1.6431   -4.1594    0.0000 H   0  0  0

+    3.1358   -3.5578    0.0000 H   0  0  0

+    2.9665   -2.9213    0.0000 H   0  0  0

+    2.2967   -2.1575    0.0000 H   0  0  0

+   -0.2525    3.9613    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+ 11  7  1  0

+  8 12  2  0

+  8 13  1  0

+ 10 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+  4  5  1  0

+  6  7  1  0

+ 18 19  1  0

+  2 21  1  0

+  5 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 13 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99-30-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.3724   -0.0001    0.0038 C   0  0  0

+   -0.6829   -1.1984    0.0031 C   0  0  0

+   -0.6826    1.1986    0.0027 C   0  0  0

+   -2.8527   -0.0001   -0.0003 N   0  3  0

+    0.6996   -1.2024    0.0012 C   0  0  0

+    0.6994    1.2025    0.0009 C   0  0  0

+   -3.4617    1.0547    0.0004 O   0  0  0

+   -3.4617   -1.0549   -0.0044 O   0  5  0

+    1.3960   -0.0001    0.0001 C   0  0  0

+    1.5644   -2.7076   -0.0004 Cl  0  0  0

+    1.5642    2.7078   -0.0011 Cl  0  0  0

+    2.7942   -0.0001   -0.0014 N   0  0  0

+   -1.2047   -2.0976    0.0000 H   0  0  0

+   -1.2043    2.0979    0.0000 H   0  0  0

+    3.3140   -0.9005    0.0000 H   0  0  0

+    3.3140    0.9003    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  9 12  1  0

+  6  9  1  0

+  2 13  1  0

+  3 14  1  0

+ 12 15  1  0

+ 12 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80-46-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    1.7051   -0.2827    0.0000 C   0  0  0

+    0.2051   -0.1374   -0.0008 C   0  0  0

+    2.3517    1.1040   -0.0026 C   0  0  0

+    2.1428   -1.0472    1.2509 C   0  0  0

+    2.1436   -1.0522   -1.2476 C   0  0  0

+   -0.5972   -1.2633    0.0012 C   0  0  0

+   -0.3665    1.1218    0.0022 C   0  0  0

+    3.8746    0.9565   -0.0018 C   0  0  0

+   -1.9727   -1.1328    0.0009 C   0  0  0

+   -1.7410    1.2576    0.0019 C   0  0  0

+   -2.5484    0.1292   -0.0014 C   0  0  0

+   -3.9011    0.2601   -0.0021 O   0  0  0

+    2.5677    2.1183    0.0000 H   0  0  0

+    1.3683    1.4332    0.0000 H   0  0  0

+    1.2428   -1.5625    0.0000 H   0  0  0

+    2.6581   -1.9472    0.0000 H   0  0  0

+    3.0428   -0.5319    0.0000 H   0  0  0

+    1.2426   -1.5656    0.0000 H   0  0  0

+    2.6570   -1.9532    0.0000 H   0  0  0

+    3.0446   -0.5388    0.0000 H   0  0  0

+   -0.1663   -2.2065    0.0000 H   0  0  0

+    0.2374    1.9649    0.0000 H   0  0  0

+    3.7746   -0.0757    0.0000 H   0  0  0

+    4.9068    0.8565    0.0000 H   0  0  0

+    3.9746    1.9887    0.0000 H   0  0  0

+   -2.5741   -1.9776    0.0000 H   0  0  0

+   -2.1692    2.2021    0.0000 H   0  0  0

+   -4.9333    0.3600    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  6  9  1  0

+  7 10  2  0

+  9 11  2  0

+ 11 12  1  0

+ 10 11  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-70-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.6097   -0.2950   -0.4122 C   0  0  1

+   -0.5612    0.3448    0.3364 C   0  0  1

+    1.9278    0.2519    0.1396 C   0  0  1

+    0.5708   -1.7125   -0.2350 O   0  0  0

+   -1.8714   -0.0035   -0.3728 C   0  0  2

+   -0.5982   -0.1513    1.6760 O   0  0  0

+    3.0987   -0.3880   -0.6090 C   0  0  0

+    1.9667    1.6693   -0.0376 O   0  0  0

+   -2.9464    1.0146    0.0129 C   0  0  0

+   -2.2919   -1.3118    0.0191 O   0  0  0

+    4.3297    0.1228   -0.0936 O   0  0  0

+   -4.1701    0.6892   -0.6495 O   0  0  0

+    0.6640    0.7203    0.0000 H   0  0  0

+   -0.4393    1.3543    0.0000 H   0  0  0

+    1.8735   -0.7634    0.0000 H   0  0  0

+    0.5429   -2.7289    0.0000 H   0  0  0

+   -1.1711   -0.7406    0.0000 H   0  0  0

+   -0.6738   -1.1653    0.0000 H   0  0  0

+    2.4237   -1.1484    0.0000 H   0  0  0

+    3.6887   -1.2161    0.0000 H   0  0  0

+    1.9946    2.6857    0.0000 H   0  0  0

+   -2.1238    1.6123    0.0000 H   0  0  0

+   -3.3833    1.9327    0.0000 H   0  0  0

+   -2.6030   -2.2798    0.0000 H   0  0  0

+    5.2688    0.5125    0.0000 H   0  0  0

+   -5.1527    0.4279    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+  1 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-44-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.0239   -1.0109    0.0000 C   0  0  0

+   -1.2300   -0.3378    0.0002 C   0  0  0

+    1.1677   -0.2974   -0.0002 C   0  0  0

+   -1.2521    1.0446    0.0001 C   0  0  0

+   -2.5235   -1.1112   -0.0001 C   0  0  0

+    1.1420    1.0917   -0.0002 C   0  0  0

+    2.3892   -0.9748    0.0002 N   0  0  0

+   -0.0673    1.7582    0.0000 C   0  0  0

+   -0.0081   -2.0503    0.0000 H   0  0  0

+   -2.1612    1.5487    0.0000 H   0  0  0

+   -3.0569   -0.2190    0.0000 H   0  0  0

+   -3.4157   -1.6446    0.0000 H   0  0  0

+   -1.9901   -2.0034    0.0000 H   0  0  0

+    2.0321    1.6286    0.0000 H   0  0  0

+    2.4071   -2.0141    0.0000 H   0  0  0

+    3.2803   -0.4396    0.0000 H   0  0  0

+   -0.0872    2.7975    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

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+  1  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2257-09-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    1.6128   -0.2253    0.3871 C   0  0  0

+    0.2463   -0.6799    0.8310 C   0  0  0

+    1.9527    1.1126    0.4575 C   0  0  0

+    2.5284   -1.1472   -0.0852 C   0  0  0

+   -0.7167   -0.6361   -0.3572 C   0  0  0

+    3.2063    1.5296    0.0502 C   0  0  0

+    3.7817   -0.7303   -0.4923 C   0  0  0

+   -2.0451   -1.0780    0.0743 N   0  0  0

+    4.1197    0.6088   -0.4273 C   0  0  0

+   -3.0242   -0.3079   -0.0292 C   0  0  0

+   -4.2411    0.6493   -0.1578 S   0  0  0

+   -0.1819   -1.5735    0.0000 H   0  0  0

+    0.9016   -1.4232    0.0000 H   0  0  0

+    1.2272    1.7874    0.0000 H   0  0  0

+    2.2988   -2.1111    0.0000 H   0  0  0

+   -0.2885    0.2575    0.0000 H   0  0  0

+   -1.3719    0.1072    0.0000 H   0  0  0

+    3.4362    2.4934    0.0000 H   0  0  0

+    4.5077   -1.4046    0.0000 H   0  0  0

+    5.0754    0.8703    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

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+ 10 11  2  0

+  7  9  1  0

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+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-88-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.5227   -0.2737    0.0024 C   0  0  0

+   -0.7055   -1.4090    0.0014 C   0  0  0

+   -0.9410    0.9988    0.0023 C   0  0  0

+   -2.9866   -0.4170   -0.0026 C   0  0  0

+    0.6655   -1.2670    0.0003 C   0  0  0

+    0.4311    1.1254    0.0013 C   0  0  0

+   -3.6924    0.5691   -0.0017 O   0  0  0

+    1.2345   -0.0038    0.0003 C   0  0  0

+    2.9623    0.1654   -0.0011 Cl  0  0  0

+   -1.1311   -2.3573    0.0000 H   0  0  0

+   -1.5424    1.8465    0.0000 H   0  0  0

+   -3.4161   -1.3635    0.0000 H   0  0  0

+    1.2740   -2.1097    0.0000 H   0  0  0

+    0.8646    2.0701    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  8  9  1  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+344-07-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -1.6756   -0.0002    0.0015 C   0  0  0

+   -0.9826   -1.1999    0.0010 C   0  0  0

+   -0.9825    1.2000    0.0012 C   0  0  0

+   -3.0266   -0.0002   -0.0035 F   0  0  0

+    0.4034   -1.1995    0.0003 C   0  0  0

+   -1.6578   -2.3701    0.0008 F   0  0  0

+    0.4031    1.1996    0.0005 C   0  0  0

+   -1.6578    2.3701    0.0012 F   0  0  0

+    1.0956   -0.0001    0.0001 C   0  0  0

+    1.0792   -2.3693    0.0003 F   0  0  0

+    1.0788    2.3695   -0.0002 F   0  0  0

+    2.8316    0.0000   -0.0008 Cl  0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

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+  5  9  2  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+  7  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+27730-03-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -2.6771   -1.2033   -0.2924 C   0  0  0

+   -3.2882   -2.2425   -0.1619 O   0  0  0

+   -1.1978   -1.2299   -0.5785 C   0  0  0

+   -3.3814    0.0838   -0.1774 C   0  0  0

+   -0.4230   -1.2222    0.7407 C   0  0  0

+   -0.6259   -2.4145   -0.0204 O   0  0  0

+   -4.7551    0.1125    0.0823 C   0  0  0

+   -2.6790    1.2847   -0.3216 C   0  0  0

+    0.9719   -0.7046    0.5011 C   0  0  0

+   -5.4077    1.3227    0.1891 C   0  0  0

+   -3.3458    2.4864   -0.2120 C   0  0  0

+    1.2345    0.6483    0.6061 C   0  0  0

+    1.9901   -1.5837    0.1816 C   0  0  0

+   -4.7068    2.5065    0.0400 C   0  0  0

+    2.5142    1.1232    0.3862 C   0  0  0

+    3.2694   -1.1089   -0.0382 C   0  0  0

+    3.5309    0.2450    0.0612 C   0  0  0

+    4.9009    0.7535   -0.1742 N   0  3  0

+    5.7968   -0.0204   -0.4605 O   0  0  0

+    5.1323    1.9457   -0.0816 O   0  5  0

+   -1.1937   -0.2028    0.0000 H   0  0  0

+   -0.6095   -0.2122    0.0000 H   0  0  0

+   -5.2907   -0.7639    0.0000 H   0  0  0

+   -1.6519    1.2731    0.0000 H   0  0  0

+   -6.4346    1.3433    0.0000 H   0  0  0

+   -2.8182    3.3676    0.0000 H   0  0  0

+    0.4513    1.3128    0.0000 H   0  0  0

+    1.8078   -2.5945    0.0000 H   0  0  0

+   -5.2089    3.4025    0.0000 H   0  0  0

+    2.6966    2.1340    0.0000 H   0  0  0

+    4.0529   -1.7730    0.0000 H   0  0  0

+  2  1  2  0

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+  5  6  1  0

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+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+127128-50-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 35                          1 V2000

+   -1.6892   -0.2624    0.0677 C   0  0  0

+   -2.8631    0.2690   -0.3449 O   0  0  0

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+   -7.6415   -0.4163   -0.1301 O   0  0  0

+    4.2629    0.4109   -0.0798 C   0  0  0

+    5.5315   -0.1634    0.3661 C   0  0  0

+    6.6835    0.4237    0.0337 C   0  0  0

+    7.9909   -0.1682    0.4933 C   0  0  0

+    8.8432   -0.5298   -0.7248 C   0  0  0

+   -1.6660   -1.2638    0.0000 H   0  0  0

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+   -4.4238   -1.4271    0.0000 H   0  0  0

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+   -5.6166   -1.5883    0.0000 H   0  0  0

+   -5.5524    2.2908    0.0000 H   0  0  0

+    3.1168   -1.1865    0.0000 H   0  0  0

+   -8.5708   -0.0423    0.0000 H   0  0  0

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+    8.1052   -1.1634    0.0000 H   0  0  0

+    8.4520   -1.4519    0.0000 H   0  0  0

+    9.7653   -0.9210    0.0000 H   0  0  0

+    9.2344    0.3923    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 16 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102-07-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    2.3729    0.5090   -0.0997 C   0  0  0

+    1.1504    1.1800   -0.2154 N   0  0  0

+    2.6557   -0.5693   -0.9274 C   0  0  0

+    3.3083    0.9239    0.8394 C   0  0  0

+   -0.0061    0.4938   -0.1258 C   0  0  0

+    3.8636   -1.2293   -0.8110 C   0  0  0

+    4.5140    0.2599    0.9507 C   0  0  0

+   -1.1781    1.1137   -0.3682 N   0  0  0

+    0.0078   -0.6845    0.1738 O   0  0  0

+    4.7905   -0.8171    0.1284 C   0  0  0

+   -2.3848    0.4426   -0.1407 C   0  0  0

+   -3.5898    1.1254   -0.2385 C   0  0  0

+   -2.3799   -0.9093    0.1779 C   0  0  0

+   -4.7792    0.4600   -0.0138 C   0  0  0

+   -3.5724   -1.5688    0.4014 C   0  0  0

+   -4.7707   -0.8846    0.3083 C   0  0  0

+    1.1334    2.1938    0.0000 H   0  0  0

+    1.8569   -1.1938    0.0000 H   0  0  0

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+   -1.5056   -1.4227    0.0000 H   0  0  0

+   -5.6555    0.9701    0.0000 H   0  0  0

+   -3.5793   -2.5827    0.0000 H   0  0  0

+   -5.6460   -1.3964    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+809-73-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 74 75                          1 V2000

+   -4.0961    1.1751    0.0042 C   0  0  0

+   -4.5948   -0.2006    0.0019 C   0  0  0

+   -2.7666    1.4113    0.0039 C   0  0  0

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+   -3.6527   -1.3204   -0.0006 C   0  0  0

+   -5.7953   -0.4140    0.0026 O   0  0  0

+   -1.8245    0.2916    0.0013 C   0  0  0

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+   -5.6218    2.5229   -1.4117 C   0  0  0

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+   -2.3231   -1.0841   -0.0009 C   0  0  0

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+ 32 73  1  0

+ 32 74  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101901-08-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

+    2.2714    0.1276   -0.4092 C   0  0  0

+    0.8093    0.4426   -0.2064 C   0  0  0

+    2.9977    1.3549   -0.5116 O   0  0  0

+    2.7923   -0.6786    0.7823 C   0  0  0

+    2.4479   -0.6815   -1.6957 C   0  0  0

+    0.3871    1.6495    0.2432 C   0  0  0

+   -0.2679   -0.3690   -0.4226 N   0  0  0

+    2.7516    2.1268    0.6631 C   0  0  0

+    1.9743   -1.9350    0.9349 C   0  0  0

+    3.7445   -0.2595   -2.3897 C   0  0  0

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+   -1.4198    0.3014   -0.1196 C   0  0  0

+    2.1523   -2.7260    2.0046 O   0  0  0

+    1.1582   -2.2304    0.0942 O   0  0  0

+   -2.0201    2.5385    0.6950 C   0  0  0

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+   -3.3314    2.1375    0.6334 C   0  0  0

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+   -3.2294   -2.3931    0.5810 C   0  0  0

+   -4.4611   -1.3861   -1.2381 O   0  0  0

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+   -2.1774   -1.6305    0.0000 H   0  0  0

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+   -3.2910   -3.4015    0.0000 H   0  0  0

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+   -5.4700   -1.3334    0.0000 H   0  0  0

+  1  2  1  0

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+ 21 40  1  0

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+ 21 42  1  0

+ 22 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+132742-01-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.5556   -0.0079   -0.0643 C   0  0  0

+   -0.7415    0.5340   -0.0139 C   0  0  0

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+   -2.2163    2.4544    0.0703 C   0  0  0

+    3.1213   -1.0822   -0.1652 C   0  0  0

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+   -3.3039    1.6043    0.0844 C   0  0  0

+   -4.3341   -0.6485    0.0660 N   0  3  0

+    4.4923   -1.6370   -0.2190 C   0  0  0

+    5.3132    0.5312    0.6132 C   0  0  0

+   -5.2693   -0.4226   -0.6808 O   0  0  0

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+    2.2852    2.9489    0.0000 H   0  0  0

+    2.1627   -2.9754    0.0000 H   0  0  0

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+   -4.2711    2.0085    0.0000 H   0  0  0

+    4.6230   -2.6771    0.0000 H   0  0  0

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+    5.6253    1.5319    0.0000 H   0  0  0

+    6.4859   -1.2856    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120812-50-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 44                          1 V2000

+   -0.3162    0.6430    0.0016 C   0  0  0

+    0.2858   -0.6309   -0.0076 C   0  0  0

+    0.4949    1.7904    0.0116 C   0  0  0

+   -1.7229    0.7789    0.0068 C   0  0  0

+    1.7060   -0.7511   -0.0049 C   0  0  0

+   -0.5341   -1.7633   -0.0189 C   0  0  0

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+   -2.5083   -0.3764    0.0010 C   0  0  0

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+   -1.9084   -1.6212   -0.0201 C   0  0  0

+    0.0703   -3.1149   -0.0301 N   0  3  0

+    2.6907    2.7985    0.0214 C   0  0  0

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+    3.7347   -2.1481   -0.4272 C   0  0  0

+    0.3285   -3.6578   -1.0894 O   0  0  0

+    0.3093   -3.6838    1.0200 O   0  5  0

+    2.0979    4.0468    0.0323 C   0  0  0

+   -4.6437   -0.9547    0.7655 O   0  0  0

+   -4.5406    0.5109   -0.7484 O   0  5  0

+    4.4783   -1.0998    0.4099 C   0  0  0

+   -3.3416    2.1785    0.0000 H   0  0  0

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+    5.3776   -0.5554    0.0000 H   0  0  0

+  1  2  2  0

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+ 20 36  1  0

+ 20 37  1  0

+ 23 38  1  0

+ 26 39  1  0

+ 26 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+699-18-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    1.2552    0.2681   -0.0013 C   0  0  0

+   -0.1800    0.5896   -0.0001 C   0  0  0

+    2.2767    1.1693   -0.0003 C   0  0  0

+    1.7888   -0.9692    0.0024 O   0  0  0

+   -1.0806   -0.3889   -0.0013 C   0  0  0

+    3.4729    0.4260   -0.0015 C   0  0  0

+    3.1287   -0.8773    0.0004 C   0  0  0

+   -2.5248   -0.0654   -0.0001 N   0  3  0

+   -2.8885    1.0971    0.0019 O   0  0  0

+   -3.3497   -0.9616   -0.0012 O   0  5  0

+   -0.4818    1.5543    0.0000 H   0  0  0

+    2.1924    2.1766    0.0000 H   0  0  0

+   -0.7788   -1.3536    0.0000 H   0  0  0

+    4.4122    0.7993    0.0000 H   0  0  0

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+  1  2  1  0

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+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+523-47-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+    1.4215    1.4402   -0.5961 C   0  0  0

+    0.6351    2.7153   -0.9070 C   0  0  0

+    2.9210    1.7367   -0.6629 C   0  0  0

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+    2.1463   -0.0088    1.3066 C   0  0  0

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+    0.7768   -0.3097    0.0000 H   0  0  0

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+   -2.0947    2.0102    0.0000 H   0  0  0

+    2.9860   -1.9537    0.0000 H   0  0  0

+   -2.1436   -2.6039    0.0000 H   0  0  0

+   -0.6686   -2.5929    0.0000 H   0  0  0

+    0.0560   -3.0969    0.0000 H   0  0  0

+    1.2316   -4.1323    0.0000 H   0  0  0

+    2.2670   -2.9567    0.0000 H   0  0  0

+   -3.6280   -1.4270    0.0000 H   0  0  0

+   -3.4325    2.0464    0.0000 H   0  0  0

+   -4.9363    1.6074    0.0000 H   0  0  0

+   -4.4973    0.1036    0.0000 H   0  0  0

+  2  1  1  0

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+  9 10  2  0

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+ 13 34  1  0

+ 13 35  1  0

+ 14 36  1  0

+ 15 37  1  0

+ 15 38  1  0

+ 15 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3958-60-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.6958    0.2482   -1.1705 C   0  0  0

+   -2.0945    0.2609    0.2110 Br  0  0  0

+    0.6188    0.6577   -0.5581 C   0  0  0

+    1.4608   -0.2998   -0.0247 C   0  0  0

+    0.9852    1.9906   -0.5349 C   0  0  0

+    1.0712   -1.7275   -0.0550 N   0  3  0

+    2.6670    0.0758    0.5368 C   0  0  0

+    2.1909    2.3662    0.0268 C   0  0  0

+    0.9321   -2.3431    0.9867 O   0  0  0

+    0.8898   -2.2868   -1.1217 O   0  5  0

+    3.0308    1.4089    0.5651 C   0  0  0

+   -1.0936   -0.6214    0.0000 H   0  0  0

+   -0.0639   -0.4696    0.0000 H   0  0  0

+    0.2977    2.6553    0.0000 H   0  0  0

+    3.3551   -0.5883    0.0000 H   0  0  0

+    2.4500    3.2867    0.0000 H   0  0  0

+    3.9626    1.6240    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  4  1  0

+  8  5  2  0

+  9  6  2  0

+ 10  6  1  0

+ 11  7  2  0

+  8 11  1  0

+  1 12  1  0

+  1 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18172-67-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.0185   -0.6094    0.8600 C   0  0  1

+    1.0850   -0.3517   -0.2216 C   0  0  0

+    0.4165    0.7737    1.4253 C   0  0  0

+   -1.3584   -0.4460    0.2230 C   0  0  0

+    0.8016    1.1458   -0.0150 C   0  0  2

+    2.4959   -0.7733    0.1935 C   0  0  0

+    0.6916   -0.8662   -1.6077 C   0  0  0

+   -1.6945    0.9762   -0.2018 C   0  0  0

+   -2.1842   -1.4490    0.0550 C   0  0  0

+   -0.4246    1.5725   -0.8264 C   0  0  0

+    0.0803   -1.6475    0.0000 H   0  0  0

+   -0.0064    1.7238    0.0000 H   0  0  0

+   -0.6209    0.7017    0.0000 H   0  0  0

+    1.5892    1.8248    0.0000 H   0  0  0

+    2.1982   -1.7697    0.0000 H   0  0  0

+    3.4923   -1.0710    0.0000 H   0  0  0

+    2.7936    0.2231    0.0000 H   0  0  0

+   -0.1345   -0.2345    0.0000 H   0  0  0

+    0.0599   -1.6923    0.0000 H   0  0  0

+    1.5177   -1.4979    0.0000 H   0  0  0

+   -2.0706    1.9457    0.0000 H   0  0  0

+   -2.6877    0.6678    0.0000 H   0  0  0

+   -3.2100   -1.2780    0.0000 H   0  0  0

+   -1.8194   -2.4228    0.0000 H   0  0  0

+    0.1630    2.4305    0.0000 H   0  0  0

+   -1.0982    2.3648    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

+  3  5  1  0

+  8 10  1  0

+  1 11  1  0

+  3 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75-21-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  7                          1 V2000

+    0.7650   -0.4826    0.0000 C   0  0  0

+   -0.7650   -0.4825    0.0000 C   0  0  0

+    0.0000    0.7244    0.0000 O   0  0  0

+    0.9656   -1.5354    0.0000 H   0  0  0

+    1.7617   -0.0885    0.0000 H   0  0  0

+   -1.7616   -0.0883    0.0000 H   0  0  0

+   -0.9657   -1.5353    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+32341-80-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 53 52                          1 V2000

+   -8.0546   -0.2068    0.0505 C   0  0  0

+   -8.9939    0.7681   -0.2577 C   0  0  0

+   -6.8473    0.1547    0.6287 C   0  0  0

+   -8.3205   -1.5145   -0.2091 O   0  0  0

+   -8.7236    2.0963    0.0124 C   0  0  0

+  -10.5068    0.3191   -0.9812 Cl  0  0  0

+   -6.5810    1.4839    0.8971 C   0  0  0

+   -7.1773   -2.2603    0.2139 C   0  0  0

+   -7.5178    2.4542    0.5896 C   0  0  0

+   -7.4089   -3.7262   -0.0478 C   0  0  0

+   -7.1802    4.1231    0.9280 Cl  0  0  0

+   -6.4626   -4.6228    0.2720 O   0  0  0

+   -8.4465   -4.0945   -0.5455 O   0  0  0

+   10.0300    0.2299    0.1987 N   0  0  0

+    8.6895    0.7759   -0.0519 C   0  0  0

+   10.9034    1.3738    0.4932 C   0  0  0

+    9.9397   -0.5610    1.4333 C   0  0  0

+    8.0393    0.0191   -1.2118 C   0  0  0

+   11.9175    1.5460   -0.6395 C   0  0  0

+   10.7923   -1.8237    1.2936 C   0  0  0

+    6.5844    0.4683   -1.3620 C   0  0  0

+    8.7505    0.2965   -2.4198 O   0  0  0

+   12.7061    2.8396   -0.4257 C   0  0  0

+   12.8169    0.4355   -0.6464 O   0  0  0

+   10.8391   -2.5585    2.6348 C   0  0  0

+   10.2191   -2.6782    0.3020 O   0  0  0

+   -6.0967   -0.5290    0.0000 H   0  0  0

+   -9.4724    2.7821    0.0000 H   0  0  0

+   -5.6066    1.7694    0.0000 H   0  0  0

+   -6.2065   -2.5576    0.0000 H   0  0  0

+   -6.7470   -1.3406    0.0000 H   0  0  0

+   -5.7256   -5.3211    0.0000 H   0  0  0

+    9.1713    1.6696    0.0000 H   0  0  0

+    7.8527    1.3510    0.0000 H   0  0  0

+   11.0101    2.3835    0.0000 H   0  0  0

+    9.9600    1.7492    0.0000 H   0  0  0

+    9.0051   -0.1643    0.0000 H   0  0  0

+    9.2941   -1.3446    0.0000 H   0  0  0

+    8.0761   -0.9956    0.0000 H   0  0  0

+   11.3478    2.3864    0.0000 H   0  0  0

+   11.7533   -1.4959    0.0000 H   0  0  0

+    6.8839    1.4384    0.0000 H   0  0  0

+    5.6143    0.7678    0.0000 H   0  0  0

+    6.2849   -0.5018    0.0000 H   0  0  0

+    9.6964    0.6655    0.0000 H   0  0  0

+   13.5730    2.3111    0.0000 H   0  0  0

+   13.2346    3.7065    0.0000 H   0  0  0

+   11.8392    3.3681    0.0000 H   0  0  0

+   13.4559   -0.3535    0.0000 H   0  0  0

+    9.8258   -2.6230    0.0000 H   0  0  0

+   10.9036   -3.5718    0.0000 H   0  0  0

+   11.8524   -2.4940    0.0000 H   0  0  0

+    9.6535   -3.5214    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

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+ 16 19  1  0

+ 17 20  1  0

+ 18 21  1  0

+ 18 22  1  0

+ 19 23  1  0

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+ 20 25  1  0

+ 20 26  1  0

+  7  9  2  0

+  3 27  1  0

+  5 28  1  0

+  7 29  1  0

+  8 30  1  0

+  8 31  1  0

+ 12 32  1  0

+ 15 33  1  0

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+ 23 48  1  0

+ 24 49  1  0

+ 25 50  1  0

+ 25 51  1  0

+ 25 52  1  0

+ 26 53  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1088-56-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -1.1228    0.7738    0.0030 C   0  0  0

+   -1.1462   -0.6982    0.0015 C   0  0  0

+    0.0151    1.4201    0.0030 N   0  0  0

+   -2.4274    1.4723   -0.0019 C   0  0  0

+    0.0344   -1.3784    0.0003 N   0  0  0

+   -2.3162   -1.3150    0.0011 N   0  0  0

+    1.1786    0.7563    0.0018 C   0  0  0

+   -3.5400    0.7021   -0.0073 N   0  0  0

+   -2.4967    2.6861   -0.0008 O   0  0  0

+    1.2091   -0.6566    0.0005 C   0  0  0

+    0.0551   -2.8432   -0.0006 C   0  0  0

+   -3.4607   -0.6361    0.0018 C   0  0  0

+    2.3933    1.4704    0.0019 C   0  0  0

+    2.4345   -1.3182   -0.0008 C   0  0  0

+   -4.5013   -1.2703    0.0013 O   0  0  0

+    3.5772    0.7977    0.0002 C   0  0  0

+    3.6051   -0.5933   -0.0016 C   0  0  0

+    4.8720    1.5687   -0.0002 C   0  0  0

+    4.9289   -1.3134   -0.0029 C   0  0  0

+   -4.4685    1.1541    0.0000 H   0  0  0

+   -0.9775   -2.8578    0.0000 H   0  0  0

+    0.0697   -3.8758    0.0000 H   0  0  0

+    1.0877   -2.8286    0.0000 H   0  0  0

+    2.3857    2.5030    0.0000 H   0  0  0

+    2.4652   -2.3504    0.0000 H   0  0  0

+    5.4003    0.6814    0.0000 H   0  0  0

+    5.7593    2.0970    0.0000 H   0  0  0

+    4.3437    2.4560    0.0000 H   0  0  0

+    4.4355   -2.2205    0.0000 H   0  0  0

+    5.8360   -1.8068    0.0000 H   0  0  0

+    5.4223   -0.4063    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  6 12  1  0

+  7 13  1  0

+ 10 14  1  0

+ 12 15  2  0

+ 13 16  2  0

+ 14 17  2  0

+ 16 18  1  0

+ 17 19  1  0

+  7 10  2  0

+  8 12  1  0

+ 16 17  1  0

+  8 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 13 24  1  0

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+ 18 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-03-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.0190    0.0039   -0.6947 C   0  0  0

+   -0.3443   -1.1939   -0.5522 C   0  0  0

+   -0.3427    1.2004   -0.5444 C   0  0  0

+   -2.4905    0.0058   -1.0200 C   0  0  0

+    1.0069   -1.1956   -0.2595 C   0  0  0

+    1.0080    1.1987   -0.2518 C   0  0  0

+   -3.2876   -0.0014    0.2589 C   0  0  0

+    1.6830    0.0005   -0.1093 C   0  0  0

+   -4.6292   -0.0011    0.2136 O   0  0  0

+   -2.7192   -0.0073    1.3251 O   0  0  0

+    3.1297   -0.0013    0.2036 N   0  3  0

+    3.7255    1.0527    0.3360 O   0  0  0

+    3.7244   -1.0569    0.3288 O   0  5  0

+   -0.8562   -2.0685    0.0000 H   0  0  0

+   -0.8529    2.0760    0.0000 H   0  0  0

+   -1.9857    0.8845    0.0000 H   0  0  0

+   -3.0021    0.8806    0.0000 H   0  0  0

+    1.5170   -2.0712    0.0000 H   0  0  0

+    1.5199    2.0733    0.0000 H   0  0  0

+   -5.6426   -0.0009    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  6  8  1  0

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+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  6 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63017-87-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -1.0452    0.4370   -0.0328 C   0  0  0

+   -1.4872   -0.9068    0.0524 C   0  0  0

+    0.3335    0.7095   -0.0457 C   0  0  0

+   -1.9941    1.4717   -0.0970 C   0  0  0

+   -0.5381   -1.9410    0.1220 C   0  0  0

+   -2.8659   -1.1790    0.0663 C   0  0  0

+    1.2235   -0.3177    0.0236 C   0  0  0

+    0.8237    2.1316   -0.1364 C   0  0  0

+   -3.3211    1.1706   -0.0765 C   0  0  0

+    0.7889   -1.6394    0.1065 C   0  0  0

+   -3.7558   -0.1516   -0.0022 C   0  0  0

+    2.6748   -0.0271    0.0093 N   0  3  0

+    3.3501   -0.3455   -0.9530 O   0  0  0

+    3.1936    0.5305    0.9597 O   0  5  0

+   -1.6829    2.4681    0.0000 H   0  0  0

+   -0.8490   -2.9375    0.0000 H   0  0  0

+   -3.2052   -2.1662    0.0000 H   0  0  0

+    1.8106    1.7914    0.0000 H   0  0  0

+    1.1639    3.1185    0.0000 H   0  0  0

+   -0.1632    2.4718    0.0000 H   0  0  0

+   -4.0235    1.9428    0.0000 H   0  0  0

+    1.4915   -2.4115    0.0000 H   0  0  0

+   -4.7793   -0.3570    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  4 15  1  0

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+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-47-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.4783   -0.0001    0.0032 C   0  0  0

+    0.2229   -1.2073    0.0018 C   0  0  0

+    0.2232    1.2075    0.0018 C   0  0  0

+   -1.9103    0.0000    0.0000 C   0  0  0

+    1.6026   -1.2000   -0.0009 C   0  0  0

+    1.6024    1.2001   -0.0009 C   0  0  0

+   -3.0463    0.0000   -0.0025 N   0  0  0

+    2.2911   -0.0002   -0.0022 C   0  0  0

+   -0.2924   -2.1080    0.0000 H   0  0  0

+   -0.2920    2.1082    0.0000 H   0  0  0

+    2.1250   -2.0966    0.0000 H   0  0  0

+    2.1249    2.0967    0.0000 H   0  0  0

+    3.3288   -0.0002    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  6  2  0

+  4  7  3  0

+  5  8  2  0

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+  2  9  1  0

+  3 10  1  0

+  5 11  1  0

+  6 12  1  0

+  8 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+26541-56-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -1.0427   -0.2753    0.2466 C   0  0  0

+   -2.4328   -0.3723    0.3203 N   0  0  0

+   -0.4363    0.1250   -0.9393 C   0  0  0

+   -0.2659   -0.5734    1.3606 C   0  0  0

+   -3.0880    0.5686    0.7312 O   0  0  0

+   -3.0504   -1.5073   -0.0632 C   0  0  0

+    0.9364    0.2218   -1.0139 C   0  0  0

+    1.1075   -0.4777    1.2899 C   0  0  0

+   -3.4079    1.5731   -0.0945 C   0  0  0

+   -3.8456   -2.3072    0.9362 C   0  0  0

+   -2.9662   -1.8850   -1.2134 O   0  0  0

+    1.7174   -0.0818    0.1006 C   0  0  0

+   -4.2186    2.7373    0.4139 C   0  0  0

+   -3.0453    1.5460   -1.2511 O   0  0  0

+    3.1951    0.0213    0.0223 C   0  0  0

+    3.9183    0.5343    1.0973 C   0  0  0

+    3.8659   -0.3999   -1.1247 C   0  0  0

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+   -0.6902    0.8738    0.0000 H   0  0  0

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+    5.5107   -1.0452    0.0000 H   0  0  0

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+ 18 20  2  0

+  8 12  2  0

+ 19 20  1  0

+  3 21  1  0

+  4 22  1  0

+  7 23  1  0

+  8 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+130933-92-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 38                          1 V2000

+    0.3418    0.2239   -0.0917 C   0  0  0

+   -0.2244   -1.0821   -0.0701 C   0  0  0

+    1.8053    0.3484   -0.1448 C   0  0  0

+   -0.4455    1.3816   -0.0584 C   0  0  0

+   -1.6305   -1.2261   -0.0165 C   0  0  0

+    0.6152   -2.2025   -0.1017 C   0  0  0

+    2.5684   -0.8060   -0.1717 C   0  0  0

+    2.4164    1.6826   -0.1683 C   0  0  0

+   -1.8359    1.2506   -0.0012 C   0  0  0

+   -2.3640   -0.0447    0.0094 C   0  0  0

+   -2.6038   -2.3095    0.0227 C   0  0  0

+    1.9683   -2.0586   -0.1504 C   0  0  0

+    4.0762   -0.6964   -0.2243 C   0  0  0

+    3.7213    1.8866   -0.2145 C   0  0  0

+   -2.7575    2.3153    0.0366 C   0  0  0

+   -3.7826   -0.3386    0.0630 C   0  0  0

+   -3.8660   -1.7962    0.0692 C   0  0  0

+    4.6792    0.7189   -0.2465 C   0  0  0

+    4.5393   -0.0388    0.9570 O   0  0  0

+   -4.0966    2.0455    0.0915 C   0  0  0

+   -4.6327    0.7589    0.0928 C   0  0  0

+    0.0014    2.3313    0.0000 H   0  0  0

+    0.1960   -3.1647    0.0000 H   0  0  0

+    1.7827    2.5193    0.0000 H   0  0  0

+   -2.3683   -3.3323    0.0000 H   0  0  0

+    2.5738   -2.9159    0.0000 H   0  0  0

+    4.5931   -1.6099    0.0000 H   0  0  0

+    4.0953    2.8673    0.0000 H   0  0  0

+   -2.4181    3.3085    0.0000 H   0  0  0

+   -4.7532   -2.3570    0.0000 H   0  0  0

+    5.6956    0.9808    0.0000 H   0  0  0

+   -4.7626    2.8567    0.0000 H   0  0  0

+   -5.6731    0.6206    0.0000 H   0  0  0

+  1  2  2  0

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+  1  4  1  0

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+  3  7  2  0

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+  5 10  2  0

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+  6 12  2  0

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+  9 15  1  0

+ 10 16  1  0

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+ 13 18  1  0

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+ 15 20  2  0

+ 16 21  2  0

+  7 12  1  0

+  9 10  1  0

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+ 14 28  1  0

+ 15 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80-82-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.1656   -0.7097   -0.0027 C   0  0  0

+   -1.1809    0.2281   -0.0117 C   0  0  0

+    1.5169   -0.1866    0.0058 S   0  0  0

+   -0.4703   -2.0582    0.0055 C   0  0  0

+   -0.8547    1.6719   -0.0142 N   0  3  0

+   -2.5011   -0.1824   -0.0189 C   0  0  0

+    2.3801   -1.4324    0.1443 O   0  0  0

+    1.7714    0.3164   -1.2986 O   0  0  0

+    1.6895    0.5391    1.2153 O   0  0  0

+   -1.7901   -2.4686    0.0045 C   0  0  0

+   -1.7440    2.4973    0.0926 O   0  0  0

+    0.3029    2.0346   -0.1231 O   0  5  0

+   -2.8056   -1.5305   -0.0166 C   0  0  0

+    0.2912   -2.7616    0.0000 H   0  0  0

+   -3.2626    0.5210    0.0000 H   0  0  0

+    2.9705   -2.2845    0.0000 H   0  0  0

+   -2.0185   -3.4797    0.0000 H   0  0  0

+   -3.7955   -1.8382    0.0000 H   0  0  0

+  1  2  2  0

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+ 10 13  1  0

+  4 14  1  0

+  6 15  1  0

+  7 16  1  0

+ 10 17  1  0

+ 13 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21919-05-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.3230   -0.7272   -0.0945 C   0  0  0

+    2.5233   -1.4408   -0.1369 N   0  0  0

+    1.3406    0.6625   -0.0842 C   0  0  0

+    0.1136   -1.4053   -0.0684 C   0  0  0

+    2.5641   -2.2707    1.0746 C   0  0  0

+    2.1667   -2.8585   -0.2810 C   0  0  0

+    0.1555    1.3731   -0.0417 C   0  0  0

+    2.6325    1.3841   -0.1183 N   0  3  0

+   -1.0817   -0.6882   -0.0260 C   0  0  0

+   -1.0528    0.7076   -0.0098 C   0  0  0

+    2.6503    2.6020   -0.1093 O   0  0  0

+    3.6779    0.7601   -0.1553 O   0  5  0

+   -2.3754   -1.4037    0.0010 C   0  0  0

+   -2.3186    1.4735    0.0361 N   0  3  0

+   -3.0585   -1.5176    1.1572 N   0  0  0

+   -2.8229   -1.8892   -1.0196 O   0  0  0

+   -2.4055    2.4648    0.7384 O   0  0  0

+   -3.2733    1.1125   -0.6285 O   0  5  0

+    0.0984   -2.4416    0.0000 H   0  0  0

+    3.2054   -3.0848    0.0000 H   0  0  0

+    3.5347   -1.9074    0.0000 H   0  0  0

+    1.1438   -3.0248    0.0000 H   0  0  0

+    2.7248   -3.7317    0.0000 H   0  0  0

+    0.1745    2.4093    0.0000 H   0  0  0

+   -3.7172   -0.7175    0.0000 H   0  0  0

+   -3.4220   -2.4881    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  7 10  2  0

+  8 11  2  0

+  8 12  1  0

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+ 14 18  1  0

+  5  6  1  0

+  9 10  1  0

+  4 19  1  0

+  5 20  1  0

+  5 21  1  0

+  6 22  1  0

+  6 23  1  0

+  7 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3234-02-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.4971    0.4274   -0.1132 C   0  0  0

+   -0.4990   -0.4271   -0.1122 C   0  0  0

+    0.2215    1.9060   -0.0203 C   0  0  0

+    2.2786   -0.1972   -0.2235 Br  0  0  0

+   -0.2230   -1.9060   -0.0233 C   0  0  0

+   -2.2805    0.1973   -0.2222 Br  0  0  0

+    0.7389    2.4104    1.2125 O   0  0  0

+   -0.7265   -2.4109    1.2151 O   0  0  0

+   -0.3934    2.8517    0.0000 H   0  0  0

+   -0.8259    1.4872    0.0000 H   0  0  0

+    0.4009   -2.8458    0.0000 H   0  0  0

+    0.8224   -1.4821    0.0000 H   0  0  0

+    1.5466    3.1978    0.0000 H   0  0  0

+   -1.5230   -3.2097    0.0000 H   0  0  0

+  1  2  2  0

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+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  7 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2980-32-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -1.0059    0.8559    0.2100 C   0  0  0

+   -1.0744   -0.5444    0.1339 C   0  0  0

+    0.1233    1.5295    0.4511 O   0  0  0

+   -2.1870    1.5792    0.0428 C   0  0  0

+    0.1856   -1.3073    0.2387 C   0  0  0

+   -2.2962   -1.2024   -0.0492 C   0  0  0

+    1.2757    0.9086    0.1757 C   0  0  0

+   -3.3902    0.9276   -0.1620 C   0  0  0

+    1.4027   -0.4830    0.0722 C   0  0  0

+    0.2196   -2.5075    0.4433 O   0  0  0

+   -3.4536   -0.4609   -0.2018 C   0  0  0

+   -2.3445   -2.5580   -0.0772 O   0  0  0

+    2.4240    1.6884   -0.0177 C   0  0  0

+   -4.5248    1.6540   -0.3261 O   0  0  0

+    2.6406   -1.0800   -0.1845 C   0  0  0

+    3.6409    1.0935   -0.2840 C   0  0  0

+    2.3387    3.0443    0.0582 O   0  0  0

+    3.7590   -0.2839   -0.3648 C   0  0  0

+    2.7455   -2.4318   -0.2561 O   0  0  0

+   -2.1596    2.6096    0.0000 H   0  0  0

+   -4.3690   -0.9348    0.0000 H   0  0  0

+   -2.3812   -3.5881    0.0000 H   0  0  0

+   -5.3929    2.2098    0.0000 H   0  0  0

+    4.4911    1.6762    0.0000 H   0  0  0

+    2.2740    4.0730    0.0000 H   0  0  0

+    4.6945   -0.7167    0.0000 H   0  0  0

+    2.8252   -3.4595    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  7  9  2  0

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+ 16 18  1  0

+  4 20  1  0

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+ 12 22  1  0

+ 14 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 19 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71400-33-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.3076    0.4013   -0.0064 C   0  0  0

+   -0.9826   -0.9516   -0.0048 C   0  0  0

+   -0.3215    1.3381   -0.0054 O   0  0  0

+   -2.6364    0.7917   -0.0031 C   0  0  0

+    0.3215   -1.3381   -0.0024 O   0  0  0

+   -1.9890   -1.9031   -0.0053 C   0  0  0

+    0.9826    0.9516   -0.0030 C   0  0  0

+   -3.6372   -0.1632    0.0017 C   0  0  0

+    1.3076   -0.4013   -0.0014 C   0  0  0

+   -3.3143   -1.5070   -0.0073 C   0  0  0

+    1.9890    1.9031   -0.0025 C   0  0  0

+   -5.0571    0.2551    0.0052 N   0  3  0

+    2.6364   -0.7917    0.0006 C   0  0  0

+    3.3143    1.5070   -0.0004 C   0  0  0

+   -5.9394   -0.5846    0.0095 O   0  0  0

+   -5.3432    1.4391    0.0039 O   0  5  0

+    3.6372    0.1632    0.0011 C   0  0  0

+    5.0571   -0.2551    0.0037 N   0  3  0

+    5.9394    0.5846    0.0041 O   0  0  0

+    5.3432   -1.4391    0.0055 O   0  5  0

+   -2.8811    1.7999    0.0000 H   0  0  0

+   -1.7490   -2.9124    0.0000 H   0  0  0

+   -4.0676   -2.2203    0.0000 H   0  0  0

+    1.7490    2.9124    0.0000 H   0  0  0

+    2.8811   -1.7999    0.0000 H   0  0  0

+    4.0676    2.2203    0.0000 H   0  0  0

+  1  2  2  0

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+  7  9  2  0

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+ 14 17  1  0

+  4 21  1  0

+  6 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121153-49-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    0.8904    1.0574    0.3453 C   0  0  1

+    1.8697   -0.1006    0.2667 C   0  0  2

+    1.4664    0.6339   -0.8915 O   0  0  0

+   -0.5726    0.6702    0.4909 C   0  0  2

+    1.2656   -1.4691    0.3329 C   0  0  0

+   -0.8959   -0.5632   -0.3471 C   0  0  1

+   -1.3976    1.7596    0.0729 O   0  0  0

+    0.0131   -1.6940    0.0512 C   0  0  0

+   -2.2554   -0.9450   -0.1278 O   0  0  0

+    1.0848    2.0811    0.0000 H   0  0  0

+    2.9107   -0.0556    0.0000 H   0  0  0

+   -1.5947    0.4674    0.0000 H   0  0  0

+    1.9097   -2.2882    0.0000 H   0  0  0

+    0.1231   -0.3456    0.0000 H   0  0  0

+   -2.0267    2.5903    0.0000 H   0  0  0

+   -0.3520   -2.6699    0.0000 H   0  0  0

+   -3.2586   -1.2267    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+103-23-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 67                          1 V2000

+    6.7476    0.3774   -0.2173 C   0  0  0

+    5.5260   -0.5436   -0.1960 C   0  0  0

+    8.0233   -0.4670   -0.1966 C   0  0  0

+    6.7211    1.2304   -1.4872 C   0  0  0

+    4.3153    0.2577   -0.2156 O   0  0  0

+    8.8325   -0.1377    1.0594 C   0  0  0

+    6.7580    2.7120   -1.1072 C   0  0  0

+    3.1140   -0.3410   -0.2020 C   0  0  0

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+    1.8574    0.4907   -0.2223 C   0  0  0

+    3.0401   -1.5466   -0.1734 O   0  0  0

+   10.9706   -0.5659    2.2791 C   0  0  0

+    0.6359   -0.4303   -0.2010 C   0  0  0

+   -0.6398    0.4140   -0.2217 C   0  0  0

+   -1.8614   -0.5070   -0.2004 C   0  0  0

+   -3.1180    0.3247   -0.2207 C   0  0  0

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+  -10.9486    0.7104    2.2688 C   0  0  0

+    7.7056    0.9115    0.0000 H   0  0  0

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+   -2.5663   -1.3472    0.0000 H   0  0  0

+   -1.1063   -1.3025    0.0000 H   0  0  0

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+  -11.2738    1.7579    0.0000 H   0  0  0

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+  -10.6234   -0.3371    0.0000 H   0  0  0

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+ 26 67  1  0

+ 26 68  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18699-02-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -1.2380   -0.2624   -0.5168 C   0  0  0

+   -0.4759   -1.0572    0.3192 C   0  0  0

+   -0.6965    0.8844   -1.0688 C   0  0  0

+   -2.6598   -0.6496   -0.8324 C   0  0  0

+    0.8295   -0.7080    0.6058 C   0  0  0

+    0.6078    1.2390   -0.7862 C   0  0  0

+   -3.5858   -0.0326    0.1840 C   0  0  0

+    1.3761    0.4426    0.0533 C   0  0  0

+   -4.9090   -0.2430    0.1013 O   0  0  0

+   -3.1372    0.6514    1.0732 O   0  0  0

+    2.6982    0.7989    0.3413 N   0  0  0

+    3.6969   -0.0773    0.1146 C   0  0  0

+    5.1030    0.2557    0.5422 C   0  0  0

+    3.4639   -1.1338   -0.4337 O   0  0  0

+   -0.7386   -1.9971    0.0000 H   0  0  0

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+   -3.3778   -1.3105    0.0000 H   0  0  0

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+ 11 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123447-62-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 56                          1 V2000

+   -2.4034   -0.1851   -0.3230 C   0  0  0

+   -3.3642   -1.1608   -0.0227 N   0  0  0

+   -2.7048    1.1776   -0.2171 C   0  0  0

+   -1.1341   -0.5790   -0.7255 C   0  0  0

+   -4.6015   -0.8203    0.3753 C   0  0  0

+   -3.5191   -2.6151    0.0170 C   0  0  0

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+   -0.1815    0.3839   -1.0232 C   0  0  0

+   -4.9817    0.5383    0.5056 C   0  0  0

+   -5.2205   -2.4608    0.5622 S   0  0  0

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+   -4.3660    2.7446    0.3253 O   0  0  0

+   -0.4913    1.7421   -0.9200 C   0  0  0

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+   -6.3368    0.8768    0.9408 C   0  0  0

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+ 30 51  1  0

+ 30 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57781-14-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 67                          1 V2000

+    3.2005    0.8801    0.5347 C   0  0  2

+    1.8033    0.5985   -0.0080 C   0  0  2

+    3.3091    2.4237    0.6067 C   0  0  0

+    4.2451    0.3262   -0.3998 C   0  0  0

+    3.3517    0.3029    1.8585 O   0  0  0

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+    1.1163   -0.6478    0.5162 C   0  0  0

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+   -0.2641   -0.7226   -0.1554 C   0  0  1

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+ 29 61  1  0

+ 29 62  1  0

+ 29 63  1  0

+ 31 64  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115314-17-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -0.3337    0.8408   -0.3787 C   0  0  0

+   -1.3142    0.2174    0.3707 C   0  0  0

+    1.1382    1.4161    0.4005 S   0  0  0

+   -0.5056    1.0076   -1.7399 C   0  0  0

+   -2.4689   -0.2338   -0.2405 C   0  0  0

+    1.8489    0.2027    0.9829 O   0  0  0

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+   -1.6581    0.5511   -2.3522 C   0  0  0

+   -2.6433   -0.0618   -1.6012 C   0  0  0

+   -3.5184   -0.9016    0.5617 N   0  3  0

+    2.2669   -0.6010   -0.1223 C   0  0  0

+   -4.5359   -1.2993    0.0231 O   0  0  0

+   -3.3645   -1.0535    1.7603 O   0  5  0

+    2.9922   -1.8441    0.3967 C   0  0  1

+    3.4398   -2.7046   -0.7866 C   0  0  0

+    4.3384   -1.8449   -0.0827 O   0  0  0

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+    1.8228   -1.3500    0.0000 H   0  0  0

+    2.2296   -2.2646    0.0000 H   0  0  0

+    2.7086   -3.1776    0.0000 H   0  0  0

+    3.9797   -3.3879    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    2.3830    0.1955    0.0036 N   0  0  0

+    2.8532   -1.2006    0.0047 C   0  0  0

+    3.4818    0.9716   -0.0017 C   0  0  0

+    1.1567    0.5957    0.0023 N   0  0  0

+    4.3632   -1.0679   -0.0008 C   0  0  0

+    4.6126    0.2565   -0.0042 N   0  0  0

+    3.4508    2.1854   -0.0040 O   0  0  0

+    0.1605   -0.2989    0.0024 C   0  0  0

+    5.1772   -1.9663   -0.0011 O   0  0  0

+   -1.1516    0.1294    0.0010 C   0  0  0

+   -2.2560   -0.6530    0.0009 O   0  0  0

+   -1.6210    1.5293    0.0058 C   0  0  0

+   -3.3471    0.1177   -0.0007 C   0  0  0

+   -2.9826    1.4666    0.0022 C   0  0  0

+   -4.7461   -0.3866   -0.0021 N   0  3  0

+   -5.6767    0.3992   -0.0034 O   0  0  0

+   -4.9963   -1.7804   -0.0018 O   0  5  0

+    1.8707   -1.4471    0.0000 H   0  0  0

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+  1  2  1  0

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+  2 18  1  0

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+  6 20  1  0

+  8 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2493-84-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 40                          1 V2000

+    0.3966    1.5307    0.0001 O   0  0  0

+   -0.5613    0.4702   -0.0006 C   0  0  0

+    1.6235    0.9510   -0.0005 C   0  0  0

+   -1.9736    1.0587    0.0001 C   0  0  0

+    2.7648    1.7443   -0.0001 C   0  0  0

+    1.7354   -0.4349    0.0042 C   0  0  0

+   -2.9992   -0.0767   -0.0006 C   0  0  0

+    4.0117    1.1600   -0.0003 C   0  0  0

+    2.9780   -1.0270    0.0040 C   0  0  0

+   -4.4115    0.5118    0.0001 C   0  0  0

+    4.1287   -0.2328   -0.0009 C   0  0  0

+   -5.4370   -0.6236   -0.0007 C   0  0  0

+    5.4620   -0.8628   -0.0011 C   0  0  0

+   -6.8493   -0.0351    0.0000 C   0  0  0

+    5.5618   -2.0737   -0.0016 O   0  0  0

+    6.5697   -0.0955   -0.0007 O   0  0  0

+   -7.8749   -1.1705   -0.0007 C   0  0  0

+   -9.2872   -0.5820    0.0000 C   0  0  0

+   -1.0771   -0.4561    0.0000 H   0  0  0

+    0.3008   -0.1470    0.0000 H   0  0  0

+   -1.4578    1.9850    0.0000 H   0  0  0

+   -2.8356    1.6759    0.0000 H   0  0  0

+    2.6752    2.8007    0.0000 H   0  0  0

+    0.8624   -1.0365    0.0000 H   0  0  0

+   -3.5150   -1.0030    0.0000 H   0  0  0

+   -2.1372   -0.6939    0.0000 H   0  0  0

+    4.8818    1.7658    0.0000 H   0  0  0

+    3.0624   -2.0838    0.0000 H   0  0  0

+   -3.8957    1.4381    0.0000 H   0  0  0

+   -5.2736    1.1290    0.0000 H   0  0  0

+   -5.9528   -1.5499    0.0000 H   0  0  0

+   -4.5749   -1.2408    0.0000 H   0  0  0

+   -6.3335    0.8912    0.0000 H   0  0  0

+   -7.7113    0.5821    0.0000 H   0  0  0

+    7.4412    0.5082    0.0000 H   0  0  0

+   -8.3907   -2.0968    0.0000 H   0  0  0

+   -7.0129   -1.7877    0.0000 H   0  0  0

+   -8.8794    0.3966    0.0000 H   0  0  0

+  -10.2658   -0.1742    0.0000 H   0  0  0

+   -9.6950   -1.5606    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  5  1  0

+  9  6  2  0

+ 10  7  1  0

+ 11  8  2  0

+ 12 10  1  0

+ 13 11  1  0

+ 14 12  1  0

+ 15 13  2  0

+ 16 13  1  0

+ 17 14  1  0

+ 18 17  1  0

+  9 11  1  0

+  2 19  1  0

+  2 20  1  0

+  4 21  1  0

+  4 22  1  0

+  5 23  1  0

+  6 24  1  0

+  7 25  1  0

+  7 26  1  0

+  8 27  1  0

+  9 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+ 12 31  1  0

+ 12 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 18 38  1  0

+ 18 39  1  0

+ 18 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129-73-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 53                          1 V2000

+    0.0108   -0.9058   -1.0630 C   0  0  0

+   -1.2377   -0.1636   -0.6611 C   0  0  0

+    1.2216   -0.0846   -0.7018 C   0  0  0

+    0.0652   -2.2263   -0.3389 C   0  0  0

+   -1.4233    0.2109    0.6569 C   0  0  0

+   -2.1925    0.1464   -1.6124 C   0  0  0

+    2.4247   -0.7109   -0.4335 C   0  0  0

+    1.1283    1.2941   -0.6450 C   0  0  0

+   -0.0396   -3.4081   -1.0479 C   0  0  0

+    0.2255   -2.2558    1.0341 C   0  0  0

+   -2.5663    0.8914    1.0287 C   0  0  0

+   -3.3376    0.8264   -1.2475 C   0  0  0

+    3.5365    0.0387   -0.1021 C   0  0  0

+    2.2359    2.0496   -0.3144 C   0  0  0

+    0.0103   -4.6196   -0.3835 C   0  0  0

+    0.2754   -3.4668    1.6982 C   0  0  0

+   -3.5299    1.1993    0.0770 C   0  0  0

+    3.4449    1.4232   -0.0386 C   0  0  0

+    0.1648   -4.6489    0.9896 C   0  0  0

+   -4.6872    1.8868    0.4496 N   0  0  0

+    4.5671    2.1843    0.2966 N   0  0  0

+   -5.7025    2.2107   -0.5557 C   0  0  0

+   -4.8857    2.2840    1.8457 C   0  0  0

+    4.4686    3.6444    0.3631 C   0  0  0

+    5.8426    1.5224    0.5817 C   0  0  0

+   -0.8460   -1.4169    0.0000 H   0  0  0

+   -0.6912    0.8887    0.0000 H   0  0  0

+   -2.6038   -0.7626    0.0000 H   0  0  0

+    2.4812   -1.7070    0.0000 H   0  0  0

+    0.2309    1.7301    0.0000 H   0  0  0

+   -1.0370   -3.3845    0.0000 H   0  0  0

+    0.9788   -1.6017    0.0000 H   0  0  0

+   -2.1566    1.8011    0.0000 H   0  0  0

+   -4.0638    0.1423    0.0000 H   0  0  0

+    4.4323   -0.4004    0.0000 H   0  0  0

+    2.1758    3.0455    0.0000 H   0  0  0

+   -0.7448   -5.2716    0.0000 H   0  0  0

+    1.2727   -3.4928    0.0000 H   0  0  0

+    0.7646   -5.4461    0.0000 H   0  0  0

+   -5.3993    3.1612    0.0000 H   0  0  0

+   -6.6530    2.5139    0.0000 H   0  0  0

+   -6.0057    1.2602    0.0000 H   0  0  0

+   -3.9933    2.7300    0.0000 H   0  0  0

+   -5.3317    3.1764    0.0000 H   0  0  0

+   -5.7781    1.8380    0.0000 H   0  0  0

+    5.4640    3.7116    0.0000 H   0  0  0

+    4.4014    4.6398    0.0000 H   0  0  0

+    3.4732    3.5772    0.0000 H   0  0  0

+    5.3831    0.6369    0.0000 H   0  0  0

+    6.7281    1.0629    0.0000 H   0  0  0

+    6.3021    2.4079    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  2  0

+ 11 17  2  0

+ 13 18  2  0

+ 15 19  2  0

+ 17 20  1  0

+ 18 21  1  0

+ 20 22  1  0

+ 20 23  1  0

+ 21 24  1  0

+ 21 25  1  0

+ 12 17  1  0

+ 14 18  1  0

+ 16 19  1  0

+  1 26  1  0

+  5 27  1  0

+  6 28  1  0

+  7 29  1  0

+  8 30  1  0

+  9 31  1  0

+ 10 32  1  0

+ 11 33  1  0

+ 12 34  1  0

+ 13 35  1  0

+ 14 36  1  0

+ 15 37  1  0

+ 16 38  1  0

+ 19 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+ 23 43  1  0

+ 23 44  1  0

+ 23 45  1  0

+ 24 46  1  0

+ 24 47  1  0

+ 24 48  1  0

+ 25 49  1  0

+ 25 50  1  0

+ 25 51  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+670-54-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.0000    0.6936    0.0026 C   0  0  0

+    0.0000   -0.6936    0.0009 C   0  0  0

+    1.2402    1.4096    0.0020 C   0  0  0

+   -1.2401    1.4096   -0.0010 C   0  0  0

+   -1.2402   -1.4096    0.0015 C   0  0  0

+    1.2401   -1.4096   -0.0015 C   0  0  0

+    2.2240    1.9776    0.0015 N   0  0  0

+   -2.2239    1.9776   -0.0039 N   0  0  0

+   -2.2240   -1.9776    0.0020 N   0  0  0

+    2.2239   -1.9776   -0.0034 N   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  3  0

+  4  8  3  0

+  5  9  3  0

+  6 10  3  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104953-00-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    2.2932   -0.1231   -0.1661 C   0  0  0

+    0.7880   -0.0784   -0.1084 C   0  0  0

+    3.0560    1.1743    0.1090 C   0  0  0

+    3.0129    0.0983    1.0484 O   0  0  0

+    2.8899   -1.0993   -1.1818 C   0  0  0

+    0.0795   -1.2052    0.2703 C   0  0  0

+    0.1211    1.0905   -0.4288 C   0  0  0

+   -1.2983   -1.1713    0.3253 C   0  0  0

+   -1.2568    1.1385   -0.3781 C   0  0  0

+   -1.9782    0.0037   -0.0024 C   0  0  0

+   -3.4085    0.0462    0.0524 C   0  0  0

+   -4.5432    0.0799    0.0959 N   0  0  0

+    4.0142    1.4916    0.0000 H   0  0  0

+    2.4217    1.9594    0.0000 H   0  0  0

+    2.0287   -1.6257    0.0000 H   0  0  0

+    3.4163   -1.9605    0.0000 H   0  0  0

+    3.7511   -0.5729    0.0000 H   0  0  0

+    0.5567   -2.0946    0.0000 H   0  0  0

+    0.6431    1.9543    0.0000 H   0  0  0

+   -1.8133   -2.0394    0.0000 H   0  0  0

+   -1.7272    2.0315    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  6  8  2  0

+  7  9  1  0

+  8 10  1  0

+ 10 11  1  0

+ 11 12  3  0

+  3  4  1  0

+  9 10  2  0

+  3 13  1  0

+  3 14  1  0

+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+113600-17-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -2.2774    0.0342   -0.0022 C   0  0  0

+   -1.6203   -1.2007   -0.0035 C   0  0  0

+   -1.3802    1.1074   -0.0003 C   0  0  0

+   -3.6678    0.1788    0.0027 C   0  0  0

+   -0.1736   -0.9019   -0.0020 C   0  0  0

+   -2.4157   -2.3336   -0.0048 C   0  0  0

+   -0.0260    0.5172    0.0001 C   0  0  0

+   -1.9253    2.3798   -0.0001 C   0  0  0

+   -4.1818    1.4868    0.0008 C   0  0  0

+   -4.4401   -0.9953    0.0097 C   0  0  0

+    0.9418   -1.7141   -0.0016 C   0  0  0

+   -3.8042   -2.2062   -0.0030 C   0  0  0

+    1.2328    1.0826    0.0017 C   0  0  0

+   -3.3103    2.5409   -0.0022 C   0  0  0

+    2.2252   -1.1471    0.0009 C   0  0  0

+    2.3716    0.2642    0.0003 C   0  0  0

+    3.3740   -1.9585    0.0026 C   0  0  0

+    3.6646    0.8226   -0.0003 C   0  0  0

+    4.6077   -1.3831    0.0032 C   0  0  0

+    4.7538    0.0024   -0.0005 C   0  0  0

+    3.8249    2.1641   -0.0011 F   0  0  0

+   -1.9752   -3.2850    0.0000 H   0  0  0

+   -1.2984    3.2202    0.0000 H   0  0  0

+   -5.2171    1.6520    0.0000 H   0  0  0

+   -5.4873   -0.9438    0.0000 H   0  0  0

+    0.8302   -2.7566    0.0000 H   0  0  0

+   -4.3869   -3.0777    0.0000 H   0  0  0

+    1.3380    2.1257    0.0000 H   0  0  0

+   -3.7012    3.5137    0.0000 H   0  0  0

+    3.2805   -3.0027    0.0000 H   0  0  0

+    5.4612   -1.9920    0.0000 H   0  0  0

+    5.7153    0.4205    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+ 11 15  2  0

+ 13 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+ 18 21  1  0

+  5  7  2  0

+  9 14  2  0

+ 10 12  2  0

+ 15 16  1  0

+ 19 20  1  0

+  6 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60827-45-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+   -0.5508    0.0620   -0.1964 C   0  0  0

+   -1.8477    0.7415    0.2476 C   0  0  0

+    0.6458    0.8167    0.3863 C   0  0  0

+   -0.5361   -1.2881    0.2716 O   0  0  0

+   -2.9653    0.0366   -0.2967 O   0  0  0

+    2.1741    0.0159   -0.1369 Cl  0  0  0

+    0.3811   -0.4454    0.0000 H   0  0  0

+   -1.1990    1.5812    0.0000 H   0  0  0

+   -2.5615    1.5266    0.0000 H   0  0  0

+    1.2945    1.6563    0.0000 H   0  0  0

+   -0.0680    1.6018    0.0000 H   0  0  0

+   -0.5245   -2.3491    0.0000 H   0  0  0

+   -3.8627   -0.5294    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118-96-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.5360    1.1965    0.0221 C   0  0  0

+   -1.2261   -0.0009    0.0020 C   0  0  0

+    0.8466    1.1976    0.0213 C   0  0  0

+   -1.2771    2.4777    0.0383 N   0  3  0

+   -0.5339   -1.1975   -0.0189 C   0  0  0

+   -2.7331   -0.0021    0.0035 C   0  0  0

+    1.5386    0.0013    0.0003 C   0  0  0

+   -1.2316    3.2198   -0.9264 O   0  0  0

+   -1.9323    2.7898    1.0164 O   0  5  0

+    0.8482   -1.1964   -0.0203 C   0  0  0

+   -1.2730   -2.4798   -0.0395 N   0  3  0

+    3.0188    0.0025   -0.0001 N   0  3  0

+   -1.2255   -3.2255    0.9224 O   0  0  0

+   -1.9286   -2.7892   -1.0182 O   0  5  0

+    3.6286   -1.0517   -0.0186 O   0  0  0

+    3.6270    1.0576    0.0180 O   0  5  0

+    1.3641    2.0957    0.0000 H   0  0  0

+   -2.7339    1.0344    0.0000 H   0  0  0

+   -3.7696   -0.0029    0.0000 H   0  0  0

+   -2.7323   -1.0386    0.0000 H   0  0  0

+    1.3671   -2.0937    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+ 12 15  2  0

+ 12 16  1  0

+  7 10  1  0

+  3 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-99-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.9856   -0.0008    0.0021 C   0  0  0

+   -0.3396   -1.2274    0.0012 C   0  0  0

+   -0.2316    1.1576    0.0012 C   0  0  0

+   -2.4910    0.0686   -0.0024 C   0  0  0

+    1.0471   -1.2429   -0.0005 C   0  0  0

+    1.0859    1.1048   -0.0004 N   0  0  0

+    1.7339   -0.0439   -0.0012 C   0  0  0

+   -0.8802   -2.1119    0.0000 H   0  0  0

+   -0.7074    2.0786    0.0000 H   0  0  0

+   -2.4433    1.1041    0.0000 H   0  0  0

+   -3.5265    0.1163    0.0000 H   0  0  0

+   -2.5387   -0.9669    0.0000 H   0  0  0

+    1.5619   -2.1427    0.0000 H   0  0  0

+    2.7705   -0.0473    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  6  7  1  0

+  2  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33685-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.7334   -1.2042    0.0018 C   0  0  0

+   -0.7333   -1.2042    0.0018 C   0  0  0

+    1.4346    0.0000    0.0009 C   0  0  0

+    1.4115   -2.4424   -0.0031 C   0  0  0

+   -1.4345   -0.0001    0.0008 C   0  0  0

+   -1.4115   -2.4423    0.0023 C   0  0  0

+    0.7332    1.2045   -0.0001 C   0  0  0

+    2.9162   -0.0001    0.0015 N   0  3  0

+    0.6977   -3.5969   -0.0077 C   0  0  0

+   -0.7332    1.2044   -0.0001 C   0  0  0

+   -2.9162   -0.0001    0.0003 N   0  3  0

+   -0.6977   -3.5969    0.0028 C   0  0  0

+    1.4113    2.4425   -0.0015 C   0  0  0

+    3.5256   -0.0011   -1.0531 O   0  0  0

+    3.5248    0.0010    1.0565 O   0  5  0

+   -1.4115    2.4424   -0.0006 C   0  0  0

+   -3.5256    0.0005    1.0549 O   0  0  0

+   -3.5248   -0.0008   -1.0548 O   0  5  0

+    0.6975    3.5971   -0.0029 C   0  0  0

+   -0.6978    3.5970   -0.0011 C   0  0  0

+    2.4565   -2.4699    0.0000 H   0  0  0

+   -2.4565   -2.4698    0.0000 H   0  0  0

+    1.2067   -4.5100    0.0000 H   0  0  0

+   -1.2067   -4.5100    0.0000 H   0  0  0

+    2.4563    2.4700    0.0000 H   0  0  0

+   -2.4565    2.4698    0.0000 H   0  0  0

+    1.2065    4.5102    0.0000 H   0  0  0

+   -1.2069    4.5100    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  8 15  1  0

+ 10 16  1  0

+ 11 17  2  0

+ 11 18  1  0

+ 13 19  2  0

+ 16 20  2  0

+  7 10  2  0

+  9 12  1  0

+ 19 20  1  0

+  4 21  1  0

+  6 22  1  0

+  9 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 16 26  1  0

+ 19 27  1  0

+ 20 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-06-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.1252    0.2831   -0.5259 C   0  0  0

+   -1.2822   -0.0059   -0.0711 C   0  0  0

+    0.7977    1.1360    0.5332 C   0  0  0

+    0.7974   -1.0378   -0.8493 C   0  0  0

+    0.0464    1.1011   -1.8165 C   0  0  0

+   -2.1883    1.0280    0.0720 C   0  0  0

+   -1.6687   -1.3059    0.1975 C   0  0  0

+    1.9270    0.6564    1.0961 N   0  0  0

+    0.3381    2.2087    0.8617 O   0  0  0

+    1.9268   -1.3444   -0.1764 N   0  0  0

+    0.3376   -1.7900   -1.6815 O   0  0  0

+    1.2146    2.0878   -1.8669 C   0  0  0

+   -3.4794    0.7628    0.4892 C   0  0  0

+   -2.9594   -1.5710    0.6146 C   0  0  0

+    2.4472   -0.5251    0.7445 C   0  0  0

+   -3.8641   -0.5361    0.7632 C   0  0  0

+    3.4665   -0.8799    1.3021 O   0  0  0

+   -0.4222    1.9598    0.0000 H   0  0  0

+   -0.8888    0.8141    0.0000 H   0  0  0

+   -1.8766    1.9552    0.0000 H   0  0  0

+   -1.0075   -2.0268    0.0000 H   0  0  0

+    2.6141    1.3526    0.0000 H   0  0  0

+    2.2805   -2.2565    0.0000 H   0  0  0

+    1.8458    1.3405    0.0000 H   0  0  0

+    1.9619    2.7190    0.0000 H   0  0  0

+    0.5834    2.8351    0.0000 H   0  0  0

+   -4.1410    1.4834    0.0000 H   0  0  0

+   -3.2717   -2.4980    0.0000 H   0  0  0

+   -4.8198   -0.7450    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  3  9  2  0

+  4 10  1  0

+  4 11  2  0

+  5 12  1  0

+  6 13  1  0

+  7 14  2  0

+  8 15  1  0

+ 13 16  2  0

+ 15 17  2  0

+ 10 15  1  0

+ 14 16  1  0

+  5 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55-63-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -0.0266    0.0284   -0.1725 C   0  0  0

+   -1.2883    0.8787   -0.0114 C   0  0  0

+    1.2097    0.9075    0.0262 C   0  0  0

+   -0.0292   -1.0170    0.8018 O   0  0  0

+   -2.4430    0.0576   -0.1969 O   0  0  0

+    2.3865    0.1416   -0.2395 O   0  0  0

+    0.1058   -2.2362    0.0943 N   0  3  0

+   -3.5721    0.8969   -0.0364 N   0  3  0

+    3.4907    1.0053   -0.0398 N   0  3  0

+    0.0878   -2.2387   -1.1236 O   0  0  0

+    0.2399   -3.2823    0.7035 O   0  5  0

+   -3.4213    2.0797    0.2118 O   0  0  0

+   -4.6942    0.4359   -0.1465 O   0  5  0

+    4.6246    0.5920   -0.2037 O   0  0  0

+    3.3065    2.1616    0.2958 O   0  5  0

+    0.7859   -0.3921    0.0000 H   0  0  0

+   -0.6899    1.5708    0.0000 H   0  0  0

+   -1.9039    1.5556    0.0000 H   0  0  0

+    1.8006    1.6060    0.0000 H   0  0  0

+    0.5905    1.5811    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  7 10  2  0

+  7 11  1  0

+  8 12  2  0

+  8 13  1  0

+  9 14  2  0

+  9 15  1  0

+  1 16  1  0

+  2 17  1  0

+  2 18  1  0

+  3 19  1  0

+  3 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3066-70-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    2.0898    0.3799    0.2172 O   0  0  0

+    0.9666    1.1186   -0.3314 C   0  0  0

+    3.3503    0.7305   -0.1073 C   0  0  0

+   -0.3411    0.5211    0.1916 C   0  0  0

+    4.4870   -0.0171    0.4479 C   0  0  0

+    3.5466    1.6650   -0.8592 O   0  0  0

+   -1.5246    1.2996   -0.3865 C   0  0  0

+   -0.4659   -1.3630   -0.3557 Br  0  0  0

+    4.2436   -1.1758    1.3803 C   0  0  0

+    5.7314    0.3290    0.1275 C   0  0  0

+   -3.2051    0.5318    0.2856 Br  0  0  0

+    1.6717    1.8478    0.0000 H   0  0  0

+    0.3810    1.9468    0.0000 H   0  0  0

+   -0.2635    1.5324    0.0000 H   0  0  0

+   -0.8195    2.0288    0.0000 H   0  0  0

+   -2.1101    2.1279    0.0000 H   0  0  0

+    3.2509   -0.9673    0.0000 H   0  0  0

+    4.0351   -2.1685    0.0000 H   0  0  0

+    5.2363   -1.3843    0.0000 H   0  0  0

+    6.4554   -0.3814    0.0000 H   0  0  0

+    5.9846    1.3112    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  2  0

+  7 11  1  0

+  2 12  1  0

+  2 13  1  0

+  4 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106626-55-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+   -1.1144    0.5896    0.0290 C   0  0  0

+   -2.1484    1.6219   -0.0767 C   0  0  0

+    0.2887    1.0050    0.0820 C   0  0  0

+   -1.4783   -0.7539    0.0825 C   0  0  0

+   -3.4335    1.2899   -0.1272 N   0  0  0

+   -1.7460    2.9753   -0.1229 C   0  0  0

+    0.5795    2.3582    0.0299 C   0  0  0

+    1.3681    0.0051    0.1889 C   0  0  0

+   -2.8412   -1.0615    0.0318 C   0  0  0

+   -3.8234    0.0211   -0.0841 C   0  0  0

+   -0.4317    3.3077   -0.0704 C   0  0  0

+    2.6563    0.3923    0.1048 N   0  0  0

+    1.0956   -1.1685    0.3529 O   0  0  0

+   -3.2940   -2.3950    0.0809 C   0  0  0

+   -5.1928   -0.3185   -0.1382 C   0  0  0

+    3.7281   -0.6007    0.2109 C   0  0  0

+   -4.6272   -2.6507    0.0295 C   0  0  0

+   -5.5635   -1.6236   -0.0919 C   0  0  0

+    5.0839    0.0968    0.0836 C   0  0  0

+    6.1587   -0.8989    0.1900 N   0  0  0

+    6.0491   -1.7662   -0.9906 C   0  0  0

+    7.4261   -0.1676    0.0603 C   0  0  0

+   -0.7546   -1.5090    0.0000 H   0  0  0

+   -2.4701    3.7300    0.0000 H   0  0  0

+    1.5779    2.6699    0.0000 H   0  0  0

+   -0.1698    4.3203    0.0000 H   0  0  0

+    2.8923    1.4112    0.0000 H   0  0  0

+   -2.6071   -3.1837    0.0000 H   0  0  0

+   -5.9198    0.4334    0.0000 H   0  0  0

+    2.9332   -1.2804    0.0000 H   0  0  0

+    4.3111   -1.4690    0.0000 H   0  0  0

+   -4.9573   -3.6432    0.0000 H   0  0  0

+   -6.5816   -1.8633    0.0000 H   0  0  0

+    5.8788    0.7765    0.0000 H   0  0  0

+    4.5009    0.9651    0.0000 H   0  0  0

+    5.0114   -1.6351    0.0000 H   0  0  0

+    5.9180   -2.8039    0.0000 H   0  0  0

+    7.0868   -1.8973    0.0000 H   0  0  0

+    7.9488   -1.0735    0.0000 H   0  0  0

+    8.3320    0.3551    0.0000 H   0  0  0

+    6.9034    0.7383    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

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+ 10 15  1  0

+ 12 16  1  0

+ 14 17  2  0

+ 15 18  2  0

+ 16 19  1  0

+ 19 20  1  0

+ 20 21  1  0

+ 20 22  1  0

+  7 11  1  0

+  9 10  1  0

+ 17 18  1  0

+  4 23  1  0

+  6 24  1  0

+  7 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+79305-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.8382    0.3431   -0.0019 C   0  0  0

+    0.4037    0.6782   -0.0018 C   0  0  0

+    2.7957    1.3616   -0.0022 C   0  0  0

+    2.2456   -0.9945    0.0043 C   0  0  0

+   -0.5147   -0.3016   -0.0015 C   0  0  0

+    4.1362    1.0443   -0.0018 C   0  0  0

+    3.5875   -1.3037    0.0047 C   0  0  0

+   -1.9499    0.0336   -0.0014 C   0  0  0

+    4.5374   -0.2873   -0.0010 C   0  0  0

+   -2.9072   -0.9832   -0.0011 C   0  0  0

+   -2.3580    1.3703    0.0041 C   0  0  0

+    5.8957   -0.6046   -0.0006 N   0  0  0

+   -4.2547   -0.6593   -0.0011 C   0  0  0

+   -3.7025    1.6809    0.0041 C   0  0  0

+   -4.6496    0.6741   -0.0014 C   0  0  0

+   -5.2165   -1.6725   -0.0012 N   0  0  0

+    0.1012    1.6768    0.0000 H   0  0  0

+    2.4954    2.3608    0.0000 H   0  0  0

+    1.5338   -1.7574    0.0000 H   0  0  0

+   -0.2122   -1.3002    0.0000 H   0  0  0

+    4.8514    1.8040    0.0000 H   0  0  0

+    3.8922   -2.3016    0.0000 H   0  0  0

+   -2.6090   -1.9831    0.0000 H   0  0  0

+   -1.6462    2.1332    0.0000 H   0  0  0

+    6.1982   -1.6032    0.0000 H   0  0  0

+    6.6093    0.1566    0.0000 H   0  0  0

+   -4.0053    2.6794    0.0000 H   0  0  0

+   -5.6647    0.9155    0.0000 H   0  0  0

+   -6.2310   -1.4288    0.0000 H   0  0  0

+   -4.9203   -2.6730    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 13 15  1  0

+ 13 16  1  0

+  7  9  1  0

+ 14 15  2  0

+  2 17  1  0

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+  4 19  1  0

+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24325-70-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    0.8710   -0.3842    0.0071 C   0  0  0

+    1.7236   -1.4910    0.0065 C   0  0  0

+    1.4105    0.9050    0.0039 C   0  0  0

+   -0.5905   -0.5753    0.0048 C   0  0  0

+    3.0904   -1.3044    0.0029 C   0  0  0

+    2.7788    1.0761    0.0003 C   0  0  0

+   -1.4068    0.4904    0.0053 C   0  0  0

+    3.6173   -0.0251   -0.0002 C   0  0  0

+   -2.8683    0.2993    0.0030 C   0  0  0

+    5.0851    0.1669   -0.0036 N   0  3  0

+   -3.7209    1.4061    0.0035 C   0  0  0

+   -3.4078   -0.9899   -0.0055 C   0  0  0

+    5.5522    1.2918   -0.0063 O   0  0  0

+    5.8257   -0.8001   -0.0036 O   0  5  0

+   -5.0877    1.2194    0.0009 C   0  0  0

+   -4.7761   -1.1610   -0.0081 C   0  0  0

+   -5.6146   -0.0599   -0.0023 C   0  0  0

+   -7.1089   -0.2553   -0.0046 C   0  0  0

+    1.3296   -2.4513    0.0000 H   0  0  0

+    0.7828    1.7317    0.0000 H   0  0  0

+   -0.9886   -1.5340    0.0000 H   0  0  0

+    3.7251   -2.1258    0.0000 H   0  0  0

+    3.1809    2.0331    0.0000 H   0  0  0

+   -1.0087    1.4491    0.0000 H   0  0  0

+   -3.3269    2.3664    0.0000 H   0  0  0

+   -2.7801   -1.8166    0.0000 H   0  0  0

+   -5.7224    2.0407    0.0000 H   0  0  0

+   -5.1782   -2.1180    0.0000 H   0  0  0

+   -7.2435    0.7740    0.0000 H   0  0  0

+   -8.1382   -0.3899    0.0000 H   0  0  0

+   -6.9743   -1.2846    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  5  8  2  0

+  7  9  1  0

+  8 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 10 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 15 17  2  0

+ 17 18  1  0

+  6  8  1  0

+ 16 17  1  0

+  2 19  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  7 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+38915-40-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 66                          1 V2000

+   -2.6800    1.3261   -0.3392 C   0  0  0

+   -4.0112    1.7031   -0.6168 C   0  0  0

+   -1.7834    2.2714    0.2168 C   0  0  0

+   -2.2674    0.0776   -0.5954 N   0  0  0

+   -4.3932    3.0233   -0.3233 C   0  0  0

+   -4.9087    0.8046   -1.1592 N   0  0  0

+   -2.1646    3.5182    0.4884 N   0  0  0

+   -0.4531    1.8663    0.4854 C   0  0  0

+   -1.0346   -0.3000   -0.3471 C   0  0  0

+   -3.4036    3.9382    0.2509 C   0  0  0

+   -5.6971    3.4884   -0.5651 C   0  0  0

+   -5.4003   -0.0231   -0.0495 C   0  0  0

+   -0.0938    0.5865    0.1977 C   0  0  0

+   -0.6628   -1.5749   -0.6228 O   0  0  0

+   -3.7984    5.2593    0.5408 C   0  0  0

+   -6.0151    4.7756   -0.2625 C   0  0  0

+   -6.4049   -1.0464   -0.5828 C   0  0  0

+   -1.8120   -2.2333   -1.1595 C   0  0  0

+   -5.0757    5.6501    0.2835 C   0  0  0

+   -6.9170   -1.9084    0.5730 C   0  0  0

+   -1.4589   -3.6839   -1.4938 C   0  0  0

+   -5.5496    7.2804    0.6459 Cl  0  0  0

+   -7.8815   -2.8910    0.0610 N   0  0  0

+   -2.6893   -4.3888   -2.0684 C   0  0  0

+   -8.3315   -3.6814    1.2145 C   0  0  0

+   -9.0472   -2.1318   -0.4111 C   0  0  0

+   -2.3362   -5.8395   -2.4027 C   0  0  0

+   -7.9112   -5.1407    1.0280 C   0  0  0

+   -9.5420   -2.7258   -1.7314 C   0  0  0

+   -8.4634   -6.1108    2.4438 Cl  0  0  0

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+ 32 66  1  0

+ 33 67  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4643-05-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+   -0.5733   -0.8094    0.0000 C   0  0  0

+   -2.0728   -0.6589    0.0000 C   0  0  0

+    0.1926    0.2553    0.0000 C   0  0  0

+   -2.4122    0.7292    0.0000 O   0  0  0

+    1.9199    0.0819    0.0000 Cl  0  0  0

+   -0.1208   -1.8131    0.0000 H   0  0  0

+   -3.1650   -0.7978    0.0000 H   0  0  0

+   -2.0582   -1.7598    0.0000 H   0  0  0

+   -0.2599    1.2590    0.0000 H   0  0  0

+   -2.6737    1.7987    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

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+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92134-96-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+   -1.4422    0.5098    0.6030 C   0  0  0

+   -2.3489   -0.5501    0.1223 N   0  0  0

+   -0.1251    0.4448   -0.1728 C   0  0  0

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+    2.0122   -0.8168   -0.4606 C   0  0  0

+    0.9230   -0.6792    1.6923 O   0  0  0

+    3.0029    0.1391    0.2071 C   0  0  0

+    2.5352   -2.1461   -0.4249 O   0  0  0

+    4.3315    0.1080   -0.5510 C   0  0  0

+    2.4730    1.4660    0.1852 O   0  0  0

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+    2.1018    2.3955    0.0000 H   0  0  0

+    5.9771    1.6956    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55965-84-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -6.1257    0.8883    0.0177 C   0  0  0

+   -6.9221   -0.1528    0.3872 C   0  0  0

+   -4.6803    0.0951   -0.5121 S   0  0  0

+   -6.4755    2.5881    0.0600 Cl  0  0  0

+   -6.3940   -1.4212    0.2451 C   0  0  0

+   -5.1412   -1.5281   -0.2447 N   0  0  0

+   -7.0390   -2.4123    0.5525 O   0  0  0

+   -4.3624   -2.7449   -0.4882 C   0  0  0

+    7.7475    1.0369    0.0018 C   0  0  0

+    6.9583    0.0053    0.3680 N   0  0  0

+    9.0087    0.7404   -0.4813 C   0  0  0

+    7.3593    2.1919    0.0892 O   0  0  0

+    7.9291   -1.3656    0.0562 S   0  0  0

+    5.5960    0.0501    0.9050 C   0  0  0

+    9.3471   -0.5747   -0.5460 C   0  0  0

+   -7.9359   -0.0210    0.0000 H   0  0  0

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+ 14 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.4832   -0.8955    0.1895 C   0  0  0

+   -0.4966    0.0597   -0.2222 O   0  0  0

+    1.8579   -0.4734   -0.3328 C   0  0  0

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+    2.1940    0.8114    0.1949 O   0  0  0

+   -2.8505    0.5961   -0.1138 C   0  0  0

+   -0.3452   -1.5013    0.0000 H   0  0  0

+    0.9431   -1.8130    0.0000 H   0  0  0

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+    2.8816   -0.5465    0.0000 H   0  0  0

+   -2.5535   -1.0287    0.0000 H   0  0  0

+   -1.2523   -1.2843    0.0000 H   0  0  0

+    2.4537    1.8043    0.0000 H   0  0  0

+   -2.1658    1.3606    0.0000 H   0  0  0

+   -3.6150    1.2808    0.0000 H   0  0  0

+   -3.5352   -0.1684    0.0000 H   0  0  0

+  1  2  1  0

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+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90421-79-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    1.2032   -0.4807    0.0414 C   0  0  0

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+    1.2833    2.0173   -0.0480 S   0  0  0

+    3.5485    0.1806   -0.1181 C   0  0  0

+    2.9545   -2.1291   -0.0004 C   0  0  0

+   -2.3699    0.1085    0.2299 C   0  0  0

+    3.9227   -1.1373   -0.0954 C   0  0  0

+   -3.6289   -0.7548    0.3323 C   0  0  0

+   -4.8639    0.1474    0.3740 C   0  0  0

+   -4.4532   -0.5328   -0.8137 O   0  0  0

+    0.9193   -2.5982    0.0000 H   0  0  0

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+    3.2509   -3.1354    0.0000 H   0  0  0

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+   -3.4525   -1.7889    0.0000 H   0  0  0

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+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35077-51-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 45                          1 V2000

+    4.4729    0.3244   -0.2961 C   0  0  0

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+ 23 42  1  0

+ 23 43  1  0

+ 23 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5296-38-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -1.0103   -1.1039   -0.6618 C   0  0  0

+   -2.4323   -1.2100   -1.1493 C   0  0  0

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+    2.8829   -0.8146    0.6719 O   0  0  0

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+   -3.2466   -1.6423    0.0000 H   0  0  0

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+    1.0796   -2.5998    0.0000 H   0  0  0

+    1.6193    0.6473    0.0000 H   0  0  0

+   -2.5916    1.4414    0.0000 H   0  0  0

+   -4.0969   -1.4208    0.0000 H   0  0  0

+   -4.0378    2.9169    0.0000 H   0  0  0

+   -5.5432    0.0559    0.0000 H   0  0  0

+   -5.6607    2.1171    0.0000 H   0  0  0

+    3.6660    1.0368    0.0000 H   0  0  0

+    2.6846    0.4597    0.0000 H   0  0  0

+    5.4666   -0.5170    0.0000 H   0  0  0

+    6.4549    0.7441    0.0000 H   0  0  0

+    6.2505    2.0256    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  7 10  2  0

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+ 14 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+31464-26-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+   -2.2921   -0.9883   -0.1350 C   0  0  0

+   -1.6827   -1.5483    0.9844 C   0  0  0

+   -1.5371   -0.2670   -1.0552 C   0  0  0

+   -3.6596   -1.1552   -0.3376 N   0  0  0

+   -0.3305   -1.3904    1.1852 C   0  0  0

+   -0.1840   -0.1046   -0.8613 C   0  0  0

+   -4.6121   -0.2531    0.3143 C   0  0  0

+   -4.1457   -2.2329   -1.2027 C   0  0  0

+    0.4321   -0.6658    0.2624 C   0  0  0

+   -4.5784    1.1109   -0.3780 C   0  0  0

+    1.7730   -0.5070    0.4580 N   0  0  0

+   -5.5356    2.0174    0.2771 C   0  0  0

+    2.4744    0.1612   -0.3938 N   0  0  0

+   -6.2742    2.7169    0.7826 N   0  0  0

+    3.8181    0.3203   -0.1978 C   0  0  0

+    4.5813    1.0437   -1.1185 C   0  0  0

+    4.4340   -0.2346    0.9270 C   0  0  0

+    5.9359    1.2004   -0.9140 C   0  0  0

+    5.7900   -0.0696    1.1183 C   0  0  0

+    6.5401    0.6434    0.1998 C   0  0  0

+   -1.9561   -2.3918    0.0000 H   0  0  0

+   -1.9156    0.5349    0.0000 H   0  0  0

+    0.0456   -2.1934    0.0000 H   0  0  0

+    0.0862    0.7399    0.0000 H   0  0  0

+   -5.4669   -0.0173    0.0000 H   0  0  0

+   -5.0478   -1.0253    0.0000 H   0  0  0

+   -4.9540   -1.8683    0.0000 H   0  0  0

+   -4.5103   -3.0412    0.0000 H   0  0  0

+   -3.3374   -2.5975    0.0000 H   0  0  0

+   -3.7236    0.8751    0.0000 H   0  0  0

+   -4.1427    1.8831    0.0000 H   0  0  0

+    4.2061    1.8471    0.0000 H   0  0  0

+    4.1668   -1.0801    0.0000 H   0  0  0

+    6.2104    2.0435    0.0000 H   0  0  0

+    6.1681   -0.8716    0.0000 H   0  0  0

+    7.4268    0.6502    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+131-73-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+   -1.1969   -0.1777    0.6447 C   0  0  0

+   -1.3208   -1.2365   -0.2466 C   0  0  0

+   -2.2652    0.6876    0.8431 C   0  0  0

+   -0.0025    0.0127    1.3440 N   0  0  0

+   -2.5046   -1.4250   -0.9318 C   0  0  0

+   -0.1852   -2.1614   -0.4609 N   0  3  0

+   -3.4465    0.4931    0.1543 C   0  0  0

+   -2.1377    1.8172    1.7912 N   0  3  0

+    1.1948    0.1906    0.6462 C   0  0  0

+   -3.5664   -0.5615   -0.7318 C   0  0  0

+    0.2276   -2.3681   -1.5880 O   0  0  0

+    0.3365   -2.7158    0.4899 O   0  5  0

+   -1.5888    1.6513    2.8658 O   0  0  0

+   -2.5815    2.9125    1.4967 O   0  5  0

+    1.3262    1.2396   -0.2548 C   0  0  0

+    2.2588   -0.6780    0.8562 C   0  0  0

+   -4.8340   -0.7668   -1.4682 N   0  3  0

+    2.5114    1.4128   -0.9425 C   0  0  0

+    0.1971    2.1705   -0.4780 N   0  3  0

+    3.4408   -0.4990    0.1653 C   0  0  0

+    2.1255   -1.7937    1.8199 N   0  3  0

+   -5.7699   -0.0072   -1.2932 O   0  0  0

+   -4.9411   -1.6954   -2.2492 O   0  5  0

+    3.5664    0.5434   -0.7350 C   0  0  0

+   -0.2107    2.3734   -1.6076 O   0  0  0

+   -0.3241    2.7334    0.4680 O   0  5  0

+    1.5750   -1.6108    2.8909 O   0  0  0

+    2.5662   -2.8945    1.5418 O   0  5  0

+    4.8350    0.7322   -1.4739 N   0  3  0

+    5.7653   -0.0327   -1.2921 O   0  0  0

+    4.9487    1.6525   -2.2636 O   0  5  0

+   -0.1384    0.8953    0.0000 H   0  0  0

+   -2.7363   -2.2874    0.0000 H   0  0  0

+   -4.0935    1.1085    0.0000 H   0  0  0

+    2.7514    2.2729    0.0000 H   0  0  0

+    4.0817   -1.1208    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+ 21 27  2  0

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+ 29 30  2  0

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+  7 10  2  0

+ 20 24  1  0

+  4 32  1  0

+  5 33  1  0

+  7 34  1  0

+ 18 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+29964-84-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 41                          1 V2000

+   -3.2560   -0.2342   -0.0400 O   0  0  0

+   -4.4773    0.3254    0.0705 C   0  0  0

+   -2.0668    0.5931    0.0582 C   0  0  0

+   -5.6809   -0.5119   -0.0288 C   0  0  0

+   -4.5831    1.5224    0.2524 O   0  0  0

+   -0.8220   -0.2823   -0.1002 C   0  0  0

+   -5.5497   -1.9961   -0.2543 C   0  0  0

+   -6.8867    0.0406    0.0803 C   0  0  0

+    0.4311    0.5895    0.0032 C   0  0  0

+    1.6758   -0.2860   -0.1552 C   0  0  0

+    2.9289    0.5858   -0.0518 C   0  0  0

+    4.1737   -0.2896   -0.2102 C   0  0  0

+    5.4268    0.5821   -0.1068 C   0  0  0

+    6.6716   -0.2933   -0.2652 C   0  0  0

+    7.9246    0.5785   -0.1617 C   0  0  0

+    6.6943   -1.3520    0.8391 C   0  0  0

+   -1.3060    1.4439    0.0000 H   0  0  0

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+   -5.4492   -3.1330    0.0000 H   0  0  0

+   -4.4128   -1.8956    0.0000 H   0  0  0

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+   -7.8172   -0.6203    0.0000 H   0  0  0

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+    2.1724    1.4404    0.0000 H   0  0  0

+    3.4129   -1.1404    0.0000 H   0  0  0

+    4.9301   -1.1443    0.0000 H   0  0  0

+    6.1876    1.4329    0.0000 H   0  0  0

+    4.6704    1.4368    0.0000 H   0  0  0

+    5.6644   -0.8301    0.0000 H   0  0  0

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+    5.5532   -1.3765    0.0000 H   0  0  0

+    6.7188   -2.4931    0.0000 H   0  0  0

+    7.8354   -1.3275    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 37  1  0

+ 15 38  1  0

+ 15 39  1  0

+ 16 40  1  0

+ 16 41  1  0

+ 16 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17573-23-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.3058   -0.2419    0.0466 C   0  0  0

+   -1.6791    0.0573   -0.0017 C   0  0  0

+    0.6365    0.8085    0.0901 C   0  0  0

+    0.1184   -1.5907    0.0454 C   0  0  0

+   -2.1024    1.4050   -0.0086 C   0  0  0

+   -2.6237   -0.9929   -0.0433 C   0  0  0

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+    1.4880   -1.8748    0.0933 C   0  0  0

+   -0.8498   -2.6220   -0.0032 C   0  0  0

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+   -3.4720    1.6815   -0.0563 C   0  0  0

+   -2.1715   -2.3346   -0.0378 C   0  0  0

+   -3.9834   -0.6748   -0.0900 C   0  0  0

+    2.4105   -0.8536    0.1431 C   0  0  0

+    3.0275    1.5457    0.1915 C   0  0  0

+   -4.3864    0.6471   -0.0956 C   0  0  0

+    3.8834   -1.1723    0.1972 C   0  0  0

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+    4.6705   -0.1208   -0.5817 C   0  0  0

+    0.8913    2.9321    0.0000 H   0  0  0

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+   -0.5367   -3.6290    0.0000 H   0  0  0

+   -1.4473    3.4444    0.0000 H   0  0  0

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+  1  2  1  0

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+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7696-62-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.0513   -0.7693    0.0028 C   0  0  0

+    0.9323   -1.7589    0.0007 C   0  0  0

+    0.3043    0.5803    0.0031 C   0  0  0

+   -1.3591   -1.1206   -0.0013 O   0  0  0

+    2.2502   -1.4152   -0.0009 C   0  0  0

+    1.6167    0.9430    0.0015 C   0  0  0

+   -2.1128    0.0935    0.0022 C   0  0  0

+    2.6199   -0.0519   -0.0005 C   0  0  0

+   -3.6074   -0.2341   -0.0022 C   0  0  0

+    3.9071    0.2938   -0.0017 N   0  0  0

+   -4.4144    1.0657    0.0015 C   0  0  0

+    4.2217    1.4705   -0.0013 O   0  0  0

+   -5.9089    0.7381   -0.0028 C   0  0  0

+    0.6565   -2.7686    0.0000 H   0  0  0

+   -0.4403    1.3160    0.0000 H   0  0  0

+    2.9868   -2.1589    0.0000 H   0  0  0

+    1.8816    1.9557    0.0000 H   0  0  0

+   -1.1668    0.5415    0.0000 H   0  0  0

+   -2.4510    1.0841    0.0000 H   0  0  0

+   -4.5534   -0.6822    0.0000 H   0  0  0

+   -3.2691   -1.2247    0.0000 H   0  0  0

+   -3.4684    1.5138    0.0000 H   0  0  0

+   -4.7527    2.0563    0.0000 H   0  0  0

+   -6.1330    1.7606    0.0000 H   0  0  0

+   -6.9314    0.5140    0.0000 H   0  0  0

+   -5.6848   -0.2844    0.0000 H   0  0  0

+  1  2  2  0

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+  6  8  1  0

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+  9 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5447-99-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -0.1253   -0.3114   -0.3127 C   0  0  0

+   -1.4253    0.2348    0.2809 C   0  0  0

+    0.9805    0.5897    0.0212 N   0  3  0

+    0.1557   -1.6997    0.2657 C   0  0  0

+   -1.7063    1.6231   -0.2975 C   0  0  0

+   -2.5039   -0.6441   -0.0449 O   0  0  0

+    1.6224    1.1213   -0.8670 O   0  0  0

+    1.2580    0.8072    1.1871 O   0  5  0

+    1.4558   -2.2459   -0.3279 C   0  0  0

+   -0.9434   -0.9816    0.0000 H   0  0  0

+   -0.6072    0.9050    0.0000 H   0  0  0

+   -0.9019   -1.7003    0.0000 H   0  0  0

+   -0.0529   -2.7365    0.0000 H   0  0  0

+   -0.6697    1.8329    0.0000 H   0  0  0

+   -1.9161    2.6597    0.0000 H   0  0  0

+   -2.7429    1.4133    0.0000 H   0  0  0

+   -3.3238   -1.3122    0.0000 H   0  0  0

+    1.0462   -3.2209    0.0000 H   0  0  0

+    2.4308   -2.6555    0.0000 H   0  0  0

+    1.8654   -1.2709    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

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+  1 10  1  0

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+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7665-72-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    1.7453    0.0168    0.0438 C   0  0  0

+    0.5349    0.2149   -0.6894 O   0  0  0

+    1.6617    0.7623    1.3773 C   0  0  0

+    1.9438   -1.4774    0.3064 C   0  0  0

+    2.9265    0.5533   -0.7672 C   0  0  0

+   -0.5255   -0.3037    0.1160 C   0  0  0

+   -1.8571   -0.1218   -0.6152 C   0  0  0

+   -2.9924   -0.6771    0.2471 C   0  0  0

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+    1.0042   -1.6022    0.0000 H   0  0  0

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+    2.8834   -1.3526    0.0000 H   0  0  0

+    3.3185   -0.3097    0.0000 H   0  0  0

+    3.7895    0.9453    0.0000 H   0  0  0

+    2.5345    1.4163    0.0000 H   0  0  0

+   -0.9484   -1.1520    0.0000 H   0  0  0

+    0.1422   -0.9765    0.0000 H   0  0  0

+   -1.7065   -1.0576    0.0000 H   0  0  0

+   -3.9401   -0.6965    0.0000 H   0  0  0

+   -2.7692   -1.5983    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74339-98-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 47                          1 V2000

+    0.5614    0.3191    0.0492 C   0  0  0

+   -0.7331    0.8312    0.1076 C   0  0  0

+    1.5454    1.3839   -0.0208 C   0  0  0

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+   -2.9648   -2.6685    1.6436 O   0  0  0

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+ 23 39  1  0

+ 24 40  1  0

+ 25 41  1  0

+ 26 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117467-28-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 69 72                          1 V2000

+    0.8839   -0.7072   -1.0473 N   0  0  0

+   -0.1528   -1.2695   -1.9261 C   0  0  1

+    1.6612    0.4492   -1.1969 C   0  0  0

+    0.5626   -1.5973   -0.1064 C   0  0  0

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+   -1.1799    0.1280   -2.4458 S   0  0  0

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+ 40 66  1  0

+ 40 67  1  0

+ 41 68  1  0

+ 41 69  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+797-63-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 54                          1 V2000

+    1.9323    0.1153   -0.2052 C   0  0  1

+    1.2611   -1.2666    0.0097 C   0  0  2

+    3.4076   -0.1664    0.0635 C   0  0  2

+    1.5811    0.5436   -1.6190 C   0  0  0

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+   -0.2376   -1.0347    0.1115 C   0  0  1

+    1.9409   -1.7459    1.2973 C   0  0  0

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+    4.0571    1.0220    0.6402 C   0  0  0

+    4.0656   -0.5545   -1.1442 O   0  0  0

+    0.0648    0.7773   -1.6469 C   0  0  0

+    1.8512    2.5320    0.4235 C   0  0  0

+   -0.7254   -0.4577   -1.2180 C   0  0  2

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+   -4.6931   -1.3664    0.0000 H   0  0  0

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+ 19 47  1  0

+ 19 48  1  0

+ 20 49  1  0

+ 21 50  1  0

+ 21 51  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6281-32-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -2.1090   -1.3387    0.0002 C   0  0  0

+   -3.4595   -0.8718    0.0011 O   0  0  0

+   -1.1700   -0.1600    0.0011 C   0  0  0

+    0.2249   -0.3466    0.0004 C   0  0  0

+   -1.6492    1.1193   -0.0032 C   0  0  0

+    1.0702    0.7909    0.0013 C   0  0  0

+    0.7910   -1.6318   -0.0007 C   0  0  0

+   -0.7627    2.1936   -0.0022 C   0  0  0

+    0.5364    2.0162    0.0023 N   0  0  0

+    2.4641    0.6065    0.0007 C   0  0  0

+    2.1453   -1.7704   -0.0009 C   0  0  0

+    2.9785   -0.6532   -0.0008 C   0  0  0

+   -2.5600   -2.2817    0.0000 H   0  0  0

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+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+580-16-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.2916    0.6426   -0.0028 C   0  0  0

+   -0.5674   -0.7477   -0.0005 C   0  0  0

+    1.0398    1.0868   -0.0024 C   0  0  0

+   -1.3665    1.5515    0.0004 C   0  0  0

+    0.5041   -1.6589    0.0017 C   0  0  0

+   -1.8341   -1.1741   -0.0009 N   0  0  0

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+   -2.6363    1.0480    0.0056 C   0  0  0

+    1.7834   -1.1984    0.0017 C   0  0  0

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+   -3.4478    1.6898    0.0000 H   0  0  0

+    2.5676   -1.8732    0.0000 H   0  0  0

+   -3.8046   -0.6980    0.0000 H   0  0  0

+    4.3265    0.9291    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7  9  1  0

+  8 10  2  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2498-75-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.0098   -0.0040   -0.0022 C   0  0  0

+   -1.4586   -0.2538   -0.0015 C   0  0  0

+    0.4629    1.3815   -0.0003 C   0  0  0

+    0.8930   -1.0541    0.0012 C   0  0  0

+   -2.3471    0.8417    0.0009 C   0  0  0

+   -1.9624   -1.5556   -0.0029 C   0  0  0

+    1.8261    1.6541   -0.0003 C   0  0  0

+   -0.5143    2.4691    0.0022 C   0  0  0

+    2.2653   -0.7861    0.0005 C   0  0  0

+   -1.8352    2.2085    0.0022 C   0  0  0

+   -3.7284    0.6015    0.0015 C   0  0  0

+   -3.3239   -1.7590   -0.0018 C   0  0  0

+    2.7417    0.5989   -0.0022 C   0  0  0

+    3.2123   -1.8295    0.0045 C   0  0  0

+   -4.1980   -0.6796   -0.0003 C   0  0  0

+    4.1311    0.8378   -0.0023 C   0  0  0

+    4.5381   -1.5314    0.0043 C   0  0  0

+   -5.6847   -0.9266    0.0004 C   0  0  0

+    4.9919   -0.2134   -0.0041 C   0  0  0

+    0.5495   -2.0444    0.0000 H   0  0  0

+   -1.3074   -2.3740    0.0000 H   0  0  0

+    2.1652    2.6460    0.0000 H   0  0  0

+   -0.1826    3.4635    0.0000 H   0  0  0

+   -2.5134    3.0078    0.0000 H   0  0  0

+   -4.4003    1.4061    0.0000 H   0  0  0

+   -3.7038   -2.7360    0.0000 H   0  0  0

+    2.8962   -2.8289    0.0000 H   0  0  0

+    4.4976    1.8199    0.0000 H   0  0  0

+    5.2373   -2.3124    0.0000 H   0  0  0

+   -5.8565    0.1075    0.0000 H   0  0  0

+   -6.7188   -1.0984    0.0000 H   0  0  0

+   -5.5129   -1.9607    0.0000 H   0  0  0

+    6.0237   -0.0285    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+ 14 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+  8 10  2  0

+  9 13  2  0

+ 12 15  1  0

+ 17 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3244-54-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.7372    0.4522   -0.0023 C   0  0  0

+   -0.7373    0.4520   -0.0010 C   0  0  0

+    1.1350    1.7973   -0.0006 C   0  0  0

+    1.6960   -0.5583    0.0004 C   0  0  0

+   -1.1353    1.7974    0.0014 C   0  0  0

+   -1.6956   -0.5583   -0.0016 C   0  0  0

+   -0.0001    2.5881    0.0016 N   0  0  0

+    2.4919    2.1068   -0.0010 C   0  0  0

+    3.0349   -0.2320   -0.0020 C   0  0  0

+   -2.4917    2.1068    0.0027 C   0  0  0

+   -3.0350   -0.2319    0.0001 C   0  0  0

+    3.4298    1.0971   -0.0029 C   0  0  0

+    4.0552   -1.3044    0.0008 N   0  3  0

+   -3.4299    1.0968    0.0016 C   0  0  0

+   -4.0552   -1.3043   -0.0006 N   0  3  0

+    5.2392   -1.0185   -0.0012 O   0  0  0

+    3.7108   -2.4726    0.0053 O   0  5  0

+   -5.2392   -1.0185    0.0009 O   0  0  0

+   -3.7108   -2.4726   -0.0027 O   0  5  0

+    1.4024   -1.5556    0.0000 H   0  0  0

+   -1.4019   -1.5556    0.0000 H   0  0  0

+    0.0000    3.6277    0.0000 H   0  0  0

+    2.7981    3.1003    0.0000 H   0  0  0

+   -2.7979    3.1003    0.0000 H   0  0  0

+    4.4421    1.3340    0.0000 H   0  0  0

+   -4.4422    1.3336    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+  9 13  1  0

+ 10 14  1  0

+ 11 15  1  0

+ 13 16  2  0

+ 13 17  1  0

+ 15 18  2  0

+ 15 19  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 14  2  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17075-03-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.7831   -0.0055   -0.0022 C   0  0  0

+   -0.4672   -0.3792   -0.0017 C   0  0  0

+    1.1298    1.4282   -0.0010 C   0  0  0

+    1.8649   -1.0066    0.0023 C   0  0  0

+   -1.5437    0.6291   -0.0001 C   0  0  0

+   -0.8223   -1.8097   -0.0024 C   0  0  0

+    0.1760    2.3287    0.0008 C   0  0  0

+    2.5593    1.7851   -0.0015 C   0  0  0

+    1.5177   -2.4376    0.0076 C   0  0  0

+    3.1119   -0.5974    0.0018 C   0  0  0

+   -1.2405    1.9053    0.0009 C   0  0  0

+   -2.9347    0.1431    0.0010 C   0  0  0

+    0.2533   -2.8155   -0.0038 C   0  0  0

+   -2.0893   -2.1519   -0.0014 C   0  0  0

+    3.4629    0.8285   -0.0030 C   0  0  0

+   -2.2256    2.8357    0.0019 N   0  0  0

+   -3.1651   -1.1525    0.0004 C   0  0  0

+    0.4304    3.4002    0.0000 H   0  0  0

+    2.8685    2.8421    0.0000 H   0  0  0

+    2.3166   -3.1957    0.0000 H   0  0  0

+    3.9196   -1.3461    0.0000 H   0  0  0

+   -3.7732    0.8571    0.0000 H   0  0  0

+    0.0014   -3.8876    0.0000 H   0  0  0

+   -2.3537   -3.2210    0.0000 H   0  0  0

+    4.5278    1.1093    0.0000 H   0  0  0

+   -1.9710    3.9072    0.0000 H   0  0  0

+   -3.2808    2.5204    0.0000 H   0  0  0

+   -4.2094   -1.5022    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  8 15  2  0

+ 11 16  1  0

+ 12 17  2  0

+  7 11  1  0

+  9 13  2  0

+ 10 15  1  0

+ 14 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74-96-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+   -1.2848    0.6981    0.0000 C   0  0  0

+   -2.2974   -0.4489    0.0000 C   0  0  0

+    0.5384   -0.0375    0.0000 Br  0  0  0

+   -0.6600    1.8507    0.0000 H   0  0  0

+   -2.3594    1.4491    0.0000 H   0  0  0

+   -3.2802    0.4188    0.0000 H   0  0  0

+   -3.1651   -1.4317    0.0000 H   0  0  0

+   -1.3146   -1.3166    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+503-30-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+    1.1226   -0.0001   -0.1537 C   0  0  0

+    0.0403   -1.0488    0.1650 C   0  0  0

+    0.0404    1.0488    0.1650 C   0  0  0

+   -0.9032    0.0001   -0.1324 O   0  0  0

+    1.8922   -0.7779    0.0000 H   0  0  0

+    1.8923    0.7776    0.0000 H   0  0  0

+   -0.7641   -1.7906    0.0000 H   0  0  0

+    0.7919   -1.8440    0.0000 H   0  0  0

+    0.7922    1.8439    0.0000 H   0  0  0

+   -0.7639    1.7907    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57835-92-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -0.3281    0.7959   -0.0157 C   0  0  0

+   -1.2555   -0.3480    0.0115 C   0  0  0

+    0.9694    0.6057   -0.0139 C   0  0  0

+   -0.9040    2.1531   -0.0510 C   0  0  0

+   -0.6797   -1.7054    0.0411 C   0  0  0

+   -2.5530   -0.1576    0.0089 C   0  0  0

+    1.5385   -0.7497    0.0149 C   0  0  0

+    1.8601    1.7828   -0.0419 C   0  0  0

+   -2.3722    2.2780   -0.0566 C   0  0  0

+   -0.1105    3.1965   -0.0756 C   0  0  0

+    0.7884   -1.8303    0.0417 C   0  0  0

+   -1.4735   -2.7486    0.0660 C   0  0  0

+   -3.1222    1.1977   -0.0214 C   0  0  0

+   -3.4440   -1.3346    0.0366 C   0  0  0

+    2.8860   -0.8912    0.0153 N   0  3  0

+    1.3511    2.9959   -0.0680 C   0  0  0

+   -2.9350   -2.5477    0.0642 C   0  0  0

+    3.4256   -1.5866   -0.8266 O   0  0  0

+    3.5578   -0.3230    0.8576 O   0  5  0

+    2.9111    1.6505    0.0000 H   0  0  0

+   -2.8230    3.2366    0.0000 H   0  0  0

+   -0.5153    4.1754    0.0000 H   0  0  0

+    1.2392   -2.7889    0.0000 H   0  0  0

+   -1.0689   -3.7276    0.0000 H   0  0  0

+   -4.1757    1.3083    0.0000 H   0  0  0

+   -4.4950   -1.2022    0.0000 H   0  0  0

+    1.9964    3.8360    0.0000 H   0  0  0

+   -3.5804   -3.3878    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

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+ 12 17  1  0

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+  7 11  2  0

+  9 13  2  0

+ 10 16  1  0

+ 14 17  2  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+61396-61-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -1.3622   -0.0772   -0.2322 C   0  0  0

+   -2.8182    0.0092    0.0411 C   0  0  0

+   -0.7200    0.9437   -0.9303 C   0  0  0

+   -0.6313   -1.1764    0.2131 C   0  0  0

+   -3.6167   -1.1287   -0.0562 C   0  0  0

+   -3.3908    1.2270    0.4016 C   0  0  0

+    0.6343    0.8584   -1.1814 C   0  0  0

+    0.7230   -1.2514   -0.0435 C   0  0  0

+   -4.9701   -1.0427    0.1996 C   0  0  0

+   -4.7456    1.3016    0.6552 C   0  0  0

+    1.3543   -0.2379   -0.7414 C   0  0  0

+   -5.5343    0.1702    0.5520 C   0  0  0

+    2.8329   -0.3257   -1.0190 C   0  0  0

+    3.6069    0.3233    0.1303 C   0  0  0

+    5.1081    0.2342   -0.1516 C   0  0  0

+    5.8821    0.8831    0.9976 C   0  0  0

+    5.7406   -0.5335    0.8744 O   0  0  0

+   -1.1835    1.8490    0.0000 H   0  0  0

+   -1.1364   -2.0592    0.0000 H   0  0  0

+   -3.1764   -2.0455    0.0000 H   0  0  0

+   -2.8223    2.0704    0.0000 H   0  0  0

+    1.1452    1.7379    0.0000 H   0  0  0

+    1.1919   -2.1539    0.0000 H   0  0  0

+   -5.5439   -1.8825    0.0000 H   0  0  0

+   -5.1912    2.2159    0.0000 H   0  0  0

+   -6.5476    0.2583    0.0000 H   0  0  0

+    2.5028   -1.2877    0.0000 H   0  0  0

+    3.6713   -0.9015    0.0000 H   0  0  0

+    3.9370    1.2853    0.0000 H   0  0  0

+    2.7685    0.8991    0.0000 H   0  0  0

+    4.7889    1.1999    0.0000 H   0  0  0

+    6.8852    1.0514    0.0000 H   0  0  0

+    5.4563    1.8068    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

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+  8 11  2  0

+ 10 12  2  0

+ 16 17  1  0

+  3 18  1  0

+  4 19  1  0

+  5 20  1  0

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+  7 22  1  0

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+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7493-63-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.5329    0.5430    0.4970 C   0  0  0

+   -1.6260   -0.0909    0.0285 O   0  0  0

+   -0.6521    1.5781    1.1224 O   0  0  0

+    0.8059   -0.0218    0.2560 C   0  0  0

+   -2.9462    0.4627    0.2712 C   0  0  0

+    1.7585    0.7056   -0.4752 C   0  0  0

+    1.1382   -1.2832    0.7589 C   0  0  0

+   -3.9878   -0.4303   -0.3522 C   0  0  0

+    1.4440    1.9618   -0.9754 N   0  0  0

+    3.0182    0.1614   -0.6950 C   0  0  0

+    2.3919   -1.8054    0.5304 C   0  0  0

+   -3.6237   -1.5150   -0.9901 C   0  0  0

+    3.3284   -1.0868   -0.1965 C   0  0  0

+   -2.4368    1.2896    0.0000 H   0  0  0

+   -3.6846    1.0936    0.0000 H   0  0  0

+    0.4060   -1.9213    0.0000 H   0  0  0

+   -4.9241   -0.1721    0.0000 H   0  0  0

+    2.1420    2.6371    0.0000 H   0  0  0

+    0.5101    2.2286    0.0000 H   0  0  0

+    3.7590    0.7895    0.0000 H   0  0  0

+    2.5177   -2.7684    0.0000 H   0  0  0

+   -4.2666   -2.2430    0.0000 H   0  0  0

+   -2.6718   -1.7077    0.0000 H   0  0  0

+    4.2452   -1.4074    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  1  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

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+ 11  7  2  0

+ 12  8  2  0

+ 13 10  2  0

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+  5 14  1  0

+  5 15  1  0

+  7 16  1  0

+  8 17  1  0

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+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+504-29-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.8999   -0.0391    0.0020 C   0  0  0

+   -0.1886   -1.2349    0.0013 C   0  0  0

+   -0.2647    1.1226    0.0011 N   0  0  0

+   -2.2897   -0.0642   -0.0022 N   0  0  0

+    1.1938   -1.1952   -0.0004 C   0  0  0

+    1.0532    1.1906   -0.0005 C   0  0  0

+    1.8213    0.0438   -0.0013 C   0  0  0

+   -0.6884   -2.1438    0.0000 H   0  0  0

+   -2.8244    0.8246    0.0000 H   0  0  0

+   -2.7920   -0.9717    0.0000 H   0  0  0

+    1.7495   -2.0710    0.0000 H   0  0  0

+    1.5179    2.1179    0.0000 H   0  0  0

+    2.8566    0.1067    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  6  7  2  0

+  2  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-72-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+   -0.1429   -0.4927   -0.2579 C   0  0  0

+   -1.2411    0.5326    0.0312 C   0  0  0

+    1.1793    0.2153   -0.4046 C   0  0  0

+   -2.5835   -0.1862    0.1801 C   0  0  0

+    2.0929   -0.0517    0.3387 O   0  0  0

+   -0.9964   -1.2269    0.0000 H   0  0  0

+    0.4937   -1.4213    0.0000 H   0  0  0

+   -0.3876    1.2668    0.0000 H   0  0  0

+   -1.8777    1.4612    0.0000 H   0  0  0

+    1.0628    1.3351    0.0000 H   0  0  0

+   -3.1150    0.8063    0.0000 H   0  0  0

+   -3.5760   -0.7177    0.0000 H   0  0  0

+   -2.0520   -1.1787    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  2  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2873-97-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    0.8028   -1.2037    0.0575 C   0  0  0

+   -0.3777   -0.6760    0.7461 N   0  0  0

+    1.3619   -0.1372   -0.8864 C   0  0  0

+    1.8683   -1.5814    1.0885 C   0  0  0

+    0.4111   -2.4436   -0.7488 C   0  0  0

+   -1.3993   -0.1611    0.0337 C   0  0  0

+    1.5476    1.1539   -0.1317 C   0  0  0

+   -2.5262    0.4843    0.7248 C   0  0  0

+   -1.3896   -0.2299   -1.1804 O   0  0  0

+    2.2497    2.3154   -0.7868 C   0  0  0

+    1.1338    1.2579    0.9980 O   0  0  0

+   -3.5344    0.9925    0.0218 C   0  0  0

+   -0.7653   -1.4917    0.0000 H   0  0  0

+    1.9281   -0.8408    0.0000 H   0  0  0

+    2.2329    0.1014    0.0000 H   0  0  0

+    1.5666   -2.4326    0.0000 H   0  0  0

+    2.7195   -1.8831    0.0000 H   0  0  0

+    2.1700   -0.7302    0.0000 H   0  0  0

+   -0.4501   -2.1715    0.0000 H   0  0  0

+    0.1390   -3.3048    0.0000 H   0  0  0

+    1.2723   -2.7157    0.0000 H   0  0  0

+   -2.0984    1.2797    0.0000 H   0  0  0

+    3.0226    1.8482    0.0000 H   0  0  0

+    2.7169    3.0883    0.0000 H   0  0  0

+    1.4768    2.7826    0.0000 H   0  0  0

+   -3.5856    1.8942    0.0000 H   0  0  0

+   -4.2897    0.4973    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  6  8  1  0

+  6  9  2  0

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+  8 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24934-91-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    0.9422    0.0393   -0.0940 P   0  0  0

+    1.1522   -1.2618   -1.0187 O   0  0  0

+    0.9655    1.3607   -1.0136 O   0  0  0

+   -0.9244   -0.0955    0.9021 S   0  0  0

+    2.3128    0.1344    1.1650 S   0  0  0

+    1.1802   -2.3907   -0.1431 C   0  0  0

+    0.7954    2.4767   -0.1374 C   0  0  0

+   -2.0457   -0.0563   -0.5233 C   0  0  0

+    1.3782   -3.6672   -0.9629 C   0  0  0

+    0.8084    3.7715   -0.9524 C   0  0  0

+   -3.7516   -0.1596    0.0511 Cl  0  0  0

+    0.3004   -1.9594    0.0000 H   0  0  0

+    0.3911   -2.9715    0.0000 H   0  0  0

+   -0.0737    2.9290    0.0000 H   0  0  0

+   -0.0014    1.9065    0.0000 H   0  0  0

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+    0.4100   -3.8174    0.0000 H   0  0  0

+    1.5284   -4.6354    0.0000 H   0  0  0

+    2.3464   -3.5170    0.0000 H   0  0  0

+    1.7882    3.7617    0.0000 H   0  0  0

+    0.8182    4.7513    0.0000 H   0  0  0

+   -0.1714    3.7813    0.0000 H   0  0  0

+  1  2  1  0

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+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+618-46-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.7982    0.6734   -0.0012 C   0  0  0

+   -3.3153   -0.1705   -0.0017 Cl  0  0  0

+   -1.7789    1.8863    0.0044 O   0  0  0

+   -0.5343   -0.0834   -0.0015 C   0  0  0

+    0.6889    0.5926   -0.0011 C   0  0  0

+   -0.5527   -1.4814    0.0037 C   0  0  0

+    1.8690   -0.1237   -0.0013 C   0  0  0

+    0.6341   -2.1835    0.0034 C   0  0  0

+    3.3901    0.7130   -0.0003 Cl  0  0  0

+    1.8420   -1.5082   -0.0020 C   0  0  0

+    0.7101    1.6358    0.0000 H   0  0  0

+   -1.4624   -1.9923    0.0000 H   0  0  0

+    0.6214   -3.2268    0.0000 H   0  0  0

+    2.7368   -2.0449    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  2  0

+  9  7  1  0

+ 10  7  2  0

+  8 10  1  0

+  5 11  1  0

+  6 12  1  0

+  8 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58775-50-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 51                          1 V2000

+    2.4450    0.3660    0.1806 C   0  0  0

+    2.0732   -0.9442    0.4695 C   0  0  0

+    3.9483    0.3814    0.0021 C   0  0  1

+    1.4950    1.3625    0.0997 C   0  0  0

+    0.7365   -1.2434    0.7115 C   0  0  0

+    3.1529   -1.7721    0.4545 O   0  0  0

+    4.3557   -1.0018    0.6005 C   0  0  1

+    4.2724    0.1819   -1.4666 C   0  0  0

+    4.5941    1.5012    0.6113 O   0  0  0

+    0.1474    1.0476    0.3090 C   0  0  0

+    1.8639    2.6379   -0.1800 O   0  0  0

+   -0.2436   -0.2556    0.6568 C   0  0  0

+    5.3118   -1.4629   -0.3731 O   0  0  0

+    5.0377   -0.8831   -1.5629 C   0  0  0

+   -0.9041    2.0728    0.1587 C   0  0  0

+   -1.5058   -0.5944    0.9428 O   0  0  0

+   -2.2709    1.5170    0.0510 C   0  0  0

+   -0.6679    3.2672    0.1262 O   0  0  0

+   -2.4724    0.1875    0.4509 C   0  0  0

+   -3.3256    2.2979   -0.4300 C   0  0  0

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+   -2.0569   -3.8038    0.8102 C   0  0  0

+    0.4562   -2.2019    0.0000 H   0  0  0

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+   -2.4107   -5.4744    0.0000 H   0  0  0

+   -1.6858   -4.2623    0.0000 H   0  0  0

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+ 29 45  1  0

+ 29 46  1  0

+ 29 47  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6334-18-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -2.4574   -0.7009    0.0005 C   0  0  0

+   -3.5937   -0.2773    0.0010 O   0  0  0

+   -1.3234    0.2357    0.0015 C   0  0  0

+   -0.0105   -0.2492    0.0009 C   0  0  0

+   -1.5514    1.6161   -0.0028 C   0  0  0

+    0.2863   -1.9596   -0.0010 Cl  0  0  0

+    1.0489    0.6385    0.0013 C   0  0  0

+   -0.4840    2.4879   -0.0024 C   0  0  0

+    2.6791    0.0417    0.0000 Cl  0  0  0

+    0.8126    2.0023    0.0024 C   0  0  0

+   -2.2841   -1.7303    0.0000 H   0  0  0

+   -2.5279    1.9849    0.0000 H   0  0  0

+   -0.6537    3.5179    0.0000 H   0  0  0

+    1.6163    2.6684    0.0000 H   0  0  0

+  2  1  2  0

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+ 10  7  2  0

+  8 10  1  0

+  1 11  1  0

+  5 12  1  0

+  8 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+112-95-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 62 61                          1 V2000

+    0.6222   -0.4450   -0.0049 C   0  0  0

+   -0.6222    0.4450    0.0049 C   0  0  0

+    1.8762    0.4316    0.0047 C   0  0  0

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+ 20 61  1  0

+ 20 62  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+127-47-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 56                          1 V2000

+    4.6438   -0.2457   -0.2116 C   0  0  0

+    5.5159    0.4606    0.7852 C   0  0  0

+    4.9334   -1.4240   -0.7345 C   0  0  0

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+    6.1665   -2.2078   -0.3904 C   0  0  0

+    3.9711   -2.0147   -1.7325 C   0  0  0

+    2.2376    0.1025    0.0063 C   0  0  0

+    7.1993   -1.2981    0.2778 C   0  0  0

+    1.0390    0.7292   -0.3901 C   0  0  0

+   -0.1270    0.4268    0.2404 C   0  0  0

+    1.0498    1.7345   -1.5127 C   0  0  0

+   -1.3256    1.0535   -0.1559 C   0  0  0

+   -2.4888    0.7518    0.4730 C   0  0  0

+   -3.7318    1.4017    0.0620 C   0  0  0

+   -4.8770    1.1046    0.6813 C   0  0  0

+   -3.7210    2.4070   -1.0607 C   0  0  0

+   -6.0077    0.4720   -0.0883 C   0  0  0

+   -6.5292   -0.6583    0.6592 O   0  0  0

+   -7.6104   -1.3167    0.2131 C   0  0  0

+   -8.2055   -2.4317    1.0339 C   0  0  0

+   -8.1066   -1.0155   -0.8466 O   0  0  0

+    3.5057    1.3200    0.0000 H   0  0  0

+    7.4071   -0.3180    0.0000 H   0  0  0

+    6.7616    0.3626    0.0000 H   0  0  0

+    7.0452    1.0587    0.0000 H   0  0  0

+    6.8074    2.3405    0.0000 H   0  0  0

+    5.5256    2.1027    0.0000 H   0  0  0

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+    5.6011   -2.9358    0.0000 H   0  0  0

+    6.8381   -2.8392    0.0000 H   0  0  0

+    3.4889   -1.2291    0.0000 H   0  0  0

+    3.1855   -2.4969    0.0000 H   0  0  0

+    4.4533   -2.8003    0.0000 H   0  0  0

+    2.1327   -0.8133    0.0000 H   0  0  0

+    7.8100   -1.9886    0.0000 H   0  0  0

+    7.8885   -0.6859    0.0000 H   0  0  0

+   -0.2319   -0.4890    0.0000 H   0  0  0

+    1.9716    1.7246    0.0000 H   0  0  0

+    1.0597    2.6563    0.0000 H   0  0  0

+    0.1280    1.7444    0.0000 H   0  0  0

+   -1.2207    1.9693    0.0000 H   0  0  0

+   -2.5937   -0.1640    0.0000 H   0  0  0

+   -5.2206    1.9600    0.0000 H   0  0  0

+   -2.7992    2.3971    0.0000 H   0  0  0

+   -3.7111    3.3288    0.0000 H   0  0  0

+   -4.6428    2.4169    0.0000 H   0  0  0

+   -6.1872    1.3762    0.0000 H   0  0  0

+   -6.9231    0.5807    0.0000 H   0  0  0

+   -9.0187   -1.9977    0.0000 H   0  0  0

+   -8.6395   -3.2449    0.0000 H   0  0  0

+   -7.3923   -2.8657    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  2  0

+  5 11  1  0

+ 10 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 15 16  2  0

+ 16 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+ 18 20  1  0

+ 20 21  1  0

+ 21 22  1  0

+ 22 23  1  0

+ 22 24  2  0

+  8 11  1  0

+  4 25  1  0

+  5 26  1  0

+  5 27  1  0

+  6 28  1  0

+  6 29  1  0

+  6 30  1  0

+  7 31  1  0

+  7 32  1  0

+  7 33  1  0

+  8 34  1  0

+  8 35  1  0

+  9 36  1  0

+  9 37  1  0

+  9 38  1  0

+ 10 39  1  0

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+ 18 48  1  0

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+ 19 51  1  0

+ 20 52  1  0

+ 20 53  1  0

+ 23 54  1  0

+ 23 55  1  0

+ 23 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-17-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.9134   -0.0299    0.0037 C   0  0  0

+   -0.3344   -1.2857    0.0033 C   0  0  0

+   -0.1178    1.1007    0.0023 C   0  0  0

+   -2.3874    0.1041   -0.0005 N   0  3  0

+    1.0409   -1.4134    0.0014 C   0  0  0

+    1.2584    0.9783    0.0005 C   0  0  0

+   -2.8984    1.2097   -0.0001 O   0  0  0

+   -3.0893   -0.8913   -0.0043 O   0  5  0

+    1.8416   -0.2802    0.0000 C   0  0  0

+    3.1951   -0.4032   -0.0014 O   0  0  0

+    3.7302    0.9218   -0.0027 C   0  0  0

+   -0.9332   -2.1322    0.0000 H   0  0  0

+   -0.5542    2.0412    0.0000 H   0  0  0

+    1.4746   -2.3552    0.0000 H   0  0  0

+    1.8547    1.8265    0.0000 H   0  0  0

+    4.6916    0.5335    0.0000 H   0  0  0

+    4.1185    1.8832    0.0000 H   0  0  0

+    2.7688    1.3101    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  1  0

+  6  9  2  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68053-32-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+   -1.6298   -0.1030    0.0680 C   0  0  2

+   -1.1540   -1.5299   -0.1234 C   0  0  2

+   -0.5859    0.9656   -0.1004 C   0  0  0

+   -1.3738   -0.9888    1.2899 C   0  0  0

+   -3.0506    0.2640   -0.2752 C   0  0  0

+    0.3100   -1.7296   -0.4733 C   0  0  1

+   -2.1362   -2.5764   -0.6534 C   0  0  0

+    0.7004    0.6491    0.0149 C   0  0  0

+   -0.9824    2.3434   -0.3895 C   0  0  0

+   -3.7827    0.7064    0.5773 O   0  0  0

+    1.1991   -0.7586    0.2984 C   0  0  2

+    0.6938   -3.0719   -0.1684 O   0  0  0

+    1.9051    1.5439   -0.1224 C   0  0  0

+   -2.1561    2.6507   -0.3848 O   0  0  0

+    2.6275   -0.7771   -0.2957 C   0  0  0

+    3.1482    0.6429    0.0487 C   0  0  0

+    4.2525    1.0607   -0.9243 C   0  0  0

+    3.6563    0.6969    1.4909 C   0  0  0

+   -2.4241   -0.7678    0.0000 H   0  0  0

+   -2.0621   -1.8124    0.0000 H   0  0  0

+   -3.4668   -0.7254    0.0000 H   0  0  0

+   -0.0549   -0.7202    0.0000 H   0  0  0

+   -2.9188   -1.8419    0.0000 H   0  0  0

+   -2.8707   -3.3590    0.0000 H   0  0  0

+   -1.3536   -3.3109    0.0000 H   0  0  0

+   -0.2326    3.1115    0.0000 H   0  0  0

+    1.6252   -1.7437    0.0000 H   0  0  0

+    0.9889   -4.1039    0.0000 H   0  0  0

+    2.6199    2.3446    0.0000 H   0  0  0

+    1.1810    2.3362    0.0000 H   0  0  0

+    2.4928   -1.8420    0.0000 H   0  0  0

+    3.6704   -1.0308    0.0000 H   0  0  0

+    4.6323    0.0568    0.0000 H   0  0  0

+    5.2564    1.4405    0.0000 H   0  0  0

+    3.8727    2.0646    0.0000 H   0  0  0

+    3.7697   -0.3704    0.0000 H   0  0  0

+    4.7236    0.8103    0.0000 H   0  0  0

+    3.5429    1.7642    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  2  0

+  3  9  1  0

+  5 10  2  0

+  6 11  1  0

+  6 12  1  0

+  8 13  1  0

+  9 14  2  0

+ 11 15  1  0

+ 13 16  1  0

+ 16 17  1  0

+ 16 18  1  0

+  2  4  1  0

+  8 11  1  0

+ 15 16  1  0

+  4 19  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+  7 24  1  0

+  7 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141-04-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+   -3.1169   -0.3248    0.1284 C   0  0  0

+   -4.3166    0.2772    0.1290 O   0  0  0

+   -1.8581    0.5038    0.1294 C   0  0  0

+   -3.0462   -1.5309    0.1321 O   0  0  0

+   -5.5294   -0.5211    0.1281 C   0  0  0

+   -0.6390   -0.4207    0.1284 C   0  0  0

+   -6.7485    0.4035    0.1291 C   0  0  0

+    0.6390    0.4205    0.1294 C   0  0  0

+   -6.7190    1.2876   -1.1193 C   0  0  0

+   -8.0265   -0.4377    0.1281 C   0  0  0

+    1.8581   -0.5041    0.1285 C   0  0  0

+    3.1169    0.3245    0.1294 C   0  0  0

+    4.3166   -0.2775    0.1288 O   0  0  0

+    3.0462    1.5307    0.1307 O   0  0  0

+    5.5294    0.5208    0.1297 C   0  0  0

+    6.7485   -0.4038    0.1288 C   0  0  0

+    6.7191   -1.2852   -1.1215 C   0  0  0

+    8.0265    0.4374    0.1298 C   0  0  0

+   -1.0777    1.3214    0.0000 H   0  0  0

+   -2.5823    1.3716    0.0000 H   0  0  0

+   -6.3098   -1.3387    0.0000 H   0  0  0

+   -4.8052   -1.3889    0.0000 H   0  0  0

+   -1.4194   -1.2383    0.0000 H   0  0  0

+    0.0852   -1.2885    0.0000 H   0  0  0

+   -5.7280    0.8893    0.0000 H   0  0  0

+    1.4194    1.2381    0.0000 H   0  0  0

+   -0.0852    1.2883    0.0000 H   0  0  0

+   -5.5894    1.2499    0.0000 H   0  0  0

+   -6.6813    2.4172    0.0000 H   0  0  0

+   -7.8486    1.3253    0.0000 H   0  0  0

+   -8.6479    0.5064    0.0000 H   0  0  0

+   -8.9706   -1.0591    0.0000 H   0  0  0

+   -7.4051   -1.3818    0.0000 H   0  0  0

+    1.0777   -1.3217    0.0000 H   0  0  0

+    2.5823   -1.3719    0.0000 H   0  0  0

+    6.3098    1.3384    0.0000 H   0  0  0

+    4.8052    1.3886    0.0000 H   0  0  0

+    5.7280   -0.8896    0.0000 H   0  0  0

+    5.5895   -1.2475    0.0000 H   0  0  0

+    6.6814   -2.4148    0.0000 H   0  0  0

+    7.8487   -1.3229    0.0000 H   0  0  0

+    8.6479   -0.5067    0.0000 H   0  0  0

+    8.9706    1.0588    0.0000 H   0  0  0

+    7.4051    1.3815    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

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+  8 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+ 13 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 16 18  1  0

+  3 19  1  0

+  3 20  1  0

+  5 21  1  0

+  5 22  1  0

+  6 23  1  0

+  6 24  1  0

+  7 25  1  0

+  8 26  1  0

+  8 27  1  0

+  9 28  1  0

+  9 29  1  0

+  9 30  1  0

+ 10 31  1  0

+ 10 32  1  0

+ 10 33  1  0

+ 11 34  1  0

+ 11 35  1  0

+ 15 36  1  0

+ 15 37  1  0

+ 16 38  1  0

+ 17 39  1  0

+ 17 40  1  0

+ 17 41  1  0

+ 18 42  1  0

+ 18 43  1  0

+ 18 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105836-99-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.6754   -0.2070   -0.0033 C   0  0  0

+   -1.1223   -1.5665   -0.0023 C   0  0  0

+   -0.8641    0.8453   -0.0035 N   0  0  0

+   -3.0778   -0.0459    0.0017 C   0  0  0

+    0.1932   -1.7535   -0.0010 N   0  0  0

+   -2.0139   -2.6609   -0.0022 C   0  0  0

+    0.4512    0.6584   -0.0027 C   0  0  0

+   -3.8783   -1.1420    0.0074 C   0  0  0

+   -3.6717    1.3100    0.0013 N   0  3  0

+    1.0044   -0.7015   -0.0006 C   0  0  0

+   -3.3522   -2.4351   -0.0031 C   0  0  0

+    1.3430    1.7527   -0.0026 C   0  0  0

+   -4.8823    1.4446    0.0056 O   0  0  0

+   -2.9499    2.2910   -0.0034 O   0  5  0

+    2.4068   -0.8626    0.0006 C   0  0  0

+    2.6813    1.5266   -0.0016 C   0  0  0

+    3.2073    0.2335    0.0007 C   0  0  0

+    4.6765    0.0530    0.0020 N   0  3  0

+    5.4095    1.0257    0.0021 O   0  0  0

+    5.1523   -1.0682    0.0029 O   0  5  0

+   -1.6553   -3.6136    0.0000 H   0  0  0

+   -4.8887   -1.0179    0.0000 H   0  0  0

+   -3.9889   -3.2293    0.0000 H   0  0  0

+    0.9846    2.7055    0.0000 H   0  0  0

+    2.8152   -1.7951    0.0000 H   0  0  0

+    3.3182    2.3208    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  9 13  2  0

+  9 14  1  0

+ 10 15  1  0

+ 12 16  2  0

+ 15 17  2  0

+ 17 18  1  0

+ 18 19  2  0

+ 18 20  1  0

+  7 10  1  0

+  8 11  1  0

+ 16 17  1  0

+  6 21  1  0

+  8 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-80-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.7546    0.7435    0.0019 C   0  0  0

+   -1.1412   -0.5912    0.0004 C   0  0  0

+    0.5934    1.0740    0.0018 C   0  0  0

+   -1.7216    1.7514   -0.0023 N   0  0  0

+   -0.1852   -1.5889   -0.0008 C   0  0  0

+   -2.6046   -0.9509    0.0005 C   0  0  0

+    1.5507    0.0697    0.0002 C   0  0  0

+    1.1572   -1.2634   -0.0009 C   0  0  0

+    2.9083    0.3979   -0.0004 N   0  0  0

+    0.8859    2.0743    0.0000 H   0  0  0

+   -1.4311    2.7523    0.0000 H   0  0  0

+   -2.7336    1.5026    0.0000 H   0  0  0

+   -0.4776   -2.5892    0.0000 H   0  0  0

+   -2.8534    0.0611    0.0000 H   0  0  0

+   -3.6166   -1.1997    0.0000 H   0  0  0

+   -2.3558   -1.9629    0.0000 H   0  0  0

+    1.8758   -2.0182    0.0000 H   0  0  0

+    3.6269   -0.3569    0.0000 H   0  0  0

+    3.2027    1.3976    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

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+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74-11-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.1503    0.0225   -0.0010 C   0  0  0

+   -2.6268    0.0360   -0.0007 C   0  0  0

+   -0.4380    1.2242    0.0007 C   0  0  0

+   -0.4602   -1.1915    0.0028 C   0  0  0

+   -3.3110   -1.1245   -0.0024 O   0  0  0

+   -3.2246    1.0935    0.0010 O   0  0  0

+    0.9405    1.2050    0.0008 C   0  0  0

+    0.9188   -1.1975    0.0030 C   0  0  0

+    1.6193   -0.0027   -0.0007 C   0  0  0

+    3.3552   -0.0185   -0.0010 Cl  0  0  0

+   -0.9460    2.1304    0.0000 H   0  0  0

+   -0.9846   -2.0883    0.0000 H   0  0  0

+   -3.8386   -2.0194    0.0000 H   0  0  0

+    1.4714    2.0980    0.0000 H   0  0  0

+    1.4333   -2.1001    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  7  9  1  0

+  9 10  1  0

+  8  9  2  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+610-30-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.4607    0.4995    0.0175 C   0  0  0

+   -0.8984   -0.8253   -0.0440 C   0  0  0

+    0.8903    0.7755    0.0432 C   0  0  0

+   -1.4445    1.6050    0.0489 N   0  3  0

+    0.0364   -1.8616   -0.0790 C   0  0  0

+   -2.3439   -1.1286   -0.0713 C   0  0  0

+    1.8115   -0.2566    0.0081 C   0  0  0

+   -1.3811    2.5002   -0.7746 O   0  0  0

+   -2.3174    1.6195    0.8982 O   0  5  0

+    1.3849   -1.5712   -0.0528 C   0  0  0

+   -2.7658   -2.4055    0.0077 O   0  0  0

+   -3.1521   -0.2266   -0.1649 O   0  0  0

+    3.2599    0.0473    0.0355 N   0  3  0

+    4.0730   -0.8590    0.0048 O   0  0  0

+    3.6385    1.2037    0.0887 O   0  5  0

+    1.2160    1.7574    0.0000 H   0  0  0

+   -0.2815   -2.8461    0.0000 H   0  0  0

+    2.0783   -2.3390    0.0000 H   0  0  0

+   -3.0904   -3.3878    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 15  1  0

+  7 10  2  0

+  3 16  1  0

+  5 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80-52-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    2.1565    0.0309    0.0144 C   0  0  0

+    0.7200    0.0107   -0.5119 C   0  0  0

+    2.8728    1.2786   -0.5060 C   0  0  0

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+    2.8648   -1.1696   -0.4493 N   0  0  0

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+   -1.4328   -1.2573   -0.5178 C   0  0  0

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+   -3.6070   -0.0272   -0.5610 C   0  0  0

+   -2.1874    0.0148    1.4340 N   0  0  0

+    1.2664   -0.9179    0.0000 H   0  0  0

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+   -3.5919   -1.1046    0.0000 H   0  0  0

+   -1.7800    1.0123    0.0000 H   0  0  0

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+ 12 33  1  0

+ 12 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2475-46-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+    0.3977    0.1672    0.1707 C   0  0  0

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+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+115664-49-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 40                          1 V2000

+   -0.6520    0.7643    0.1143 C   0  0  0

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+ 24 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+148193-34-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    1.3426    0.2131   -0.0329 C   0  0  0

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+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105-74-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 74 73                          1 V2000

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+ 26 69  1  0

+ 27 70  1  0

+ 27 71  1  0

+ 28 72  1  0

+ 28 73  1  0

+ 28 74  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1070-13-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.6765   -0.6641   -0.1043 C   0  0  0

+   -0.6642   -0.2407   -0.6466 C   0  0  0

+    1.7013    0.3403    0.1785 C   0  0  0

+    0.9268   -1.9552    0.1231 C   0  0  0

+   -1.6201    0.0360    0.5156 C   0  0  0

+    1.4720    1.5145   -0.0235 O   0  0  0

+   -2.9813    0.4659   -0.0350 C   0  0  0

+    0.0829    0.4544    0.0000 H   0  0  0

+   -0.9006    0.7520    0.0000 H   0  0  0

+    2.6757    0.0375    0.0000 H   0  0  0

+    0.1564   -2.6243    0.0000 H   0  0  0

+    1.8915   -2.2879    0.0000 H   0  0  0

+   -2.3672   -0.6591    0.0000 H   0  0  0

+   -1.3837   -0.9567    0.0000 H   0  0  0

+   -2.6740    1.4389    0.0000 H   0  0  0

+   -3.9543    0.7732    0.0000 H   0  0  0

+   -3.2886   -0.5071    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

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+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+226-36-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -1.3809   -0.2125   -0.0013 C   0  0  0

+   -2.8443   -0.3177   -0.0013 C   0  0  0

+   -0.7768    1.0699    0.0010 C   0  0  0

+   -0.5816   -1.3523    0.0023 C   0  0  0

+   -3.6107    0.8691    0.0009 C   0  0  0

+   -3.4888   -1.5552   -0.0040 C   0  0  0

+    0.5493    1.1864    0.0007 N   0  0  0

+   -1.5857    2.2329    0.0032 C   0  0  0

+    0.8070   -1.1836    0.0021 C   0  0  0

+   -2.9318    2.1600    0.0028 C   0  0  0

+   -5.0085    0.7837    0.0009 C   0  0  0

+   -4.8545   -1.6070   -0.0044 C   0  0  0

+    1.3449    0.1279   -0.0013 C   0  0  0

+    1.6953   -2.3403    0.0062 C   0  0  0

+   -5.6106   -0.4415   -0.0013 C   0  0  0

+    2.8053    0.2928   -0.0016 C   0  0  0

+    3.0352   -2.1833    0.0063 C   0  0  0

+    3.6310   -0.8514   -0.0038 C   0  0  0

+    3.3847    1.5637   -0.0002 C   0  0  0

+    5.0237   -0.6908   -0.0041 C   0  0  0

+    4.7452    1.6881   -0.0010 C   0  0  0

+    5.5611    0.5636   -0.0022 C   0  0  0

+   -1.0083   -2.3099    0.0000 H   0  0  0

+   -2.9281   -2.4410    0.0000 H   0  0  0

+   -1.1255    3.1748    0.0000 H   0  0  0

+   -3.4978    3.0424    0.0000 H   0  0  0

+   -5.5896    1.6562    0.0000 H   0  0  0

+   -5.3374   -2.5375    0.0000 H   0  0  0

+    1.2874   -3.3060    0.0000 H   0  0  0

+   -6.6571   -0.5037    0.0000 H   0  0  0

+    3.6557   -3.0283    0.0000 H   0  0  0

+    2.7780    2.4187    0.0000 H   0  0  0

+    5.6501   -1.5314    0.0000 H   0  0  0

+    5.1784    2.6428    0.0000 H   0  0  0

+    6.6029    0.6802    0.0000 H   0  0  0

+  1  2  2  0

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+ 15 30  1  0

+ 17 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1817-73-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.1301    1.1424   -0.0017 C   0  0  0

+   -1.8907   -0.0108   -0.0223 C   0  0  0

+    0.2558    1.0581    0.0145 C   0  0  0

+   -1.7918    2.4664   -0.0033 N   0  3  0

+   -1.2738   -1.2480   -0.0266 C   0  0  0

+    0.8732   -0.1874    0.0101 C   0  0  0

+    1.0280    2.2224    0.0348 N   0  0  0

+   -2.6151    2.7368    0.8526 O   0  0  0

+   -1.5130    3.2856   -0.8604 O   0  5  0

+    0.1064   -1.3363   -0.0105 C   0  0  0

+   -2.0924   -2.4811   -0.0481 N   0  3  0

+    2.7602   -0.3087    0.0328 Br  0  0  0

+   -1.5504   -3.5719   -0.0520 O   0  0  0

+   -3.3079   -2.4051   -0.0620 O   0  5  0

+   -2.9259    0.0517    0.0000 H   0  0  0

+    2.0631    2.1581    0.0000 H   0  0  0

+    0.5661    3.1509    0.0000 H   0  0  0

+    0.5660   -2.2659    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 11 14  1  0

+  6 10  2  0

+  2 15  1  0

+  7 16  1  0

+  7 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+556-52-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -0.3000   -0.0698   -0.5311 C   0  0  0

+   -1.5974   -0.6784    0.0050 C   0  0  0

+   -1.2786    0.7055    0.1641 O   0  0  0

+    0.8518   -0.4069    0.4179 C   0  0  0

+    2.0635    0.1615   -0.0829 O   0  0  0

+    0.1612    0.8218    0.0000 H   0  0  0

+   -2.6012   -0.6736    0.0000 H   0  0  0

+   -1.3813   -1.6587    0.0000 H   0  0  0

+    0.3125   -1.2535    0.0000 H   0  0  0

+    1.5145   -1.1608    0.0000 H   0  0  0

+    2.9723    0.5878    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  2  3  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4548-53-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 47                          1 V2000

+   -4.3095    3.0474    0.1198 C   0  0  0

+   -5.0105    1.8231    0.2549 C   0  0  0

+   -2.9112    3.0375   -0.0471 C   0  0  0

+   -5.0239    4.2558    0.1606 C   0  0  0

+   -4.2978    0.6089    0.2205 C   0  0  0

+   -6.4053    1.8413    0.4215 C   0  0  0

+   -2.2357    1.8619   -0.0786 C   0  0  0

+   -2.0363    4.5576   -0.2160 S   0  0  0

+   -6.3754    4.2361    0.3287 C   0  0  0

+   -2.9133    0.6350    0.0538 C   0  0  0

+   -4.9503   -0.5725    0.3485 O   0  0  0

+   -7.0653    3.0321    0.4511 C   0  0  0

+   -2.1470    4.9165   -1.5864 O   0  0  0

+   -2.4460    5.3628    0.8808 O   0  0  0

+   -0.5614    4.2620    0.0162 O   0  0  0

+   -2.2128   -0.5332    0.0189 N   0  0  0

+   -0.9322   -0.5130   -0.1352 N   0  0  0

+   -0.2294   -1.6851   -0.1702 C   0  0  0

+   -0.8949   -2.9072   -0.0394 C   0  0  0

+    1.1571   -1.6674   -0.3427 C   0  0  0

+   -0.1794   -4.0853   -0.0762 C   0  0  0

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+   -1.0142   -6.2084   -1.2076 O   0  0  0

+   -0.4863   -6.2303    1.2616 O   0  0  0

+   -2.4738   -5.3224    0.4034 O   0  0  0

+   14.0890    1.5464   -0.2441 Na  0  3  0

+   22.6678    2.4837    0.4810 Na  0  3  0

+   -4.5159    5.1616    0.0000 H   0  0  0

+   -6.9383    0.9499    0.0000 H   0  0  0

+   -1.1972    1.8707    0.0000 H   0  0  0

+   -6.9027    5.1309    0.0000 H   0  0  0

+   -5.4524   -1.4816    0.0000 H   0  0  0

+   -8.1038    3.0395    0.0000 H   0  0  0

+   -1.9332   -2.9317    0.0000 H   0  0  0

+    2.8979   -2.8382    0.0000 H   0  0  0

+    2.7919   -0.8580    0.0000 H   0  0  0

+    2.3860    0.5535    0.0000 H   0  0  0

+    0.9745    0.1476    0.0000 H   0  0  0

+    1.0785   -5.8859    0.0000 H   0  0  0

+    2.5033   -6.2425    0.0000 H   0  0  0

+    2.8599   -4.8177    0.0000 H   0  0  0

+    0.4569    4.0579    0.0000 H   0  0  0

+   -3.4904   -5.1098    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 26 43  1  0

+ 26 44  1  0

+ 26 45  1  0

+ 15 46  1  0

+ 29 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+135086-93-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -3.1244   -0.5780   -0.0003 C   0  0  0

+   -4.5947   -0.5647   -0.0010 C   0  0  0

+   -2.7192    0.7558    0.0011 C   0  0  0

+   -2.2103   -1.5609    0.0041 N   0  0  0

+   -4.9799    0.7868    0.0000 C   0  0  0

+   -5.5661   -1.5661   -0.0024 C   0  0  0

+   -3.8388    1.5601    0.0013 N   0  0  0

+   -1.3330    1.0411    0.0016 C   0  0  0

+   -0.9495   -1.3083    0.0041 N   0  0  0

+   -6.3356    1.1075   -0.0007 C   0  0  0

+   -6.8906   -1.2295   -0.0027 C   0  0  0

+   -0.4658    0.0047    0.0007 N   0  0  0

+   -0.9313    2.1930    0.0024 O   0  0  0

+   -7.2779    0.1032   -0.0025 C   0  0  0

+    0.9146    0.2443    0.0007 N   0  0  0

+    1.7472   -0.7533   -0.0001 C   0  0  0

+    3.1992   -0.5013   -0.0001 C   0  0  0

+    4.0976   -1.5722   -0.0010 C   0  0  0

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+    5.4546   -1.3293   -0.0009 C   0  0  0

+    5.0438    1.0381   -0.0047 C   0  0  0

+    5.9285   -0.0275    0.0001 C   0  0  0

+    7.6389    0.2694    0.0008 Cl  0  0  0

+   -5.2828   -2.5667    0.0000 H   0  0  0

+   -3.8246    2.6000    0.0000 H   0  0  0

+   -6.6354    2.1033    0.0000 H   0  0  0

+   -7.6134   -1.9772    0.0000 H   0  0  0

+   -8.2892    0.3457    0.0000 H   0  0  0

+    1.3889   -1.7296    0.0000 H   0  0  0

+    3.7431   -2.5499    0.0000 H   0  0  0

+    3.0207    1.6103    0.0000 H   0  0  0

+    6.1241   -2.1251    0.0000 H   0  0  0

+    5.4059    2.0130    0.0000 H   0  0  0

+  1  2  1  0

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+  5  7  1  0

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+ 14 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7119-89-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    0.1545    0.0936   -0.5512 C   0  0  0

+   -1.1676   -0.3264   -0.0803 N   0  3  0

+    0.5766    1.6850    0.1836 Cl  0  0  0

+    1.3825   -1.1355   -0.0694 Cl  0  0  0

+   -1.2917   -1.3706    0.5344 O   0  0  0

+   -2.1427    0.3686   -0.3034 O   0  5  0

+   -0.5987    0.8113    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  1  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+817-99-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.9118   -0.1396   -0.0009 C   0  0  0

+   -0.3665    0.2877   -0.0002 N   0  0  0

+    1.9615    0.7895    0.0003 C   0  0  0

+    1.1550   -1.3337    0.0025 O   0  0  0

+   -1.4634   -0.6833   -0.0014 C   0  0  0

+    3.1470    0.3932   -0.0004 N   0  3  0

+   -2.7813    0.0477   -0.0002 C   0  0  0

+    4.2130    0.0368   -0.0010 N   0  5  0

+   -3.9367   -0.6461   -0.0011 N   0  0  0

+   -2.8021    1.2603    0.0015 O   0  0  0

+   -0.5683    1.2781    0.0000 H   0  0  0

+    1.7597    1.7799    0.0000 H   0  0  0

+   -2.0504   -1.5061    0.0000 H   0  0  0

+   -0.7122   -1.3596    0.0000 H   0  0  0

+   -4.8206   -0.1558    0.0000 H   0  0  0

+   -3.9193   -1.6567    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

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+  7 10  2  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  5 14  1  0

+  9 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+73-31-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+   -1.0667   -0.5844    0.2701 C   0  0  0

+   -1.9710   -1.5083   -0.2830 C   0  0  0

+    0.1668   -1.3306    0.5307 C   0  0  0

+   -1.4552    0.7433    0.4624 C   0  0  0

+   -1.3215   -2.7231   -0.3480 N   0  0  0

+   -3.2483   -1.0881   -0.6392 C   0  0  0

+   -0.0501   -2.5968    0.1410 C   0  0  0

+    1.4383   -0.7808    1.1239 C   0  0  0

+   -2.7287    1.1395    0.1067 C   0  0  0

+   -3.6190    0.2242   -0.4493 C   0  0  0

+    2.3448   -0.2694    0.0025 C   0  0  0

+   -3.1126    2.4310    0.2916 O   0  0  0

+    3.5810    0.2650    0.5792 N   0  0  0

+   -4.4629    2.5300   -0.1655 C   0  0  0

+    4.5349    0.7741   -0.2254 C   0  0  0

+    5.8064    1.3239    0.3679 C   0  0  0

+    4.3699    0.7898   -1.4268 O   0  0  0

+   -0.7355    1.4509    0.0000 H   0  0  0

+   -1.7968   -3.6134    0.0000 H   0  0  0

+   -3.9770   -1.7864    0.0000 H   0  0  0

+    0.6379   -3.3352    0.0000 H   0  0  0

+    1.3573   -1.7868    0.0000 H   0  0  0

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+    4.0192   -0.6442    0.0000 H   0  0  0

+   -4.3891    3.5366    0.0000 H   0  0  0

+   -5.4695    2.6038    0.0000 H   0  0  0

+   -4.5367    1.5234    0.0000 H   0  0  0

+    6.2070    0.3975    0.0000 H   0  0  0

+    6.7328    1.7245    0.0000 H   0  0  0

+    5.4058    2.2503    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  6 10  2  0

+  8 11  1  0

+  9 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 15 16  1  0

+ 15 17  2  0

+  5  7  1  0

+  9 10  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+139-40-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    1.1487   -0.7233   -0.0521 C   0  0  0

+   -0.0002   -1.3890   -0.0026 N   0  0  0

+    1.1456    0.6074   -0.0513 N   0  0  0

+    2.3441   -1.4112   -0.0985 N   0  0  0

+   -1.1488   -0.7232    0.0475 C   0  0  0

+    0.0001    1.2676   -0.0013 C   0  0  0

+    3.6104   -0.6764   -0.1530 C   0  0  0

+   -1.1453    0.6078    0.0480 N   0  0  0

+   -2.3441   -1.4108    0.0994 N   0  0  0

+    0.0004    3.0036    0.0002 Cl  0  0  0

+    4.1102   -0.4155    1.2693 C   0  0  0

+    4.6479   -1.5041   -0.9143 C   0  0  0

+   -3.6102   -0.6758    0.1547 C   0  0  0

+   -4.1137   -0.4197   -1.2672 C   0  0  0

+   -4.6457   -1.5007    0.9216 C   0  0  0

+    2.3459   -2.4071    0.0000 H   0  0  0

+    3.1299    0.1959    0.0000 H   0  0  0

+   -2.3461   -2.4067    0.0000 H   0  0  0

+    4.5710   -1.2983    0.0000 H   0  0  0

+    4.9930    0.0453    0.0000 H   0  0  0

+    3.6494    0.4673    0.0000 H   0  0  0

+    4.0268   -2.2826    0.0000 H   0  0  0

+    5.4264   -2.1252    0.0000 H   0  0  0

+    5.2690   -0.7256    0.0000 H   0  0  0

+   -3.1343    0.1990    0.0000 H   0  0  0

+   -3.6622    0.4679    0.0000 H   0  0  0

+   -5.0013    0.0318    0.0000 H   0  0  0

+   -4.5652   -1.3073    0.0000 H   0  0  0

+   -5.2662   -0.7218    0.0000 H   0  0  0

+   -5.4246   -2.1212    0.0000 H   0  0  0

+   -4.0252   -2.2796    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 13 14  1  0

+ 13 15  1  0

+  6  8  2  0

+  4 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129-43-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -1.1570    0.3129    0.0415 C   0  0  0

+   -0.9242   -1.0765    0.0273 C   0  0  0

+   -0.0227    1.2431    0.1975 C   0  0  0

+   -2.4598    0.7968   -0.0981 C   0  0  0

+    0.4564   -1.5884    0.1687 C   0  0  0

+   -1.9917   -1.9533   -0.1196 C   0  0  0

+    1.3570    0.7350    0.0307 C   0  0  0

+   -0.2192    2.4136    0.4598 O   0  0  0

+   -3.5150   -0.1000   -0.2499 C   0  0  0

+   -2.6961    2.1317   -0.0854 O   0  0  0

+    1.5916   -0.6523    0.0168 C   0  0  0

+    0.6554   -2.7633    0.4063 O   0  0  0

+   -3.2808   -1.4592   -0.2522 C   0  0  0

+    2.4232    1.6162   -0.1131 C   0  0  0

+    2.8882   -1.1312   -0.1398 C   0  0  0

+    3.7073    1.1231   -0.2686 C   0  0  0

+    3.9381   -0.2404   -0.2811 C   0  0  0

+   -1.8256   -2.9771    0.0000 H   0  0  0

+   -4.4900    0.2536    0.0000 H   0  0  0

+   -2.8769    3.1530    0.0000 H   0  0  0

+   -4.0822   -2.1176    0.0000 H   0  0  0

+    2.2559    2.6398    0.0000 H   0  0  0

+    3.0687   -2.1525    0.0000 H   0  0  0

+    4.5099    1.7800    0.0000 H   0  0  0

+    4.9125   -0.5958    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  7 14  1  0

+ 11 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+  7 11  2  0

+  9 13  2  0

+ 16 17  1  0

+  6 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-55-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.7370    0.1244    0.0036 C   0  0  0

+    0.1201   -0.9582    0.0033 C   0  0  0

+   -0.2288    1.4108    0.0017 C   0  0  0

+   -2.2011   -0.0920   -0.0003 N   0  3  0

+    1.4944   -0.7541    0.0012 C   0  0  0

+    1.1383    1.6174   -0.0005 C   0  0  0

+   -2.9578    0.8624   -0.0001 O   0  0  0

+   -2.6493   -1.2245   -0.0037 O   0  5  0

+    2.0013    0.5389   -0.0007 C   0  0  0

+    2.3643   -1.8470    0.0004 N   0  0  0

+    3.4912    0.7651   -0.0035 C   0  0  0

+   -0.2616   -1.9228    0.0000 H   0  0  0

+   -0.8748    2.2224    0.0000 H   0  0  0

+    1.5163    2.5834    0.0000 H   0  0  0

+    1.9844   -2.8123    0.0000 H   0  0  0

+    3.3902   -1.6933    0.0000 H   0  0  0

+    3.6469   -0.2605    0.0000 H   0  0  0

+    4.5168    0.9208    0.0000 H   0  0  0

+    3.3355    1.7907    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  9 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-50-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.0001   -1.0056   -0.0001 N   0  0  0

+   -1.1444   -0.3449    0.0001 C   0  0  0

+    1.1444   -0.3450   -0.0001 C   0  0  0

+   -1.1445    1.0385   -0.0001 C   0  0  0

+   -2.4494   -1.0985    0.0001 C   0  0  0

+    1.1443    1.0389    0.0001 C   0  0  0

+    2.4495   -1.0984    0.0001 C   0  0  0

+    0.0000    1.6994   -0.0001 N   0  0  0

+   -2.0230    1.5456    0.0000 H   0  0  0

+   -2.9567   -0.2201    0.0000 H   0  0  0

+   -3.3278   -1.6058    0.0000 H   0  0  0

+   -1.9421   -1.9769    0.0000 H   0  0  0

+    2.0227    1.5462    0.0000 H   0  0  0

+    1.9424   -1.9769    0.0000 H   0  0  0

+    3.3280   -1.6055    0.0000 H   0  0  0

+    2.9566   -0.2199    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-94-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.9780   -0.2858    0.0021 C   0  0  0

+   -0.1215   -1.3765    0.0014 C   0  0  0

+   -0.4624    1.0020    0.0017 C   0  0  0

+   -2.3242   -0.4788   -0.0025 O   0  0  0

+    1.2459   -1.1814    0.0003 C   0  0  0

+    0.9044    1.1989    0.0006 C   0  0  0

+   -2.9273    0.8167   -0.0005 C   0  0  0

+    1.7629    0.1072   -0.0002 C   0  0  0

+    3.1481    0.3058   -0.0018 N   0  0  0

+   -0.5090   -2.3420    0.0000 H   0  0  0

+   -1.1056    1.8197    0.0000 H   0  0  0

+    1.8883   -1.9998    0.0000 H   0  0  0

+    1.2909    2.1648    0.0000 H   0  0  0

+   -1.9841    1.2558    0.0000 H   0  0  0

+   -3.3664    1.7599    0.0000 H   0  0  0

+   -3.8705    0.3776    0.0000 H   0  0  0

+    3.7909   -0.5123    0.0000 H   0  0  0

+    3.5352    1.2715    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  8  9  1  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+610-49-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.0643    0.3974   -0.0029 C   0  0  0

+   -0.8955   -1.0591   -0.0016 C   0  0  0

+    0.0490    1.2325   -0.0029 C   0  0  0

+   -2.3782    0.9295    0.0017 C   0  0  0

+    0.3822   -1.6168    0.0002 C   0  0  0

+   -2.0463   -1.8760   -0.0017 C   0  0  0

+    1.3272    0.6757   -0.0016 C   0  0  0

+   -3.4463    0.0786    0.0072 C   0  0  0

+   -2.5779    2.3075    0.0002 N   0  0  0

+    1.4972   -0.7809    0.0007 C   0  0  0

+   -3.2786   -1.3038   -0.0030 C   0  0  0

+    2.4780    1.4927   -0.0011 C   0  0  0

+    2.8055   -1.3111    0.0020 C   0  0  0

+    3.7077    0.9177    0.0007 C   0  0  0

+    3.8696   -0.4682    0.0021 C   0  0  0

+   -0.0724    2.2710    0.0000 H   0  0  0

+    0.5031   -2.6554    0.0000 H   0  0  0

+   -1.9510   -2.9172    0.0000 H   0  0  0

+   -4.4139    0.4749    0.0000 H   0  0  0

+   -1.7567    2.9548    0.0000 H   0  0  0

+   -3.5490    2.6950    0.0000 H   0  0  0

+   -4.1244   -1.9185    0.0000 H   0  0  0

+    2.3840    2.5341    0.0000 H   0  0  0

+    2.9539   -2.3461    0.0000 H   0  0  0

+    4.5557    1.5293    0.0000 H   0  0  0

+    4.8358   -0.8679    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+ 10 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+  7 10  1  0

+  8 11  2  0

+ 14 15  1  0

+  3 16  1  0

+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102-13-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    1.9348    0.3567    0.4535 C   0  0  0

+    0.5689    0.7130    0.9813 C   0  0  0

+    2.5134    1.1237   -0.5408 C   0  0  0

+    2.6115   -0.7333    0.9675 C   0  0  0

+   -0.4840    0.0028    0.1701 C   0  0  0

+    3.7660    0.7969   -1.0248 C   0  0  0

+    3.8646   -1.0602    0.4833 C   0  0  0

+   -1.7832    0.1717    0.4618 O   0  0  0

+   -0.1586   -0.7186   -0.7430 O   0  0  0

+    4.4405   -0.2969   -0.5148 C   0  0  0

+   -2.7977   -0.5126   -0.3198 C   0  0  0

+   -4.1844   -0.1509    0.2160 C   0  0  0

+   -4.3933    1.3612    0.1108 C   0  0  0

+   -5.2534   -0.8719   -0.6076 C   0  0  0

+    1.0283    1.5621    0.0000 H   0  0  0

+   -0.1462    1.3616    0.0000 H   0  0  0

+    2.1963    2.0356    0.0000 H   0  0  0

+    2.0387   -1.5104    0.0000 H   0  0  0

+    4.3400    1.5732    0.0000 H   0  0  0

+    4.1817   -1.9721    0.0000 H   0  0  0

+    5.4049   -0.3422    0.0000 H   0  0  0

+   -3.2571   -1.3617    0.0000 H   0  0  0

+   -2.0826   -1.1612    0.0000 H   0  0  0

+   -4.0219   -1.1026    0.0000 H   0  0  0

+   -3.4370    1.4933    0.0000 H   0  0  0

+   -4.5254    2.3175    0.0000 H   0  0  0

+   -5.3496    1.2291    0.0000 H   0  0  0

+   -5.7932   -0.0715    0.0000 H   0  0  0

+   -6.0538   -1.4117    0.0000 H   0  0  0

+   -4.7136   -1.6723    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  8 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 12 14  1  0

+  7 10  2  0

+  2 15  1  0

+  2 16  1  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+63390-11-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -0.3349    0.0002   -0.0027 C   0  0  0

+   -1.8181    0.0006   -0.0020 C   0  0  0

+    0.3634    1.2052   -0.0687 C   0  0  0

+    0.3627   -1.2044    0.0684 C   0  0  0

+   -2.5169   -0.9681   -0.7214 C   0  0  0

+   -2.5155    0.9658    0.7225 C   0  0  0

+    1.7431    1.2028   -0.0693 C   0  0  0

+    1.7428   -1.2028    0.0676 C   0  0  0

+   -3.8954   -0.9658   -0.7194 C   0  0  0

+   -3.8944    0.9643    0.7217 C   0  0  0

+    2.4373   -0.0005   -0.0046 C   0  0  0

+    2.6131    2.7029   -0.1514 Cl  0  0  0

+    2.6121   -2.7028    0.1566 Cl  0  0  0

+   -4.5889    0.0013   -0.0008 C   0  0  0

+    3.8350   -0.0009   -0.0057 N   0  0  0

+   -5.9852    0.0017   -0.0002 N   0  0  0

+   -0.1558    2.1079    0.0000 H   0  0  0

+   -0.1569   -2.1069    0.0000 H   0  0  0

+   -2.0433   -1.8955    0.0000 H   0  0  0

+   -2.0420    1.8933    0.0000 H   0  0  0

+   -4.3718   -1.8918    0.0000 H   0  0  0

+   -4.3693    1.8911    0.0000 H   0  0  0

+    4.3554   -0.9029    0.0000 H   0  0  0

+    4.3559    0.9008    0.0000 H   0  0  0

+   -6.5056    0.9037    0.0000 H   0  0  0

+   -6.5061   -0.9000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 14 16  1  0

+  8 11  2  0

+ 10 14  2  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+585-07-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    1.7133    0.1507    0.0106 C   0  0  0

+    0.3422    0.6198   -0.0801 O   0  0  0

+    2.0204   -0.7604   -1.1795 C   0  0  0

+    2.6644    1.3491   -0.0059 C   0  0  0

+    1.9000   -0.6307    1.3127 C   0  0  0

+   -0.6763   -0.2622   -0.0347 C   0  0  0

+   -2.0642    0.2193    0.0013 C   0  0  0

+   -0.4466   -1.4556   -0.0234 O   0  0  0

+   -2.3490    1.6991   -0.0126 C   0  0  0

+   -3.0696   -0.6514    0.0461 C   0  0  0

+    1.0628   -1.0832    0.0000 H   0  0  0

+    2.3432   -1.7180    0.0000 H   0  0  0

+    2.9780   -0.4376    0.0000 H   0  0  0

+    3.4559    0.7209    0.0000 H   0  0  0

+    3.2926    2.1406    0.0000 H   0  0  0

+    1.8729    1.9773    0.0000 H   0  0  0

+    0.9172   -0.8655    0.0000 H   0  0  0

+    2.1348   -1.6135    0.0000 H   0  0  0

+    2.8828   -0.3959    0.0000 H   0  0  0

+   -1.3567    1.8901    0.0000 H   0  0  0

+   -2.5400    2.6914    0.0000 H   0  0  0

+   -3.3413    1.5081    0.0000 H   0  0  0

+   -4.0244   -0.3206    0.0000 H   0  0  0

+   -2.8786   -1.6437    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  6  8  2  0

+  7  9  1  0

+  7 10  2  0

+  3 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  5 19  1  0

+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19660-16-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.1401    0.4952   -0.2010 C   0  0  0

+   -1.2083    0.9939    0.3225 C   0  0  0

+    1.2705    1.2515    0.4999 C   0  0  0

+    0.3139   -1.4287    0.1641 Br  0  0  0

+   -2.2811    0.2762   -0.3427 O   0  0  0

+    3.0032    0.6107   -0.1728 Br  0  0  0

+   -3.5653    0.5506   -0.0387 C   0  0  0

+   -4.6510   -0.1757   -0.7119 C   0  0  0

+   -3.8253    1.3987    0.7920 O   0  0  0

+   -5.9190    0.0952   -0.4118 C   0  0  0

+    0.0244    1.4733    0.0000 H   0  0  0

+   -0.6825    1.8267    0.0000 H   0  0  0

+   -1.9139    1.6811    0.0000 H   0  0  0

+    1.7963    2.0843    0.0000 H   0  0  0

+    0.5649    1.9387    0.0000 H   0  0  0

+   -4.4654   -1.1429    0.0000 H   0  0  0

+   -6.2224    1.0322    0.0000 H   0  0  0

+   -6.5788   -0.6360    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  7  9  2  0

+  8 10  2  0

+  1 11  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  3 15  1  0

+  8 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83504-80-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.6290   -0.7800   -0.0097 C   0  0  0

+   -1.0138   -1.3920   -0.1863 S   0  0  0

+    1.1992   -0.6737    1.2644 C   0  0  0

+    1.3594   -0.4081   -1.1450 C   0  0  0

+   -2.3819   -0.2867   -0.0795 C   0  0  0

+    2.4661   -0.2029    1.4089 C   0  0  0

+    2.6272    0.0644   -1.0171 C   0  0  0

+   -3.6806   -0.7826   -0.0878 C   0  0  0

+   -2.1652    1.0824    0.0191 C   0  0  0

+    3.2087    0.1800    0.2675 C   0  0  0

+   -4.7500    0.0864   -0.0040 C   0  0  0

+   -3.2399    1.9456    0.1026 C   0  0  0

+    4.4489    0.6419    0.4009 N   0  0  0

+   -4.5305    1.4491    0.0882 C   0  0  0

+    5.0855    0.9707   -0.5841 O   0  0  0

+    1.4724   -1.6607    0.0000 H   0  0  0

+    0.9476    0.5295    0.0000 H   0  0  0

+    2.8799   -1.1397    0.0000 H   0  0  0

+    2.3476    1.0496    0.0000 H   0  0  0

+   -3.8426   -1.7938    0.0000 H   0  0  0

+   -1.2099    1.4514    0.0000 H   0  0  0

+   -5.7069   -0.2785    0.0000 H   0  0  0

+   -3.0821    2.9575    0.0000 H   0  0  0

+   -5.3258    2.0943    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+ 13 15  2  0

+  7 10  1  0

+ 12 14  2  0

+  3 16  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-70-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    0.6010   -1.0759   -0.2778 C   0  0  0

+   -0.7883   -0.5215    0.0439 C   0  0  0

+    1.6339   -0.0007   -0.0589 C   0  0  0

+   -0.9032    0.8055   -0.4736 O   0  0  0

+   -1.8540   -1.4129   -0.5968 C   0  0  0

+   -0.9887   -0.4966    1.5606 C   0  0  0

+    3.1005   -0.3336   -0.1566 C   0  0  0

+    1.2865    1.1277    0.1947 O   0  0  0

+   -2.2150    1.2656   -0.1428 C   0  0  0

+    0.0938   -1.9865    0.0000 H   0  0  0

+    1.4390   -1.6957    0.0000 H   0  0  0

+   -2.5227   -0.6134    0.0000 H   0  0  0

+   -2.6535   -2.0816    0.0000 H   0  0  0

+   -1.1853   -2.2124    0.0000 H   0  0  0

+   -0.8602    0.5378    0.0000 H   0  0  0

+   -2.0231   -0.3681    0.0000 H   0  0  0

+   -1.1172   -1.5310    0.0000 H   0  0  0

+    2.8698   -1.3501    0.0000 H   0  0  0

+    4.1170   -0.5643    0.0000 H   0  0  0

+    3.3312    0.6829    0.0000 H   0  0  0

+   -1.8700    2.2492    0.0000 H   0  0  0

+   -3.1986    1.6106    0.0000 H   0  0  0

+   -2.5600    0.2820    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  1 10  1  0

+  1 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  7 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+609-65-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.2348    0.3762   -0.0013 C   0  0  0

+   -2.7771   -0.4208   -0.0015 Cl  0  0  0

+   -1.1783    1.5880    0.0042 O   0  0  0

+    0.0045   -0.4186   -0.0016 C   0  0  0

+    1.2495    0.2198   -0.0013 C   0  0  0

+   -0.0564   -1.8158    0.0037 C   0  0  0

+    1.3389    1.9535   -0.0001 Cl  0  0  0

+    2.4070   -0.5336   -0.0017 C   0  0  0

+    1.1082   -2.5531    0.0034 C   0  0  0

+    2.3369   -1.9147   -0.0022 C   0  0  0

+   -0.9815   -2.2991    0.0000 H   0  0  0

+    3.3368   -0.0595    0.0000 H   0  0  0

+    1.0637   -3.5958    0.0000 H   0  0  0

+    3.2149   -2.4789    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  5  1  0

+  9  6  2  0

+ 10  8  2  0

+  9 10  1  0

+  6 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78415-72-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -0.1973   -0.1617   -0.0018 C   0  0  0

+   -1.6514    0.1317   -0.0011 C   0  0  0

+    0.7295    0.8952   -0.0004 C   0  0  0

+    0.2380   -1.4678    0.0019 C   0  0  0

+   -2.3533    0.2801    1.1985 C   0  0  0

+   -2.3561    0.2732   -1.2004 C   0  0  0

+    2.0876    0.5946   -0.0007 C   0  0  0

+    1.5492   -1.7748    0.0018 N   0  0  0

+   -0.7776   -2.5811    0.0066 C   0  0  0

+   -3.7049    0.5530    1.1538 C   0  0  0

+   -3.7071    0.5464   -1.1544 C   0  0  0

+    2.4915   -0.8127   -0.0024 C   0  0  0

+    3.0684    1.6379    0.0003 C   0  0  0

+   -4.3335    0.6739    0.0001 N   0  0  0

+    3.6731   -1.1115   -0.0026 O   0  0  0

+    3.8466    2.4656    0.0010 N   0  0  0

+    0.4081    1.8765    0.0000 H   0  0  0

+   -2.1443    1.2913    0.0000 H   0  0  0

+   -2.5601   -0.7390    0.0000 H   0  0  0

+    1.8374   -2.7663    0.0000 H   0  0  0

+   -1.5404   -1.8852    0.0000 H   0  0  0

+   -1.4735   -3.3439    0.0000 H   0  0  0

+   -0.0148   -3.2770    0.0000 H   0  0  0

+   -3.5052    1.5661    0.0000 H   0  0  0

+   -3.9124   -0.4655    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  7 13  1  0

+ 10 14  2  0

+ 12 15  2  0

+ 13 16  3  0

+  8 12  1  0

+ 11 14  1  0

+  3 17  1  0

+  5 18  1  0

+  6 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+139-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.6063    0.9075    0.0199 C   0  0  0

+   -0.5934    1.5471    0.0465 O   0  0  0

+    1.1760    0.5526   -1.1945 C   0  0  0

+    1.2625    0.6151    1.2064 C   0  0  0

+   -1.5522    0.5845    0.0291 C   0  0  0

+    2.3941   -0.0969   -1.2224 C   0  0  0

+    2.4810   -0.0346    1.1802 C   0  0  0

+   -2.8879    0.9364   -0.1011 C   0  0  0

+   -1.1967   -0.7528    0.1359 C   0  0  0

+    3.0491   -0.3951   -0.0344 C   0  0  0

+   -3.8608   -0.0444   -0.1190 C   0  0  0

+   -2.1733   -1.7292    0.1174 C   0  0  0

+    4.2835   -1.0533   -0.0619 N   0  0  0

+   -3.5044   -1.3754   -0.0073 C   0  0  0

+    0.6594   -0.3424    0.0000 H   0  0  0

+    1.7162    1.5436    0.0000 H   0  0  0

+    1.9367   -1.0236    0.0000 H   0  0  0

+    3.0013    0.8583    0.0000 H   0  0  0

+   -3.1595    1.9335    0.0000 H   0  0  0

+   -0.1988   -1.0213    0.0000 H   0  0  0

+   -4.8595    0.2211    0.0000 H   0  0  0

+   -1.9049   -2.7271    0.0000 H   0  0  0

+    4.3184   -2.0861    0.0000 H   0  0  0

+    5.1605   -0.5067    0.0000 H   0  0  0

+   -4.2345   -2.1068    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+  7 10  2  0

+ 12 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-30-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.0000   -0.2658    0.0006 C   0  0  0

+   -1.2289    0.6170   -0.2259 C   0  0  0

+    1.2289    0.6180    0.2231 C   0  0  0

+   -2.4393   -0.2535   -0.4451 C   0  0  0

+    2.4393   -0.2515    0.4463 C   0  0  0

+   -3.3840   -0.1735    0.3028 O   0  0  0

+    3.3840   -0.1749   -0.3020 O   0  0  0

+   -0.7464   -1.0981    0.0000 H   0  0  0

+    0.7469   -1.0977    0.0000 H   0  0  0

+   -0.4825    1.4493    0.0000 H   0  0  0

+   -1.9758    1.4489    0.0000 H   0  0  0

+    1.9753    1.4503    0.0000 H   0  0  0

+    0.4820    1.4499    0.0000 H   0  0  0

+   -2.1416   -1.3311    0.0000 H   0  0  0

+    2.1400   -1.3287    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  2  0

+  5  7  2  0

+  1  8  1  0

+  1  9  1  0

+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33399-00-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    2.6065    0.5890    0.2311 P   0  0  0

+    1.1242    1.1842    0.0296 O   0  0  0

+    2.8968   -0.5218   -0.8976 O   0  0  0

+    3.6843    1.7782    0.1034 O   0  0  0

+    2.7116   -0.0302    1.5712 O   0  0  0

+    0.2583    0.1530    0.2143 C   0  0  0

+    4.2392   -0.9702   -0.7003 C   0  0  0

+    3.3934    2.7128    1.1445 C   0  0  0

+   -1.2000    0.4042    0.2251 C   0  0  0

+    0.7224   -1.0838    0.3856 C   0  0  0

+    4.5808   -2.0331   -1.7464 C   0  0  0

+    4.3870    3.8745    1.0793 C   0  0  0

+   -1.8698    0.6955   -0.9649 C   0  0  0

+   -1.9117    0.3452    1.4230 C   0  0  0

+   -0.4785   -2.5427    0.4579 Br  0  0  0

+   -3.2306    0.9285   -0.9482 C   0  0  0

+   -0.9936    0.7652   -2.4619 Cl  0  0  0

+   -3.2714    0.5798    1.4272 C   0  0  0

+   -3.9301    0.8735    0.2454 C   0  0  0

+   -5.6408    1.1680    0.2592 Cl  0  0  0

+    5.2345   -0.8705    0.0000 H   0  0  0

+    4.3503    0.0239    0.0000 H   0  0  0

+    2.7675    3.4931    0.0000 H   0  0  0

+    2.5103    2.2430    0.0000 H   0  0  0

+    1.7092   -1.2480    0.0000 H   0  0  0

+    3.6284   -2.3392    0.0000 H   0  0  0

+    4.8869   -2.9855    0.0000 H   0  0  0

+    5.5332   -1.7270    0.0000 H   0  0  0

+    5.1472    3.2243    0.0000 H   0  0  0

+    5.0372    4.6347    0.0000 H   0  0  0

+    3.6268    4.5247    0.0000 H   0  0  0

+   -1.9558   -0.6542    0.0000 H   0  0  0

+   -3.1850    1.9278    0.0000 H   0  0  0

+   -3.5624   -0.3773    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+  9 14  2  0

+ 10 15  1  0

+ 13 16  2  0

+ 13 17  1  0

+ 14 18  1  0

+ 16 19  1  0

+ 19 20  1  0

+ 18 19  2  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 14 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109143-19-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    0.5409    0.0861    0.3315 C   0  0  0

+   -0.8439    0.2843    0.3376 C   0  0  0

+    1.2499    0.1870    1.5206 C   0  0  0

+    1.2048   -0.2170   -0.8619 N   0  0  0

+   -1.5085    0.5827    1.5376 C   0  0  0

+   -1.8875    0.2577   -0.6941 C   0  0  0

+    0.5859    0.4830    2.7047 C   0  0  0

+    2.5975   -0.0039    1.5266 O   0  0  0

+    2.4168    0.6123   -0.8931 C   0  0  0

+    1.6508   -1.6125   -0.7542 C   0  0  0

+   -2.8187    0.7197    1.2459 O   0  0  0

+   -0.7793    0.6790    2.7166 C   0  0  0

+   -3.0399    0.5283   -0.0669 C   0  0  0

+    2.8406   -1.2099    2.2536 C   0  0  0

+    2.0385    2.0558   -1.2312 C   0  0  0

+    0.4486   -2.5457   -0.9115 C   0  0  0

+   -4.3645    0.6064   -0.7236 N   0  3  0

+    3.5262    3.0737   -1.2695 Cl  0  0  0

+    0.9960   -4.2585   -0.7792 Cl  0  0  0

+   -5.3570    0.8596   -0.0646 O   0  0  0

+   -4.4617    0.4175   -1.9230 O   0  5  0

+   -1.9853   -0.6926    0.0000 H   0  0  0

+    0.8508    1.4009    0.0000 H   0  0  0

+    2.8626   -0.2327    0.0000 H   0  0  0

+    3.3072    0.9586    0.0000 H   0  0  0

+    2.1446   -2.4304    0.0000 H   0  0  0

+    2.5207   -1.2175    0.0000 H   0  0  0

+   -0.7739    1.6343    0.0000 H   0  0  0

+    1.9041   -1.3987    0.0000 H   0  0  0

+    3.0294   -2.1464    0.0000 H   0  0  0

+    3.7771   -1.0211    0.0000 H   0  0  0

+    1.5927    2.9008    0.0000 H   0  0  0

+    1.1481    1.7095    0.0000 H   0  0  0

+   -0.0452   -1.7278    0.0000 H   0  0  0

+   -0.4213   -2.9407    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 13 17  1  0

+ 15 18  1  0

+ 16 19  1  0

+ 17 20  2  0

+ 17 21  1  0

+  7 12  2  0

+ 11 13  1  0

+  6 22  1  0

+  7 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84174-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.1739   -0.7298   -0.5255 C   0  0  0

+    0.6644   -1.7110   -0.0300 C   0  0  0

+    0.2931    0.5607   -0.6957 C   0  0  0

+   -1.5973   -1.0684   -0.8867 C   0  0  0

+    1.9714   -1.4044    0.2966 C   0  0  0

+    1.5989    0.8723   -0.3707 C   0  0  0

+   -2.5120   -0.3191   -0.0219 N   0  0  0

+    2.4423   -0.1107    0.1268 C   0  0  0

+   -2.8225    0.8987   -0.3129 N   0  0  0

+   -3.0742   -0.9527    1.1734 C   0  0  0

+    3.7273    0.1935    0.4477 O   0  0  0

+   -3.5830    1.5218    0.4061 O   0  0  0

+    3.9058    1.5828    0.1649 C   0  0  0

+    0.3560   -2.6521    0.0000 H   0  0  0

+   -0.3666    1.2994    0.0000 H   0  0  0

+   -2.3751   -1.6815    0.0000 H   0  0  0

+   -1.1661   -1.9600    0.0000 H   0  0  0

+    2.6289   -2.1450    0.0000 H   0  0  0

+    1.9045    1.8143    0.0000 H   0  0  0

+   -3.8150   -0.2954    0.0000 H   0  0  0

+   -3.7315   -1.6935    0.0000 H   0  0  0

+   -2.3334   -1.6100    0.0000 H   0  0  0

+    4.8881    1.4566    0.0000 H   0  0  0

+    4.0320    2.5651    0.0000 H   0  0  0

+    2.9235    1.7090    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  7  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  2  0

+ 11 13  1  0

+  6  8  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  6 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-90-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -2.1692    0.4494   -0.4103 C   0  0  0

+   -3.4051   -0.4521   -0.3806 C   0  0  0

+   -3.0228    0.3588    0.7322 O   0  0  0

+   -0.9154   -0.3962   -0.1785 C   0  0  0

+    0.2574    0.4593   -0.2066 O   0  0  0

+    1.4831   -0.0711   -0.0241 C   0  0  0

+    2.6701    0.7948   -0.0526 C   0  0  0

+    1.6066   -1.2654    0.1640 O   0  0  0

+    3.8802    0.2711    0.1276 C   0  0  0

+   -1.9274    1.4214    0.0000 H   0  0  0

+   -4.4033   -0.3684    0.0000 H   0  0  0

+   -3.1348   -1.4166    0.0000 H   0  0  0

+   -1.5676   -1.1564    0.0000 H   0  0  0

+   -0.2356   -1.1319    0.0000 H   0  0  0

+    2.5592    1.7903    0.0000 H   0  0  0

+    3.9953   -0.7239    0.0000 H   0  0  0

+    4.6844    0.8683    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  6  8  2  0

+  7  9  2  0

+  2  3  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  4 13  1  0

+  4 14  1  0

+  7 15  1  0

+  9 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13071-79-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 35                          1 V2000

+    1.6097    0.1476   -0.0343 P   0  0  0

+   -0.0313   -0.0273    1.2965 S   0  0  0

+    2.9672    0.3396    0.8099 O   0  0  0

+    1.7188   -1.1859   -0.9299 O   0  0  0

+    1.3548    1.6224   -1.1444 S   0  0  0

+   -1.4059    0.0936    0.1191 C   0  0  0

+    3.9684    0.7760   -0.1116 C   0  0  0

+    1.8056   -2.2867   -0.0229 C   0  0  0

+   -2.9798   -0.0294    1.0125 S   0  0  0

+    5.2910    0.9784    0.6305 C   0  0  0

+    1.9122   -3.5920   -0.8139 C   0  0  0

+   -4.1411    0.1183   -0.3732 C   0  0  0

+   -5.5756    0.0398    0.1529 C   0  0  0

+   -3.9283    1.4607   -1.0760 C   0  0  0

+   -3.8986   -1.0208   -1.3654 C   0  0  0

+   -0.8720    0.9526    0.0000 H   0  0  0

+   -1.9314    0.9578    0.0000 H   0  0  0

+    4.2531    1.7465    0.0000 H   0  0  0

+    3.2097    1.4449    0.0000 H   0  0  0

+    0.8922   -1.8523    0.0000 H   0  0  0

+    0.9732   -2.8613    0.0000 H   0  0  0

+    5.4440   -0.0214    0.0000 H   0  0  0

+    6.2908    1.1314    0.0000 H   0  0  0

+    5.1380    1.9782    0.0000 H   0  0  0

+    0.9041   -3.6743    0.0000 H   0  0  0

+    1.9945   -4.6001    0.0000 H   0  0  0

+    2.9203   -3.5097    0.0000 H   0  0  0

+   -5.6309    1.0497    0.0000 H   0  0  0

+   -6.5855   -0.0155    0.0000 H   0  0  0

+   -5.5203   -0.9701    0.0000 H   0  0  0

+   -2.9293    1.3023    0.0000 H   0  0  0

+   -3.7699    2.4597    0.0000 H   0  0  0

+   -4.9273    1.6191    0.0000 H   0  0  0

+   -4.8879   -1.2314    0.0000 H   0  0  0

+   -3.6880   -2.0101    0.0000 H   0  0  0

+   -2.9093   -0.8102    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

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+  3  7  1  0

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+  6 16  1  0

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+ 13 28  1  0

+ 13 29  1  0

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+ 14 31  1  0

+ 14 32  1  0

+ 14 33  1  0

+ 15 34  1  0

+ 15 35  1  0

+ 15 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-14-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 15                          1 V2000

+    0.1693    0.7184   -0.0025 C   0  0  0

+    0.1980   -0.6870   -0.0001 C   0  0  0

+    1.4819    1.1263   -0.0018 N   0  0  0

+   -1.0505    1.3867    0.0001 C   0  0  0

+    1.4904   -1.0699    0.0020 N   0  0  0

+   -1.0114   -1.3949   -0.0006 C   0  0  0

+    2.2613   -0.0400    0.0011 N   0  0  0

+   -2.2161    0.6732    0.0050 C   0  0  0

+   -2.1945   -0.7157   -0.0034 C   0  0  0

+    1.8277    2.1033    0.0000 H   0  0  0

+   -1.0754    2.4227    0.0000 H   0  0  0

+   -1.0070   -2.4312    0.0000 H   0  0  0

+   -3.1241    1.1728    0.0000 H   0  0  0

+   -3.0873   -1.2419    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  6  9  2  0

+  5  7  2  0

+  8  9  1  0

+  3 10  1  0

+  4 11  1  0

+  6 12  1  0

+  8 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+321-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    0.8448    0.2305   -0.0546 C   0  0  0

+   -0.6370    0.3023   -0.0679 C   0  0  0

+    1.5747    1.0124    0.8382 C   0  0  0

+    1.5116   -0.6236   -0.9312 C   0  0  0

+   -1.3960   -0.8399    0.1899 C   0  0  0

+   -1.2764    1.5117   -0.3321 C   0  0  0

+    2.9533    0.9413    0.8465 C   0  0  0

+    2.8900   -0.6866   -0.9142 C   0  0  0

+   -2.7767   -0.7658    0.1758 C   0  0  0

+   -0.7834   -2.0152    0.4520 F   0  0  0

+   -2.6550    1.5730   -0.3433 C   0  0  0

+    3.6099    0.0959   -0.0292 C   0  0  0

+   -3.4037    0.4367   -0.0929 C   0  0  0

+    1.1912    1.9611    0.0000 H   0  0  0

+    1.0420   -1.5328    0.0000 H   0  0  0

+   -0.7290    2.3763    0.0000 H   0  0  0

+    3.4267    1.8485    0.0000 H   0  0  0

+    3.2797   -1.6328    0.0000 H   0  0  0

+   -3.3305   -1.6263    0.0000 H   0  0  0

+   -3.1202    2.4845    0.0000 H   0  0  0

+    4.6323    0.0532    0.0000 H   0  0  0

+   -4.4257    0.4889    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+ 11 13  1  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-58-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.7661    0.5749   -0.0028 C   0  0  0

+   -1.1356   -0.7936   -0.0005 C   0  0  0

+    0.5954    0.9210   -0.0024 C   0  0  0

+   -1.7692    1.5595    0.0004 C   0  0  0

+   -0.1332   -1.7782    0.0018 C   0  0  0

+   -2.4979   -1.1392   -0.0009 C   0  0  0

+    1.5402   -0.0606    0.0002 C   0  0  0

+   -3.0781    1.1871    0.0057 C   0  0  0

+    1.1761   -1.4067    0.0017 C   0  0  0

+   -3.4415   -0.1585   -0.0035 C   0  0  0

+    3.2218    0.3707    0.0001 Cl  0  0  0

+    0.8833    1.9305    0.0000 H   0  0  0

+   -1.5101    2.5767    0.0000 H   0  0  0

+   -0.3929   -2.7953    0.0000 H   0  0  0

+   -2.7861   -2.1486    0.0000 H   0  0  0

+   -3.8253    1.9244    0.0000 H   0  0  0

+    1.9229   -2.1444    0.0000 H   0  0  0

+   -4.4583   -0.4194    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  7  9  2  0

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+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+34592-47-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.3309    0.0394    0.5069 C   0  0  2

+   -1.7446    0.0052   -0.0140 C   0  0  0

+    0.4479    1.1880   -0.1863 C   0  0  0

+    0.3224   -1.2557    0.2412 N   0  0  0

+   -2.7023    0.7208    0.5964 O   0  0  0

+   -2.0160   -0.6664   -0.9810 O   0  0  0

+    2.1539    0.4932   -0.2217 S   0  0  0

+    1.7878   -1.1569    0.5161 C   0  0  0

+   -0.8455    0.9824    0.0000 H   0  0  0

+    0.9214    2.1523    0.0000 H   0  0  0

+   -0.4811    1.7275    0.0000 H   0  0  0

+   -0.2096   -2.1889    0.0000 H   0  0  0

+   -3.5629    1.3638    0.0000 H   0  0  0

+    1.7578   -2.2307    0.0000 H   0  0  0

+    2.8539   -1.2888    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

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+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  8 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2634-33-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+   -0.1692    0.5828    0.0020 C   0  0  0

+   -0.4722   -0.7983    0.0007 C   0  0  0

+    1.2608    0.8457    0.0011 C   0  0  0

+   -1.2632    1.4762   -0.0016 C   0  0  0

+   -1.7716   -1.2598    0.0019 C   0  0  0

+    1.1311   -1.5532   -0.0015 S   0  0  0

+    2.1009   -0.1470   -0.0007 N   0  0  0

+    1.7182    2.1252    0.0017 O   0  0  0

+   -2.5378    1.0017   -0.0060 C   0  0  0

+   -2.8060   -0.3618    0.0044 C   0  0  0

+   -1.0928    2.5044    0.0000 H   0  0  0

+   -1.9652   -2.2839    0.0000 H   0  0  0

+    2.0690    3.1066    0.0000 H   0  0  0

+   -3.3320    1.6766    0.0000 H   0  0  0

+   -3.7917   -0.7003    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

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+  3  8  1  0

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+  5 10  2  0

+  6  7  1  0

+  9 10  1  0

+  4 11  1  0

+  5 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2008-39-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+   -2.1976   -0.2259    0.0492 C   0  0  0

+   -3.1710    0.7065   -0.2839 C   0  0  0

+   -0.9497    0.2005    0.4775 C   0  0  0

+   -2.4695   -1.5550   -0.0392 O   0  0  0

+   -2.8940    2.0572   -0.1878 C   0  0  0

+   -4.7347    0.1763   -0.8200 Cl  0  0  0

+   -0.6769    1.5519    0.5722 C   0  0  0

+   -1.2859   -2.2464    0.3645 C   0  0  0

+   -1.6476    2.4798    0.2400 C   0  0  0

+   -1.5220   -3.7329    0.2888 C   0  0  0

+   -1.3018    4.1768    0.3600 Cl  0  0  0

+   -2.6073   -4.1619   -0.0783 O   0  0  0

+   -0.6282   -4.5106    0.5943 O   0  0  0

+   12.5070   -0.5558   -0.2697 N   0  0  0

+   11.4771    0.4307   -0.6221 C   0  0  0

+   13.6965    0.2034    0.1389 C   0  0  0

+   -0.1770   -0.4777    0.0000 H   0  0  0

+   -3.6648    2.7375    0.0000 H   0  0  0

+    0.3039    1.8600    0.0000 H   0  0  0

+   -0.2982   -2.5317    0.0000 H   0  0  0

+   -0.8809   -1.3015    0.0000 H   0  0  0

+   13.1273   -1.3757    0.0000 H   0  0  0

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+   13.1434    1.0700    0.0000 H   0  0  0

+    0.1474   -5.1854    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  2  0

+ 10 13  1  0

+ 14 15  1  0

+ 14 16  1  0

+  7  9  2  0

+  3 17  1  0

+  5 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 13 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5064-31-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 21                          1 V2000

+   -5.9073    0.0065   -0.3587 N   0  0  0

+   -6.2663   -1.3251   -0.8644 C   0  0  0

+   -4.7456    0.4550   -1.1380 C   0  0  0

+   -7.0187    0.9030   -0.7038 C   0  0  0

+   -6.9444   -2.1112    0.2280 C   0  0  0

+   -3.4787    0.0527   -0.4279 C   0  0  0

+   -7.0326    2.0740    0.2446 C   0  0  0

+   -7.4384   -3.2026   -0.0202 O   0  0  0

+   -7.0009   -1.6580    1.3630 O   0  0  0

+   -3.5382   -0.5581    0.6304 O   0  0  0

+   -2.3907    0.3369   -0.9099 O   0  0  0

+   -6.1710    2.1726    1.1075 O   0  0  0

+   -7.9055    2.9262    0.1516 O   0  0  0

+    6.7124   -0.0570   -0.2155 Na  0  3  0

+   15.3700   -0.0137   -0.0024 Na  0  3  0

+   24.0275    0.0296    0.2107 Na  0  3  0

+   -5.8522   -2.1111    0.0000 H   0  0  0

+   -5.3833   -1.2269    0.0000 H   0  0  0

+   -4.2397    1.1853    0.0000 H   0  0  0

+   -5.2950    1.1531    0.0000 H   0  0  0

+   -7.8860    1.0954    0.0000 H   0  0  0

+   -7.4040    0.1025    0.0000 H   0  0  0

+   -7.1108   -0.7764    0.0000 H   0  0  0

+   -1.5311    0.5614    0.0000 H   0  0  0

+   -8.5412    3.5468    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  2  0

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+  2 17  1  0

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+  3 19  1  0

+  3 20  1  0

+  4 21  1  0

+  4 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97509-27-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.6932   -0.4145    0.1783 C   0  0  0

+   -0.6295   -0.8053    0.0889 C   0  0  0

+    1.0414    0.9507    0.1682 C   0  0  0

+    1.7679   -1.4252    0.2800 C   0  0  0

+   -1.6311    0.1726   -0.0147 C   0  0  0

+   -0.9865   -2.2419    0.1018 N   0  3  0

+    0.0860    1.9086    0.0660 C   0  0  0

+    2.4948    1.3374    0.2732 C   0  0  2

+    3.0149   -1.0839   -0.0113 C   0  0  0

+   -1.2696    1.5436   -0.0284 C   0  0  0

+   -2.9886   -0.1839   -0.1049 C   0  0  0

+   -1.2130   -2.8037    1.1585 O   0  0  0

+   -1.0536   -2.8622   -0.9443 O   0  5  0

+    3.3574    0.3076   -0.4531 C   0  0  1

+    2.8750    1.3914    1.6496 O   0  0  0

+   -2.2758    2.5185   -0.1352 C   0  0  0

+   -3.9350    0.7887   -0.2061 C   0  0  0

+    3.1479    0.4196   -1.8622 O   0  0  0

+   -3.5794    2.1361   -0.2216 C   0  0  0

+    1.5156   -2.4394    0.0000 H   0  0  0

+    0.3566    2.9181    0.0000 H   0  0  0

+    2.2866    2.3616    0.0000 H   0  0  0

+    3.7634   -1.8133    0.0000 H   0  0  0

+   -3.2685   -1.1909    0.0000 H   0  0  0

+    4.3755    0.5438    0.0000 H   0  0  0

+    3.9098    1.5384    0.0000 H   0  0  0

+   -2.0252    3.5332    0.0000 H   0  0  0

+   -4.9459    0.5232    0.0000 H   0  0  0

+    2.2262    0.9123    0.0000 H   0  0  0

+   -4.3285    2.8650    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

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+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5355-16-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    0.6288   -0.1862    1.1386 C   0  0  0

+   -0.6864   -0.0358    1.8589 C   0  0  0

+    1.1724    0.8907    0.4634 C   0  0  0

+    1.2918   -1.3992    1.1592 C   0  0  0

+   -1.8183   -0.2073    0.8788 C   0  0  0

+    2.3818    0.7543   -0.1990 C   0  0  0

+    2.4987   -1.5421    0.5004 C   0  0  0

+   -2.5789    0.8895    0.4671 C   0  0  0

+   -2.1234   -1.4514    0.3631 C   0  0  0

+    3.0465   -0.4681   -0.1826 C   0  0  0

+    2.9178    1.8126   -0.8640 O   0  0  0

+   -3.5689    0.6991   -0.3989 N   0  0  0

+   -2.3051    2.1572    0.9539 N   0  0  0

+   -3.1245   -1.5689   -0.4971 N   0  0  0

+    4.2337   -0.6070   -0.8313 O   0  0  0

+    2.0130    2.9061   -0.6976 C   0  0  0

+   -3.8327   -0.5120   -0.8663 C   0  0  0

+    4.6578   -1.9570   -0.6319 C   0  0  0

+   -4.8705   -0.6764   -1.7670 N   0  0  0

+   -0.2054    0.7499    0.0000 H   0  0  0

+   -1.1958    0.7318    0.0000 H   0  0  0

+    0.7344    1.7011    0.0000 H   0  0  0

+    0.7760   -2.1625    0.0000 H   0  0  0

+    2.9328   -2.3546    0.0000 H   0  0  0

+   -1.5135   -2.1418    0.0000 H   0  0  0

+   -1.4280    2.4390    0.0000 H   0  0  0

+   -2.9877    2.7758    0.0000 H   0  0  0

+    2.7227    3.4934    0.0000 H   0  0  0

+    1.4257    3.6158    0.0000 H   0  0  0

+    1.3033    2.3188    0.0000 H   0  0  0

+    3.7789   -2.2331    0.0000 H   0  0  0

+    4.9339   -2.8359    0.0000 H   0  0  0

+    5.5367   -1.6809    0.0000 H   0  0  0

+   -5.4503    0.0395    0.0000 H   0  0  0

+   -5.2006   -1.5364    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

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+  7 10  1  0

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+  2 20  1  0

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+ 16 28  1  0

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+ 16 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98451-51-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.5138    0.3782   -0.1852 C   0  0  0

+   -0.4326   -0.6184   -0.0482 C   0  0  0

+    1.8652    0.0637   -0.1236 C   0  0  0

+    0.0806    1.8044   -0.4075 C   0  0  0

+   -0.0360   -1.9280    0.1505 C   0  0  0

+   -1.8729   -0.2842   -0.1137 N   0  3  0

+    2.2602   -1.2533    0.0757 C   0  0  0

+    2.8249    1.0691   -0.2613 N   0  0  0

+   -0.0758    2.4568    0.8542 O   0  0  0

+    1.3089   -2.2447    0.2123 C   0  0  0

+   -2.5914   -0.4954    0.8469 O   0  0  0

+   -2.3398    0.2022   -1.1281 O   0  5  0

+   -0.9135    2.0779    0.0000 H   0  0  0

+   -0.6387    1.0658    0.0000 H   0  0  0

+   -0.7418   -2.6796    0.0000 H   0  0  0

+    3.2625   -1.4951    0.0000 H   0  0  0

+    3.8267    0.8255    0.0000 H   0  0  0

+    2.5350    2.0585    0.0000 H   0  0  0

+   -0.3162    3.4594    0.0000 H   0  0  0

+    1.6011   -3.2334    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  7 10  2  0

+  4 13  1  0

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+  5 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+626-17-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.0001   -0.6790   -0.0004 C   0  0  0

+   -1.2051    0.0210   -0.0003 C   0  0  0

+    1.2051    0.0211   -0.0003 C   0  0  0

+   -1.1975    1.4185    0.0000 C   0  0  0

+   -2.4481   -0.6899    0.0000 C   0  0  0

+    1.1977    1.4182    0.0000 C   0  0  0

+    2.4481   -0.6899    0.0001 C   0  0  0

+   -0.0001    2.1055    0.0002 C   0  0  0

+   -3.4342   -1.2539    0.0003 N   0  0  0

+    3.4342   -1.2540    0.0003 N   0  0  0

+   -0.0001   -1.7243    0.0000 H   0  0  0

+   -2.1006    1.9448    0.0000 H   0  0  0

+    2.1008    1.9444    0.0000 H   0  0  0

+   -0.0001    3.1508    0.0000 H   0  0  0

+  1  2  2  0

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+  6  8  1  0

+  1 11  1  0

+  4 12  1  0

+  6 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+28322-02-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.0972    0.6300   -0.1617 C   0  0  0

+   -1.2670   -0.2794   -0.1012 C   0  0  0

+   -0.5138    1.9383    0.0651 C   0  0  0

+    1.2613    0.3719   -0.3919 C   0  0  0

+   -2.4164    0.4606    0.1637 C   0  0  0

+   -1.3650   -1.6633   -0.2611 C   0  0  0

+   -2.0067    1.9080    0.2845 C   0  0  0

+    0.4002    2.9706    0.0583 C   0  0  0

+    2.1704    1.4190   -0.3976 C   0  0  0

+    1.6980   -0.9365   -0.6156 N   0  0  0

+   -3.6392   -0.1680    0.2670 C   0  0  0

+   -2.5924   -2.2833   -0.1560 C   0  0  0

+    1.7404    2.7127   -0.1745 C   0  0  0

+    2.6813   -1.4579    0.1445 C   0  0  0

+   -3.7287   -1.5395    0.1075 C   0  0  0

+    3.2422   -2.8188   -0.1787 C   0  0  0

+    3.1149   -0.8318    1.0885 O   0  0  0

+   -0.5062   -2.2344    0.0000 H   0  0  0

+   -1.9259    2.9362    0.0000 H   0  0  0

+   -3.0219    2.0897    0.0000 H   0  0  0

+    0.0680    3.9469    0.0000 H   0  0  0

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+    0.9110   -1.6030    0.0000 H   0  0  0

+   -4.5015    0.3977    0.0000 H   0  0  0

+   -2.6500   -3.3130    0.0000 H   0  0  0

+    2.4204    3.4881    0.0000 H   0  0  0

+   -4.6514   -2.0001    0.0000 H   0  0  0

+    2.2887   -3.2118    0.0000 H   0  0  0

+    3.6352   -3.7723    0.0000 H   0  0  0

+    4.1957   -2.4258    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+ 12 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+22181-94-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+    3.0051   -0.5057    0.0003 S   0  0  0

+    1.5053    0.5076    0.0012 C   0  0  0

+    4.5893    0.2655    0.0012 C   0  0  0

+    0.2751   -0.4022    0.0002 C   0  0  0

+    5.7647   -0.5055    0.0006 C   0  0  0

+    4.7011    1.5908   -0.0031 N   0  0  0

+   -0.9926    0.4543    0.0009 C   0  0  0

+    6.9987    0.1664    0.0008 C   0  0  0

+    6.0331   -1.8331   -0.0003 N   0  0  0

+    5.8840    2.1770   -0.0029 C   0  0  0

+   -2.2227   -0.4555   -0.0001 C   0  0  0

+    7.9615   -0.8109    0.0001 N   0  0  0

+    7.0105    1.4956    0.0010 N   0  0  0

+    7.3218   -2.0147   -0.0005 C   0  0  0

+   -3.4715    0.3881    0.0006 C   0  0  0

+   -4.6833   -0.2018   -0.0001 N   0  0  0

+   -3.3860    1.5979    0.0018 O   0  0  0

+   -5.8972    0.6183    0.0006 C   0  0  0

+   -7.1088   -0.2778   -0.0003 C   0  0  0

+   -8.3397    0.2577    0.0001 O   0  0  0

+   -6.9723   -1.4783   -0.0015 O   0  0  0

+   -9.5071   -0.6057   -0.0009 C   0  0  0

+  -10.7748    0.2508   -0.0002 C   0  0  0

+    2.1821    1.2991    0.0000 H   0  0  0

+    0.7954    1.2695    0.0000 H   0  0  0

+   -0.4017   -1.1936    0.0000 H   0  0  0

+    0.9850   -1.1641    0.0000 H   0  0  0

+   -0.3158    1.2458    0.0000 H   0  0  0

+   -1.7025    1.2162    0.0000 H   0  0  0

+    5.9277    3.2174    0.0000 H   0  0  0

+   -2.8994   -1.2470    0.0000 H   0  0  0

+   -1.5128   -1.2174    0.0000 H   0  0  0

+    8.9920   -0.6607    0.0000 H   0  0  0

+    7.7945   -2.9426    0.0000 H   0  0  0

+   -4.7567   -1.2406    0.0000 H   0  0  0

+   -5.2204    1.4098    0.0000 H   0  0  0

+   -6.6071    1.3802    0.0000 H   0  0  0

+  -10.1839   -1.3972    0.0000 H   0  0  0

+   -8.7972   -1.3676    0.0000 H   0  0  0

+  -10.1918    1.1137    0.0000 H   0  0  0

+  -11.6377    0.8338    0.0000 H   0  0  0

+  -11.3578   -0.6121    0.0000 H   0  0  0

+  2  1  1  0

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+  7  4  1  0

+  8  5  1  0

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+ 22 20  1  0

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+ 10 13  1  0

+ 12 14  1  0

+  2 24  1  0

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+  7 28  1  0

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+ 10 30  1  0

+ 11 31  1  0

+ 11 32  1  0

+ 12 33  1  0

+ 14 34  1  0

+ 16 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104-28-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+   -2.2151   -0.6923    0.1274 C   0  0  0

+   -3.3300   -1.4748    0.4517 C   0  0  0

+   -2.3881    0.6504   -0.2284 C   0  0  0

+   -0.8674   -1.2771    0.1664 C   0  0  0

+   -4.5894   -0.9208    0.4192 C   0  0  0

+   -3.6522    1.1948   -0.2578 C   0  0  0

+    0.2067   -0.5200   -0.1470 C   0  0  0

+   -4.7557    0.4135    0.0651 C   0  0  0

+    1.5069   -1.0841   -0.1094 C   0  0  0

+   -6.0000    0.9551    0.0345 O   0  0  0

+    2.5797   -0.3280   -0.4224 O   0  0  0

+    1.6553   -2.2499    0.2050 O   0  0  0

+   -5.8466    2.3203   -0.3589 C   0  0  0

+    3.7287   -1.1676   -0.2932 C   0  0  0

+    4.9866   -0.3670   -0.6359 C   0  0  0

+    5.1038    0.7417    0.2580 O   0  0  0

+    6.2910    1.4463   -0.1113 C   0  0  0

+    6.4764    2.6521    0.8121 C   0  0  0

+   -3.2294   -2.4895    0.0000 H   0  0  0

+   -1.5740    1.2644    0.0000 H   0  0  0

+   -0.7633   -2.2915    0.0000 H   0  0  0

+   -5.4072   -1.5299    0.0000 H   0  0  0

+   -3.7588    2.2089    0.0000 H   0  0  0

+    0.1025    0.4944    0.0000 H   0  0  0

+   -4.8333    2.2064    0.0000 H   0  0  0

+   -5.7327    3.3336    0.0000 H   0  0  0

+   -6.8599    2.4342    0.0000 H   0  0  0

+    3.0297   -1.9100    0.0000 H   0  0  0

+    4.3786   -1.9533    0.0000 H   0  0  0

+    5.3293   -1.3274    0.0000 H   0  0  0

+    5.9991   -0.2462    0.0000 H   0  0  0

+    6.5984    0.4741    0.0000 H   0  0  0

+    7.3077    1.5246    0.0000 H   0  0  0

+    7.4842    2.4971    0.0000 H   0  0  0

+    6.6314    3.6599    0.0000 H   0  0  0

+    5.4686    2.8071    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+  6  8  2  0

+  2 19  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  7 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6341-85-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+    0.5631    0.2585    0.1220 C   0  0  0

+   -0.7716   -0.1895    0.7210 C   0  0  0

+    1.8405   -0.3825    0.6680 C   0  0  0

+    1.3151   -0.7023   -0.6218 O   0  0  0

+    0.6334    1.7205   -0.3237 C   0  0  0

+   -1.9150    0.5667    0.0415 C   0  0  0

+   -1.5781   -0.7792   -0.3006 O   0  0  0

+   -0.2962   -1.1081    0.0000 H   0  0  0

+    2.5327   -1.1511    0.0000 H   0  0  0

+    2.4676    0.4401    0.0000 H   0  0  0

+    1.6666    1.6708    0.0000 H   0  0  0

+    0.6831    2.7537    0.0000 H   0  0  0

+   -0.3998    1.7702    0.0000 H   0  0  0

+   -1.6016    1.5524    0.0000 H   0  0  0

+   -2.9488    0.5990    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  4  1  0

+  6  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+821-95-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 32                          1 V2000

+    0.0472   -0.3973    0.1373 C   0  0  0

+   -1.2260    0.4394   -0.0036 C   0  0  0

+    1.2699    0.5202    0.0746 C   0  0  0

+   -2.4487   -0.4782    0.0591 C   0  0  0

+    2.5431   -0.3164    0.2155 C   0  0  0

+   -3.7219    0.3585   -0.0818 C   0  0  0

+    3.7659    0.6011    0.1529 C   0  0  0

+   -4.9447   -0.5591   -0.0191 C   0  0  0

+    5.0199   -0.2230    0.2916 C   0  0  0

+   -6.2178    0.2776   -0.1600 C   0  0  0

+    5.9131   -0.2229   -0.6667 C   0  0  0

+   -0.6859   -1.2737    0.0000 H   0  0  0

+    0.8335   -1.2263    0.0000 H   0  0  0

+   -0.4929    1.3158    0.0000 H   0  0  0

+   -2.0124    1.2684    0.0000 H   0  0  0

+    2.0030    1.3967    0.0000 H   0  0  0

+    0.4836    1.3492    0.0000 H   0  0  0

+   -3.1818   -1.3546    0.0000 H   0  0  0

+   -1.6623   -1.3072    0.0000 H   0  0  0

+    1.8100   -1.1928    0.0000 H   0  0  0

+    3.3294   -1.1454    0.0000 H   0  0  0

+   -2.9888    1.2349    0.0000 H   0  0  0

+   -4.5082    1.1875    0.0000 H   0  0  0

+    4.4991    1.4775    0.0000 H   0  0  0

+    2.9796    1.4302    0.0000 H   0  0  0

+   -5.6779   -1.4355    0.0000 H   0  0  0

+   -4.1584   -1.3881    0.0000 H   0  0  0

+    4.6925   -1.3177    0.0000 H   0  0  0

+   -5.5902    1.2325    0.0000 H   0  0  0

+   -7.1727    0.9052    0.0000 H   0  0  0

+   -6.8454   -0.6773    0.0000 H   0  0  0

+    6.4845   -1.2124    0.0000 H   0  0  0

+    6.4843    0.7667    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  1  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

+  9  7  1  0

+ 10  8  1  0

+ 11  9  2  0

+  1 12  1  0

+  1 13  1  0

+  2 14  1  0

+  2 15  1  0

+  3 16  1  0

+  3 17  1  0

+  4 18  1  0

+  4 19  1  0

+  5 20  1  0

+  5 21  1  0

+  6 22  1  0

+  6 23  1  0

+  7 24  1  0

+  7 25  1  0

+  8 26  1  0

+  8 27  1  0

+  9 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 11 32  1  0

+ 11 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5694-00-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    0.6151    0.0552   -0.6980 C   0  0  0

+   -0.7751    0.0007   -0.1190 C   0  0  0

+    1.5320    0.8317    0.2493 C   0  0  0

+    1.5265   -0.5961    0.1893 O   0  0  0

+   -1.4493    1.1423    0.1238 N   0  0  0

+   -1.2874   -1.0704    0.1285 O   0  0  0

+    0.3435   -0.8528    0.0000 H   0  0  0

+    2.4544    1.0493    0.0000 H   0  0  0

+    1.1052    1.6779    0.0000 H   0  0  0

+   -0.9835    1.9677    0.0000 H   0  0  0

+   -2.3970    1.1330    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  4  1  0

+  1  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+539-21-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+   -1.9143   -0.6873    0.0043 C   0  0  0

+   -1.2714   -2.0037    0.0026 C   0  0  0

+   -1.0957    0.5276    0.0043 C   0  0  0

+   -3.2310   -0.5959    0.0004 N   0  0  0

+    0.0726   -2.0970    0.0010 C   0  0  0

+    0.2483    0.4343    0.0028 C   0  0  0

+   -3.8458    0.6630    0.0021 N   0  0  0

+    0.8911   -0.8820    0.0010 C   0  0  0

+   -5.2187    0.7583   -0.0020 C   0  0  0

+    2.2079   -0.9734   -0.0001 N   0  0  0

+   -5.8225    1.9947   -0.0004 N   0  0  0

+   -5.9472   -0.3230   -0.0075 N   0  0  0

+    2.9907    0.1884   -0.0001 N   0  0  0

+    4.3353    0.0951   -0.0012 C   0  0  0

+    4.9267   -1.1159   -0.0024 N   0  0  0

+    5.2919    1.5149   -0.0012 S   0  0  0

+   -1.8481   -2.8596    0.0000 H   0  0  0

+   -1.5486    1.4550    0.0000 H   0  0  0

+    0.5255   -3.0244    0.0000 H   0  0  0

+    0.8250    1.2902    0.0000 H   0  0  0

+   -3.2691    1.5189    0.0000 H   0  0  0

+   -5.2458    2.8506    0.0000 H   0  0  0

+   -6.8521    2.0662    0.0000 H   0  0  0

+   -6.5239   -1.1789    0.0000 H   0  0  0

+    2.5378    1.1158    0.0000 H   0  0  0

+    4.3500   -1.9718    0.0000 H   0  0  0

+    5.9563   -1.1874    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  8 10  2  0

+  9 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+  6  8  1  0

+  2 17  1  0

+  3 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+123-42-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    1.0960   -0.1489    0.0335 C   0  0  0

+   -0.1539   -0.9994   -0.2020 C   0  0  0

+    1.1728    0.2471    1.5093 C   0  0  0

+    2.3402   -0.9555   -0.3436 C   0  0  0

+    1.0294    1.0290   -0.7729 O   0  0  0

+   -1.3826   -0.1418   -0.0417 C   0  0  0

+   -2.7496   -0.7761   -0.0423 C   0  0  0

+   -1.2718    1.0538    0.0874 O   0  0  0

+   -0.8961   -1.8276    0.0000 H   0  0  0

+    0.5784   -1.8363    0.0000 H   0  0  0

+    2.2645    0.0354    0.0000 H   0  0  0

+    1.3845    1.3388    0.0000 H   0  0  0

+    0.0811    0.4588    0.0000 H   0  0  0

+    1.7352   -1.8886    0.0000 H   0  0  0

+    3.2734   -1.5604    0.0000 H   0  0  0

+    2.9451   -0.0224    0.0000 H   0  0  0

+    0.9666    2.1393    0.0000 H   0  0  0

+   -3.2177    0.2327    0.0000 H   0  0  0

+   -3.7584   -1.2442    0.0000 H   0  0  0

+   -2.2815   -1.7849    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  6  8  2  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  7 18  1  0

+  7 19  1  0

+  7 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2912-62-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.9327    0.0065    0.2833 C   0  0  0

+   -0.4866   -0.4159    0.5631 C   0  0  0

+    1.6868    0.5977    1.2793 C   0  0  0

+    1.4822   -0.2025   -0.9680 C   0  0  0

+   -1.4208    0.3157   -0.3660 C   0  0  0

+   -0.6477   -2.1924    0.3010 Cl  0  0  0

+    2.9889    0.9853    1.0226 C   0  0  0

+    2.7839    0.1849   -1.2246 C   0  0  0

+   -1.3079    0.1856   -1.5615 O   0  0  0

+   -2.6592    1.3453    0.2819 Cl  0  0  0

+    3.5364    0.7815   -0.2300 C   0  0  0

+   -0.3207    0.4584    0.0000 H   0  0  0

+    1.2781    1.3883    0.0000 H   0  0  0

+    1.4492   -1.0918    0.0000 H   0  0  0

+    3.0187    1.8747    0.0000 H   0  0  0

+    3.1947   -0.6045    0.0000 H   0  0  0

+    4.4154    0.9206    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  7 11  2  0

+  8 11  1  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+538-41-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.7514    0.3040   -0.0014 C   0  0  0

+    0.4012    0.5050   -0.0016 N   0  0  0

+    2.6234    1.3981   -0.0014 C   0  0  0

+    2.2666   -0.9963    0.0046 C   0  0  0

+   -0.4012   -0.5050   -0.0016 N   0  0  0

+    3.9841    1.1913   -0.0013 C   0  0  0

+    3.6291   -1.1950    0.0047 C   0  0  0

+   -1.7514   -0.3040   -0.0017 C   0  0  0

+    4.4931   -0.1043   -0.0012 C   0  0  0

+   -2.6234   -1.3981   -0.0017 C   0  0  0

+   -2.2667    0.9963    0.0040 C   0  0  0

+    5.8709   -0.3094   -0.0015 N   0  0  0

+   -3.9841   -1.1913   -0.0014 C   0  0  0

+   -3.6291    1.1950    0.0043 C   0  0  0

+   -4.4931    0.1043   -0.0011 C   0  0  0

+   -5.8709    0.3094   -0.0008 N   0  0  0

+    2.2426    2.3697    0.0000 H   0  0  0

+    1.6192   -1.8148    0.0000 H   0  0  0

+    4.6351    2.0069    0.0000 H   0  0  0

+    4.0143   -2.1649    0.0000 H   0  0  0

+   -2.2426   -2.3697    0.0000 H   0  0  0

+   -1.6193    1.8148    0.0000 H   0  0  0

+    6.2539   -1.2801    0.0000 H   0  0  0

+    6.5201    0.5077    0.0000 H   0  0  0

+   -4.6351   -2.0069    0.0000 H   0  0  0

+   -4.0143    2.1649    0.0000 H   0  0  0

+   -6.2539    1.2801    0.0000 H   0  0  0

+   -6.5201   -0.5077    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 13 15  1  0

+ 15 16  1  0

+  7  9  2  0

+ 14 15  2  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67-45-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.8070   -0.0374   -0.0012 C   0  0  0

+   -1.9657    0.6619   -0.0003 O   0  0  0

+    0.4704    0.4859    0.0004 C   0  0  0

+   -1.1725   -1.4680    0.0021 C   0  0  0

+   -2.9974   -0.1866   -0.0017 C   0  0  0

+    1.5293   -0.3331   -0.0008 N   0  0  0

+   -2.5350   -1.5052    0.0048 C   0  0  0

+   -4.4304    0.2140   -0.0008 N   0  3  0

+    2.7230    0.1559    0.0007 N   0  0  0

+   -5.3009   -0.6378   -0.0023 O   0  0  0

+   -4.7821    1.5857    0.0017 O   0  5  0

+    3.8574   -0.5573   -0.0002 C   0  0  0

+    3.0610    1.5875   -0.0025 C   0  0  0

+    4.9662    0.1896    0.0018 O   0  0  0

+    3.8766   -1.7711   -0.0023 O   0  0  0

+    4.6019    1.6003    0.0013 C   0  0  0

+    0.6077    1.4989    0.0000 H   0  0  0

+   -0.5345   -2.2667    0.0000 H   0  0  0

+   -3.1148   -2.3471    0.0000 H   0  0  0

+    3.1343    2.6071    0.0000 H   0  0  0

+    2.0505    1.7421    0.0000 H   0  0  0

+    5.6092    1.7745    0.0000 H   0  0  0

+    4.5102    2.6184    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+  9 13  1  0

+ 12 14  1  0

+ 12 15  2  0

+ 13 16  1  0

+  5  7  2  0

+ 14 16  1  0

+  3 17  1  0

+  4 18  1  0

+  7 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 16 22  1  0

+ 16 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1007-28-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -2.1159   -0.9560   -0.0004 N   0  0  0

+   -3.3779   -0.2119    0.0014 C   0  0  0

+   -0.9145   -0.2770    0.0012 C   0  0  0

+   -4.5499   -1.1954   -0.0009 C   0  0  0

+    0.2321   -0.9522   -0.0004 N   0  0  0

+   -0.9015    1.0517   -0.0012 N   0  0  0

+    1.3844   -0.3019    0.0011 C   0  0  0

+    0.2572    1.7018    0.0003 C   0  0  0

+    2.8781   -1.1865   -0.0010 Cl  0  0  0

+    1.4006    1.0208    0.0046 N   0  0  0

+    0.2750    3.0817   -0.0026 N   0  0  0

+   -2.1250   -1.9541    0.0000 H   0  0  0

+   -2.7770    0.5851    0.0000 H   0  0  0

+   -4.1018    0.4753    0.0000 H   0  0  0

+   -5.1915   -0.4308    0.0000 H   0  0  0

+   -5.3145   -1.8370    0.0000 H   0  0  0

+   -3.9083   -1.9600    0.0000 H   0  0  0

+    1.1458    3.5696    0.0000 H   0  0  0

+   -0.5829    3.5919    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  5  1  0

+  8  6  2  0

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+ 11  8  1  0

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+  1 12  1  0

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+  2 14  1  0

+  4 15  1  0

+  4 16  1  0

+  4 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105596-42-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 33                          1 V2000

+   -0.1491    0.3445    0.1087 C   0  0  0

+   -1.4013   -0.4167    0.0635 C   0  0  0

+   -0.1293    1.7346    0.2421 C   0  0  0

+    1.0748   -0.3583    0.0196 C   0  0  0

+   -2.6503    0.2022    0.1504 C   0  0  0

+   -1.3350   -1.8228   -0.0721 C   0  0  0

+   -1.4270    2.5008    0.3445 C   0  0  0

+    1.0598    2.4023    0.2797 C   0  0  0

+    2.2809    0.3555    0.0607 C   0  0  0

+    1.0729   -1.7667   -0.1091 C   0  0  0

+   -2.7398    1.7028    0.2963 C   0  0  0

+   -3.7901   -0.5461    0.1042 C   0  0  0

+   -0.0783   -2.4654   -0.1617 C   0  0  0

+   -2.5237   -2.5650   -0.1167 C   0  0  0

+   -2.1752    2.3242   -0.8601 O   0  0  0

+    2.2637    1.7133    0.1864 C   0  0  0

+    3.5713   -0.3639   -0.0314 N   0  3  0

+   -3.7266   -1.9285   -0.0291 C   0  0  0

+    3.7684   -1.3513    0.6540 O   0  0  0

+    4.4360    0.0315   -0.7927 O   0  5  0

+   -1.2702    3.5330    0.0000 H   0  0  0

+    1.0641    3.4464    0.0000 H   0  0  0

+    1.9824   -2.2794    0.0000 H   0  0  0

+   -3.7244    2.0500    0.0000 H   0  0  0

+   -4.7200   -0.0714    0.0000 H   0  0  0

+   -0.0403   -3.5088    0.0000 H   0  0  0

+   -2.4864   -3.6084    0.0000 H   0  0  0

+    3.1636    2.2428    0.0000 H   0  0  0

+   -4.6084   -2.4875    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

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+  6 13  1  0

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+  7 21  1  0

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+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+72848-48-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.2874    0.4464   -0.0071 C   0  0  0

+   -0.9453   -0.9812   -0.0054 C   0  0  0

+   -0.3270    1.3643   -0.0066 N   0  0  0

+   -2.6496    0.8168   -0.0034 C   0  0  0

+    0.3268   -1.3641   -0.0029 N   0  0  0

+   -1.9917   -1.9288   -0.0061 C   0  0  0

+    0.9454    0.9813   -0.0045 C   0  0  0

+   -3.6059   -0.1462    0.0016 C   0  0  0

+    1.2874   -0.4461   -0.0019 C   0  0  0

+   -3.2806   -1.5038   -0.0083 C   0  0  0

+    1.9917    1.9288   -0.0034 C   0  0  0

+   -5.0312    0.2534    0.0060 N   0  3  0

+    2.6494   -0.8167    0.0006 C   0  0  0

+    3.2808    1.5038   -0.0008 C   0  0  0

+   -5.9023   -0.5979    0.0106 O   0  0  0

+   -5.3328    1.4334    0.0051 O   0  5  0

+    3.6060    0.1462    0.0014 C   0  0  0

+    5.0312   -0.2535    0.0045 N   0  3  0

+    5.9024    0.5976    0.0052 O   0  0  0

+    5.3327   -1.4336    0.0063 O   0  5  0

+   -2.9130    1.8001    0.0000 H   0  0  0

+   -1.7808   -2.9247    0.0000 H   0  0  0

+   -4.0298   -2.1930    0.0000 H   0  0  0

+    1.7808    2.9247    0.0000 H   0  0  0

+    2.9126   -1.8001    0.0000 H   0  0  0

+    4.0300    2.1930    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

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+ 11 14  2  0

+ 12 15  2  0

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+ 13 17  2  0

+ 17 18  1  0

+ 18 19  2  0

+ 18 20  1  0

+  7  9  2  0

+  8 10  1  0

+ 14 17  1  0

+  4 21  1  0

+  6 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-24-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    1.6817   -1.0532    0.2429 C   0  0  0

+    0.2636   -1.2231    0.7239 C   0  0  0

+    2.3715    0.0026    0.5973 C   0  0  0

+    2.3082   -2.1009   -0.6407 C   0  0  0

+   -0.6955   -0.5766   -0.2776 C   0  0  0

+    2.8321    0.9870   -0.4467 C   0  0  0

+   -2.1135   -0.7465    0.2035 C   0  0  0

+    2.5398    2.3159   -0.0101 O   0  0  0

+   -3.0029    0.1847   -0.0374 C   0  0  0

+   -3.6501    0.9223    1.1063 C   0  0  0

+   -3.3787    0.5184   -1.4581 C   0  0  0

+   -0.4533   -1.8166    0.0000 H   0  0  0

+    0.6306   -2.0784    0.0000 H   0  0  0

+    3.1846   -0.4503    0.0000 H   0  0  0

+    1.5094   -2.5786    0.0000 H   0  0  0

+    2.7859   -2.8997    0.0000 H   0  0  0

+    3.1070   -1.6232    0.0000 H   0  0  0

+    0.0214    0.0169    0.0000 H   0  0  0

+   -1.0626    0.2787    0.0000 H   0  0  0

+    3.5174    0.3572    0.0000 H   0  0  0

+    3.6388    1.4511    0.0000 H   0  0  0

+   -2.4279   -1.6225    0.0000 H   0  0  0

+    2.3399    3.2249    0.0000 H   0  0  0

+   -2.9505    1.5361    0.0000 H   0  0  0

+   -4.2639    1.6219    0.0000 H   0  0  0

+   -4.3497    0.3085    0.0000 H   0  0  0

+   -2.7607    1.2143    0.0000 H   0  0  0

+   -4.0746    1.1364    0.0000 H   0  0  0

+   -3.9967   -0.1775    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  2  0

+  9 10  1  0

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+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-62-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 80 79                          1 V2000

+    9.2483    0.4319   -0.2009 C   0  0  0

+    8.0237   -0.4853   -0.2022 C   0  0  0

+   10.5213   -0.4169   -0.2020 C   0  0  0

+    9.2242    1.3165   -1.4491 C   0  0  0

+    6.8157    0.3202   -0.2011 O   0  0  0

+   11.3151   -0.1473    1.0778 C   0  0  0

+    9.2843    2.7875   -1.0328 C   0  0  0

+    5.6124   -0.2746   -0.2019 C   0  0  0

+   12.5198   -1.0886    1.1385 C   0  0  0

+    4.3586    0.5615   -0.2008 C   0  0  0

+    5.5345   -1.4803   -0.2035 O   0  0  0

+   13.3136   -0.8190    2.4184 C   0  0  0

+    3.1340   -0.3558   -0.2020 C   0  0  0

+    1.8611    0.4931   -0.2009 C   0  0  0

+    0.6365   -0.4242   -0.2021 C   0  0  0

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+  -12.9462   -0.2561    0.0000 H   0  0  0

+  1  2  1  0

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+ 29 77  1  0

+ 30 78  1  0

+ 30 79  1  0

+ 30 80  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21314-05-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.8322   -0.7283    0.1590 N   0  0  0

+   -1.8323    0.1909   -0.0493 C   0  0  0

+    0.5465   -0.4807    0.1083 C   0  0  0

+   -1.4292   -1.9259    0.4304 C   0  0  0

+   -3.0403   -0.5101    0.1032 C   0  0  0

+   -1.8695    1.4875   -0.3382 N   0  0  0

+    1.3421   -1.1610   -0.8034 C   0  0  0

+    1.1182    0.4497    0.9659 C   0  0  0

+   -2.7236   -1.7935    0.4003 N   0  0  0

+   -4.2432    0.1986   -0.0584 C   0  0  0

+   -3.0203    2.1103   -0.4805 C   0  0  0

+    2.7006   -0.9148   -0.8510 C   0  0  0

+    2.4769    0.6914    0.9136 C   0  0  0

+   -4.1809    1.4943   -0.3468 N   0  0  0

+   -5.4641   -0.4383    0.0793 N   0  0  0

+    3.2679    0.0079    0.0081 C   0  0  0

+    4.7239    0.2694   -0.0454 N   0  3  0

+    5.2249    1.0820    0.7109 O   0  0  0

+    5.4209   -0.3282   -0.8458 O   0  5  0

+   -0.9540   -2.7892    0.0000 H   0  0  0

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+   -5.5062   -1.4229    0.0000 H   0  0  0

+  1  2  1  0

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+  5  9  1  0

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+  4 20  1  0

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+  8 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+589-18-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.8603   -0.2019   -0.2601 C   0  0  0

+   -0.0710   -1.3174   -0.0499 C   0  0  0

+   -0.2842    1.0537   -0.3053 C   0  0  0

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+    1.0813    1.1941   -0.1402 C   0  0  0

+   -3.0332    0.3704    0.5761 O   0  0  0

+    1.8703    0.0789    0.0699 C   0  0  0

+    3.3587    0.2319    0.2493 C   0  0  0

+   -0.4967   -2.2548    0.0000 H   0  0  0

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+   -3.7400    1.1190    0.0000 H   0  0  0

+    3.4640   -0.7922    0.0000 H   0  0  0

+    4.3828    0.3372    0.0000 H   0  0  0

+    3.2534    1.2560    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  6  8  2  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+994-05-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.0280   -0.4062   -0.0037 C   0  0  0

+   -1.4773   -0.5061    0.2512 C   0  0  0

+    0.4661    0.9305    0.2482 O   0  0  0

+    0.7679   -1.3693    0.9268 C   0  0  0

+    0.3243   -0.7743   -1.4589 C   0  0  0

+   -2.1310    0.8511   -0.0162 C   0  0  0

+    1.8673    0.9652   -0.0299 C   0  0  0

+   -2.4765   -0.8387    0.0000 H   0  0  0

+   -1.2745   -1.5395    0.0000 H   0  0  0

+   -0.0672   -2.0109    0.0000 H   0  0  0

+    1.4095   -2.2044    0.0000 H   0  0  0

+    1.6030   -0.7277    0.0000 H   0  0  0

+   -0.4961   -1.4346    0.0000 H   0  0  0

+    0.9846   -1.5947    0.0000 H   0  0  0

+    1.1447   -0.1140    0.0000 H   0  0  0

+   -1.1822    1.3081    0.0000 H   0  0  0

+   -2.5880    1.7999    0.0000 H   0  0  0

+   -3.0798    0.3941    0.0000 H   0  0  0

+    1.8934   -0.0876    0.0000 H   0  0  0

+    2.9201    0.9913    0.0000 H   0  0  0

+    1.8412    2.0180    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  2  8  1  0

+  2  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  7 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-50-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.1417    0.6922    0.0028 C   0  0  0

+    0.1417   -0.6922    0.0003 C   0  0  0

+    1.3403    1.3831    0.0028 C   0  0  0

+   -1.3614    1.5607   -0.0015 Cl  0  0  0

+    1.3402   -1.3832   -0.0021 C   0  0  0

+   -1.3615   -1.5607    0.0008 Cl  0  0  0

+    2.5367    0.6913    0.0004 C   0  0  0

+    2.5367   -0.6913   -0.0021 C   0  0  0

+    1.3410    2.4207    0.0000 H   0  0  0

+    1.3409   -2.4208    0.0000 H   0  0  0

+    3.4354    1.2098    0.0000 H   0  0  0

+    3.4355   -1.2098    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  8  1  0

+  3  9  1  0

+  5 10  1  0

+  7 11  1  0

+  8 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1148-79-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    1.1562    0.7314   -0.0035 C   0  0  0

+    0.0001    0.0842   -0.0037 N   0  0  0

+    1.1911    2.1250   -0.0006 C   0  0  0

+    2.4268   -0.0350   -0.0002 C   0  0  0

+   -1.1563    0.7315   -0.0012 C   0  0  0

+    0.0001    2.8322    0.0021 C   0  0  0

+    2.3934   -1.4272    0.0027 C   0  0  0

+    3.5851    0.6118   -0.0054 N   0  0  0

+   -1.1912    2.1247    0.0014 C   0  0  0

+   -2.4268   -0.0349   -0.0015 C   0  0  0

+    3.5873   -2.1289    0.0058 C   0  0  0

+    4.7347   -0.0306   -0.0027 C   0  0  0

+   -2.3934   -1.4272   -0.0045 C   0  0  0

+   -3.5852    0.6118    0.0065 N   0  0  0

+    4.7756   -1.4135    0.0059 C   0  0  0

+   -3.5872   -2.1289   -0.0048 C   0  0  0

+   -4.7347   -0.0306    0.0065 C   0  0  0

+   -4.7756   -1.4135   -0.0021 C   0  0  0

+    2.1002    2.6275    0.0000 H   0  0  0

+    0.0001    3.8709    0.0000 H   0  0  0

+    1.4857   -1.9322    0.0000 H   0  0  0

+   -2.1003    2.6272    0.0000 H   0  0  0

+    3.5928   -3.1676    0.0000 H   0  0  0

+    5.6227    0.5083    0.0000 H   0  0  0

+   -1.4857   -1.9322    0.0000 H   0  0  0

+    5.6874   -1.9112    0.0000 H   0  0  0

+   -3.5926   -3.1676    0.0000 H   0  0  0

+   -5.6228    0.5082    0.0000 H   0  0  0

+   -5.6873   -1.9112    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  3  2  0

+  7  4  2  0

+  8  4  1  0

+  9  5  2  0

+ 10  5  1  0

+ 11  7  1  0

+ 12  8  2  0

+ 13 10  2  0

+ 14 10  1  0

+ 15 11  2  0

+ 16 13  1  0

+ 17 14  2  0

+ 18 16  2  0

+  6  9  1  0

+ 12 15  1  0

+ 17 18  1  0

+  3 19  1  0

+  6 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+612-83-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.7058   -0.2276    0.2666 C   0  0  0

+   -0.7058    0.2277    0.2665 C   0  0  0

+    1.7185    0.6382   -0.1433 C   0  0  0

+    1.0223   -1.5202    0.6822 C   0  0  0

+   -1.7185   -0.6381   -0.1435 C   0  0  0

+   -1.0223    1.5204    0.6819 C   0  0  0

+    3.0309    0.2125   -0.1419 C   0  0  0

+    2.3351   -1.9418    0.6821 C   0  0  0

+   -3.0309   -0.2124   -0.1423 C   0  0  0

+   -2.3351    1.9419    0.6816 C   0  0  0

+    3.3432   -1.0793    0.2682 C   0  0  0

+    4.2930    1.2895   -0.6527 Cl  0  0  0

+   -3.3432    1.0793    0.2680 C   0  0  0

+   -4.2929   -1.2896   -0.6527 Cl  0  0  0

+    4.6725   -1.5089    0.2686 N   0  0  0

+   -4.6726    1.5086    0.2691 N   0  0  0

+    1.5163    1.6523    0.0000 H   0  0  0

+    0.2657   -2.2252    0.0000 H   0  0  0

+   -1.5163   -1.6522    0.0000 H   0  0  0

+   -0.2657    2.2254    0.0000 H   0  0  0

+    2.5390   -2.9556    0.0000 H   0  0  0

+   -2.5391    2.9557    0.0000 H   0  0  0

+    4.8891   -2.5201    0.0000 H   0  0  0

+    5.4399   -0.8157    0.0000 H   0  0  0

+   -4.8894    2.5197    0.0000 H   0  0  0

+   -5.4398    0.8153    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  7 12  1  0

+  9 13  2  0

+  9 14  1  0

+ 11 15  1  0

+ 13 16  1  0

+  8 11  1  0

+ 10 13  1  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+114451-08-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.2258   -0.1908   -0.0124 C   0  0  0

+   -1.6615   -0.4554   -0.0292 C   0  0  0

+    0.2094    1.1367    0.0544 C   0  0  0

+    0.8704   -0.9709   -0.0428 N   0  0  0

+   -2.5612    0.6360    0.0225 C   0  0  0

+   -2.1695   -1.7591   -0.0955 C   0  0  0

+    1.5880    1.0835    0.0558 N   0  0  0

+   -0.7178    2.1818    0.1040 C   0  0  0

+    1.9399   -0.2273   -0.0057 C   0  0  0

+   -2.0533    1.9487    0.0888 C   0  0  0

+   -3.8780    0.4088    0.0075 N   0  0  0

+   -3.5284   -1.9234   -0.1075 C   0  0  0

+    2.5019    2.2270    0.1145 C   0  0  0

+    3.3303   -0.7351   -0.0223 N   0  3  0

+   -4.3601   -0.8096   -0.0545 C   0  0  0

+    4.1293   -0.2964   -0.8301 O   0  0  0

+    3.6753   -1.5917    0.7719 O   0  5  0

+   -1.5353   -2.5767    0.0000 H   0  0  0

+   -0.3765    3.1586    0.0000 H   0  0  0

+   -2.7097    2.7486    0.0000 H   0  0  0

+   -3.9357   -2.8746    0.0000 H   0  0  0

+    3.3102    1.5810    0.0000 H   0  0  0

+    3.1479    3.0353    0.0000 H   0  0  0

+    1.6936    2.8730    0.0000 H   0  0  0

+   -5.3858   -0.9461    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 14 16  2  0

+ 14 17  1  0

+  7  9  1  0

+  8 10  2  0

+ 12 15  1  0

+  6 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51042-51-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+   -2.0374   -0.5085   -0.0018 C   0  0  0

+   -3.0478    0.4570   -0.0008 C   0  0  0

+   -0.6216   -0.0986   -0.0009 C   0  0  0

+   -2.3757   -1.8640    0.0021 C   0  0  0

+   -4.3703    0.0660   -0.0012 C   0  0  0

+    0.3464   -1.0287   -0.0019 C   0  0  0

+   -3.7029   -2.2401    0.0069 C   0  0  0

+   -4.6979   -1.2787   -0.0026 C   0  0  0

+   -5.4420    1.0870    0.0004 N   0  3  0

+    1.7622   -0.6188   -0.0009 C   0  0  0

+   -6.6105    0.7433    0.0000 O   0  0  0

+   -5.1553    2.2708    0.0020 O   0  5  0

+    2.7727   -1.5843   -0.0019 C   0  0  0

+    2.1006    0.7367   -0.0048 C   0  0  0

+    4.0951   -1.1933   -0.0010 C   0  0  0

+    3.4277    1.1128   -0.0038 C   0  0  0

+    4.4227    0.1513    0.0010 C   0  0  0

+    5.8446    0.5630    0.0020 N   0  3  0

+    6.1363    1.7455    0.0037 O   0  0  0

+    6.7229   -0.2809    0.0011 O   0  5  0

+   -2.8035    1.4656    0.0000 H   0  0  0

+   -0.3731    0.9090    0.0000 H   0  0  0

+   -1.6304   -2.5861    0.0000 H   0  0  0

+    0.0979   -2.0363    0.0000 H   0  0  0

+   -3.9557   -3.2466    0.0000 H   0  0  0

+   -5.6947   -1.5673    0.0000 H   0  0  0

+    2.5285   -2.5929    0.0000 H   0  0  0

+    1.3553    1.4588    0.0000 H   0  0  0

+    4.8465   -1.9091    0.0000 H   0  0  0

+    3.6805    2.1193    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 17 18  1  0

+ 18 19  2  0

+ 18 20  1  0

+  7  8  2  0

+ 16 17  2  0

+  2 21  1  0

+  3 22  1  0

+  4 23  1  0

+  6 24  1  0

+  7 25  1  0

+  8 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+34331-95-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.4844    1.2045    0.4074 C   0  0  0

+   -0.1763   -0.0007    0.6391 C   0  0  0

+    1.8679    1.2060   -0.0786 C   0  0  0

+   -0.1583    2.4419    0.6273 C   0  0  0

+    0.4863   -1.2042    0.4059 C   0  0  0

+   -1.5980   -0.0023    1.1390 C   0  0  0

+    2.5310    0.0022   -0.3109 C   0  0  0

+    2.5068    2.4445   -0.3031 C   0  0  0

+    0.5142    3.5972    0.3912 C   0  0  0

+    1.8701   -1.2026   -0.0801 C   0  0  0

+   -0.1521   -2.4431    0.6303 C   0  0  0

+   -2.8310   -0.0020   -0.3923 Br  0  0  0

+    3.9528    0.0037   -0.8104 C   0  0  0

+    1.8324    3.5985   -0.0663 C   0  0  0

+    2.5114   -2.4399   -0.3053 C   0  0  0

+    0.5227   -3.5968    0.3933 C   0  0  0

+    1.8392   -3.5953   -0.0691 C   0  0  0

+   -1.1888    2.4667    0.0000 H   0  0  0

+   -2.1132   -0.8951    0.0000 H   0  0  0

+   -1.0820   -0.8946    0.0000 H   0  0  0

+    3.5372    2.4716    0.0000 H   0  0  0

+    0.0000    4.4905    0.0000 H   0  0  0

+   -1.1825   -2.4706    0.0000 H   0  0  0

+    3.9539   -1.0271    0.0000 H   0  0  0

+    4.9836    0.0048    0.0000 H   0  0  0

+    3.9517    1.0345    0.0000 H   0  0  0

+    2.3450    4.4928    0.0000 H   0  0  0

+    3.5419   -2.4650    0.0000 H   0  0  0

+    0.0103   -4.4912    0.0000 H   0  0  0

+    2.3536   -4.4885    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  1  0

+ 11 16  2  0

+ 15 17  2  0

+  7 10  2  0

+  9 14  1  0

+ 16 17  1  0

+  4 18  1  0

+  6 19  1  0

+  6 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+65-85-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.1252   -0.0182    0.0033 C   0  0  0

+    0.6000   -1.2116    0.0029 C   0  0  0

+    0.5518    1.2027    0.0009 C   0  0  0

+   -1.6022   -0.0476    0.0000 C   0  0  0

+    1.9788   -1.1770    0.0002 C   0  0  0

+    1.9313    1.2228   -0.0018 C   0  0  0

+   -2.2988    1.1055    0.0004 O   0  0  0

+   -2.1885   -1.1114   -0.0030 O   0  0  0

+    2.6436    0.0368   -0.0022 C   0  0  0

+    0.1027   -2.1223    0.0000 H   0  0  0

+    0.0187    2.0929    0.0000 H   0  0  0

+    2.5188   -2.0630    0.0000 H   0  0  0

+    2.4357    2.1295    0.0000 H   0  0  0

+   -2.8353    1.9936    0.0000 H   0  0  0

+    3.6810    0.0574    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6  9  2  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94-70-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.1297   -0.0450   -0.0022 C   0  0  0

+   -0.9398   -0.9378   -0.0004 C   0  0  0

+   -0.1111    1.3189   -0.0020 C   0  0  0

+    1.4073   -0.5117    0.0014 O   0  0  0

+   -2.2406   -0.4559    0.0017 C   0  0  0

+   -0.7024   -2.3172   -0.0011 N   0  0  0

+   -1.4105    1.7920    0.0000 C   0  0  0

+    2.2646    0.6316   -0.0017 C   0  0  0

+   -2.4725    0.9067    0.0019 C   0  0  0

+    3.7246    0.1741    0.0022 C   0  0  0

+    0.6852    1.9872    0.0000 H   0  0  0

+   -3.0408   -1.1195    0.0000 H   0  0  0

+   -1.5015   -2.9822    0.0000 H   0  0  0

+    0.2730   -2.6768    0.0000 H   0  0  0

+   -1.5893    2.8161    0.0000 H   0  0  0

+    2.6856    1.5821    0.0000 H   0  0  0

+    1.3677    1.1573    0.0000 H   0  0  0

+   -3.4477    1.2667    0.0000 H   0  0  0

+    3.4137   -0.8179    0.0000 H   0  0  0

+    4.7166   -0.1368    0.0000 H   0  0  0

+    4.0355    1.1661    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  8 10  1  0

+  7  9  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1520-21-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -2.4834    0.4531   -0.0001 C   0  0  0

+   -3.2905   -0.5991   -0.0020 C   0  0  0

+   -1.0185    0.2604   -0.0008 C   0  0  0

+   -0.1676    1.3669    0.0013 C   0  0  0

+   -0.4825   -1.0289    0.0022 C   0  0  0

+    1.1984    1.1840    0.0010 C   0  0  0

+    0.8840   -1.2054    0.0020 C   0  0  0

+    1.7291   -0.1010   -0.0013 C   0  0  0

+    3.1126   -0.2829   -0.0020 N   0  0  0

+   -2.8827    1.4166    0.0000 H   0  0  0

+   -4.3246   -0.4631    0.0000 H   0  0  0

+   -2.8912   -1.5626    0.0000 H   0  0  0

+   -0.5652    2.3311    0.0000 H   0  0  0

+   -1.1159   -1.8575    0.0000 H   0  0  0

+    1.8347    2.0104    0.0000 H   0  0  0

+    1.2850   -2.1682    0.0000 H   0  0  0

+    3.5119   -1.2464    0.0000 H   0  0  0

+    3.7474    0.5447    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

+  9  8  1  0

+  7  8  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-69-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.2215    0.8139    0.0018 C   0  0  0

+   -1.7426   -0.4734    0.0004 C   0  0  0

+    0.1467    1.0037    0.0017 C   0  0  0

+   -2.1479    2.0025   -0.0028 C   0  0  0

+   -0.8857   -1.5668   -0.0011 C   0  0  0

+   -3.1264   -0.6684    0.0010 N   0  0  0

+    0.9978   -0.0871    0.0001 C   0  0  0

+    0.4812   -1.3711   -0.0013 C   0  0  0

+    2.7168    0.1552    0.0000 Cl  0  0  0

+    0.5381    1.9690    0.0000 H   0  0  0

+   -1.3264    2.6428    0.0000 H   0  0  0

+   -2.7882    2.8240    0.0000 H   0  0  0

+   -2.9694    1.3622    0.0000 H   0  0  0

+   -1.2739   -2.5333    0.0000 H   0  0  0

+   -3.7680    0.1521    0.0000 H   0  0  0

+   -3.5162   -1.6343    0.0000 H   0  0  0

+    1.1241   -2.1906    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88020-91-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.1961    0.6039   -0.0663 C   0  0  0

+   -0.0055   -0.6741   -0.1172 C   0  0  0

+    1.0728    1.3219    0.0453 C   0  0  0

+   -1.4840    1.2854   -0.1164 C   0  0  0

+    1.4450   -0.9086   -0.0409 C   0  0  0

+   -1.2159   -1.5100   -0.2312 C   0  0  0

+    2.0826    0.2525    0.0545 C   0  0  0

+    1.0165    2.6290    0.1050 C   0  0  0

+   -2.5602    0.5436   -0.2228 C   0  0  0

+   -1.4447    2.7558   -0.0419 C   0  0  0

+    2.2261   -2.1596   -0.0554 C   0  0  0

+   -2.4004   -0.9264   -0.2741 C   0  0  0

+    3.5505    0.2810    0.1455 C   0  0  0

+   -0.2679    3.3467    0.0620 C   0  0  0

+    3.5371   -2.1292    0.0255 C   0  0  0

+   -3.6314   -1.7879   -0.3903 C   0  0  0

+    4.2398   -0.8391    0.1328 C   0  0  0

+   -4.4770   -1.5651    0.7399 O   0  0  0

+   -1.1358   -2.6005    0.0000 H   0  0  0

+    1.9475    3.2025    0.0000 H   0  0  0

+   -3.5543    0.9989    0.0000 H   0  0  0

+   -2.3676    3.3423    0.0000 H   0  0  0

+    1.7069   -3.1220    0.0000 H   0  0  0

+    4.0746    1.2407    0.0000 H   0  0  0

+   -0.2437    4.4399    0.0000 H   0  0  0

+    4.1064   -3.0628    0.0000 H   0  0  0

+   -4.1478   -2.7518    0.0000 H   0  0  0

+   -2.8137   -2.5138    0.0000 H   0  0  0

+    5.3329   -0.8102    0.0000 H   0  0  0

+   -5.5344   -1.2865    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+ 16 18  1  0

+  5  7  2  0

+  9 12  1  0

+ 10 14  2  0

+ 15 17  1  0

+  6 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98025-31-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+   -2.8865   -0.7102    0.1840 C   0  0  2

+   -4.0897    0.1955    0.1284 C   0  0  0

+   -1.6113    0.1292    0.0832 C   0  0  0

+   -2.9369   -1.6605   -0.9350 N   0  0  0

+   -4.6017    0.7017    1.2613 O   0  0  0

+   -4.5936    0.4660   -0.9359 O   0  0  0

+   -0.1630   -0.9609    0.1501 S   0  0  0

+    1.1255    0.2336    0.0174 C   0  0  0

+    2.3907   -0.1542    0.0258 C   0  0  0

+    0.7352    1.9192   -0.1242 Cl  0  0  0

+    3.6602    1.0226   -0.1049 Cl  0  0  0

+    2.7810   -1.8399    0.1674 Cl  0  0  0

+   -1.8933   -1.2799    0.0000 H   0  0  0

+   -0.8227    0.9594    0.0000 H   0  0  0

+   -2.3460    1.0074    0.0000 H   0  0  0

+   -3.9574   -2.1797    0.0000 H   0  0  0

+   -1.9770   -2.2847    0.0000 H   0  0  0

+   -5.4159    1.5067    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  7  8  1  0

+  8  9  2  0

+  8 10  1  0

+  9 11  1  0

+  9 12  1  0

+  1 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67411-86-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.3817    0.1322    0.0026 C   0  0  0

+   -0.4693   -0.9890    0.0009 C   0  0  0

+    1.8290   -0.0891    0.0018 C   0  0  0

+   -0.1574    1.4306   -0.0009 C   0  0  0

+   -1.9165   -0.7675    0.0011 C   0  0  0

+    0.0701   -2.2873   -0.0014 C   0  0  0

+    2.3152   -1.4171   -0.0004 C   0  0  0

+    2.7309    0.9788    0.0027 C   0  0  0

+   -1.4938    1.6404   -0.0066 C   0  0  0

+    0.7742    2.6151    0.0015 C   0  0  0

+   -2.4025    0.5606    0.0031 C   0  0  0

+   -2.8187   -1.8351   -0.0012 C   0  0  0

+    1.4065   -2.4969   -0.0024 C   0  0  0

+    3.7013   -1.6377   -0.0013 C   0  0  0

+    4.0727    0.7298    0.0014 C   0  0  0

+    0.0097    3.8224   -0.0027 O   0  0  0

+   -3.7885    0.7816    0.0032 C   0  0  0

+   -4.1605   -1.5858   -0.0015 C   0  0  0

+    4.5548   -0.5750    0.0000 C   0  0  0

+   -4.6423   -0.2809    0.0013 C   0  0  0

+   -0.5805   -3.1148    0.0000 H   0  0  0

+    2.3769    1.9701    0.0000 H   0  0  0

+   -1.8624    2.6264    0.0000 H   0  0  0

+    1.5227    1.8750    0.0000 H   0  0  0

+    1.5942    3.2752    0.0000 H   0  0  0

+   -2.4649   -2.8265    0.0000 H   0  0  0

+    1.7752   -3.4829    0.0000 H   0  0  0

+    4.0801   -2.6198    0.0000 H   0  0  0

+    4.7510    1.5348    0.0000 H   0  0  0

+   -0.5535    4.7117    0.0000 H   0  0  0

+   -4.1671    1.7638    0.0000 H   0  0  0

+   -4.8390   -2.3906    0.0000 H   0  0  0

+    5.5938   -0.7441    0.0000 H   0  0  0

+   -5.6812   -0.1115    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+  8 15  2  0

+ 10 16  1  0

+ 11 17  1  0

+ 12 18  2  0

+ 14 19  2  0

+ 17 20  2  0

+  7 13  1  0

+  9 11  1  0

+ 15 19  1  0

+ 18 20  1  0

+  6 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71422-67-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

+   -1.6054   -1.2920   -0.1625 C   0  0  0

+   -2.8453   -1.7344   -0.5039 O   0  0  0

+   -1.1302   -1.4859    1.1269 C   0  0  0

+   -0.8130   -0.6515   -1.1055 C   0  0  0

+   -3.7087   -0.7204   -0.2442 C   0  0  0

+    0.1301   -1.0368    1.4740 C   0  0  0

+   -2.1189   -2.2922    2.3042 Cl  0  0  0

+    0.4472   -0.2028   -0.7591 C   0  0  0

+   -1.4051   -0.4149   -2.7201 Cl  0  0  0

+   -5.0654   -0.8886   -0.4989 C   0  0  0

+   -3.2530    0.4168    0.2538 N   0  0  0

+    0.9206   -0.3917    0.5326 C   0  0  0

+   -5.9352    0.1543   -0.2292 C   0  0  0

+   -5.6601   -2.3854   -1.1467 Cl  0  0  0

+   -4.0579    1.4279    0.5210 C   0  0  0

+    2.1981    0.0636    0.8842 N   0  0  0

+   -5.4152    1.3332    0.2877 C   0  0  0

+    3.2697   -0.3065    0.1554 C   0  0  0

+   -6.3237    2.4951    0.5968 C   0  0  0

+    4.4790    0.2287    0.4154 N   0  0  0

+    3.1455   -1.1231   -0.7364 O   0  0  0

+   -5.5668    3.5571    1.1032 F   0  0  0

+   -6.9744    2.9023   -0.5729 F   0  0  0

+   -7.2735    2.1046    1.5469 F   0  0  0

+    5.5505   -0.1415   -0.3134 C   0  0  0

+    6.8736    0.4441   -0.0290 C   0  0  0

+    5.4263   -0.9580   -1.2052 O   0  0  0

+    7.2791    1.6154   -0.6784 C   0  0  0

+    7.7288   -0.1652    0.8964 C   0  0  0

+    8.5209    2.1576   -0.4053 C   0  0  0

+    6.4592    2.2147   -1.5693 F   0  0  0

+    8.9668    0.3908    1.1572 C   0  0  0

+    7.3450   -1.2932    1.5332 F   0  0  0

+    9.3616    1.5460    0.5067 C   0  0  0

+    0.5934   -1.8584    0.0000 H   0  0  0

+    0.4649    0.7403    0.0000 H   0  0  0

+   -6.8692    0.0228    0.0000 H   0  0  0

+   -3.6781    2.2913    0.0000 H   0  0  0

+    2.1935    1.0068    0.0000 H   0  0  0

+    4.4394    1.1711    0.0000 H   0  0  0

+    8.6232    3.0953    0.0000 H   0  0  0

+    9.6640   -0.2445    0.0000 H   0  0  0

+   10.2609    1.8304    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

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+ 10 13  2  0

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+ 12 16  1  0

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+ 16 18  1  0

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+ 19 23  1  0

+ 19 24  1  0

+ 20 25  1  0

+ 25 26  1  0

+ 25 27  2  0

+ 26 28  2  0

+ 26 29  1  0

+ 28 30  1  0

+ 28 31  1  0

+ 29 32  2  0

+ 29 33  1  0

+ 30 34  2  0

+  8 12  1  0

+ 15 17  2  0

+ 32 34  1  0

+  6 35  1  0

+  8 36  1  0

+ 13 37  1  0

+ 15 38  1  0

+ 16 39  1  0

+ 20 40  1  0

+ 30 41  1  0

+ 32 42  1  0

+ 34 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+580-22-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.2560    0.5924   -0.0029 C   0  0  0

+   -0.5234   -0.7984   -0.0009 C   0  0  0

+    1.0087    1.0286   -0.0022 N   0  0  0

+   -1.3329    1.4955    0.0003 C   0  0  0

+    0.5563   -1.7048    0.0014 C   0  0  0

+   -1.8526   -1.2490   -0.0007 C   0  0  0

+    2.0218    0.1867    0.0004 C   0  0  0

+   -2.6100    1.0242    0.0051 C   0  0  0

+    1.8222   -1.2012    0.0015 C   0  0  0

+   -2.8706   -0.3441   -0.0025 C   0  0  0

+    3.3161    0.6847    0.0006 N   0  0  0

+   -1.1543    2.5225    0.0000 H   0  0  0

+    0.3904   -2.7339    0.0000 H   0  0  0

+   -2.0596   -2.2706    0.0000 H   0  0  0

+   -3.4054    1.6979    0.0000 H   0  0  0

+    2.6409   -1.8465    0.0000 H   0  0  0

+   -3.8574   -0.6799    0.0000 H   0  0  0

+    4.1267    0.0293    0.0000 H   0  0  0

+    3.4784    1.7144    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+  7  9  2  0

+  8 10  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+69304-47-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    2.8260   -0.5596    0.3736 C   0  0  2

+    1.4478   -1.0488    0.2867 N   0  0  0

+    2.8173    0.8555    0.6620 O   0  0  0

+    3.5020   -0.6762   -1.0106 C   0  0  0

+    1.2152   -2.3704    0.3347 C   0  0  0

+    0.4263   -0.1508    0.1641 C   0  0  0

+    4.1004    1.3432    0.2132 C   0  0  1

+    4.3597    0.6045   -1.1185 C   0  0  1

+   -0.0283   -2.8760    0.2591 N   0  0  0

+    2.1562   -3.1318    0.4495 O   0  0  0

+   -0.8594   -0.6034    0.0829 C   0  0  0

+    4.0112    2.8482   -0.0475 C   0  0  0

+    5.7406    0.2471   -1.2040 O   0  0  0

+   -1.0915   -2.0545    0.1314 C   0  0  0

+   -1.9877    0.3402   -0.0497 C   0  0  0

+    3.6827    3.5235    1.1683 O   0  0  0

+   -2.2200   -2.5055    0.0624 O   0  0  0

+   -3.2366   -0.1089   -0.0127 C   0  0  0

+   -4.6813    1.0993   -0.1825 Br  0  0  0

+    2.9128   -1.5771    0.0000 H   0  0  0

+    3.1899   -1.6485    0.0000 H   0  0  0

+    4.4214   -1.1207    0.0000 H   0  0  0

+    0.6205    0.8517    0.0000 H   0  0  0

+    5.1015    1.5445    0.0000 H   0  0  0

+    3.3467    0.7331    0.0000 H   0  0  0

+   -0.1666   -3.8878    0.0000 H   0  0  0

+    4.9762    2.5142    0.0000 H   0  0  0

+    4.6889    3.6121    0.0000 H   0  0  0

+    6.7292   -0.0088    0.0000 H   0  0  0

+   -1.8093    1.3457    0.0000 H   0  0  0

+    3.2360    4.4418    0.0000 H   0  0  0

+   -3.4150   -1.1144    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 14 17  2  0

+ 15 18  2  0

+ 18 19  1  0

+  7  8  1  0

+ 11 14  1  0

+  1 20  1  0

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+ 12 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2747-04-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -0.2506    0.2070   -0.2605 C   0  0  0

+   -1.0259   -0.9671   -0.2614 C   0  0  0

+    1.2013    0.0985   -0.1008 C   0  0  0

+   -0.8671    1.4537   -0.4164 C   0  0  0

+   -2.4016   -0.8747   -0.4121 C   0  0  0

+   -0.4267   -2.1684   -0.1167 O   0  0  0

+    1.7405   -1.1401    0.0406 C   0  0  0

+    2.0733    1.3276   -0.0940 C   0  0  0

+   -2.2214    1.5261   -0.5691 C   0  0  0

+   -2.9957    0.3676   -0.5595 C   0  0  0

+    0.9032   -2.2750    0.0296 C   0  0  0

+    3.9519    0.7971    0.1395 Br  0  0  0

+   -4.3427    0.4567   -0.7069 O   0  0  0

+    1.3996   -3.3798    0.1570 O   0  0  0

+   -5.1348    0.5080    0.3763 C   0  0  0

+   -6.6330    0.4824    0.2161 C   0  0  0

+   -4.6462    0.5748    1.4794 O   0  0  0

+   -0.2986    2.3167    0.0000 H   0  0  0

+   -2.9816   -1.7300    0.0000 H   0  0  0

+    2.7674   -1.2561    0.0000 H   0  0  0

+    2.4654    2.2838    0.0000 H   0  0  0

+    1.1679    1.8259    0.0000 H   0  0  0

+   -2.6840    2.4502    0.0000 H   0  0  0

+   -6.6507    1.5157    0.0000 H   0  0  0

+   -7.6663    0.4647    0.0000 H   0  0  0

+   -6.6153   -0.5509    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

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+  7 11  1  0

+  9 10  1  0

+  4 18  1  0

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+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 16 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+85-98-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 41                          1 V2000

+   -1.0198    1.0633   -0.3000 N   0  0  0

+   -1.7743   -0.0846   -0.0327 C   0  0  0

+    0.0717    1.3398    0.4406 C   0  0  0

+   -1.4130    1.9611   -1.3888 C   0  0  0

+   -3.1591   -0.0072    0.0332 C   0  0  0

+   -1.1399   -1.3047    0.1616 C   0  0  0

+    1.3014    1.0985   -0.0553 N   0  0  0

+   -0.0530    1.8071    1.5562 O   0  0  0

+   -2.1915    3.1471   -0.8158 C   0  0  0

+   -3.9010   -1.1421    0.2968 C   0  0  0

+   -1.8873   -2.4357    0.4247 C   0  0  0

+    1.7708   -0.2162   -0.1531 C   0  0  0

+    2.1467    2.2125   -0.4921 C   0  0  0

+   -3.2662   -2.3543    0.4949 C   0  0  0

+    1.4425   -0.9919   -1.2569 C   0  0  0

+    2.5709   -0.7459    0.8511 C   0  0  0

+    2.8311    2.8405    0.7237 C   0  0  0

+    1.9078   -2.2891   -1.3506 C   0  0  0

+    3.0329   -2.0434    0.7514 C   0  0  0

+    2.6997   -2.8152   -0.3468 C   0  0  0

+   -0.3976    1.9054    0.0000 H   0  0  0

+   -0.9056    2.8424    0.0000 H   0  0  0

+   -3.6178    0.9004    0.0000 H   0  0  0

+   -0.1244   -1.3578    0.0000 H   0  0  0

+   -1.3414    3.7051    0.0000 H   0  0  0

+   -2.7495    3.9972    0.0000 H   0  0  0

+   -3.0416    2.5891    0.0000 H   0  0  0

+   -4.9167   -1.0930    0.0000 H   0  0  0

+   -1.4323   -3.3451    0.0000 H   0  0  0

+    1.8670    3.1902    0.0000 H   0  0  0

+    1.1472    2.3998    0.0000 H   0  0  0

+   -3.8181   -3.2084    0.0000 H   0  0  0

+    0.4260   -0.9634    0.0000 H   0  0  0

+    3.3717   -0.1192    0.0000 H   0  0  0

+    3.5186    2.0912    0.0000 H   0  0  0

+    3.5804    3.5280    0.0000 H   0  0  0

+    2.1436    3.5898    0.0000 H   0  0  0

+    1.1072   -2.9161    0.0000 H   0  0  0

+    4.0493   -2.0767    0.0000 H   0  0  0

+    2.9890   -3.7901    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 33  1  0

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+ 17 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103-84-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.2329    0.3603   -0.2733 C   0  0  0

+    0.6680   -0.9275   -0.5563 C   0  0  0

+    1.1279    1.2989    0.2239 C   0  0  0

+   -1.1029    0.7135   -0.4940 N   0  0  0

+    1.9887   -1.2714   -0.3428 C   0  0  0

+    2.4469    0.9489    0.4352 C   0  0  0

+   -2.0924   -0.0066    0.0708 C   0  0  0

+    2.8771   -0.3347    0.1523 C   0  0  0

+   -3.5300    0.2930   -0.2677 C   0  0  0

+   -1.8258   -0.8957    0.8514 O   0  0  0

+   -0.0254   -1.6720    0.0000 H   0  0  0

+    0.8517    2.2781    0.0000 H   0  0  0

+   -1.2904    1.7135    0.0000 H   0  0  0

+    2.2685   -2.2496    0.0000 H   0  0  0

+    3.1429    1.6910    0.0000 H   0  0  0

+    3.8705   -0.5545    0.0000 H   0  0  0

+   -3.3224    1.2890    0.0000 H   0  0  0

+   -4.5260    0.5006    0.0000 H   0  0  0

+   -3.7376   -0.7030    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  5 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+544-16-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -0.1675   -0.5868    0.0000 C   0  0  0

+   -1.3822    0.3435    0.0000 C   0  0  0

+    1.0491    0.2058    0.0000 O   0  0  0

+   -2.6641   -0.4916    0.0000 C   0  0  0

+    2.1352   -0.3456    0.0000 N   0  0  0

+   -3.8788    0.4387    0.0000 C   0  0  0

+    3.1557    0.3192    0.0000 O   0  0  0

+   -0.9434   -1.3920    0.0000 H   0  0  0

+    0.5449   -1.4487    0.0000 H   0  0  0

+   -0.6063    1.1487    0.0000 H   0  0  0

+   -2.0946    1.2054    0.0000 H   0  0  0

+   -3.4400   -1.2968    0.0000 H   0  0  0

+   -1.9517   -1.3535    0.0000 H   0  0  0

+   -3.1989    1.3265    0.0000 H   0  0  0

+   -4.7666    1.1186    0.0000 H   0  0  0

+   -4.5587   -0.4491    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  2  0

+  1  8  1  0

+  1  9  1  0

+  2 10  1  0

+  2 11  1  0

+  4 12  1  0

+  4 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+563-04-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 49                          1 V2000

+    0.1683   -1.3288   -0.1610 P   0  0  0

+   -1.0526   -2.3587    0.0414 O   0  0  0

+    0.2382   -0.3257    1.0964 O   0  0  0

+    1.5495   -2.1487   -0.2709 O   0  0  0

+   -0.0434   -0.5504   -1.4018 O   0  0  0

+   -2.1691   -1.6100    0.2406 C   0  0  0

+    0.0861    0.9320    0.6045 C   0  0  0

+    2.5479   -1.2292   -0.3384 C   0  0  0

+   -2.8742   -1.1116   -0.8450 C   0  0  0

+   -2.6090   -1.3476    1.5301 C   0  0  0

+   -1.1647    1.5315    0.6050 C   0  0  0

+    1.1828    1.6206    0.1062 C   0  0  0

+    3.2152   -0.8425    0.8145 C   0  0  0

+    2.9051   -0.6798   -1.5614 C   0  0  0

+   -4.0090   -0.3507   -0.6398 C   0  0  0

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+ 25 44  1  0

+ 25 45  1  0

+ 25 46  1  0

+ 26 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+586-78-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.9399    0.0001   -0.0008 C   0  0  0

+   -3.4199    0.0001   -0.0009 N   0  3  0

+   -1.2490    1.1972    0.0011 C   0  0  0

+   -1.2488   -1.1975    0.0031 C   0  0  0

+   -4.0289   -1.0548   -0.0026 O   0  0  0

+   -4.0289    1.0549    0.0007 O   0  5  0

+    0.1334    1.1977    0.0012 C   0  0  0

+    0.1332   -1.1980    0.0032 C   0  0  0

+    0.8252    0.0000   -0.0007 C   0  0  0

+    2.7162    0.0000   -0.0005 Br  0  0  0

+   -1.7677    2.0951    0.0000 H   0  0  0

+   -1.7675   -2.0953    0.0000 H   0  0  0

+    0.6516    2.0958    0.0000 H   0  0  0

+    0.6514   -2.0961    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  8  9  1  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42373-04-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

+   -1.3994    0.7154    0.1854 C   0  0  0

+   -2.4739    1.5550   -0.1206 C   0  0  0

+   -0.2929    1.6000    0.5966 C   0  0  0

+   -1.3800   -0.6241    0.1234 N   0  0  0

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+   -0.7848    2.9117    0.5074 C   0  0  0

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+ 23 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+ 25 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+155379-83-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.4963   -0.0222    0.0029 C   0  0  0

+    0.2408   -1.1897    0.0016 C   0  0  0

+    0.1500    1.2071    0.0022 C   0  0  0

+   -1.9751   -0.0807   -0.0012 N   0  3  0

+    1.6286   -1.1347   -0.0004 C   0  0  0

+   -0.4605   -2.5235    0.0028 C   0  0  0

+    1.5373    1.2620    0.0002 C   0  0  0

+   -0.5974    2.3909    0.0031 N   0  0  0

+   -2.5864   -0.1077    1.0520 O   0  0  0

+   -2.5809   -0.1018   -1.0576 O   0  5  0

+    2.2747    0.0941   -0.0010 C   0  0  0

+    2.3760   -2.3186   -0.0022 N   0  0  0

+    2.2386    2.5959   -0.0005 C   0  0  0

+   -1.3825   -2.0387    0.0000 H   0  0  0

+   -0.9453   -3.4455    0.0000 H   0  0  0

+    0.4615   -3.0083    0.0000 H   0  0  0

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+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57470-96-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 54                          1 V2000

+   -0.1468   -0.5215   -0.3210 C   0  0  0

+   -1.2889   -1.3381   -0.3267 C   0  0  0

+   -0.2794    0.8500   -0.4779 C   0  0  0

+    1.0823   -1.0719   -0.1570 O   0  0  0

+   -2.5528   -0.7589   -0.4909 C   0  0  0

+   -1.1585   -2.7909   -0.1618 C   0  0  0

+   -1.5291    1.4124   -0.6391 C   0  0  0

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+   -2.3872   -3.6633   -0.1685 C   0  0  0

+   -0.0616   -3.2891   -0.0201 O   0  0  0

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+   -3.9310    1.1923   -0.8110 N   0  0  0

+    4.4472    0.5963   -0.0588 C   0  0  0

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+   -4.9003    0.9672    0.0980 C   0  0  0

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+ 25 53  1  0

+ 25 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+518-83-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.7620    0.6152    0.0741 C   0  0  0

+   -0.7741   -0.7948    0.0836 C   0  0  0

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+    0.4997   -1.5364    0.2129 C   0  0  0

+   -1.9777   -1.4750   -0.0291 C   0  0  0

+    1.7850    0.5930    0.0137 C   0  0  0

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+   -3.1613    0.6220   -0.1721 C   0  0  0

+   -1.9619    2.6744   -0.0644 O   0  0  0

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+    0.4970   -2.7238    0.4710 O   0  0  0

+   -3.1699   -0.7629   -0.1521 C   0  0  0

+    2.9840    1.2739   -0.1657 C   0  0  0

+    2.9674   -1.5125   -0.1459 C   0  0  0

+   -4.3458   -1.4312   -0.2629 O   0  0  0

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+    4.1522   -0.8193   -0.3228 C   0  0  0

+   -1.9902   -2.5129    0.0000 H   0  0  0

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+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3524-68-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 38                          1 V2000

+    0.0000   -0.8041   -0.2821 C   0  0  0

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+   -0.0001   -3.1700   -0.7749 O   0  0  0

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+ 21 38  1  0

+ 21 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+634-90-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.8669   -0.0001    0.0018 C   0  0  0

+   -0.1746   -1.1987    0.0011 C   0  0  0

+   -0.1743    1.1989    0.0016 C   0  0  0

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+  7  9  1  0

+  5 11  1  0

+  7 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4651-67-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 66 69                          1 V2000

+   -0.0892   -2.9562   -0.0914 C   0  0  0

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+ 26 64  1  0

+ 27 65  1  0

+ 28 66  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+159092-81-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.7761   -0.3321    0.0019 C   0  0  0

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+   -1.2568   -1.7838   -0.0025 C   0  0  0

+    0.4151    2.0883   -0.0079 C   0  0  0

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+    2.9979   -1.2083    0.0212 C   0  0  0

+   -0.9228    1.9216   -0.0143 C   0  0  0

+   -2.8977    0.4709   -0.0175 C   0  0  0

+   -2.6173   -1.9082   -0.0087 C   0  0  0

+    0.9740    3.4590   -0.0098 N   0  3  0

+    3.5133    0.0824    0.0128 C   0  0  0

+    3.9215   -2.3650    0.0356 N   0  3  0

+   -3.4336   -0.7838   -0.0155 C   0  0  0

+    0.5473    4.2918    0.7699 O   0  0  0

+    1.8606    3.7540   -0.7911 O   0  5  0

+    5.1258   -2.1826    0.0407 O   0  0  0

+    3.4773   -3.4990    0.0425 O   0  5  0

+   -4.9045   -0.9495   -0.0210 N   0  3  0

+   -5.3916   -2.0658   -0.0192 O   0  0  0

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+    1.2727   -2.3938    0.0000 H   0  0  0

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+   -1.5412    2.7607    0.0000 H   0  0  0

+   -3.5214    1.3061    0.0000 H   0  0  0

+   -3.0479   -2.8575    0.0000 H   0  0  0

+    4.5460    0.2236    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 29  1  0

+ 14 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98644-23-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

+    0.2995   -1.4995    0.0353 C   0  0  0

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+    2.5543   -1.6480    2.4979 O   0  0  0

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+   -5.3018    2.3838    0.8174 O   0  0  0

+   13.0924    3.0059   -1.4560 Na  0  3  0

+   -2.8936   -1.0673    0.0000 H   0  0  0

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+ 20 40  1  0

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+ 22 42  1  0

+ 26 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68641-49-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    1.4719   -0.0173    0.0539 N   0  0  0

+    0.0469    0.7429    0.3383 P   0  0  0

+    1.7228   -1.3137    0.2826 C   0  0  0

+    2.6811    0.6111   -0.4997 C   0  0  0

+   -1.1812   -0.1457   -0.2876 N   0  0  0

+   -0.1483    0.8954    1.7974 O   0  0  0

+    0.0714    2.6198   -0.5578 Cl  0  0  0

+    2.9668   -1.6883   -0.0358 O   0  0  0

+    0.8959   -2.0788    0.7380 O   0  0  0

+    3.7015   -0.5422   -0.5550 C   0  0  0

+   -2.3142   -0.4681    0.3513 C   0  0  0

+   -1.2215   -0.7133   -1.6439 C   0  0  0

+   -3.1587   -1.2020   -0.3819 O   0  0  0

+   -2.5525   -0.1255    1.4925 O   0  0  0

+   -2.5803   -1.4380   -1.6982 C   0  0  0

+    3.4675    1.1998    0.0000 H   0  0  0

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+ 12 20  1  0

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+ 15 22  1  0

+ 15 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107534-94-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 83 87                          1 V2000

+    6.6000    0.4949   -0.3403 C   0  0  1

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+ 37 82  1  0

+ 37 83  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142-09-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+   -1.1536   -0.2405    0.0000 O   0  0  0

+   -2.3593    0.3624    0.0000 C   0  0  0

+    0.0581    0.5596    0.0000 C   0  0  0

+   -3.5856   -0.4473    0.0000 C   0  0  0

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+  2  1  1  0

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+ 12 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5405-53-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.7419   -0.5879   -0.0011 C   0  0  0

+   -0.7420   -0.5880   -0.0007 C   0  0  0

+    1.2055    0.7246   -0.0005 C   0  0  0

+    1.6607   -1.6391    0.0033 C   0  0  0

+   -1.2057    0.7249    0.0001 C   0  0  0

+   -1.6605   -1.6389   -0.0011 C   0  0  0

+    0.0000    1.6324    0.0003 C   0  0  0

+    2.5600    0.9831   -0.0003 C   0  0  0

+    3.0137   -1.3711    0.0018 C   0  0  0

+   -2.5597    0.9834    0.0002 C   0  0  0

+   -3.0139   -1.3708   -0.0006 C   0  0  0

+    3.4650   -0.0634   -0.0006 C   0  0  0

+   -3.4650   -0.0635   -0.0005 C   0  0  0

+    4.9184    0.2167   -0.0004 N   0  3  0

+   -4.9185    0.2166    0.0001 N   0  3  0

+    5.7160   -0.7038   -0.0008 O   0  0  0

+    5.3169    1.3677    0.0001 O   0  5  0

+   -5.7160   -0.7039   -0.0006 O   0  0  0

+   -5.3169    1.3676    0.0012 O   0  5  0

+    1.3259   -2.6213    0.0000 H   0  0  0

+   -1.3257   -2.6211    0.0000 H   0  0  0

+    0.6988    2.3995    0.0000 H   0  0  0

+   -0.6986    2.3997    0.0000 H   0  0  0

+    2.9008    1.9632    0.0000 H   0  0  0

+    3.6956   -2.1533    0.0000 H   0  0  0

+   -2.9004    1.9635    0.0000 H   0  0  0

+   -3.6958   -2.1529    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+ 10 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 14 17  1  0

+ 15 18  2  0

+ 15 19  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  2  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6943-00-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -1.9173   -2.2260   -0.3370 O   0  0  0

+   -2.3683   -1.1135   -0.1679 C   0  0  0

+   -1.6438   -0.0004    0.0006 N   0  0  0

+   -3.8393   -0.7620   -0.1203 C   0  0  0

+   -2.3683    1.1127    0.1695 C   0  0  0

+   -0.2414   -0.0003    0.0001 C   0  0  0

+   -3.8393    0.7624    0.1136 C   0  0  0

+   -1.9173    2.2252    0.3383 O   0  0  0

+    0.4534    1.0283   -0.6208 C   0  0  0

+    0.4541   -1.0263    0.6258 C   0  0  0

+    1.8348    1.0262   -0.6200 C   0  0  0

+    1.8350   -1.0241    0.6240 C   0  0  0

+    2.5257   -0.0003   -0.0008 C   0  0  0

+    4.2617   -0.0005   -0.0019 Cl  0  0  0

+   -4.8323   -0.6842    0.0000 H   0  0  0

+   -3.9944   -1.7459    0.0000 H   0  0  0

+   -3.9939    1.7464    0.0000 H   0  0  0

+   -4.8324    0.6849    0.0000 H   0  0  0

+   -0.0133    1.9083    0.0000 H   0  0  0

+   -0.0118   -1.9067    0.0000 H   0  0  0

+    2.3035    1.9051    0.0000 H   0  0  0

+    2.3033   -1.9032    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  1  0

+  8  5  2  0

+  9  6  2  0

+ 10  6  1  0

+ 11  9  1  0

+ 12 10  2  0

+ 13 11  2  0

+ 14 13  1  0

+  5  7  1  0

+ 12 13  1  0

+  4 15  1  0

+  4 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+928-51-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    1.3868   -0.4385    0.0000 C   0  0  0

+    0.0451    0.2969    0.0000 C   0  0  0

+    2.5273    0.5813    0.0000 C   0  0  0

+   -1.0954   -0.7230    0.0000 C   0  0  0

+    3.7804   -0.1055    0.0000 O   0  0  0

+   -2.6765    0.1436    0.0000 Cl  0  0  0

+    0.7250   -1.3760    0.0000 H   0  0  0

+    2.2435   -1.2020    0.0000 H   0  0  0

+    0.7068    1.2344    0.0000 H   0  0  0

+   -0.8116    1.0603    0.0000 H   0  0  0

+    3.1890    1.5188    0.0000 H   0  0  0

+    1.6706    1.3448    0.0000 H   0  0  0

+   -1.7571   -1.6605    0.0000 H   0  0  0

+   -0.2387   -1.4864    0.0000 H   0  0  0

+    4.7867   -0.6570    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  1  7  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+548-93-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.5253   -0.3564   -0.0522 C   0  0  0

+   -0.4767    0.6202    0.0463 C   0  0  0

+    1.9450    0.0359   -0.0474 C   0  0  0

+    0.1686   -1.7054   -0.1493 C   0  0  0

+   -1.8163    0.2354    0.0405 C   0  0  0

+   -0.1356    1.9645    0.1496 N   0  0  0

+    2.7301   -0.2879    0.9990 O   0  0  0

+    2.4084    0.6516   -0.9871 O   0  0  0

+   -1.1597   -2.0686   -0.1477 C   0  0  0

+   -2.1506   -1.1032   -0.0620 C   0  0  0

+   -2.7946    1.1754    0.1361 O   0  0  0

+    0.9054   -2.4360    0.0000 H   0  0  0

+    0.8630    2.2464    0.0000 H   0  0  0

+   -0.8790    2.6883    0.0000 H   0  0  0

+    3.6893   -0.6835    0.0000 H   0  0  0

+   -1.4191   -3.0732    0.0000 H   0  0  0

+   -3.1487   -1.3868    0.0000 H   0  0  0

+   -3.5428    1.8943    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  9 10  2  0

+  4 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19406-51-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    1.1984    0.0829    0.0016 C   0  0  0

+    0.0002   -0.6057   -0.0390 C   0  0  0

+    1.2020    1.4616    0.0853 C   0  0  0

+    2.4789   -0.6585   -0.0386 N   0  3  0

+   -1.1985    0.0829    0.0045 C   0  0  0

+    0.0002   -2.1099   -0.1305 C   0  0  0

+    0.0001    2.1563    0.1288 C   0  0  0

+    2.8007   -1.3692    0.8967 O   0  0  0

+    3.2107   -0.5580   -1.0071 O   0  5  0

+   -1.2022    1.4612    0.0879 C   0  0  0

+   -2.4789   -0.6585   -0.0387 N   0  3  0

+    0.0000    3.5504    0.2135 N   0  0  0

+   -3.2092   -0.5566   -1.0081 O   0  0  0

+   -2.8022   -1.3705    0.8952 O   0  5  0

+    2.1006    1.9785    0.0000 H   0  0  0

+   -1.0364   -2.1099    0.0000 H   0  0  0

+    0.0002   -3.1465    0.0000 H   0  0  0

+    1.0368   -2.1099    0.0000 H   0  0  0

+   -2.1008    1.9780    0.0000 H   0  0  0

+    0.8977    4.0688    0.0000 H   0  0  0

+   -0.8978    4.0687    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+  7 10  1  0

+  3 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+126-73-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+   -0.0035   -0.6995   -0.2044 P   0  0  0

+   -1.3174   -0.8438    0.7148 O   0  0  0

+   -0.0098    0.7390   -0.9275 O   0  0  0

+    1.3117   -0.8324    0.7146 O   0  0  0

+    0.0011   -1.7670   -1.2296 O   0  0  0

+   -2.4331   -0.9444   -0.1723 C   0  0  0

+    0.0100    1.7224    0.1091 C   0  0  0

+    2.4247   -0.9580   -0.1728 C   0  0  0

+   -3.7209   -1.0847    0.6418 C   0  0  0

+    0.0052    3.1199   -0.5137 C   0  0  0

+    3.7137   -1.0890    0.6411 C   0  0  0

+   -4.9155   -1.1924   -0.3081 C   0  0  0

+    0.0263    4.1729    0.5962 C   0  0  0

+    4.9053   -1.2234   -0.3090 C   0  0  0

+   -6.2033   -1.3327    0.5061 C   0  0  0

+    0.0215    5.5704   -0.0266 C   0  0  0

+    6.1942   -1.3544    0.5049 C   0  0  0

+   -2.0303   -0.0603    0.0000 H   0  0  0

+   -3.0023   -0.1570    0.0000 H   0  0  0

+    0.8454    1.2263    0.0000 H   0  0  0

+    0.8535    2.2045    0.0000 H   0  0  0

+    1.8505   -1.7417    0.0000 H   0  0  0

+    2.8196   -1.8457    0.0000 H   0  0  0

+   -4.1237   -1.9688    0.0000 H   0  0  0

+   -3.1517   -1.8721    0.0000 H   0  0  0

+   -0.8302    3.6159    0.0000 H   0  0  0

+   -0.8383    2.6378    0.0000 H   0  0  0

+    4.2878   -0.3052    0.0000 H   0  0  0

+    3.3187   -0.2013    0.0000 H   0  0  0

+   -4.5127   -0.3083    0.0000 H   0  0  0

+   -5.4847   -0.4050    0.0000 H   0  0  0

+    0.8617    3.6769    0.0000 H   0  0  0

+    0.8698    4.6550    0.0000 H   0  0  0

+    4.3312   -2.0072    0.0000 H   0  0  0

+    5.3003   -2.1111    0.0000 H   0  0  0

+   -6.3085   -0.3669    0.0000 H   0  0  0

+   -7.1691   -1.4379    0.0000 H   0  0  0

+   -6.0981   -2.2985    0.0000 H   0  0  0

+    0.9931    5.5737    0.0000 H   0  0  0

+    0.0182    6.5420    0.0000 H   0  0  0

+   -0.9501    5.5671    0.0000 H   0  0  0

+    6.0960   -2.3210    0.0000 H   0  0  0

+    7.1608   -1.4526    0.0000 H   0  0  0

+    6.2924   -0.3878    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+ 12 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 14 34  1  0

+ 14 35  1  0

+ 15 36  1  0

+ 15 37  1  0

+ 15 38  1  0

+ 16 39  1  0

+ 16 40  1  0

+ 16 41  1  0

+ 17 42  1  0

+ 17 43  1  0

+ 17 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+542-56-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -0.4701   -0.6873   -0.2128 C   0  0  0

+   -1.6918    0.0345    0.3594 C   0  0  0

+    0.7345    0.0374    0.1509 O   0  0  0

+   -1.7587    1.4532   -0.2095 C   0  0  0

+   -2.9610   -0.7291   -0.0238 C   0  0  0

+    1.8237   -0.3726   -0.2084 N   0  0  0

+    2.8341    0.2353    0.0967 O   0  0  0

+   -1.1516   -1.4983    0.0000 H   0  0  0

+    0.2178   -1.4928    0.0000 H   0  0  0

+   -0.7844    0.5811    0.0000 H   0  0  0

+   -0.7006    1.5031    0.0000 H   0  0  0

+   -1.8086    2.5113    0.0000 H   0  0  0

+   -2.8168    1.4033    0.0000 H   0  0  0

+   -3.5071    0.1786    0.0000 H   0  0  0

+   -3.8687   -1.2752    0.0000 H   0  0  0

+   -2.4149   -1.6368    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  1  0

+  6  7  2  0

+  1  8  1  0

+  1  9  1  0

+  2 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+611-35-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -2.4716    0.9262   -0.0003 Cl  0  0  0

+   -1.1574   -0.2081   -0.0015 C   0  0  0

+    0.1803    0.2334   -0.0006 C   0  0  0

+   -1.3916   -1.5557    0.0024 C   0  0  0

+    1.2207   -0.7283   -0.0011 C   0  0  0

+    0.4991    1.6007    0.0004 C   0  0  0

+   -0.3220   -2.4464    0.0019 C   0  0  0

+    0.9221   -2.0314   -0.0020 N   0  0  0

+    2.5565   -0.2900   -0.0002 C   0  0  0

+    1.8046    1.9871    0.0007 C   0  0  0

+    2.8297    1.0431    0.0011 C   0  0  0

+   -2.3720   -1.9160    0.0000 H   0  0  0

+   -0.2609    2.3173    0.0000 H   0  0  0

+   -0.5154   -3.4729    0.0000 H   0  0  0

+    3.3363   -0.9850    0.0000 H   0  0  0

+    2.0409    3.0046    0.0000 H   0  0  0

+    3.8237    1.3639    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  2  0

+  8  5  2  0

+  9  5  1  0

+ 10  6  2  0

+ 11  9  2  0

+  7  8  1  0

+ 10 11  1  0

+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+48134-75-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.3194   -0.0001   -0.0016 C   0  0  0

+   -1.1643    0.0004   -0.0019 C   0  0  0

+    1.0377    1.1241   -0.4191 C   0  0  0

+    1.0367   -1.1222    0.4216 C   0  0  0

+   -1.8639   -1.1369   -0.4014 C   0  0  0

+   -1.8633    1.1357    0.4026 C   0  0  0

+    2.4165    1.0812   -0.4031 C   0  0  0

+    2.4160   -1.0801    0.4058 C   0  0  0

+   -3.2439   -1.1311   -0.3993 C   0  0  0

+   -3.2436    1.1304    0.4008 C   0  0  0

+    3.0558   -0.0007   -0.0011 N   0  3  0

+   -3.9328    0.0008   -0.0016 C   0  0  0

+    4.5208   -0.0013   -0.0013 C   0  0  0

+    0.5705    2.0094    0.0000 H   0  0  0

+    0.5694   -2.0074    0.0000 H   0  0  0

+   -1.3774   -2.0117    0.0000 H   0  0  0

+   -1.3768    2.0105    0.0000 H   0  0  0

+    2.9261    1.9428    0.0000 H   0  0  0

+    2.9247   -1.9422    0.0000 H   0  0  0

+   -3.7362   -2.0027    0.0000 H   0  0  0

+   -3.7352    2.0024    0.0000 H   0  0  0

+   -4.9338    0.0013    0.0000 H   0  0  0

+    4.5204   -1.0023    0.0000 H   0  0  0

+    5.5218   -0.0017    0.0000 H   0  0  0

+    4.5212    0.9997    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  9 12  1  0

+ 11 13  1  0

+  8 11  2  0

+ 10 12  2  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120-36-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.1886   -0.0303    0.7097 C   0  0  0

+   -0.5725   -1.0361    0.1302 C   0  0  0

+    1.4814   -0.2688    1.0561 O   0  0  0

+   -0.3699    1.2201    0.9296 C   0  0  0

+   -1.8869   -0.7909   -0.2215 C   0  0  0

+    0.1255   -2.6001   -0.1530 Cl  0  0  0

+    2.2494   -0.2081   -0.1475 C   0  0  0

+   -1.6821    1.4624    0.5718 C   0  0  0

+   -2.4430    0.4557    0.0038 C   0  0  0

+    2.7755    1.1912   -0.3376 C   0  0  0

+    3.4225   -1.1857   -0.0537 C   0  0  0

+   -4.0936    0.7613   -0.4387 Cl  0  0  0

+    3.5290    1.4851   -1.4089 O   0  0  0

+    2.5192    2.0485    0.4742 O   0  0  0

+    0.2496    2.0074    0.0000 H   0  0  0

+   -2.5073   -1.5775    0.0000 H   0  0  0

+    1.9458   -1.1628    0.0000 H   0  0  0

+   -2.0448    2.3962    0.0000 H   0  0  0

+    2.7812   -1.9553    0.0000 H   0  0  0

+    4.1921   -1.8270    0.0000 H   0  0  0

+    4.0638   -0.4161    0.0000 H   0  0  0

+    4.4623    1.8491    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

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+ 10 13  1  0

+ 10 14  2  0

+  8  9  1  0

+  4 15  1  0

+  5 16  1  0

+  7 17  1  0

+  8 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1937-35-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 71 76                          1 V2000

+   -7.6698   -0.6552   -0.1492 C   0  0  0

+   -9.0518   -0.9303   -0.0193 C   0  0  0

+   -6.7185   -1.7644   -0.0942 C   0  0  0

+   -7.2398    0.6685   -0.3332 C   0  0  0

+   -9.9723    0.1302   -0.0711 C   0  0  0

+   -9.4816   -2.2584    0.1589 C   0  0  0

+   -5.3851   -1.5415   -0.2143 N   0  0  0

+   -7.2143   -3.0617    0.0858 C   0  0  0

+   -8.1727    1.6826   -0.3846 C   0  0  0

+   -5.9163    0.9479   -0.4590 O   0  0  0

+   -9.5293    1.4064   -0.2450 C   0  0  0

+   -8.5877   -3.2801    0.2078 C   0  0  0

+   -4.5812   -1.9188    0.7214 N   0  0  0

+   -6.3357   -4.1360    0.1421 N   0  0  0

+  -10.6938    2.7272   -0.3083 S   0  0  0

+   -3.2407   -1.6948    0.6006 C   0  0  0

+  -10.1129    3.7141   -1.1496 O   0  0  0

+  -11.9604    2.1158   -0.5109 O   0  0  0

+  -10.7522    3.3493    1.0796 O   0  0  0

+   -2.3680   -2.1038    1.6152 C   0  0  0

+   -2.7365   -1.0609   -0.5406 C   0  0  0

+   -1.0167   -1.8757    1.4892 C   0  0  0

+   -1.3952   -0.8361   -0.6626 C   0  0  0

+   -0.5215   -1.2375    0.3501 C   0  0  0

+    0.9323   -0.9915    0.2133 C   0  0  0

+    1.5546   -1.1593   -1.0255 C   0  0  0

+    1.6786   -0.5864    1.3219 C   0  0  0

+    2.9058   -0.9303   -1.1512 C   0  0  0

+    3.0195   -0.3585    1.2001 C   0  0  0

+    3.6508   -0.5301   -0.0366 C   0  0  0

+    4.9915   -0.3024   -0.1569 N   0  0  0

+    5.6778    0.0666    0.8712 N   0  0  0

+    7.0142    0.2936    0.7514 C   0  0  0

+    7.7547    0.6933    1.8675 C   0  0  0

+    7.6455    0.1191   -0.4948 C   0  0  0

+    9.1393    0.9246    1.7286 C   0  0  0

+    7.1361    0.8607    3.0955 N   0  0  0

+    8.9758    0.3387   -0.6389 C   0  0  0

+    9.7520    0.7478    0.4633 C   0  0  0

+    9.9204    1.3276    2.8234 C   0  0  0

+    9.7371    0.1112   -2.2116 S   0  0  0

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+   11.2551    1.5434    2.6567 C   0  0  0

+   10.2769    1.3770   -2.5660 O   0  0  0

+   10.4752   -1.0989   -2.1118 O   0  0  0

+    8.6288   -0.1623   -3.2183 O   0  0  0

+   11.8580    1.3698    1.4133 C   0  0  0

+  -10.9682   -0.0617    0.0000 H   0  0  0

+  -10.4751   -2.4628    0.0000 H   0  0  0

+   -7.8603    2.6475    0.0000 H   0  0  0

+   -4.9239    1.1574    0.0000 H   0  0  0

+   -8.9328   -4.2339    0.0000 H   0  0  0

+   -6.6946   -5.0846    0.0000 H   0  0  0

+   -5.3347   -3.9725    0.0000 H   0  0  0

+  -10.8470    4.3591    0.0000 H   0  0  0

+   -2.5050   -3.1088    0.0000 H   0  0  0

+   -3.2514   -0.1871    0.0000 H   0  0  0

+   -0.4960   -2.7461    0.0000 H   0  0  0

+   -1.2614    0.1693    0.0000 H   0  0  0

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+    3.2349   -1.8897    0.0000 H   0  0  0

+    3.0687    0.6546    0.0000 H   0  0  0

+    7.5917   -0.8937    0.0000 H   0  0  0

+    6.8760    1.8411    0.0000 H   0  0  0

+    6.4171    0.1453    0.0000 H   0  0  0

+    9.6030    2.2909    0.0000 H   0  0  0

+   11.4586    0.0199    0.0000 H   0  0  0

+   11.3160    2.5558    0.0000 H   0  0  0

+    7.6441   -0.4053    0.0000 H   0  0  0

+   12.8666    1.4771    0.0000 H   0  0  0

+  1  2  1  0

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+ 37 66  1  0

+ 40 67  1  0

+ 42 68  1  0

+ 43 69  1  0

+ 46 70  1  0

+ 47 71  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105837-00-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.1479    0.1680   -0.0068 C   0  0  0

+   -1.1479   -1.3000   -0.0034 C   0  0  0

+   -0.0001    0.8368   -0.0067 N   0  0  0

+   -2.3864    0.8456   -0.0042 C   0  0  0

+   -0.0001   -1.9688    0.0003 N   0  0  0

+   -2.3863   -1.9777   -0.0037 C   0  0  0

+    1.1480    0.1679   -0.0034 C   0  0  0

+   -3.5408    0.1319    0.0012 C   0  0  0

+    1.1480   -1.2998    0.0009 C   0  0  0

+   -3.5408   -1.2641   -0.0070 C   0  0  0

+    2.3863    0.8455   -0.0027 C   0  0  0

+   -4.8337    0.8526    0.0043 N   0  3  0

+    2.3862   -1.9776    0.0046 C   0  0  0

+    3.5408    0.1319    0.0012 C   0  0  0

+   -5.8792    0.2278    0.0092 O   0  0  0

+   -4.8520    2.0705    0.0020 O   0  5  0

+    3.5408   -1.2641    0.0049 C   0  0  0

+    4.8337    0.8526    0.0014 N   0  3  0

+    5.8792    0.2278    0.0049 O   0  0  0

+    4.8520    2.0705   -0.0017 O   0  5  0

+   -2.4134    1.8632    0.0000 H   0  0  0

+   -2.4132   -2.9953    0.0000 H   0  0  0

+   -4.4299   -1.7598    0.0000 H   0  0  0

+    2.4132    1.8631    0.0000 H   0  0  0

+    2.4130   -2.9952    0.0000 H   0  0  0

+    4.4299   -1.7598    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+ 11 14  2  0

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+  7  9  2  0

+  8 10  1  0

+ 14 17  1  0

+  4 21  1  0

+  6 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+191-07-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 42                          1 V2000

+   -0.4799    1.3252    0.0022 C   0  0  0

+   -1.3878    0.2472    0.0018 C   0  0  0

+    0.9078    1.0782    0.0017 C   0  0  0

+   -0.9602    2.6519   -0.0028 C   0  0  0

+   -0.9078   -1.0782    0.0009 C   0  0  0

+   -2.7769    0.4944    0.0019 C   0  0  0

+    1.3877   -0.2470    0.0007 C   0  0  0

+    1.8167    2.1574    0.0017 C   0  0  0

+   -2.3523    2.8690   -0.0077 C   0  0  0

+   -0.0299    3.7095   -0.0022 C   0  0  0

+    0.4798   -1.3252   -0.0002 C   0  0  0

+   -1.8166   -2.1575    0.0005 C   0  0  0

+   -3.2279    1.8292    0.0028 C   0  0  0

+   -3.6606   -0.6023    0.0006 C   0  0  0

+    2.7768   -0.4944   -0.0003 C   0  0  0

+    1.3087    3.4711    0.0027 C   0  0  0

+    3.1981    1.8807    0.0003 C   0  0  0

+    0.9602   -2.6519   -0.0011 C   0  0  0

+   -3.1977   -1.8808    0.0006 C   0  0  0

+   -1.3085   -3.4716   -0.0004 C   0  0  0

+    3.6609    0.6026    0.0003 C   0  0  0

+    3.2277   -1.8288   -0.0013 C   0  0  0

+    0.0298   -3.7099   -0.0015 C   0  0  0

+    2.3519   -2.8689   -0.0012 C   0  0  0

+   -2.7227    3.8587    0.0000 H   0  0  0

+   -0.3789    4.7069    0.0000 H   0  0  0

+   -4.2662    2.0257    0.0000 H   0  0  0

+   -4.7029   -0.4283    0.0000 H   0  0  0

+    1.9805    4.2867    0.0000 H   0  0  0

+    3.8873    2.6817    0.0000 H   0  0  0

+   -3.8869   -2.6818    0.0000 H   0  0  0

+   -1.9803   -4.2872    0.0000 H   0  0  0

+    4.7032    0.4286    0.0000 H   0  0  0

+    4.2660   -2.0252    0.0000 H   0  0  0

+    0.3788   -4.7073    0.0000 H   0  0  0

+    2.7223   -3.8585    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  7 11  1  0

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+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+ 24 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+19246-18-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.1637   -0.8283    0.0151 C   0  0  0

+   -0.9427   -0.0743    0.1697 N   0  0  0

+    1.5031   -0.3013    0.4614 C   0  0  2

+    0.0805   -1.9330   -0.4785 O   0  0  0

+   -2.2448   -0.5866   -0.2642 C   0  0  0

+    2.1655    0.4517   -0.6941 C   0  0  0

+    2.3593   -1.4230    0.8696 N   0  0  0

+   -3.3089    0.4425    0.0181 C   0  0  0

+    3.7779    1.0861   -0.1569 S   0  0  0

+   -4.5885    0.1890   -0.2982 O   0  0  0

+   -3.0102    1.4958    0.5292 O   0  0  0

+   -0.8283    0.9461    0.0000 H   0  0  0

+    0.9131    0.5391    0.0000 H   0  0  0

+   -3.0562   -1.2159    0.0000 H   0  0  0

+   -1.7370   -1.4791    0.0000 H   0  0  0

+    2.1558    1.4785    0.0000 H   0  0  0

+    1.2031    0.8096    0.0000 H   0  0  0

+    1.9640   -2.3706    0.0000 H   0  0  0

+    3.3777   -1.2916    0.0000 H   0  0  0

+    4.7334    1.4620    0.0000 H   0  0  0

+   -5.5957   -0.0105    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

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+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  9 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-61-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.8776    0.1586   -0.0034 C   0  0  0

+   -0.1989   -0.7028   -0.0033 C   0  0  0

+    0.6731    1.5276   -0.0009 C   0  0  0

+    2.2554   -0.3819    0.0000 N   0  3  0

+   -1.5002   -0.1900   -0.0006 C   0  0  0

+   -0.6113    2.0427    0.0017 C   0  0  0

+    3.2075    0.3777    0.0000 O   0  0  0

+    2.4371   -1.5863    0.0029 O   0  5  0

+   -1.6984    1.1942    0.0019 C   0  0  0

+   -2.6548   -1.1026   -0.0010 C   0  0  0

+   -3.7816   -0.6547    0.0013 O   0  0  0

+   -0.0441   -1.7291    0.0000 H   0  0  0

+    1.4874    2.1712    0.0000 H   0  0  0

+   -0.7568    3.0703    0.0000 H   0  0  0

+   -2.6611    1.5820    0.0000 H   0  0  0

+   -2.5046   -2.1295    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

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+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+  9 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3048-12-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -1.0735    0.5534    0.3695 C   0  0  0

+   -1.7419   -0.4923   -0.3388 O   0  0  0

+    0.4173    0.3686    0.2490 C   0  0  0

+   -3.0755   -0.2739   -0.1952 C   0  0  0

+    1.1910    1.3545   -0.3336 C   0  0  0

+    1.0117   -0.7848    0.7265 C   0  0  0

+   -3.9881   -1.1383   -0.7817 C   0  0  0

+   -3.5265    0.8108    0.5431 C   0  0  0

+    2.5587    1.1849   -0.4442 C   0  0  0

+    2.3789   -0.9543    0.6160 C   0  0  0

+   -5.3435   -0.9141   -0.6343 C   0  0  0

+   -4.8825    1.0306    0.6876 C   0  0  0

+    3.1522    0.0294    0.0279 C   0  0  0

+   -5.7903    0.1707    0.0971 C   0  0  0

+    4.6164   -0.1521   -0.0905 N   0  3  0

+    5.1394   -1.1704    0.3256 O   0  0  0

+    5.2983    0.7168   -0.6039 O   0  5  0

+   -0.8163    1.4762    0.0000 H   0  0  0

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+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+124489-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    1.0172    0.3374   -0.0537 C   0  0  0

+    1.3925   -0.9970    0.1270 C   0  0  0

+    2.1824    1.0954   -0.1562 N   0  0  0

+   -0.3282    0.6675   -0.0933 C   0  0  0

+    2.7816   -1.0405    0.1330 N   0  0  0

+    0.4724   -1.9420    0.2549 N   0  0  0

+    3.2563    0.2407   -0.0404 C   0  0  0

+    2.2525    2.5455   -0.3521 C   0  0  0

+   -1.2657   -0.3602    0.0508 C   0  0  0

+   -0.8155   -1.6677    0.2177 C   0  0  0

+    4.5117    0.5866   -0.0872 N   0  0  0

+   -2.7190   -0.0634    0.0162 C   0  0  0

+    5.5223   -0.3963    0.0460 O   0  0  0

+   -3.5936   -0.9272   -0.6397 C   0  0  0

+   -3.2150    1.0775    0.6444 C   0  0  0

+   -4.9448   -0.6464   -0.6684 C   0  0  0

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+   -0.6294    1.6575    0.0000 H   0  0  0

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+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2880-58-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.9739   -0.8996   -0.0001 O   0  0  0

+   -1.7312   -2.3079   -0.0020 C   0  0  0

+   -0.7634   -0.2941   -0.0014 C   0  0  0

+   -0.6724    1.1877    0.0001 C   0  0  0

+    0.3640   -1.0355    0.0014 C   0  0  0

+   -1.6834    1.8594    0.0030 O   0  0  0

+    0.6510    1.8423   -0.0015 C   0  0  0

+    1.6753   -0.3768   -0.0001 C   0  0  0

+    1.7656    1.0993   -0.0042 C   0  0  0

+    2.6899   -1.0462    0.0029 O   0  0  0

+   -2.7595   -2.4851    0.0000 H   0  0  0

+   -1.5540   -3.3362    0.0000 H   0  0  0

+   -0.7029   -2.1307    0.0000 H   0  0  0

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+  5 14  1  0

+  7 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107673-64-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -1.0137    0.8538    0.0027 C   0  0  0

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+   -2.0612    3.3453    0.0036 C   0  0  0

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+    5.8425   -0.5503   -0.0018 O   0  0  0

+    4.6524   -2.2922   -0.0034 O   0  5  0

+   -0.5769   -2.4847    0.0000 H   0  0  0

+   -0.0613    4.0392    0.0000 H   0  0  0

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+ 19 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6548-29-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 82 83                          1 V2000

+   -8.5798    4.6949   -0.4470 C   0  0  0

+   -9.6343    5.6392   -0.4817 C   0  0  0

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+ 19 79  1  0

+ 22 80  1  0

+ 52 81  1  0

+ 56 82  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109-55-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -0.4057   -0.6089    0.1628 C   0  0  0

+   -1.6052    0.0438   -0.3784 N   0  0  0

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+   -1.7157    1.3465    0.2916 C   0  0  0

+    2.0866   -0.5029    0.3040 C   0  0  0

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+  7 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6483-86-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -2.3352   -0.2653   -0.0161 C   0  0  0

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+  9 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 21 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+334-22-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.0000   -0.7495    0.0000 N   0  0  0

+   -1.1786    0.1274    0.0000 C   0  0  0

+    1.1786    0.1274    0.0000 C   0  0  0

+   -2.4488   -0.7255    0.0000 C   0  0  0

+    2.4488   -0.7255    0.0000 C   0  0  0

+   -3.8953    0.3507    0.0000 Cl  0  0  0

+    3.8953    0.3507    0.0000 Cl  0  0  0

+    0.0000   -1.8970    0.0000 H   0  0  0

+   -0.3940    0.9647    0.0000 H   0  0  0

+   -1.9219    1.0016    0.0000 H   0  0  0

+    1.9219    1.0016    0.0000 H   0  0  0

+    0.3940    0.9647    0.0000 H   0  0  0

+   -3.2334   -1.5628    0.0000 H   0  0  0

+   -1.7055   -1.5997    0.0000 H   0  0  0

+    1.7055   -1.5997    0.0000 H   0  0  0

+    3.2334   -1.5628    0.0000 H   0  0  0

+  1  2  1  0

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+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+696-54-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.0464   -0.2863    0.0029 C   0  0  0

+    1.0080   -1.3033    0.0012 C   0  0  0

+    0.4899    1.0416    0.0020 C   0  0  0

+   -1.3961   -0.6051   -0.0005 C   0  0  0

+    2.3447   -0.9600   -0.0012 C   0  0  0

+    1.8463    1.2936   -0.0005 C   0  0  0

+   -2.2689    0.3486    0.0011 N   0  0  0

+    2.7193    0.3046   -0.0020 N   0  0  0

+   -3.6515    0.0430   -0.0021 O   0  0  0

+    0.7210   -2.2978    0.0000 H   0  0  0

+   -0.1895    1.8224    0.0000 H   0  0  0

+   -1.7080   -1.5921    0.0000 H   0  0  0

+    3.0631   -1.7052    0.0000 H   0  0  0

+    2.1836    2.2722    0.0000 H   0  0  0

+   -4.6622   -0.1804    0.0000 H   0  0  0

+  1  2  2  0

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+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1877-73-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.8131   -0.5357   -0.5842 C   0  0  0

+   -0.2739    0.3139   -0.4935 C   0  0  0

+    2.1463   -0.0068   -1.0469 C   0  0  0

+    0.6785   -1.8688   -0.2451 C   0  0  0

+   -1.4965   -0.1712   -0.0692 C   0  0  0

+    2.9379    0.4703    0.1433 C   0  0  0

+   -0.5431   -2.3528    0.1848 C   0  0  0

+   -1.6326   -1.5060    0.2646 C   0  0  0

+   -2.6602    0.7384    0.0285 N   0  3  0

+    4.1653    0.9854   -0.0298 O   0  0  0

+    2.4678    0.3891    1.2534 O   0  0  0

+   -3.7376    0.3109    0.4024 O   0  0  0

+   -2.5402    1.9144   -0.2651 O   0  5  0

+   -0.1318    1.3021    0.0000 H   0  0  0

+    2.0556   -1.0010    0.0000 H   0  0  0

+    2.9923   -0.5368    0.0000 H   0  0  0

+    1.4750   -2.4707    0.0000 H   0  0  0

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+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  7 18  1  0

+  8 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24961-39-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    1.4189    0.6469   -0.0694 C   0  0  0

+    0.4234   -0.3298   -0.5147 C   0  0  0

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+   -1.9330   -0.9595   -1.1151 C   0  0  0

+    2.1357   -2.0643   -0.6719 C   0  0  0

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+    5.1072    0.6725    0.6080 C   0  0  0

+   -0.7035    3.6541    0.3390 C   0  0  0

+   -2.6306    1.7737   -0.5032 C   0  0  0

+   -2.7004   -1.8730    0.4476 Br  0  0  0

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+  1  2  1  0

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+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1675-54-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 52                          1 V2000

+    0.0336    2.7487   -0.2640 C   0  0  0

+   -0.1579    3.3152   -1.6723 C   0  0  0

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+ 24 48  1  0

+ 24 49  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+140-49-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -2.0023    0.4148   -0.3914 C   0  0  0

+   -1.5122   -0.8745   -0.5800 C   0  0  0

+   -1.1293    1.4612   -0.1069 C   0  0  0

+   -3.3700    0.6596   -0.4932 N   0  0  0

+   -0.1609   -1.1170   -0.4853 C   0  0  0

+    0.2130    1.2299   -0.0111 C   0  0  0

+   -4.2385   -0.0446    0.2593 C   0  0  0

+    0.7164   -0.0634   -0.1992 C   0  0  0

+   -5.7221    0.1282    0.0583 C   0  0  0

+   -3.8262   -0.8173    1.0982 O   0  0  0

+    2.1597   -0.3141   -0.0965 C   0  0  0

+    3.1016    0.8213    0.2115 C   0  0  0

+    2.5937   -1.4349   -0.2597 O   0  0  0

+    4.7930    0.1996    0.2709 Cl  0  0  0

+   -2.1712   -1.6688    0.0000 H   0  0  0

+   -1.4855    2.4298    0.0000 H   0  0  0

+   -3.6274    1.6591    0.0000 H   0  0  0

+    0.1925   -2.0867    0.0000 H   0  0  0

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+   -5.8415   -0.8969    0.0000 H   0  0  0

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+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54779-53-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    0.2469    0.1326    0.0032 C   0  0  0

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+ 17 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+139-65-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    1.3264    0.8544    0.0071 C   0  0  0

+   -0.0537    1.9494    0.0367 S   0  0  0

+    1.8168    0.3871   -1.2061 C   0  0  0

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+   -1.3721    0.7804    0.0247 C   0  0  0

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+    4.5919   -1.7371   -0.0628 N   0  0  0

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+   -4.6955    0.6249    0.0000 H   0  0  0

+   -1.9255   -2.5029    0.0000 H   0  0  0

+    4.4398   -2.7610    0.0000 H   0  0  0

+    5.5547   -1.3569    0.0000 H   0  0  0

+   -5.4735   -1.6584    0.0000 H   0  0  0

+   -4.2840   -3.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 14 15  1  0

+  7 10  2  0

+ 12 14  1  0

+  3 16  1  0

+  4 17  1  0

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+  7 19  1  0

+  8 20  1  0

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+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2371-42-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    0.0469   -0.1671   -0.7941 C   0  0  2

+   -1.0860   -0.5530    0.2208 C   0  0  0

+    1.2290    0.1117    0.1831 C   0  0  2

+   -0.4265    1.2525   -1.2311 C   0  0  0

+    0.3246   -1.1721   -1.9139 C   0  0  0

+   -0.9602    0.7332    1.1110 C   0  0  1

+   -2.4544   -0.6498   -0.4568 C   0  0  0

+   -0.7483   -1.8254    1.0005 C   0  0  0

+    0.5625    0.7075    1.4440 C   0  0  0

+    2.2029    1.1189   -0.4317 C   0  0  0

+    1.9063   -1.1047    0.5054 O   0  0  0

+   -1.0930    1.8483    0.0298 C   0  0  0

+    0.5424    1.2248    0.0000 H   0  0  0

+   -0.0679    2.1530    0.0000 H   0  0  0

+   -0.6096   -1.4302    0.0000 H   0  0  0

+    0.5827   -2.1063    0.0000 H   0  0  0

+    1.2588   -0.9140    0.0000 H   0  0  0

+   -1.9294    0.7230    0.0000 H   0  0  0

+   -2.5228    0.3170    0.0000 H   0  0  0

+   -3.4212   -0.7182    0.0000 H   0  0  0

+   -2.3860   -1.6166    0.0000 H   0  0  0

+   -1.6851   -2.0740    0.0000 H   0  0  0

+   -0.4997   -2.7622    0.0000 H   0  0  0

+    0.1885   -1.5768    0.0000 H   0  0  0

+    1.3861    1.2185    0.0000 H   0  0  0

+    0.3047    1.6418    0.0000 H   0  0  0

+    2.8997    0.4451    0.0000 H   0  0  0

+    2.8767    1.8157    0.0000 H   0  0  0

+    1.5061    1.7926    0.0000 H   0  0  0

+    2.3778   -1.9515    0.0000 H   0  0  0

+   -0.6742    2.7224    0.0000 H   0  0  0

+   -2.0492    2.0067    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

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+  6  9  1  0

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+ 10 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 11 30  1  0

+ 12 31  1  0

+ 12 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+603-34-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    0.0007   -0.0001   -0.0043 N   0  0  0

+   -1.2048    0.7077    0.0031 C   0  0  0

+    1.2165    0.6900   -0.0072 C   0  0  0

+   -0.0095   -1.3981   -0.0031 C   0  0  0

+   -1.7843    1.1083   -1.1942 C   0  0  0

+   -1.8291    1.0072    1.2078 C   0  0  0

+    1.8467    0.9850   -1.2094 C   0  0  0

+    1.7944    1.0875    1.1923 C   0  0  0

+    1.1813   -2.1028    0.1189 C   0  0  0

+   -1.2114   -2.0858   -0.1180 C   0  0  0

+   -2.9753    1.8075   -1.1832 C   0  0  0

+   -3.0196    1.7065    1.2115 C   0  0  0

+    3.0476    1.6674   -1.2086 C   0  0  0

+    2.9950    1.7694    1.1858 C   0  0  0

+    1.1676   -3.4839    0.1202 C   0  0  0

+   -1.2179   -3.4665   -0.1160 C   0  0  0

+   -3.5909    2.1088    0.0177 C   0  0  0

+    3.6225    2.0569   -0.0129 C   0  0  0

+   -0.0298   -4.1651    0.0004 C   0  0  0

+   -1.2274    1.9813    0.0000 H   0  0  0

+   -2.3157    0.0931    0.0000 H   0  0  0

+    2.3224    0.0652    0.0000 H   0  0  0

+    1.2448    1.9651    0.0000 H   0  0  0

+    2.0834   -1.5943    0.0000 H   0  0  0

+   -2.1060   -1.5642    0.0000 H   0  0  0

+   -2.4852    2.7197    0.0000 H   0  0  0

+   -3.5804    0.8360    0.0000 H   0  0  0

+    3.5942    0.7879    0.0000 H   0  0  0

+    2.5232    2.6912    0.0000 H   0  0  0

+    2.0601   -4.0089    0.0000 H   0  0  0

+   -2.1179   -3.9786    0.0000 H   0  0  0

+   -4.4821    2.6362    0.0000 H   0  0  0

+    4.5250    2.5647    0.0000 H   0  0  0

+   -0.0372   -5.2006    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88741-67-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+   -0.8694    0.7115    0.0024 C   0  0  0

+   -1.0643   -0.6879    0.0015 C   0  0  0

+    0.4220    1.2763    0.0027 C   0  0  0

+   -1.9943    1.5711   -0.0031 C   0  0  0

+    0.0985   -1.5857    0.0010 C   0  0  0

+   -2.3628   -1.1986    0.0007 C   0  0  0

+    1.6088    0.3980    0.0013 C   0  0  0

+    0.5627    2.5935    0.0033 N   0  0  0

+   -3.2908    1.0254   -0.0086 C   0  0  0

+   -1.7678    2.9576   -0.0023 C   0  0  0

+    1.4508   -1.0016    0.0011 C   0  0  0

+   -0.0532   -2.7942    0.0009 O   0  0  0

+   -3.4647   -0.3278    0.0007 C   0  0  0

+   -2.5612   -2.5383   -0.0005 O   0  0  0

+    2.8885    0.9457    0.0009 C   0  0  0

+   -0.4692    3.4172    0.0035 C   0  0  0

+    2.5774   -1.8278    0.0003 C   0  0  0

+   -4.7233   -0.8409   -0.0002 O   0  0  0

+    3.9955    0.1118   -0.0009 C   0  0  0

+    3.8363   -1.2712    0.0004 C   0  0  0

+   -5.6222    0.2700    0.0000 C   0  0  0

+    5.2430    0.6471   -0.0019 O   0  0  0

+    6.1620   -0.4472   -0.0037 C   0  0  0

+   -4.1244    1.6592    0.0000 H   0  0  0

+   -2.5712    3.6292    0.0000 H   0  0  0

+   -2.7146   -3.5742    0.0000 H   0  0  0

+    3.0145    1.9852    0.0000 H   0  0  0

+   -0.2954    4.4498    0.0000 H   0  0  0

+    2.4643   -2.8688    0.0000 H   0  0  0

+    4.6796   -1.8920    0.0000 H   0  0  0

+   -4.8082    0.9287    0.0000 H   0  0  0

+   -6.2809    1.0840    0.0000 H   0  0  0

+   -6.4362   -0.3887    0.0000 H   0  0  0

+    5.3601   -1.1206    0.0000 H   0  0  0

+    6.8354   -1.2491    0.0000 H   0  0  0

+    6.9639    0.2262    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 19  2  0

+ 17 20  2  0

+ 18 21  1  0

+ 19 22  1  0

+ 22 23  1  0

+  7 11  2  0

+  9 13  2  0

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+ 16 28  1  0

+ 17 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+ 23 34  1  0

+ 23 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10474-14-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+   -0.4851   -0.6725    0.1040 C   0  0  0

+   -1.7041   -1.2587    0.8190 C   0  0  0

+    0.7836   -1.0341    0.8791 C   0  0  0

+   -0.3990   -1.2469   -1.3115 C   0  0  0

+   -0.6593    1.2834    0.0080 Br  0  0  0

+   -3.1990   -0.8326   -0.0944 Cl  0  0  0

+    2.3499   -0.2808   -0.0398 Br  0  0  0

+   -2.2825   -2.1827    0.0000 H   0  0  0

+   -0.9772   -2.0711    0.0000 H   0  0  0

+    0.2052   -1.9582    0.0000 H   0  0  0

+    1.5105   -1.8465    0.0000 H   0  0  0

+   -1.4771   -1.4085    0.0000 H   0  0  0

+   -0.2374   -2.3250    0.0000 H   0  0  0

+    0.6791   -1.0853    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14691-88-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+   -2.3096   -0.0024    0.1920 O   0  0  0

+   -0.9887   -0.0009   -0.4369 N   0  0  0

+   -0.3326    1.2371   -0.0921 C   0  0  0

+   -0.3300   -1.2376   -0.0923 C   0  0  0

+   -0.9515    2.3628   -0.9536 C   0  0  0

+   -0.5754    1.6137    1.3750 C   0  0  0

+    1.1701    1.2339   -0.3661 C   0  0  0

+   -0.5678   -1.6125    1.3761 C   0  0  0

+   -0.9488   -2.3655   -0.9507 C   0  0  0

+    1.1721   -1.2312   -0.3701 C   0  0  0

+    1.8028    0.0009    0.2863 C   0  0  0

+    3.2502    0.0024    0.0353 N   0  0  0

+   -3.3483   -0.0036    0.0000 H   0  0  0

+   -0.0413    2.8632    0.0000 H   0  0  0

+   -1.4519    3.2730    0.0000 H   0  0  0

+   -1.8617    1.8624    0.0000 H   0  0  0

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+   -1.1383    2.4867    0.0000 H   0  0  0

+   -1.4484    1.0508    0.0000 H   0  0  0

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+    1.0081    2.2599    0.0000 H   0  0  0

+   -1.4450   -1.0561    0.0000 H   0  0  0

+   -1.1242   -2.4897    0.0000 H   0  0  0

+    0.3094   -2.1689    0.0000 H   0  0  0

+   -1.8595   -1.8659    0.0000 H   0  0  0

+   -1.4484   -3.2762    0.0000 H   0  0  0

+   -0.0381   -2.8651    0.0000 H   0  0  0

+    1.0119   -2.2575    0.0000 H   0  0  0

+    2.1601   -1.5520    0.0000 H   0  0  0

+    0.7641    0.0004    0.0000 H   0  0  0

+    3.7705   -0.8966    0.0000 H   0  0  0

+    3.7686    0.9025    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

+  5  3  1  0

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+  7  3  1  0

+  8  4  1  0

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+ 11  7  1  0

+ 12 11  1  0

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+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 11 30  1  0

+ 12 31  1  0

+ 12 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-00-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    0.6319   -0.1359   -0.0033 C   0  0  0

+   -0.5049   -0.9203   -0.0032 C   0  0  0

+    0.5205    1.2468   -0.0012 C   0  0  0

+    1.9933   -0.7821    0.0007 C   0  0  0

+   -1.7580   -0.3254   -0.0010 C   0  0  0

+   -0.7323    1.8415    0.0009 C   0  0  0

+    1.6397    2.0191   -0.0009 O   0  0  0

+    1.8354   -2.3040   -0.0007 C   0  0  0

+    2.7673   -0.3485   -1.2458 C   0  0  0

+    2.7593   -0.3500    1.2526 C   0  0  0

+   -1.8694    1.0569    0.0011 C   0  0  0

+   -2.8773   -1.0977   -0.0005 O   0  0  0

+   -3.9942   -0.2064    0.0018 C   0  0  0

+   -0.4214   -1.9570    0.0000 H   0  0  0

+   -0.8158    2.8782    0.0000 H   0  0  0

+    2.4958    2.6098    0.0000 H   0  0  0

+    0.8009   -2.1967    0.0000 H   0  0  0

+    1.7281   -3.3385    0.0000 H   0  0  0

+    2.8699   -2.4113    0.0000 H   0  0  0

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+    2.2483    0.5559    0.0000 H   0  0  0

+   -2.8090    1.5029    0.0000 H   0  0  0

+   -3.3454    0.6066    0.0000 H   0  0  0

+   -4.8072    0.4424    0.0000 H   0  0  0

+   -4.6430   -1.0194    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24463-19-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    1.2040    0.0905   -0.2665 C   0  0  0

+    0.0002   -0.5842   -0.4597 C   0  0  0

+    1.2034    1.5000    0.1391 C   0  0  0

+    2.4425   -0.5620   -0.4490 C   0  0  0

+   -1.2047    0.0891   -0.2650 C   0  0  0

+    0.0009   -2.0326   -0.8759 C   0  0  0

+   -0.0009    2.1735    0.3328 C   0  0  0

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+   -1.2052    1.4986    0.1406 C   0  0  0

+   -2.4422   -0.5629   -0.4521 C   0  0  0

+    0.0021   -3.0797    0.5919 Cl  0  0  0

+    3.5961    1.4672    0.1288 C   0  0  0

+   -2.4430    2.1498    0.3284 C   0  0  0

+   -3.5973    0.1228   -0.2544 C   0  0  0

+   -3.5978    1.4633    0.1313 C   0  0  0

+    2.4693   -1.5967    0.0000 H   0  0  0

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+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105735-71-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.6320    0.1146   -0.0060 C   0  0  0

+   -0.5821   -0.6997    0.0220 C   0  0  0

+    0.3468    1.3750   -0.0551 C   0  0  0

+    1.9693   -0.4653    0.0254 C   0  0  0

+   -1.6702    0.2893   -0.0189 C   0  0  0

+   -0.4289   -1.9994    0.0727 C   0  0  0

+   -1.1194    1.4968   -0.0641 C   0  0  0

+    1.4937    2.3025   -0.0873 C   0  0  0

+    2.9895    0.3582   -0.0032 C   0  0  0

+    2.0391   -1.9351    0.0873 C   0  0  0

+   -3.1343    0.1474   -0.0172 C   0  0  0

+    0.9073   -2.6162    0.1000 C   0  0  0

+   -1.9924    2.6846   -0.1126 C   0  0  0

+    2.7201    1.8118   -0.0652 C   0  0  0

+    4.2604   -0.1110    0.0238 N   0  3  0

+   -3.9059    1.2116   -0.0606 C   0  0  0

+   -3.6913   -1.0869    0.0298 N   0  3  0

+   -3.2997    2.5531   -0.1109 C   0  0  0

+    5.0684    0.3638    0.8017 O   0  0  0

+    4.5947   -1.0076   -0.7298 O   0  5  0

+   -3.2976   -1.9617   -0.7207 O   0  0  0

+   -4.5857   -1.3217    0.8225 O   0  5  0

+   -1.2508   -2.5960    0.0000 H   0  0  0

+    1.3422    3.3068    0.0000 H   0  0  0

+    2.9348   -2.4138    0.0000 H   0  0  0

+    0.9628   -3.6303    0.0000 H   0  0  0

+   -1.5798    3.6126    0.0000 H   0  0  0

+    3.5055    2.4557    0.0000 H   0  0  0

+   -4.9163    1.1087    0.0000 H   0  0  0

+   -3.8925    3.3777    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

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+ 16 18  1  0

+  6 23  1  0

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+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52819-96-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.3140   -0.4646    0.2900 C   0  0  0

+   -1.6715   -0.2131    0.3138 C   0  0  0

+    0.5774    0.6017    0.0128 C   0  0  0

+    0.1543   -1.7085    0.5586 O   0  0  0

+   -2.1681    1.0660    0.0917 C   0  0  0

+   -2.8584   -1.1208    0.5662 C   0  0  0

+    1.9486    0.3020   -0.0849 C   0  0  0

+    0.0790    1.9022   -0.1723 C   0  0  0

+    1.3626   -2.1049    0.0741 C   0  0  0

+   -1.2819    2.1231   -0.1385 C   0  0  0

+   -3.5272    1.0774    0.1253 O   0  0  0

+   -4.0042   -0.0898    0.8118 C   0  0  0

+   -3.2855   -1.7393   -0.7517 C   0  0  0

+    2.3721   -1.0331   -0.0456 C   0  0  0

+    3.1345    1.2009   -0.2303 C   0  0  2

+    0.9319    2.9351   -0.3836 O   0  0  0

+    1.5944   -3.2578   -0.2380 O   0  0  0

+   -5.0746   -0.6627    0.0365 O   0  0  0

+   -4.5434   -1.4143   -0.9534 C   0  0  0

+    3.8111   -1.1279   -0.1452 C   0  0  0

+    4.3654    0.2763   -0.2680 C   0  0  0

+    3.2210    2.0630    0.9061 O   0  0  0

+    0.1304    4.1087   -0.5326 C   0  0  0

+    4.4610   -2.1529   -0.1326 O   0  0  0

+   -2.1095   -1.8342    0.0000 H   0  0  0

+   -1.6425    3.0925    0.0000 H   0  0  0

+   -4.7724    0.6028    0.0000 H   0  0  0

+   -2.9242   -2.7085    0.0000 H   0  0  0

+    2.2324    1.7068    0.0000 H   0  0  0

+   -5.1310   -2.2655    0.0000 H   0  0  0

+    5.2897   -0.1879    0.0000 H   0  0  0

+    4.9103    1.1555    0.0000 H   0  0  0

+    3.3243    3.0921    0.0000 H   0  0  0

+    0.9845    4.6920    0.0000 H   0  0  0

+   -0.4529    4.9628    0.0000 H   0  0  0

+   -0.7237    3.5254    0.0000 H   0  0  0

+  1  2  2  0

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+  8 10  1  0

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+ 18 19  1  0

+ 20 21  1  0

+  6 25  1  0

+ 10 26  1  0

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+ 13 28  1  0

+ 15 29  1  0

+ 19 30  1  0

+ 21 31  1  0

+ 21 32  1  0

+ 22 33  1  0

+ 23 34  1  0

+ 23 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1874-12-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.6384    0.0504   -0.0040 C   0  0  0

+   -1.7942   -0.6462   -0.0035 O   0  0  0

+   -0.9558    1.3935   -0.0012 C   0  0  0

+    0.6661   -0.4983   -0.0016 C   0  0  0

+   -2.8285    0.2059   -0.0005 C   0  0  0

+   -2.3563    1.4726    0.0010 C   0  0  0

+    1.7477    0.3222   -0.0024 C   0  0  0

+   -4.2582   -0.1782    0.0013 N   0  3  0

+    3.0500   -0.2257    0.0000 C   0  0  0

+   -5.1200    0.6825    0.0041 O   0  0  0

+   -4.5727   -1.3549    0.0002 O   0  5  0

+    4.1255    0.5902   -0.0008 O   0  0  0

+    3.2022   -1.4332    0.0028 O   0  0  0

+    5.2814   -0.2500    0.0021 C   0  0  0

+    6.5421    0.6170    0.0013 C   0  0  0

+   -0.3017    2.1738    0.0000 H   0  0  0

+    0.7935   -1.5085    0.0000 H   0  0  0

+   -2.9133    2.3250    0.0000 H   0  0  0

+    1.6204    1.3324    0.0000 H   0  0  0

+    4.5935   -1.0007    0.0000 H   0  0  0

+    5.9495   -1.0184    0.0000 H   0  0  0

+    7.1191   -0.2220    0.0000 H   0  0  0

+    7.3811    1.1940    0.0000 H   0  0  0

+    5.9651    1.4560    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

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+  5  6  2  0

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+  4 17  1  0

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+  7 19  1  0

+ 14 20  1  0

+ 14 21  1  0

+ 15 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111119-29-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.1670   -0.0005   -0.6445 N   0  0  0

+   -1.1245   -0.9785   -0.5749 C   0  0  0

+   -0.7243    1.1379   -0.1767 C   0  0  0

+    1.2060   -0.1610   -1.1296 C   0  0  0

+   -2.2316   -0.4047   -0.0679 C   0  0  0

+   -1.9596    0.8884    0.1664 N   0  0  0

+    0.0695    2.6768   -0.0528 Cl  0  0  0

+    2.1224   -0.5187    0.0423 C   0  0  0

+   -3.5234   -1.0814    0.1858 N   0  3  0

+    3.5193   -0.8512   -0.4858 C   0  0  0

+    2.2038    0.5909    0.9391 O   0  0  0

+   -4.4587   -0.4542    0.6499 O   0  0  0

+   -3.6511   -2.2655   -0.0695 O   0  5  0

+    4.3752   -1.1853    0.6087 O   0  0  0

+    5.6577   -1.4841    0.0539 C   0  0  0

+   -0.9741   -1.9171    0.0000 H   0  0  0

+    1.8948    0.4941    0.0000 H   0  0  0

+    0.9052    0.7408    0.0000 H   0  0  0

+    1.8388   -1.4260    0.0000 H   0  0  0

+    4.2332   -0.2235    0.0000 H   0  0  0

+    3.2899    0.0713    0.0000 H   0  0  0

+    2.2734    1.5390    0.0000 H   0  0  0

+    5.4420   -2.4099    0.0000 H   0  0  0

+    6.5835   -1.6998    0.0000 H   0  0  0

+    5.8734   -0.5583    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

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+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+59363-17-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.1848    0.2273    0.6404 C   0  0  0

+   -1.6391    0.3679    1.0096 C   0  0  0

+    0.5467    1.3426    0.2776 C   0  0  0

+    0.4187   -1.0163    0.6702 C   0  0  0

+   -2.5012    0.2095   -0.2444 C   0  0  0

+    1.8809    1.2144   -0.0608 C   0  0  0

+    1.7524   -1.1457    0.3321 C   0  0  0

+   -3.9777    0.3522    0.1305 C   0  0  0

+    2.4838   -0.0304   -0.0363 C   0  0  0

+   -4.8399    0.1938   -1.1235 C   0  0  0

+   -4.6664   -0.8618   -0.1761 O   0  0  0

+    4.1593   -0.1922   -0.4611 Cl  0  0  0

+   -1.1333    1.2366    0.0000 H   0  0  0

+   -2.2171    1.1904    0.0000 H   0  0  0

+    0.1119    2.2490    0.0000 H   0  0  0

+   -0.1554   -1.8415    0.0000 H   0  0  0

+   -3.0070   -0.6592    0.0000 H   0  0  0

+   -1.9232   -0.6129    0.0000 H   0  0  0

+    2.4549    2.0396    0.0000 H   0  0  0

+    2.1868   -2.0523    0.0000 H   0  0  0

+   -4.0206    1.3565    0.0000 H   0  0  0

+   -5.0153    1.1836    0.0000 H   0  0  0

+   -5.8308    0.0246    0.0000 H   0  0  0

+  1  2  1  0

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+  5 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2050-92-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 33                          1 V2000

+    0.0000   -0.5230    0.0000 N   0  0  0

+   -1.1786    0.3539    0.0000 C   0  0  0

+    1.1786    0.3539    0.0000 C   0  0  0

+   -2.4488   -0.4990    0.0000 C   0  0  0

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+   -3.6763    0.4143    0.0000 C   0  0  0

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+   -4.9465   -0.4387    0.0000 C   0  0  0

+    4.9465   -0.4387    0.0000 C   0  0  0

+   -6.1740    0.4746    0.0000 C   0  0  0

+    6.1740    0.4746    0.0000 C   0  0  0

+    0.0000   -1.6705    0.0000 H   0  0  0

+   -0.3940    1.1912    0.0000 H   0  0  0

+   -1.9219    1.2281    0.0000 H   0  0  0

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+    0.3940    1.1912    0.0000 H   0  0  0

+   -3.2334   -1.3363    0.0000 H   0  0  0

+   -1.7055   -1.3733    0.0000 H   0  0  0

+    1.7055   -1.3733    0.0000 H   0  0  0

+    3.2334   -1.3363    0.0000 H   0  0  0

+   -2.8917    1.2516    0.0000 H   0  0  0

+   -4.4196    1.2885    0.0000 H   0  0  0

+    4.4196    1.2885    0.0000 H   0  0  0

+    2.8917    1.2516    0.0000 H   0  0  0

+   -5.7311   -1.2760    0.0000 H   0  0  0

+   -4.2032   -1.3129    0.0000 H   0  0  0

+    4.2032   -1.3129    0.0000 H   0  0  0

+    5.7311   -1.2760    0.0000 H   0  0  0

+   -5.4890    1.3952    0.0000 H   0  0  0

+   -7.0946    1.1596    0.0000 H   0  0  0

+   -6.8590   -0.4460    0.0000 H   0  0  0

+    6.8590   -0.4460    0.0000 H   0  0  0

+    7.0946    1.1596    0.0000 H   0  0  0

+    5.4890    1.3952    0.0000 H   0  0  0

+  1  2  1  0

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+  3  5  1  0

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+ 10 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 11 32  1  0

+ 11 33  1  0

+ 11 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2892-51-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -0.7720    0.7446    0.0014 C   0  0  0

+   -0.7724   -0.7442    0.0005 C   0  0  0

+    0.7023    0.6993    0.0007 C   0  0  0

+   -1.6184    1.6177   -0.0015 O   0  0  0

+    0.7019   -0.6996   -0.0002 C   0  0  0

+   -1.6193   -1.6169    0.0003 O   0  0  0

+    1.6719    1.6393    0.0003 O   0  0  0

+    1.6711   -1.6402   -0.0009 O   0  0  0

+    2.4122    2.3570    0.0000 H   0  0  0

+    2.4110   -2.3583    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  5  8  1  0

+  3  5  2  0

+  7  9  1  0

+  8 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+349-95-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.5797   -0.0410    0.0609 C   0  0  0

+    0.0446   -1.2705   -0.0346 C   0  0  0

+    0.1717    1.1019    0.2625 C   0  0  0

+   -2.0787    0.0544   -0.0610 C   0  0  0

+    1.4203   -1.3573    0.0715 C   0  0  0

+    1.5470    1.0151    0.3685 C   0  0  0

+   -2.4729    1.3905    0.0681 F   0  0  0

+   -2.4767   -0.4305   -1.3114 F   0  0  0

+   -2.6780   -0.7081    0.9473 F   0  0  0

+    2.1714   -0.2148    0.2730 C   0  0  0

+    3.6710   -0.3094    0.3881 C   0  0  0

+    4.2781    0.4677   -0.6461 O   0  0  0

+   -0.5236   -2.1340    0.0000 H   0  0  0

+   -0.2901    2.0267    0.0000 H   0  0  0

+    1.8821   -2.2821    0.0000 H   0  0  0

+    2.1152    1.8786    0.0000 H   0  0  0

+    3.4022   -1.3075    0.0000 H   0  0  0

+    4.5958   -0.7712    0.0000 H   0  0  0

+    4.9145    1.2823    0.0000 H   0  0  0

+  1  2  2  0

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+  6 10  1  0

+  2 13  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1248-18-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+    0.9522   -3.0449    0.0942 C   0  0  0

+   -0.1411   -2.1768   -0.0400 C   0  0  0

+    2.1518   -2.5720    0.6846 C   0  0  0

+    0.8775   -4.3803   -0.3420 C   0  0  0

+   -0.0314   -0.8683    0.4073 C   0  0  0

+   -1.6414   -2.7435   -0.7699 S   0  0  0

+    2.2321   -1.2387    1.1287 C   0  0  0

+    3.2433   -3.4460    0.8168 C   0  0  0

+    1.9562   -5.1974   -0.1970 C   0  0  0

+   -1.0917   -0.0171    0.2801 N   0  0  0

+    1.1658   -0.4115    0.9912 C   0  0  0

+   -2.3332   -3.4377    0.2590 O   0  0  0

+   -2.1531   -1.6410   -1.5061 O   0  0  0

+   -1.2741   -3.7972   -1.8050 O   0  0  0

+    3.1365   -4.7307    0.3785 C   0  0  0

+   -0.9945    1.2006    0.6945 N   0  0  0

+   -2.0494    2.0475    0.5679 C   0  0  0

+   -1.8726    3.3813   -0.0056 C   0  0  0

+   -3.3287    1.6614    0.9776 C   0  0  0

+   -2.9987    4.2323   -0.1193 C   0  0  0

+   -0.6203    3.8286   -0.4413 C   0  0  0

+   -4.4057    2.5362    0.8443 C   0  0  0

+   -3.5235    0.4278    1.5076 O   0  0  0

+   -4.2565    3.7811    0.3191 C   0  0  0

+   -2.8359    5.5150   -0.6694 C   0  0  0

+   -0.4979    5.0793   -0.9708 C   0  0  0

+   -1.6028    5.9191   -1.0833 C   0  0  0

+   14.6840    3.8044   -0.1907 Na  0  3  0

+   -0.0297   -4.8000    0.0000 H   0  0  0

+    3.1426   -0.8262    0.0000 H   0  0  0

+    4.1615   -3.0509    0.0000 H   0  0  0

+    1.8208   -6.1878    0.0000 H   0  0  0

+    1.3128    0.5772    0.0000 H   0  0  0

+    3.9391   -5.3265    0.0000 H   0  0  0

+    0.1677    3.2137    0.0000 H   0  0  0

+   -5.3322    2.1611    0.0000 H   0  0  0

+   -3.6794   -0.5595    0.0000 H   0  0  0

+   -5.0382    4.4040    0.0000 H   0  0  0

+   -3.6067    6.1514    0.0000 H   0  0  0

+    0.4182    5.4793    0.0000 H   0  0  0

+   -1.4370    6.9048    0.0000 H   0  0  0

+   -0.9451   -4.7411    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  6 13  2  0

+  6 14  1  0

+  8 15  2  0

+ 10 16  2  0

+ 16 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+ 18 20  1  0

+ 18 21  1  0

+ 19 22  2  0

+ 19 23  1  0

+ 20 24  2  0

+ 20 25  1  0

+ 21 26  2  0

+ 25 27  2  0

+  7 11  2  0

+  9 15  1  0

+ 22 24  1  0

+ 26 27  1  0

+  4 29  1  0

+  7 30  1  0

+  8 31  1  0

+  9 32  1  0

+ 11 33  1  0

+ 15 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+ 25 39  1  0

+ 26 40  1  0

+ 27 41  1  0

+ 14 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+627-03-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.1182   -0.7454    0.0000 C   0  0  0

+   -1.4178    0.0176   -0.0001 C   0  0  0

+    0.9746    0.1753    0.0001 O   0  0  0

+   -2.5851   -0.6451   -0.0001 O   0  0  0

+   -1.4090    1.2258   -0.0001 O   0  0  0

+    2.1719   -0.6048    0.0001 C   0  0  0

+    3.3867    0.3254    0.0002 C   0  0  0

+   -0.7618   -1.6024    0.0000 H   0  0  0

+    0.6605   -1.4817    0.0000 H   0  0  0

+   -3.5171   -1.1742    0.0000 H   0  0  0

+    1.4891   -1.4309    0.0000 H   0  0  0

+    2.9155   -1.3766    0.0000 H   0  0  0

+    4.0383   -0.5255    0.0000 H   0  0  0

+    4.2376    0.9770    0.0000 H   0  0  0

+    2.7351    1.1763    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  6  7  1  0

+  1  8  1  0

+  1  9  1  0

+  4 10  1  0

+  6 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-64-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.3170    0.5794   -0.0028 C   0  0  0

+   -0.5821   -0.8012   -0.0009 C   0  0  0

+    0.9595    1.0189   -0.0021 O   0  0  0

+   -1.3779    1.4763    0.0003 C   0  0  0

+    0.5431   -1.7411    0.0014 C   0  0  0

+   -1.9036   -1.2583   -0.0008 C   0  0  0

+    1.9946    0.1648    0.0005 C   0  0  0

+   -2.6740    1.0053    0.0053 C   0  0  0

+    1.8018   -1.2337    0.0015 C   0  0  0

+   -2.9318   -0.3581   -0.0025 C   0  0  0

+    3.1290    0.6074    0.0006 O   0  0  0

+   -1.1956    2.4976    0.0000 H   0  0  0

+    0.3815   -2.7659    0.0000 H   0  0  0

+   -2.1026   -2.2765    0.0000 H   0  0  0

+   -3.4644    1.6773    0.0000 H   0  0  0

+    2.6199   -1.8717    0.0000 H   0  0  0

+   -3.9125   -0.6966    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  2  0

+  7  9  1  0

+  8 10  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+18868-66-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+    0.3524    0.2090   -0.0494 C   0  0  0

+   -0.6143   -0.7781   -0.1432 C   0  0  0

+    1.7830   -0.1287   -0.0759 C   0  0  0

+   -0.0334    1.6161    0.0726 C   0  0  0

+   -1.9673   -0.4261   -0.1152 C   0  0  0

+   -0.2102   -2.2239   -0.2754 C   0  0  0

+    2.7374    0.9054    0.0221 C   0  0  0

+    2.2062   -1.4535   -0.1958 C   0  0  0

+   -1.3768    1.9726    0.0948 C   0  0  0

+    1.0090    2.6366    0.1699 C   0  0  0

+   -2.3565    0.9800    0.0130 C   0  0  0

+   -2.9778   -1.4038   -0.2089 C   0  0  0

+   -0.3444   -2.9170    1.0820 C   0  0  0

+    2.3112    2.2954    0.1491 C   0  0  0

+    4.1014    0.5818   -0.0034 C   0  0  0

+    3.5526   -1.7393   -0.2174 C   0  0  0

+   -3.7282    1.3045    0.0380 C   0  0  0

+   -4.2824   -1.0245   -0.1786 C   0  0  0

+    4.4915   -0.7203   -0.1218 C   0  0  0

+   -4.6530    0.3137   -0.0566 C   0  0  0

+    0.6759   -2.7797    0.0000 H   0  0  0

+    0.6278   -1.5979    0.0000 H   0  0  0

+    1.5045   -2.2292    0.0000 H   0  0  0

+   -1.6520    2.9817    0.0000 H   0  0  0

+    0.7408    3.6476    0.0000 H   0  0  0

+   -2.7261   -2.4191    0.0000 H   0  0  0

+   -1.3713   -2.7182    0.0000 H   0  0  0

+   -0.5432   -3.9439    0.0000 H   0  0  0

+    0.6825   -3.1158    0.0000 H   0  0  0

+    3.0354    3.0501    0.0000 H   0  0  0

+    4.8192    1.3426    0.0000 H   0  0  0

+    3.8703   -2.7359    0.0000 H   0  0  0

+   -4.0311    2.3057    0.0000 H   0  0  0

+   -5.0267   -1.7594    0.0000 H   0  0  0

+    5.5107   -0.9554    0.0000 H   0  0  0

+   -5.6689    0.5627    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  2  0

+ 11 17  1  0

+ 12 18  2  0

+ 15 19  2  0

+ 17 20  2  0

+  9 11  1  0

+ 10 14  2  0

+ 16 19  1  0

+ 18 20  1  0

+  6 21  1  0

+  6 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+65954-42-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.2328   -0.3588   -0.0116 C   0  0  0

+   -1.4454    0.1230   -0.0150 C   0  0  0

+    0.9279    0.5505   -0.0523 C   0  0  0

+   -0.0042   -1.8141    0.0389 C   0  0  0

+   -1.6652    1.5809   -0.0595 C   0  0  0

+   -2.6107   -0.7786    0.0260 C   0  0  0

+    2.2709   -0.0556   -0.0456 C   0  0  0

+    0.7376    1.8477   -0.0930 C   0  0  0

+   -1.1637   -2.7208    0.0846 C   0  0  0

+    1.2279   -2.2661    0.0415 C   0  0  0

+   -0.6363    2.3937   -0.0959 C   0  0  0

+   -3.0579    2.0618   -0.0604 C   0  0  0

+   -2.3901   -2.2339    0.0698 C   0  0  0

+   -3.8170   -0.2617    0.0220 C   0  0  0

+    2.3870   -1.3657   -0.0043 C   0  0  0

+    3.4994    0.8163   -0.0862 C   0  0  0

+   -4.0418    1.1888   -0.0221 C   0  0  0

+    3.9736    1.0960    1.3413 C   0  0  0

+    4.5345    0.1474   -0.8094 O   0  0  0

+    1.6011    2.5305    0.0000 H   0  0  0

+   -1.0070   -3.8104    0.0000 H   0  0  0

+    1.3972   -3.3538    0.0000 H   0  0  0

+   -0.7955    3.4830    0.0000 H   0  0  0

+   -3.2730    3.1414    0.0000 H   0  0  0

+   -3.2518   -2.9189    0.0000 H   0  0  0

+   -4.6867   -0.9365    0.0000 H   0  0  0

+    3.3962   -1.8055    0.0000 H   0  0  0

+    2.9007    1.7401    0.0000 H   0  0  0

+   -5.0775    1.5618    0.0000 H   0  0  0

+    4.5329    0.1478    0.0000 H   0  0  0

+    4.9218    1.6553    0.0000 H   0  0  0

+    3.4143    2.0442    0.0000 H   0  0  0

+    5.4591   -0.4501    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+ 12 17  2  0

+ 16 18  1  0

+ 16 19  1  0

+  8 11  1  0

+  9 13  2  0

+ 10 15  1  0

+ 14 17  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+115-11-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.0000   -0.0492   -0.0015 C   0  0  0

+   -1.3051    0.7042    0.0005 C   0  0  0

+    1.3051    0.7042    0.0005 C   0  0  0

+    0.0000   -1.3592    0.0006 C   0  0  0

+   -0.7400    1.6830    0.0000 H   0  0  0

+   -2.2839    1.2693    0.0000 H   0  0  0

+   -1.8701   -0.2746    0.0000 H   0  0  0

+    1.8701   -0.2746    0.0000 H   0  0  0

+    2.2839    1.2693    0.0000 H   0  0  0

+    0.7400    1.6830    0.0000 H   0  0  0

+   -0.9788   -1.9243    0.0000 H   0  0  0

+    0.9788   -1.9243    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+573-56-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    1.2006   -0.3916    0.0245 C   0  0  0

+   -0.0002    0.3032   -0.0003 C   0  0  0

+    2.4832    0.3467    0.0543 N   0  3  0

+    1.1979   -1.7728    0.0271 C   0  0  0

+   -1.2004   -0.3915   -0.0282 C   0  0  0

+   -0.0003    1.6622    0.0024 O   0  0  0

+    3.4148   -0.0229   -0.6378 O   0  0  0

+    2.6069    1.3238    0.7708 O   0  5  0

+   -0.0001   -2.4632    0.0050 C   0  0  0

+   -2.4831    0.3466   -0.0551 N   0  3  0

+   -1.1975   -1.7732   -0.0312 C   0  0  0

+   -3.4129   -0.0225    0.6398 O   0  0  0

+   -2.6089    1.3231   -0.7721 O   0  5  0

+    2.0946   -2.2922    0.0000 H   0  0  0

+   -0.0004    2.6985    0.0000 H   0  0  0

+   -0.0001   -3.4995    0.0000 H   0  0  0

+   -2.0942   -2.2927    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+ 10 12  2  0

+ 10 13  1  0

+  9 11  2  0

+  4 14  1  0

+  6 15  1  0

+  9 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+126-07-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+   -1.3433    0.3924    0.3244 C   0  0  1

+   -0.8915   -1.0374    0.1306 C   0  0  0

+   -0.1542    1.1761    0.3976 O   0  0  0

+   -2.1898    0.8262   -0.8393 C   0  0  0

+   -2.1379    0.5126    1.6255 C   0  0  1

+    0.5722   -0.9614    0.1152 C   0  0  0

+   -1.5854   -2.0264    0.0140 O   0  0  0

+    0.9398    0.3848    0.2809 C   0  0  0

+   -3.5284    0.6871   -0.8149 C   0  0  0

+   -1.5994    1.3630   -1.9239 O   0  0  0

+   -3.4179   -0.3209    1.5018 C   0  0  0

+   -1.2955   -0.0159    2.7882 C   0  0  0

+    1.5596   -1.9524   -0.0284 C   0  0  0

+    2.2880    0.7168    0.3045 C   0  0  0

+   -4.1908    0.1383    0.2926 C   0  0  0

+   -2.4058    1.7861   -3.0548 C   0  0  0

+    2.8954   -1.5983   -0.0029 C   0  0  0

+    1.2024   -3.2507   -0.1909 O   0  0  0

+    3.2569   -0.2671    0.1649 C   0  0  0

+    2.7647    2.3733    0.5105 Cl  0  0  0

+   -5.4008    0.0319    0.2770 O   0  0  0

+    0.7990   -3.4007   -1.5535 C   0  0  0

+    4.5699    0.0744    0.1911 O   0  0  0

+    4.8830    0.6106   -1.0960 C   0  0  0

+   -2.3522    1.5009    0.0000 H   0  0  0

+   -3.9201    1.6194    0.0000 H   0  0  0

+   -4.0605   -1.1017    0.0000 H   0  0  0

+   -2.7437   -1.0747    0.0000 H   0  0  0

+   -1.8329   -0.8725    0.0000 H   0  0  0

+   -0.4389   -0.5533    0.0000 H   0  0  0

+   -0.7581    0.8407    0.0000 H   0  0  0

+   -1.9360    2.6816    0.0000 H   0  0  0

+   -3.3013    2.2559    0.0000 H   0  0  0

+   -2.8756    0.8906    0.0000 H   0  0  0

+    3.6083   -2.3155    0.0000 H   0  0  0

+    0.4465   -2.4528    0.0000 H   0  0  0

+   -0.1489   -3.7532    0.0000 H   0  0  0

+    1.1515   -4.3486    0.0000 H   0  0  0

+    5.7563    0.1007    0.0000 H   0  0  0

+    5.3929    1.4839    0.0000 H   0  0  0

+    4.0097    1.1205    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

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+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 13 17  2  0

+ 13 18  1  0

+ 14 19  2  0

+ 14 20  1  0

+ 15 21  2  0

+ 18 22  1  0

+ 19 23  1  0

+ 23 24  1  0

+  6  8  2  0

+ 11 15  1  0

+ 17 19  1  0

+  5 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+ 24 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+193-98-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 28                          1 V2000

+    0.7742    0.0460   -0.0020 C   0  0  0

+   -0.6909   -0.0512   -0.0013 C   0  0  0

+    1.3621    1.2181   -0.0009 C   0  0  0

+    1.5451   -1.2115    0.0021 C   0  0  0

+   -1.4831    1.1936    0.0009 C   0  0  0

+   -1.2955   -1.2156   -0.0021 C   0  0  0

+    0.5737    2.4591    0.0015 C   0  0  0

+    2.8373    1.2655   -0.0015 C   0  0  0

+    0.7919   -2.4780    0.0065 C   0  0  0

+    2.8552   -1.1638    0.0021 C   0  0  0

+   -0.7439    2.4667    0.0020 C   0  0  0

+   -2.7895    1.1092    0.0012 C   0  0  0

+   -0.5266   -2.4649   -0.0039 C   0  0  0

+   -2.7711   -1.2072   -0.0007 C   0  0  0

+    3.5322    0.1474   -0.0033 C   0  0  0

+   -3.4044   -0.0972   -0.0004 N   0  0  0

+    1.1063    3.4218    0.0000 H   0  0  0

+    3.3564    2.2356    0.0000 H   0  0  0

+    1.3311   -3.4370    0.0000 H   0  0  0

+    3.4445   -2.0929    0.0000 H   0  0  0

+   -1.2901    3.4218    0.0000 H   0  0  0

+   -3.3943    2.0283    0.0000 H   0  0  0

+   -1.0680   -3.4227    0.0000 H   0  0  0

+   -3.3264   -2.1570    0.0000 H   0  0  0

+    4.6315    0.1911    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  8 15  2  0

+ 12 16  1  0

+  7 11  2  0

+  9 13  2  0

+ 10 15  1  0

+ 14 16  2  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25148-26-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    1.2042   -0.1124   -0.3018 C   0  0  0

+    0.0005   -0.7944   -0.4681 C   0  0  0

+    1.2033    1.3120    0.0475 C   0  0  0

+    2.4428   -0.7713   -0.4583 C   0  0  0

+   -1.2045   -0.1142   -0.3003 C   0  0  0

+    0.0014   -2.2582   -0.8266 C   0  0  0

+   -0.0013    1.9924    0.2144 C   0  0  0

+    2.4408    1.9718    0.2088 C   0  0  0

+    3.5969   -0.0770   -0.2887 C   0  0  0

+   -1.2053    1.3100    0.0490 C   0  0  0

+   -2.4422   -0.7735   -0.4614 C   0  0  0

+    0.0028   -3.2462    0.6816 Cl  0  0  0

+   -0.0022    3.4559    0.5738 C   0  0  0

+    3.5959    1.2794    0.0386 C   0  0  0

+   -2.4436    1.9680    0.2109 C   0  0  0

+   -3.5971   -0.0810   -0.2911 C   0  0  0

+   -3.5979    1.2742    0.0413 C   0  0  0

+    2.4701   -1.8087    0.0000 H   0  0  0

+   -0.8978   -1.7401    0.0000 H   0  0  0

+   -0.8968   -2.7781    0.0000 H   0  0  0

+    2.4668    3.0093    0.0000 H   0  0  0

+    4.5005   -0.5875    0.0000 H   0  0  0

+   -2.4685   -1.8110    0.0000 H   0  0  0

+    1.0356    3.4565    0.0000 H   0  0  0

+   -0.0028    4.4937    0.0000 H   0  0  0

+   -1.0400    3.4553    0.0000 H   0  0  0

+    4.4987    1.7912    0.0000 H   0  0  0

+   -2.4710    3.0054    0.0000 H   0  0  0

+   -4.5000   -0.5927    0.0000 H   0  0  0

+   -4.5013    1.7849    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  1  0

+ 11 16  2  0

+ 15 17  2  0

+  7 10  1  0

+  9 14  1  0

+ 16 17  1  0

+  4 18  1  0

+  6 19  1  0

+  6 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-52-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+   -0.0326    0.0000   -0.0014 N   0  3  0

+   -1.4976    0.0001    0.0005 C   0  0  0

+    0.5764    1.0548    0.0004 O   0  0  0

+    0.5763   -1.0549    0.0004 O   0  5  0

+   -1.4975    0.9136    0.0000 H   0  0  0

+   -2.4111    0.0002    0.0000 H   0  0  0

+   -1.4977   -0.9134    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4444-68-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+   -0.9517   -0.0032    0.0302 N   0  0  0

+    0.3357   -0.0283    0.7373 C   0  0  0

+   -1.7114   -1.1715    0.4949 C   0  0  0

+   -1.6719    1.1852    0.5065 C   0  0  0

+    1.4774   -0.0044   -0.2810 C   0  0  0

+   -2.1029   -2.0357   -0.7055 C   0  0  0

+   -1.9948    2.0954   -0.6802 C   0  0  0

+    2.8182   -0.0305    0.4555 C   0  0  0

+    3.9599   -0.0066   -0.5628 C   0  0  0

+   -0.1246   -0.8146    0.0000 H   0  0  0

+    0.7971   -0.8139    0.0000 H   0  0  0

+   -2.1649   -0.3813    0.0000 H   0  0  0

+   -2.6215   -1.2151    0.0000 H   0  0  0

+   -2.5770    1.2895    0.0000 H   0  0  0

+   -2.1638    0.4183    0.0000 H   0  0  0

+    1.9377    0.7819    0.0000 H   0  0  0

+    1.0160    0.7812    0.0000 H   0  0  0

+   -2.9328   -1.6597    0.0000 H   0  0  0

+   -2.4789   -2.8656    0.0000 H   0  0  0

+   -1.2730   -2.4117    0.0000 H   0  0  0

+   -1.1361    2.4000    0.0000 H   0  0  0

+   -2.2994    2.9541    0.0000 H   0  0  0

+   -2.8535    1.7908    0.0000 H   0  0  0

+    2.3579   -0.8168    0.0000 H   0  0  0

+    3.2796   -0.8161    0.0000 H   0  0  0

+    3.9790   -0.9175    0.0000 H   0  0  0

+    4.8708    0.0125    0.0000 H   0  0  0

+    3.9408    0.9043    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+  9 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+113058-38-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+   -0.3073    0.4931   -0.0041 C   0  0  0

+   -0.5654   -0.8997   -0.0032 C   0  0  0

+    1.0850    0.9819   -0.0029 C   0  0  0

+   -1.3552    1.3983   -0.0004 C   0  0  0

+    0.5601   -1.8537   -0.0009 C   0  0  0

+   -1.8685   -1.3681   -0.0039 C   0  0  0

+    2.1526    0.0676   -0.0008 C   0  0  0

+    1.3479    2.3516   -0.0030 C   0  0  0

+   -2.6769    0.9349    0.0044 C   0  0  0

+    1.8839   -1.3817    0.0003 C   0  0  0

+    0.3179   -3.2282    0.0005 C   0  0  0

+   -2.9359   -0.4612   -0.0059 C   0  0  0

+    3.4668    0.5396    0.0014 C   0  0  0

+    2.6555    2.8012   -0.0008 C   0  0  0

+   -3.7586    1.8361    0.0089 C   0  0  0

+    2.9412   -2.2933    0.0030 C   0  0  0

+    1.3748   -4.1117    0.0031 C   0  0  0

+   -4.2693   -0.9132   -0.0061 C   0  0  0

+    3.7112    1.8940    0.0013 C   0  0  0

+    2.9113    4.1358   -0.0013 O   0  0  0

+   -5.0324    1.3601    0.0140 C   0  0  0

+    2.6813   -3.6461    0.0044 C   0  0  0

+   -5.2871   -0.0113   -0.0075 C   0  0  0

+   -1.1600    2.4267    0.0000 H   0  0  0

+   -2.0555   -2.3980    0.0000 H   0  0  0

+    0.5572    3.0376    0.0000 H   0  0  0

+   -0.6654   -3.5872    0.0000 H   0  0  0

+    4.2659   -0.1365    0.0000 H   0  0  0

+   -3.5831    2.8680    0.0000 H   0  0  0

+    3.9299   -1.9494    0.0000 H   0  0  0

+    1.1905   -5.1421    0.0000 H   0  0  0

+   -4.4764   -1.9393    0.0000 H   0  0  0

+    4.6976    2.2443    0.0000 H   0  0  0

+    3.1083    5.1638    0.0000 H   0  0  0

+   -5.8341    2.0332    0.0000 H   0  0  0

+    3.4757   -4.3277    0.0000 H   0  0  0

+   -6.2770   -0.3515    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  2  0

+ 12 18  1  0

+ 13 19  2  0

+ 14 20  1  0

+ 15 21  2  0

+ 16 22  2  0

+ 18 23  2  0

+  7 10  1  0

+  9 12  2  0

+ 14 19  1  0

+ 17 22  1  0

+ 21 23  1  0

+  4 24  1  0

+  6 25  1  0

+  8 26  1  0

+ 11 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7300-59-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+   -4.0874    0.0859    0.0176 C   0  0  0

+   -3.1894    0.9153   -0.6293 C   0  0  0

+   -3.6958   -1.1745    0.4296 C   0  0  0

+   -5.4689    0.5509    0.2749 N   0  3  0

+   -1.8981    0.4866   -0.8657 C   0  0  0

+   -2.4056   -1.6092    0.1960 C   0  0  0

+   -6.2608   -0.1784    0.8445 O   0  0  0

+   -5.8137    1.6629   -0.0830 O   0  5  0

+   -1.5017   -0.7790   -0.4532 C   0  0  0

+   -0.1939   -1.2162   -0.6909 N   0  0  0

+    0.8509   -0.4820   -0.2599 C   0  0  0

+    2.2565   -0.8843   -0.6254 C   0  0  0

+    0.6600    0.5026    0.4222 O   0  0  0

+    3.2466    0.1093   -0.0145 C   0  0  0

+    4.6736   -0.2993   -0.3856 C   0  0  1

+    5.6488    0.6794    0.2162 C   0  0  0

+    4.9480   -1.6458    0.1334 N   0  0  0

+    6.0204    1.7680   -0.4756 O   0  0  0

+    6.0963    0.4842    1.3214 O   0  0  0

+   -3.3993    1.8876    0.0000 H   0  0  0

+   -4.4074   -1.8694    0.0000 H   0  0  0

+   -1.1888    1.1839    0.0000 H   0  0  0

+   -2.1993   -2.5822    0.0000 H   0  0  0

+   -0.0502   -2.2004    0.0000 H   0  0  0

+    1.8265   -1.7812    0.0000 H   0  0  0

+    3.0687   -1.4585    0.0000 H   0  0  0

+    3.6767    1.0062    0.0000 H   0  0  0

+    2.4344    0.6835    0.0000 H   0  0  0

+    5.6264   -0.5850    0.0000 H   0  0  0

+    4.2032   -2.3051    0.0000 H   0  0  0

+    5.8914   -1.9611    0.0000 H   0  0  0

+    6.3417    2.7093    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 16 19  2  0

+  6  9  2  0

+  2 20  1  0

+  3 21  1  0

+  5 22  1  0

+  6 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+597-25-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+    0.9816    0.0219   -0.2072 P   0  0  0

+   -0.5781    0.2477    0.3833 N   0  0  0

+    1.8154    1.3911   -0.0579 O   0  0  0

+    1.7094   -1.1438    0.6315 O   0  0  0

+    0.9177   -0.3636   -1.6346 O   0  0  0

+   -1.1733   -1.0877    0.5250 C   0  0  0

+   -1.3334    0.9358   -0.6720 C   0  0  0

+    1.7531    1.7645    1.3201 C   0  0  0

+    2.9031   -1.4800   -0.0786 C   0  0  0

+   -2.6512   -0.9522    0.8937 C   0  0  0

+   -2.8074    1.0206   -0.2733 C   0  0  0

+   -3.3525   -0.2938   -0.1609 O   0  0  0

+   -1.3824   -2.1156    0.0000 H   0  0  0

+   -0.1744   -1.4077    0.0000 H   0  0  0

+   -0.4313    1.4710    0.0000 H   0  0  0

+   -1.5817    1.9549    0.0000 H   0  0  0

+    2.7877    1.9371    0.0000 H   0  0  0

+    1.5805    2.7991    0.0000 H   0  0  0

+    0.7185    1.5919    0.0000 H   0  0  0

+    2.6187   -2.4897    0.0000 H   0  0  0

+    3.9128   -1.7644    0.0000 H   0  0  0

+    3.1875   -0.4703    0.0000 H   0  0  0

+   -3.5645   -1.4681    0.0000 H   0  0  0

+   -2.4311   -1.9778    0.0000 H   0  0  0

+   -2.6306    2.0545    0.0000 H   0  0  0

+   -3.8151    1.3117    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+  6 10  1  0

+  7 11  1  0

+ 10 12  1  0

+ 11 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+497-56-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    1.0146   -0.3229   -0.0040 C   0  0  0

+   -0.2455   -0.8919    0.0212 C   0  0  0

+    1.1527    1.0510   -0.0375 C   0  0  0

+    2.2164   -1.1867    0.0111 N   0  3  0

+   -1.3700   -0.0877    0.0129 C   0  0  0

+    0.0257    1.8604   -0.0458 C   0  0  0

+    2.5262    1.6705   -0.0644 C   0  0  0

+    2.4689   -1.8957   -0.9465 O   0  0  0

+    2.9530   -1.1885    0.9812 O   0  5  0

+   -1.2372    1.2872   -0.0201 C   0  0  0

+   -2.7173   -0.7001    0.0400 N   0  3  0

+    0.1589    3.2125   -0.0783 O   0  0  0

+   -3.7083    0.0080    0.0327 O   0  0  0

+   -2.8349   -1.9120    0.0695 O   0  5  0

+   -0.3473   -1.9233    0.0000 H   0  0  0

+    2.9523    0.7257    0.0000 H   0  0  0

+    3.4710    2.0966    0.0000 H   0  0  0

+    2.1001    2.6153    0.0000 H   0  0  0

+   -2.0804    1.8898    0.0000 H   0  0  0

+    0.2605    4.2439    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+  6 10  2  0

+  2 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120-72-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+    0.2161    0.7252   -0.0026 C   0  0  0

+    0.2468   -0.6811   -0.0004 C   0  0  0

+    1.6148    1.1605   -0.0014 C   0  0  0

+   -1.0089    1.3953   -0.0001 C   0  0  0

+    1.5709   -1.0586    0.0018 N   0  0  0

+   -0.9510   -1.3890   -0.0005 C   0  0  0

+    2.3710    0.0514    0.0012 C   0  0  0

+   -2.1731    0.6803    0.0044 C   0  0  0

+   -2.1482   -0.7078   -0.0027 C   0  0  0

+    1.9561    2.1399    0.0000 H   0  0  0

+   -1.0349    2.4321    0.0000 H   0  0  0

+    1.9112   -2.0384    0.0000 H   0  0  0

+   -0.9425   -2.4261    0.0000 H   0  0  0

+    3.4081    0.0378    0.0000 H   0  0  0

+   -3.0828    1.1785    0.0000 H   0  0  0

+   -3.0401   -1.2372    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  6  9  2  0

+  5  7  1  0

+  8  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4457-41-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    3.5506    0.0061    0.0180 C   0  0  0

+    2.5045    1.0386   -0.1302 C   0  0  0

+    4.8999    0.3636   -0.0240 C   0  0  0

+    3.1947   -1.3307    0.2065 C   0  0  0

+    1.2039    0.6904   -0.0891 O   0  0  0

+    2.8172    2.2015   -0.2890 O   0  0  0

+    5.8714   -0.6055    0.1150 C   0  0  0

+    4.1768   -2.2898    0.3442 C   0  0  0

+    0.1757    1.7052   -0.2348 C   0  0  0

+    5.5117   -1.9295    0.2958 C   0  0  0

+   -1.1832    1.0588   -0.1529 C   0  0  0

+   -2.0709    1.4387    0.8366 C   0  0  0

+   -1.5442    0.0903   -1.0705 C   0  0  0

+   -3.3172    0.8459    0.9118 C   0  0  0

+   -2.7909   -0.5027   -0.9953 C   0  0  0

+   -3.6762   -0.1270   -0.0026 C   0  0  0

+   -5.0109   -0.7619    0.0778 N   0  3  0

+   -5.3271   -1.6190   -0.7277 O   0  0  0

+   -5.7929   -0.4272    0.9496 O   0  5  0

+    5.1671    1.3577    0.0000 H   0  0  0

+    2.2022   -1.6038    0.0000 H   0  0  0

+    6.8660   -0.3402    0.0000 H   0  0  0

+    3.9172   -3.2859    0.0000 H   0  0  0

+    0.9787    2.3492    0.0000 H   0  0  0

+   -0.3711    2.5773    0.0000 H   0  0  0

+    6.2390   -2.6580    0.0000 H   0  0  0

+   -2.0913    2.4679    0.0000 H   0  0  0

+   -0.7853   -0.6051    0.0000 H   0  0  0

+   -4.0772    1.5401    0.0000 H   0  0  0

+   -2.7690   -1.5318    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  9 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+ 12 14  2  0

+ 13 15  1  0

+ 14 16  1  0

+ 16 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+  8 10  2  0

+ 15 16  2  0

+  3 20  1  0

+  4 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5875-25-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+   -0.5327    0.7132   -0.3901 C   0  0  0

+   -1.6250   -0.2740   -0.0685 C   0  0  0

+   -0.7020    1.9618    0.4778 C   0  0  0

+    1.2177   -0.1049   -0.0268 Br  0  0  0

+   -1.3103   -1.5009    0.3921 N   0  0  0

+   -2.7872    0.0356   -0.2242 O   0  0  0

+   -1.4249    1.0394    0.0000 H   0  0  0

+    0.2393    2.0894    0.0000 H   0  0  0

+   -0.8296    2.9031    0.0000 H   0  0  0

+   -1.6433    1.8342    0.0000 H   0  0  0

+   -1.9892   -2.1654    0.0000 H   0  0  0

+   -0.3954   -1.7566    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  1  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102791-32-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -0.3479   -0.8819    0.0104 C   0  0  0

+   -1.6461   -0.1861   -0.0073 C   0  0  0

+    0.9039   -0.1057    0.0052 C   0  0  0

+   -0.3066   -2.1970    0.0363 C   0  0  0

+   -1.6924    1.2860   -0.0302 C   0  0  0

+   -2.7645   -0.8796   -0.0022 C   0  0  0

+    2.0637   -0.7273    0.0217 C   0  0  0

+    0.8576    1.3664   -0.0179 C   0  0  0

+   -1.5585   -2.9732    0.0469 C   0  0  0

+    0.9916   -2.8928    0.0551 C   0  0  0

+   -0.4406    2.0623   -0.0361 C   0  0  0

+   -2.8522    1.9077   -0.0449 C   0  0  0

+   -2.7182   -2.3517    0.0205 C   0  0  0

+   -4.0627   -0.1837   -0.0188 C   0  0  0

+    2.1100   -2.1994    0.0453 C   0  0  0

+    3.2153   -0.0132    0.0166 N   0  3  0

+    1.8825    2.0020   -0.0224 O   0  0  0

+   -0.4785    3.2675   -0.0549 O   0  0  0

+   -4.1041    1.1315   -0.0385 C   0  0  0

+    4.0093   -0.1448   -0.8976 O   0  0  0

+    3.4563    0.7601    0.9261 O   0  5  0

+   -1.5251   -4.0331    0.0000 H   0  0  0

+    1.0250   -3.9527    0.0000 H   0  0  0

+   -2.8856    2.9676    0.0000 H   0  0  0

+   -3.6194   -2.9106    0.0000 H   0  0  0

+   -4.9639   -0.7426    0.0000 H   0  0  0

+    3.0446   -2.7005    0.0000 H   0  0  0

+   -5.0387    1.6326    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  2  0

+ 11 18  2  0

+ 12 19  1  0

+ 16 20  2  0

+ 16 21  1  0

+  8 11  1  0

+  9 13  2  0

+ 10 15  2  0

+ 14 19  2  0

+  9 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 19 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85-68-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+   -0.1242   -1.7064   -0.2886 C   0  0  0

+   -1.4476   -1.4485    0.1160 C   0  0  0

+    0.6753   -0.6455   -0.9376 C   0  0  0

+    0.4292   -2.9650   -0.0686 C   0  0  0

+   -2.1891   -2.4569    0.7260 C   0  0  0

+   -2.0464   -0.1149   -0.1050 C   0  0  0

+    1.8534   -0.2684   -0.4043 O   0  0  0

+    0.2698   -0.1140   -1.9516 O   0  0  0

+   -0.3202   -3.9520    0.5437 C   0  0  0

+   -1.6249   -3.7020    0.9309 C   0  0  0

+   -3.3481    0.0932    0.1718 O   0  0  0

+   -1.3646    0.7930   -0.5363 O   0  0  0

+    2.6385    0.7735   -1.0417 C   0  0  0

+   -3.9362    1.4029   -0.0452 C   0  0  0

+    3.9014    1.0046   -0.2526 C   0  0  0

+   -5.4151    1.3690    0.3454 C   0  0  0

+    5.1336    0.8178   -0.8502 C   0  0  0

+    3.8275    1.4089    1.0675 C   0  0  0

+   -6.0348    2.7491    0.1167 C   0  0  0

+    6.2923    1.0297   -0.1262 C   0  0  0

+    4.9857    1.6208    1.7912 C   0  0  0

+   -7.5137    2.7152    0.5074 C   0  0  0

+    6.2183    1.4284    1.1951 C   0  0  0

+    1.3932   -3.0789    0.0000 H   0  0  0

+   -3.1545   -2.3559    0.0000 H   0  0  0

+    0.0272   -4.8584    0.0000 H   0  0  0

+   -2.2256   -4.4644    0.0000 H   0  0  0

+    2.7302    1.7398    0.0000 H   0  0  0

+    1.7336    1.1247    0.0000 H   0  0  0

+   -3.0058    1.6795    0.0000 H   0  0  0

+   -4.0870    2.3618    0.0000 H   0  0  0

+   -6.3455    1.0924    0.0000 H   0  0  0

+   -5.2643    0.4101    0.0000 H   0  0  0

+    5.1484   -0.1528    0.0000 H   0  0  0

+    3.0289    1.9606    0.0000 H   0  0  0

+   -5.1044    3.0257    0.0000 H   0  0  0

+   -6.1856    3.7080    0.0000 H   0  0  0

+    7.0917    0.4791    0.0000 H   0  0  0

+    4.9730    2.5914    0.0000 H   0  0  0

+   -7.5359    3.6856    0.0000 H   0  0  0

+   -8.4841    2.6930    0.0000 H   0  0  0

+   -7.4915    1.7448    0.0000 H   0  0  0

+    6.8948    2.1245    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  6 12  2  0

+  7 13  1  0

+ 11 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  1  0

+ 17 20  1  0

+ 18 21  2  0

+ 19 22  1  0

+ 20 23  2  0

+  9 10  1  0

+ 21 23  1  0

+  4 24  1  0

+  5 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+ 23 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98-15-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.6056    0.3162   -0.0035 C   0  0  0

+   -0.5260   -0.4778   -0.0027 C   0  0  0

+    0.4840    1.6930   -0.0020 C   0  0  0

+    1.9719   -0.3195    0.0001 C   0  0  0

+   -1.7802    0.1058   -0.0003 C   0  0  0

+   -0.7692    2.2770    0.0004 C   0  0  0

+    2.9511    0.6797   -0.0016 F   0  0  0

+    2.1151   -1.1108    1.1449 F   0  0  0

+    2.1180   -1.1175   -1.1396 F   0  0  0

+   -1.9012    1.4842    0.0013 C   0  0  0

+   -3.2017   -0.8907    0.0002 Cl  0  0  0

+   -0.4347   -1.5107    0.0000 H   0  0  0

+    1.3331    2.2882    0.0000 H   0  0  0

+   -0.8598    3.3100    0.0000 H   0  0  0

+   -2.8411    1.9222    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 10  2  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78411-56-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.6861   -0.4074   -0.0016 C   0  0  0

+   -0.7746   -0.3891   -0.0009 C   0  0  0

+    1.3729    0.8095   -0.0009 C   0  0  0

+    1.6104   -1.3948    0.0026 N   0  0  0

+   -1.4399    0.8627    0.0004 C   0  0  0

+   -1.4844   -1.5160   -0.0020 N   0  0  0

+    0.6712    2.0176    0.0008 C   0  0  0

+    2.7197    0.4897   -0.0018 N   0  0  0

+    2.8126   -0.8707   -0.0005 C   0  0  0

+   -0.6853    2.0513    0.0015 C   0  0  0

+   -2.7763    0.8952    0.0010 N   0  0  0

+   -2.7991   -1.4590   -0.0017 C   0  0  0

+    3.8374    1.4368   -0.0015 C   0  0  0

+    3.9919   -1.5868    0.0027 N   0  0  0

+   -3.4562   -0.2302    0.0004 C   0  0  0

+   -4.9627   -0.1907    0.0011 C   0  0  0

+    1.1994    2.9094    0.0000 H   0  0  0

+   -1.1732    2.9657    0.0000 H   0  0  0

+   -3.3510   -2.3363    0.0000 H   0  0  0

+    4.5075    0.6460    0.0000 H   0  0  0

+    4.6282    2.1069    0.0000 H   0  0  0

+    3.1673    2.2276    0.0000 H   0  0  0

+    3.9690   -2.6230    0.0000 H   0  0  0

+    4.9008   -1.0885    0.0000 H   0  0  0

+   -4.9355    0.8454    0.0000 H   0  0  0

+   -5.9988   -0.1635    0.0000 H   0  0  0

+   -4.9899   -1.2268    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 15 16  1  0

+  7 10  2  0

+  8  9  1  0

+ 12 15  2  0

+  7 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55256-49-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+    2.0293    0.3450    0.2938 C   0  0  0

+    2.0536   -1.0464    0.2522 C   0  0  0

+    3.4647    0.8247    0.2515 C   0  0  1

+    0.8302    1.0236    0.3558 C   0  0  0

+    0.8597   -1.7580    0.3072 C   0  0  0

+    3.3288   -1.5089    0.1455 O   0  0  0

+    4.2500   -0.4887    0.5604 C   0  0  1

+    3.8573    1.0784   -1.1918 C   0  0  0

+   -0.3690    0.3020    0.3747 C   0  0  0

+    0.8132    2.3795    0.3984 O   0  0  0

+   -0.3661   -1.1023    0.3901 C   0  0  0

+    5.3154   -0.4177   -0.4064 O   0  0  0

+    4.9029    0.3263   -1.4567 C   0  0  0

+   -1.6724    0.9951    0.3669 C   0  0  0

+   -1.4778   -1.8403    0.4856 O   0  0  0

+   -2.8139    0.1192    0.0229 C   0  0  0

+   -1.7966    2.1798    0.6204 O   0  0  0

+   -2.6230   -1.2686    0.0992 C   0  0  0

+   -4.0432    0.6626   -0.3606 C   0  0  0

+   -3.6919   -2.0946   -0.2580 C   0  0  0

+   -5.0846   -0.1839   -0.7057 C   0  0  0

+   -4.2157    2.0080   -0.3942 O   0  0  0

+   -4.8985   -1.5550   -0.6452 C   0  0  0

+    3.0239    1.7416    0.0000 H   0  0  0

+    0.8833   -2.7751    0.0000 H   0  0  0

+    4.6938   -1.4041    0.0000 H   0  0  0

+    3.8827    2.0954    0.0000 H   0  0  0

+    0.8004    3.3968    0.0000 H   0  0  0

+    5.6632    1.0023    0.0000 H   0  0  0

+   -3.5714   -3.1048    0.0000 H   0  0  0

+   -6.0306    0.1903    0.0000 H   0  0  0

+   -4.3451    3.0171    0.0000 H   0  0  0

+   -5.7129   -2.1647    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  1  0

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+  5 11  1  0

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+  8 13  2  0

+  9 14  1  0

+ 11 15  1  0

+ 14 16  1  0

+ 14 17  2  0

+ 15 18  1  0

+ 16 19  1  0

+ 18 20  1  0

+ 19 21  2  0

+ 19 22  1  0

+ 20 23  2  0

+  6  7  1  0

+  9 11  2  0

+ 12 13  1  0

+ 16 18  2  0

+ 21 23  1  0

+  3 24  1  0

+  5 25  1  0

+  7 26  1  0

+  8 27  1  0

+ 10 28  1  0

+ 13 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+ 22 32  1  0

+ 23 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+68247-85-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+190196                          1 V2000

+   -5.5172   -1.3703   -0.3867 C   0  0  1

+   -4.3096   -0.5349   -0.8165 C   0  0  2

+   -6.4551   -0.5358    0.2958 O   0  0  0

+   -6.1719   -1.9703   -1.6043 C   0  0  0

+   -4.7711    0.6659   -1.5175 N   0  0  0

+   -3.4371   -1.3494   -1.7364 C   0  0  0

+   -6.1123   -0.5774    1.6825 C   0  0  2

+   -6.5713   -3.2493   -1.7388 C   0  0  0

+   -6.4641   -1.3225   -2.7419 N   0  0  0

+   -4.7868    1.8537   -0.8808 C   0  0  0

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+102190  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-09-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    1.2694    0.0763   -0.2480 C   0  0  0

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+  7 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13177-25-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

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+  6 12  2  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+ 11 16  2  0

+ 14 17  2  0

+  5  7  2  0

+  9 12  1  0

+ 10 15  2  0

+ 16 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3375-84-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.1081   -0.3942   -0.2936 N   0  0  0

+   -1.0809   -1.3825    0.1968 C   0  0  0

+   -0.6442    0.8296   -0.1915 C   0  0  0

+    1.2310   -0.6978   -0.8044 C   0  0  0

+   -2.2949   -0.5285    0.6103 C   0  0  0

+   -1.8833    0.8371    0.3127 O   0  0  0

+   -0.0584    1.8402   -0.5260 O   0  0  0

+    2.2553   -0.5332    0.3202 C   0  0  0

+   -3.4987   -0.8990   -0.2583 C   0  0  0

+    3.6232   -1.0217   -0.1604 C   0  0  0

+    2.3434    0.8453    0.6862 O   0  0  0

+   -1.7187   -2.1911    0.0000 H   0  0  0

+   -0.3085   -2.0636    0.0000 H   0  0  0

+    0.6334   -1.5365    0.0000 H   0  0  0

+    1.7741   -1.5728    0.0000 H   0  0  0

+   -2.4562   -1.5456    0.0000 H   0  0  0

+    2.1609   -1.5587    0.0000 H   0  0  0

+   -3.8016    0.0853    0.0000 H   0  0  0

+   -4.4830   -1.2019    0.0000 H   0  0  0

+   -3.1958   -1.8833    0.0000 H   0  0  0

+    3.2769   -1.9915    0.0000 H   0  0  0

+    4.5930   -1.3680    0.0000 H   0  0  0

+    3.9695   -0.0519    0.0000 H   0  0  0

+    2.4091    1.8730    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  8 10  1  0

+  8 11  1  0

+  5  6  1  0

+  2 12  1  0

+  2 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6850-22-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.8929    0.5155   -0.0041 C   0  0  0

+   -1.2436   -0.9134   -0.0023 C   0  0  0

+    0.4720    0.8753   -0.0029 C   0  0  0

+   -2.0301    1.1868   -0.0013 N   0  0  0

+   -0.2041   -1.8679    0.0000 C   0  0  0

+   -2.6246   -0.9767   -0.0035 C   0  0  0

+    1.4204   -0.0944   -0.0002 C   0  0  0

+   -3.0945    0.2780    0.0021 N   0  0  0

+    1.0868   -1.4508    0.0006 C   0  0  0

+    2.8483    0.2954    0.0010 N   0  3  0

+   -4.5129    0.6446    0.0062 C   0  0  0

+    3.7136   -0.5617    0.0034 O   0  0  0

+    3.1579    1.4734   -0.0004 O   0  5  0

+    0.7494    1.8799    0.0000 H   0  0  0

+   -0.4266   -2.8861    0.0000 H   0  0  0

+   -3.1987   -1.8466    0.0000 H   0  0  0

+    1.8496   -2.1610    0.0000 H   0  0  0

+   -4.2521    1.6537    0.0000 H   0  0  0

+   -5.5220    0.9054    0.0000 H   0  0  0

+   -4.7737   -0.3645    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+  8 11  1  0

+ 10 12  2  0

+ 10 13  1  0

+  6  8  1  0

+  7  9  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+555-84-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.7608   -0.0357   -0.0011 C   0  0  0

+   -1.9202    0.6626    0.0000 O   0  0  0

+    0.5159    0.4886    0.0006 C   0  0  0

+   -1.1251   -1.4666    0.0022 C   0  0  0

+   -2.9511   -0.1868   -0.0015 C   0  0  0

+    1.5758   -0.3297   -0.0008 N   0  0  0

+   -2.4877   -1.5049    0.0049 C   0  0  0

+   -4.3823    0.2120   -0.0009 N   0  3  0

+    2.7690    0.1603    0.0008 N   0  0  0

+   -5.2521   -0.6406   -0.0024 O   0  0  0

+   -4.7351    1.5833    0.0012 O   0  5  0

+    3.9017   -0.5547   -0.0003 C   0  0  0

+    3.1019    1.5927   -0.0024 C   0  0  0

+    5.0145    0.1909    0.0018 N   0  0  0

+    3.9182   -1.7693   -0.0026 O   0  0  0

+    4.6428    1.6136    0.0013 C   0  0  0

+    0.6524    1.5018    0.0000 H   0  0  0

+   -0.4864   -2.2649    0.0000 H   0  0  0

+   -3.0669   -2.3473    0.0000 H   0  0  0

+    3.1704    2.6128    0.0000 H   0  0  0

+    2.0907    1.7432    0.0000 H   0  0  0

+    5.9704   -0.1716    0.0000 H   0  0  0

+    5.6496    1.7915    0.0000 H   0  0  0

+    4.5466    2.6314    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+  9 13  1  0

+ 12 14  1  0

+ 12 15  2  0

+ 13 16  1  0

+  5  7  2  0

+ 14 16  1  0

+  3 17  1  0

+  4 18  1  0

+  7 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 16 23  1  0

+ 16 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88-44-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    1.5857   -0.2840   -0.0007 S   0  0  0

+   -0.1458    0.0423    0.0014 C   0  0  0

+    1.7640   -1.7954    0.0181 O   0  0  0

+    2.0578    0.1447   -1.2706 O   0  0  0

+    2.0670    0.1772    1.2543 O   0  0  0

+   -0.6064    1.3526   -0.0009 C   0  0  0

+   -1.0467   -1.0048   -0.0003 C   0  0  0

+   -1.9725    1.6054    0.0003 C   0  0  0

+    0.3018    2.4138   -0.0040 N   0  0  0

+   -2.4056   -0.7496    0.0009 C   0  0  0

+   -2.8676    0.5540    0.0038 C   0  0  0

+   -3.3855   -1.8946   -0.0011 C   0  0  0

+    1.8858   -2.8277    0.0000 H   0  0  0

+   -0.7027   -1.9857    0.0000 H   0  0  0

+   -2.3204    2.5849    0.0000 H   0  0  0

+    1.3237    2.2233    0.0000 H   0  0  0

+   -0.0442    3.3940    0.0000 H   0  0  0

+   -3.8898    0.7425    0.0000 H   0  0  0

+   -4.1753   -1.2187    0.0000 H   0  0  0

+   -4.0614   -2.6844    0.0000 H   0  0  0

+   -2.5957   -2.5705    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  6  9  1  0

+  7 10  2  0

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+  3 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5343-65-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.5626   -1.2783    0.1051 N   0  0  0

+   -0.5417   -0.5063    0.0745 C   0  0  0

+    1.8303   -0.6883    0.0550 C   0  0  0

+   -1.9044   -1.1435   -0.0149 C   0  0  0

+   -0.4387    0.7014    0.1188 O   0  0  0

+    2.9640   -1.4832   -0.0495 C   0  0  0

+    1.9571    0.6939    0.1038 C   0  0  0

+   -3.2829    0.2580   -0.0390 Br  0  0  0

+    4.2141   -0.8977   -0.0993 C   0  0  0

+    3.2097    1.2731    0.0536 C   0  0  0

+    4.3372    0.4784   -0.0452 C   0  0  0

+    5.7026    1.1138   -0.0993 C   0  0  0

+    0.4722   -2.3117    0.0000 H   0  0  0

+   -2.7214   -1.7827    0.0000 H   0  0  0

+   -1.3616   -2.0275    0.0000 H   0  0  0

+    2.8741   -2.5166    0.0000 H   0  0  0

+    1.1096    1.2920    0.0000 H   0  0  0

+    5.0637   -1.4928    0.0000 H   0  0  0

+    3.3034    2.3062    0.0000 H   0  0  0

+    6.1403    0.1733    0.0000 H   0  0  0

+    6.6431    1.5515    0.0000 H   0  0  0

+    5.2649    2.0543    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  2  2  0

+  6  3  2  0

+  7  3  1  0

+  8  4  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  9  2  0

+ 12 11  1  0

+ 10 11  1  0

+  1 13  1  0

+  4 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86853-97-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+    0.7411    0.4983   -0.0030 C   0  0  0

+   -0.7410    0.4983   -0.0010 C   0  0  0

+    1.1937    1.8185   -0.0019 C   0  0  0

+    1.6823   -0.5526   -0.0003 C   0  0  0

+   -1.1935    1.8185    0.0013 C   0  0  0

+   -1.6823   -0.5525   -0.0016 C   0  0  0

+    0.0001    2.7028    0.0009 C   0  0  0

+    2.5645    2.0984   -0.0033 C   0  0  0

+    3.0687   -0.2475   -0.0033 C   0  0  0

+    1.2706   -1.8958    0.0057 C   0  0  0

+   -2.5643    2.0985    0.0039 C   0  0  0

+   -3.0687   -0.2473    0.0003 C   0  0  0

+   -1.2708   -1.8958   -0.0044 C   0  0  0

+    0.0001    3.9165    0.0030 O   0  0  0

+    3.4860    1.0931   -0.0058 C   0  0  0

+    4.0026   -1.2990   -0.0007 C   0  0  0

+    2.2039   -2.8863    0.0085 C   0  0  0

+   -3.4859    1.0933    0.0041 C   0  0  0

+   -4.0026   -1.2987   -0.0002 C   0  0  0

+   -2.2042   -2.8862   -0.0052 C   0  0  0

+    3.5662   -2.5879    0.0047 C   0  0  0

+   -3.5665   -2.5877   -0.0026 C   0  0  0

+    2.8889    3.0983    0.0000 H   0  0  0

+    0.2469   -2.1346    0.0000 H   0  0  0

+   -2.8886    3.0984    0.0000 H   0  0  0

+   -0.2471   -2.1347    0.0000 H   0  0  0

+    4.5118    1.3226    0.0000 H   0  0  0

+    5.0328   -1.0903    0.0000 H   0  0  0

+    1.8935   -3.8906    0.0000 H   0  0  0

+   -4.5117    1.3229    0.0000 H   0  0  0

+   -5.0328   -1.0898    0.0000 H   0  0  0

+   -1.8939   -3.8905    0.0000 H   0  0  0

+    4.2672   -3.3712    0.0000 H   0  0  0

+   -4.2676   -3.3709    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+ 13 20  2  0

+ 16 21  2  0

+ 19 22  2  0

+  5  7  1  0

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+ 12 18  1  0

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+ 20 22  1  0

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+ 10 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84-88-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -0.4928   -0.4405    0.0055 C   0  0  0

+   -1.8352    0.0119    0.0014 C   0  0  0

+    0.5554    0.4944    0.0027 C   0  0  0

+   -0.2396   -1.8249    0.0064 C   0  0  0

+   -2.0903    1.3995   -0.0049 C   0  0  0

+   -2.8355   -0.8732    0.0032 N   0  0  0

+    0.2721    1.8263   -0.0039 C   0  0  0

+    2.2299   -0.0539    0.0083 S   0  0  0

+   -1.3086   -2.6756    0.0033 C   0  0  0

+   -1.0449    2.2783   -0.0070 C   0  0  0

+   -3.3687    1.8589   -0.0094 O   0  0  0

+   -2.6040   -2.1636    0.0086 C   0  0  0

+    3.1115    1.1746   -0.1647 O   0  0  0

+    2.4776   -0.5244    1.3261 O   0  0  0

+    2.3908   -0.8152   -1.1807 O   0  0  0

+    0.7290   -2.1882    0.0000 H   0  0  0

+    1.0465    2.5122    0.0000 H   0  0  0

+   -1.1562   -3.6988    0.0000 H   0  0  0

+   -1.2344    3.2953    0.0000 H   0  0  0

+   -4.3422    2.2087    0.0000 H   0  0  0

+   -3.4045   -2.8188    0.0000 H   0  0  0

+    3.7146    2.0151    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  8 13  1  0

+  8 14  2  0

+  8 15  2  0

+  7 10  1  0

+  9 12  2  0

+  4 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51-17-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+    0.2164    0.7112   -0.0025 C   0  0  0

+    0.2266   -0.6938   -0.0004 C   0  0  0

+    1.5404    1.1019   -0.0014 N   0  0  0

+   -0.9930    1.3931    0.0000 C   0  0  0

+    1.5285   -1.0797    0.0018 N   0  0  0

+   -0.9850   -1.3901   -0.0006 C   0  0  0

+    2.2961   -0.0292    0.0013 C   0  0  0

+   -2.1759    0.6853    0.0044 C   0  0  0

+   -2.1652   -0.7024   -0.0027 C   0  0  0

+    1.8927    2.0747    0.0000 H   0  0  0

+   -1.0064    2.4276    0.0000 H   0  0  0

+   -0.9881   -2.4247    0.0000 H   0  0  0

+    3.3305   -0.0509    0.0000 H   0  0  0

+   -3.0779    1.1921    0.0000 H   0  0  0

+   -3.0602   -1.2214    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  6  9  2  0

+  5  7  2  0

+  8  9  1  0

+  3 10  1  0

+  4 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-30-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    1.5977   -0.1301   -0.0009 C   0  0  0

+    0.3431    0.7047    0.0008 C   0  0  0

+    2.8004    0.4660    0.0001 O   0  0  0

+    1.5211   -1.3359    0.0018 O   0  0  0

+   -0.8806   -0.2138   -0.0009 C   0  0  0

+    4.0093   -0.3383   -0.0015 C   0  0  0

+   -2.1544    0.6338    0.0008 C   0  0  0

+    5.2329    0.5801    0.0001 C   0  0  0

+   -3.3780   -0.2847   -0.0009 C   0  0  0

+   -4.6518    0.5628    0.0009 C   0  0  0

+   -5.8755   -0.3557   -0.0008 C   0  0  0

+    1.0827    1.5820    0.0000 H   0  0  0

+   -0.4450    1.5387    0.0000 H   0  0  0

+   -1.6202   -1.0911    0.0000 H   0  0  0

+   -0.0925   -1.0478    0.0000 H   0  0  0

+    3.2698   -1.2157    0.0000 H   0  0  0

+    4.7974   -1.1723    0.0000 H   0  0  0

+   -1.4149    1.5111    0.0000 H   0  0  0

+   -2.9426    1.4678    0.0000 H   0  0  0

+    5.9217   -0.3376    0.0000 H   0  0  0

+    6.1506    1.2689    0.0000 H   0  0  0

+    4.5441    1.4978    0.0000 H   0  0  0

+   -4.1175   -1.1621    0.0000 H   0  0  0

+   -2.5898   -1.1186    0.0000 H   0  0  0

+   -3.9123    1.4402    0.0000 H   0  0  0

+   -5.4399    1.3968    0.0000 H   0  0  0

+   -6.5643    0.5620    0.0000 H   0  0  0

+   -6.7932   -1.0445    0.0000 H   0  0  0

+   -5.1867   -1.2734    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  9 10  1  0

+ 10 11  1  0

+  2 12  1  0

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+  5 14  1  0

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+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

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+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+529-49-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.0541    0.8928    0.2272 C   0  0  0

+   -1.0418   -0.5081    0.1297 C   0  0  0

+    0.0291    1.6254    0.5030 O   0  0  0

+   -2.2707    1.5507    0.0440 C   0  0  0

+    0.2561   -1.2002    0.2511 C   0  0  0

+   -2.2206   -1.2311   -0.0897 C   0  0  0

+    1.2212    1.0759    0.2465 C   0  0  0

+   -3.4303    0.8356   -0.1965 C   0  0  0

+    1.4297   -0.3041    0.1228 C   0  0  0

+    0.3540   -2.3991    0.4404 O   0  0  0

+   -3.4144   -0.5536   -0.2572 C   0  0  0

+   -2.1917   -2.5867   -0.1382 O   0  0  0

+    2.3252    1.9222    0.0995 C   0  0  0

+   -4.6003    1.4994   -0.3758 O   0  0  0

+    2.6987   -0.8249   -0.1163 C   0  0  0

+    3.5763    1.4061   -0.1436 C   0  0  0

+    3.7750    0.0333   -0.2488 C   0  0  0

+    5.0199   -0.4618   -0.4809 O   0  0  0

+   -2.3000    2.5812    0.0000 H   0  0  0

+   -4.3023   -1.0775    0.0000 H   0  0  0

+   -2.1697   -3.6174    0.0000 H   0  0  0

+    2.1901    2.9443    0.0000 H   0  0  0

+   -5.4970    2.0081    0.0000 H   0  0  0

+    2.8444   -1.8455    0.0000 H   0  0  0

+    4.3897    2.0395    0.0000 H   0  0  0

+    5.9779   -0.8428    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+  6 11  2  0

+  6 12  1  0

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+  7  9  2  0

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+ 16 17  1  0

+  4 19  1  0

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+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64091-91-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    2.4511    0.1961    0.0046 C   0  0  0

+    1.0240    0.5456    0.0869 C   0  0  0

+    3.4336    1.1968    0.0294 C   0  0  0

+    2.8519   -1.1400   -0.0938 C   0  0  0

+   -0.0206   -0.5403    0.0592 C   0  0  0

+    0.6885    1.7074    0.1770 O   0  0  0

+    4.7604    0.8142   -0.0510 C   0  0  0

+    4.1287   -1.4512   -0.1673 N   0  0  0

+   -1.4121    0.0880    0.1582 C   0  0  0

+    5.0734   -0.5297   -0.1521 C   0  0  0

+   -2.4726   -1.0145    0.1301 C   0  0  0

+   -3.8050   -0.4129    0.2249 N   0  0  0

+   -4.4380   -0.0750   -0.8471 N   0  0  0

+   -4.4186   -0.1951    1.5373 C   0  0  0

+   -5.5457    0.4251   -0.7683 O   0  0  0

+    3.1704    2.1985    0.0000 H   0  0  0

+    2.1390   -1.8912    0.0000 H   0  0  0

+   -0.5514   -1.4296    0.0000 H   0  0  0

+    0.8026   -1.1687    0.0000 H   0  0  0

+    5.5115    1.5273    0.0000 H   0  0  0

+   -0.8813    0.9773    0.0000 H   0  0  0

+   -2.2353    0.7164    0.0000 H   0  0  0

+    6.0674   -0.8204    0.0000 H   0  0  0

+   -3.0033   -1.9038    0.0000 H   0  0  0

+   -1.6494   -1.6429    0.0000 H   0  0  0

+   -4.0722    0.7809    0.0000 H   0  0  0

+   -5.3946    0.1513    0.0000 H   0  0  0

+   -4.7650   -1.1711    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  2  6  2  0

+  3  7  1  0

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+  5  9  1  0

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+ 10 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66-71-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    0.7340   -0.3514   -0.0015 C   0  0  0

+   -0.7340   -0.3514   -0.0010 C   0  0  0

+    1.4083    0.8894   -0.0006 C   0  0  0

+    1.4242   -1.4877    0.0027 N   0  0  0

+   -1.4083    0.8895    0.0004 C   0  0  0

+   -1.4242   -1.4877   -0.0014 N   0  0  0

+    0.6745    2.0971    0.0012 C   0  0  0

+    2.8132    0.8962   -0.0011 C   0  0  0

+    2.7381   -1.4899    0.0027 C   0  0  0

+   -0.6745    2.0971    0.0008 C   0  0  0

+   -2.8132    0.8963    0.0009 C   0  0  0

+   -2.7381   -1.4899   -0.0005 C   0  0  0

+    3.4666   -0.3061   -0.0025 C   0  0  0

+   -3.4666   -0.3061    0.0000 C   0  0  0

+    1.1856    3.0057    0.0000 H   0  0  0

+    3.3439    1.7935    0.0000 H   0  0  0

+    3.2459   -2.4004    0.0000 H   0  0  0

+   -1.1856    3.0057    0.0000 H   0  0  0

+   -3.3439    1.7936    0.0000 H   0  0  0

+   -3.2459   -2.4004    0.0000 H   0  0  0

+    4.5087   -0.3342    0.0000 H   0  0  0

+   -4.5087   -0.3342    0.0000 H   0  0  0

+  1  2  1  0

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+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+32828-84-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -2.3591    0.7346    0.0469 C   0  0  0

+   -3.1800   -0.2448    0.6311 C   0  0  0

+   -1.0879    0.4161   -0.4602 C   0  0  0

+   -2.8253    2.0705   -0.0378 C   0  0  0

+   -2.7065   -1.6723    0.7262 C   0  0  0

+   -4.4052    0.1008    1.1115 C   0  0  0

+   -0.5744   -0.9986   -0.3844 C   0  0  0

+   -0.3214    1.3909   -1.0201 C   0  0  0

+   -4.0985    2.3889    0.4650 C   0  0  0

+   -2.0056    3.0503   -0.6233 C   0  0  0

+   -1.7564   -1.9703   -0.4364 C   0  0  0

+   -4.8612    1.4157    1.0335 C   0  0  0

+   -0.7780    2.7055   -1.0989 C   0  0  0

+   -1.2620   -3.3490   -0.3237 N   0  0  0

+   -0.3611   -3.5689   -1.4630 C   0  0  0

+   -0.4320   -3.4022    0.8872 C   0  0  0

+   11.2561    0.5050    0.3389 Cl  0  0  0

+   -3.6711   -1.7810    0.0000 H   0  0  0

+   -2.7994   -2.6385    0.0000 H   0  0  0

+   -5.0711   -0.6055    0.0000 H   0  0  0

+   -0.0467   -1.8133    0.0000 H   0  0  0

+    0.2947   -0.5664    0.0000 H   0  0  0

+    0.6359    1.2305    0.0000 H   0  0  0

+   -4.4135    3.3070    0.0000 H   0  0  0

+   -2.2926    3.9776    0.0000 H   0  0  0

+   -2.4288   -2.6704    0.0000 H   0  0  0

+   -5.8186    1.5756    0.0000 H   0  0  0

+   -0.1127    3.4123    0.0000 H   0  0  0

+   -0.5913   -4.5119    0.0000 H   0  0  0

+    0.5819   -3.7991    0.0000 H   0  0  0

+   -0.1309   -2.6259    0.0000 H   0  0  0

+   -0.4941   -4.3709    0.0000 H   0  0  0

+    0.5367   -3.4643    0.0000 H   0  0  0

+   -0.3699   -2.4335    0.0000 H   0  0  0

+   12.2268    0.5050    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

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+  7 11  1  0

+  9 12  2  0

+ 10 13  2  0

+  5 18  1  0

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+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3351-30-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.5679    0.6909    0.0018 C   0  0  0

+   -0.3194   -0.4021    0.0008 C   0  0  0

+    2.0069    0.4226    0.0012 C   0  0  0

+    0.0713    2.0063   -0.0023 C   0  0  0

+   -1.7588   -0.1334    0.0009 C   0  0  0

+    0.1772   -1.7169   -0.0007 C   0  0  0

+    2.4495   -0.9209   -0.0002 C   0  0  0

+    2.9432    1.4603    0.0023 C   0  0  0

+   -1.2574    2.2597   -0.0077 C   0  0  0

+   -2.2011    1.2102    0.0022 C   0  0  0

+   -2.6952   -1.1706    0.0002 C   0  0  0

+    1.5063   -1.9702   -0.0016 C   0  0  0

+    3.8277   -1.1866   -0.0011 C   0  0  0

+    4.2762    1.1676    0.0020 C   0  0  0

+   -3.5787    1.4764    0.0022 C   0  0  0

+   -4.0284   -0.8774    0.0007 C   0  0  0

+   -2.2355   -2.6057   -0.0016 C   0  0  0

+    4.7154   -0.1523   -0.0004 C   0  0  0

+   -4.4671    0.4422    0.0010 C   0  0  0

+    0.7486    2.8119    0.0000 H   0  0  0

+   -0.5000   -2.5226    0.0000 H   0  0  0

+    2.6218    2.4625    0.0000 H   0  0  0

+   -1.5935    3.2571    0.0000 H   0  0  0

+    1.8425   -2.9676    0.0000 H   0  0  0

+    4.1743   -2.1804    0.0000 H   0  0  0

+    4.9803    1.9499    0.0000 H   0  0  0

+   -3.9248    2.4704    0.0000 H   0  0  0

+   -4.7328   -1.6595    0.0000 H   0  0  0

+   -3.2378   -2.9268    0.0000 H   0  0  0

+   -1.9144   -3.6080    0.0000 H   0  0  0

+   -1.2332   -2.2846    0.0000 H   0  0  0

+    5.7482   -0.3552    0.0000 H   0  0  0

+   -5.4998    0.6455    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  1  0

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+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+759-73-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.2941    0.2139    0.2843 N   0  0  0

+   -0.5859   -0.7745    0.0291 C   0  0  0

+    1.6291   -0.1077    0.7949 C   0  0  0

+   -0.0372    1.4427    0.0739 N   0  0  0

+   -1.6164   -0.9929    0.8698 N   0  0  0

+   -0.4503   -1.4685   -0.9587 O   0  0  0

+    2.6119   -0.2061   -0.3736 C   0  0  0

+   -1.1029    1.7042   -0.4547 O   0  0  0

+    1.0899   -0.7294    0.0000 H   0  0  0

+    1.9330   -0.8725    0.0000 H   0  0  0

+   -2.1667   -0.3810    0.0000 H   0  0  0

+   -1.8712   -1.7755    0.0000 H   0  0  0

+    2.5299   -1.0250    0.0000 H   0  0  0

+    3.4308   -0.2881    0.0000 H   0  0  0

+    2.6939    0.6128    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  2  6  2  0

+  3  7  1  0

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+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17309-86-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+   -4.0747    0.7575   -0.0019 C   0  0  0

+   -4.5117   -0.5824   -0.0018 C   0  0  0

+   -2.7075    1.0423   -0.0013 C   0  0  0

+   -5.2801    1.5819    0.0033 C   0  0  0

+   -3.5752   -1.6166   -0.0016 C   0  0  0

+   -5.8808   -0.5495   -0.0020 N   0  0  0

+   -1.7922   -0.0047   -0.0007 C   0  0  0

+   -6.3077    0.7821    0.0060 N   0  0  0

+   -2.2429   -1.3348   -0.0015 C   0  0  0

+   -0.4519    0.2612   -0.0001 N   0  0  0

+    0.3982   -0.7091    0.0005 N   0  0  0

+    1.7370   -0.4435    0.0010 C   0  0  0

+    2.6603   -1.4942    0.0017 C   0  0  0

+    2.1893    0.8805   -0.0048 C   0  0  0

+    4.0099   -1.2222    0.0018 C   0  0  0

+    3.5401    1.1443   -0.0047 C   0  0  0

+    4.4559    0.0959    0.0012 C   0  0  0

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+    6.7875   -0.7349    0.0020 C   0  0  0

+   -2.3755    2.0325    0.0000 H   0  0  0

+   -5.3122    2.6257    0.0000 H   0  0  0

+   -3.8970   -2.6101    0.0000 H   0  0  0

+   -6.5064   -1.3857    0.0000 H   0  0  0

+   -1.5494   -2.1156    0.0000 H   0  0  0

+    2.3264   -2.4837    0.0000 H   0  0  0

+    1.5029    1.6675    0.0000 H   0  0  0

+    4.6999   -2.0062    0.0000 H   0  0  0

+    3.8785    2.1323    0.0000 H   0  0  0

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+    6.6299    2.7427    0.0000 H   0  0  0

+    5.3050    2.0902    0.0000 H   0  0  0

+    6.0020   -1.4231    0.0000 H   0  0  0

+    7.4757   -1.5204    0.0000 H   0  0  0

+    7.5730   -0.0467    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  6  8  1  0

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+ 16 17  1  0

+  3 21  1  0

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+ 13 26  1  0

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+ 15 28  1  0

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+ 19 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+32588-76-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+   -3.9589    0.7053   -0.2784 C   0  0  0

+   -3.9589   -0.7053   -0.2793 C   0  0  0

+   -2.5475    1.1093   -0.4391 C   0  0  0

+   -5.1533    1.3950   -0.1368 C   0  0  0

+   -2.5475   -1.1091   -0.4404 C   0  0  0

+   -5.1540   -1.3952   -0.1441 C   0  0  0

+   -1.7913    0.0002   -0.5259 N   0  0  0

+   -2.1380    2.2519   -0.4851 O   0  0  0

+   -6.3422    0.6914    0.0033 C   0  0  0

+   -5.1631    3.2860   -0.1339 Br  0  0  0

+   -2.1379   -2.2517   -0.4874 O   0  0  0

+   -6.3435   -0.6918   -0.0088 C   0  0  0

+   -5.1637   -3.2862   -0.1435 Br  0  0  0

+   -0.3358    0.0003   -0.6923 C   0  0  0

+   -7.9722    1.6305    0.1965 Br  0  0  0

+   -7.9744   -1.6311    0.1750 Br  0  0  0

+    0.3347   -0.0002    0.6830 C   0  0  0

+    1.7902   -0.0001    0.5166 N   0  0  0

+    2.5464    1.1092    0.4306 C   0  0  0

+    2.5471   -1.1093    0.4355 C   0  0  0

+    3.9579    0.7053    0.2700 C   0  0  0

+    2.1367    2.2517    0.4766 O   0  0  0

+    3.9583   -0.7052    0.2732 C   0  0  0

+    2.1383   -2.2519    0.4879 O   0  0  0

+    5.1529    1.3952    0.1345 C   0  0  0

+    5.1537   -1.3950    0.1403 C   0  0  0

+    6.3425    0.6918   -0.0004 C   0  0  0

+    5.1626    3.2862    0.1328 Br  0  0  0

+    6.3428   -0.6914    0.0019 C   0  0  0

+    5.1647   -3.2859    0.1483 Br  0  0  0

+    7.9732    1.6311   -0.1860 Br  0  0  0

+    7.9742   -1.6305   -0.1788 Br  0  0  0

+    0.1833    0.8985    0.0000 H   0  0  0

+   -0.8543    0.8988    0.0000 H   0  0  0

+   -0.1844   -0.8984    0.0000 H   0  0  0

+    0.8532   -0.8987    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  6 12  2  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+ 12 16  1  0

+ 14 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 18 20  1  0

+ 19 21  1  0

+ 19 22  2  0

+ 20 23  1  0

+ 20 24  2  0

+ 21 25  1  0

+ 23 26  1  0

+ 25 27  2  0

+ 25 28  1  0

+ 26 29  2  0

+ 26 30  1  0

+ 27 31  1  0

+ 29 32  1  0

+  5  7  1  0

+  9 12  1  0

+ 21 23  2  0

+ 27 29  1  0

+ 14 33  1  0

+ 14 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2719-05-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+   -0.0035   -2.0575   -0.1836 C   0  0  0

+   -1.2242   -1.1740   -0.2005 C   0  0  0

+    1.2269   -1.2104    0.0153 C   0  0  0

+   -1.6767   -0.6454   -1.3952 C   0  0  0

+   -1.8929   -0.8984    0.9784 C   0  0  0

+    1.6838   -0.9469    1.2933 C   0  0  0

+    1.8999   -0.7029   -1.0812 C   0  0  0

+   -2.7956    0.1644   -1.4141 C   0  0  0

+   -3.0121   -0.0896    0.9663 C   0  0  0

+    2.8116   -0.1711    1.4790 C   0  0  0

+    3.0280    0.0733   -0.9024 C   0  0  0

+   -3.4661    0.4473   -0.2315 C   0  0  0

+    3.4865    0.3442    0.3804 C   0  0  0

+   -4.5998    1.2673   -0.2473 N   0  0  0

+    4.6292    1.1304    0.5650 N   0  0  0

+   -5.7987    0.7664    0.1108 C   0  0  0

+    5.7838    0.7945   -0.0437 C   0  0  0

+   -7.0358    1.6196   -0.0016 C   0  0  0

+   -5.8820   -0.3711    0.5235 O   0  0  0

+    6.9761    1.7121    0.0432 C   0  0  0

+    5.8633   -0.2463   -0.6613 O   0  0  0

+   -0.6363   -2.7501    0.0000 H   0  0  0

+    0.6128   -2.7648    0.0000 H   0  0  0

+   -1.0409    0.0445    0.0000 H   0  0  0

+   -2.3495   -1.7179    0.0000 H   0  0  0

+    2.1844   -1.7404    0.0000 H   0  0  0

+    1.3514    0.0583    0.0000 H   0  0  0

+   -2.3353    0.9819    0.0000 H   0  0  0

+   -3.6498   -0.7778    0.0000 H   0  0  0

+    3.3623   -0.9306    0.0000 H   0  0  0

+    2.5232    0.8641    0.0000 H   0  0  0

+   -4.4919    2.1993    0.0000 H   0  0  0

+    4.4799    2.0566    0.0000 H   0  0  0

+   -6.5032    2.3919    0.0000 H   0  0  0

+   -7.8081    2.1522    0.0000 H   0  0  0

+   -7.5684    0.8473    0.0000 H   0  0  0

+    7.5483    0.9686    0.0000 H   0  0  0

+    7.7196    2.2843    0.0000 H   0  0  0

+    6.4039    2.4556    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  2  0

+  5  2  1  0

+  6  3  2  0

+  7  3  1  0

+  8  4  1  0

+  9  5  2  0

+ 10  6  1  0

+ 11  7  2  0

+ 12  8  2  0

+ 13 10  2  0

+ 14 12  1  0

+ 15 13  1  0

+ 16 14  1  0

+ 17 15  1  0

+ 18 16  1  0

+ 19 16  2  0

+ 20 17  1  0

+ 21 17  2  0

+  9 12  1  0

+ 11 13  1  0

+  1 22  1  0

+  1 23  1  0

+  4 24  1  0

+  5 25  1  0

+  6 26  1  0

+  7 27  1  0

+  8 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 11 31  1  0

+ 14 32  1  0

+ 15 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+620-22-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.7810    0.0781    0.0032 C   0  0  0

+    0.2025   -0.9128    0.0024 C   0  0  0

+   -0.4074    1.4237    0.0014 C   0  0  0

+   -2.1665   -0.2837    0.0000 C   0  0  0

+    1.5356   -0.5572   -0.0002 C   0  0  0

+    0.9290    1.7651   -0.0013 C   0  0  0

+   -3.2656   -0.5707   -0.0026 N   0  0  0

+    1.8986    0.7778   -0.0016 C   0  0  0

+    2.5986   -1.6253   -0.0010 C   0  0  0

+   -0.0686   -1.9146    0.0000 H   0  0  0

+   -1.1336    2.1651    0.0000 H   0  0  0

+    1.2080    2.7647    0.0000 H   0  0  0

+    2.9028    1.0400    0.0000 H   0  0  0

+    1.8630   -2.3574    0.0000 H   0  0  0

+    3.3307   -2.3609    0.0000 H   0  0  0

+    3.3342   -0.8932    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  3  0

+  5  8  2  0

+  5  9  1  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  6 12  1  0

+  8 13  1  0

+  9 14  1  0

+  9 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+530-50-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.2093   -0.3544   -0.0029 C   0  0  0

+   -0.0001   -1.0538   -0.0087 N   0  0  0

+    1.8135   -0.0186    1.2020 C   0  0  0

+    1.8135    0.0019   -1.2024 C   0  0  0

+   -1.2105   -0.3562   -0.0029 C   0  0  0

+    0.0009   -2.4198   -0.0201 N   0  0  0

+    3.0091    0.6729    1.2041 C   0  0  0

+    3.0087    0.6932   -1.1929 C   0  0  0

+   -1.8121   -0.0159    1.2021 C   0  0  0

+   -1.8125    0.0039   -1.2023 C   0  0  0

+    3.6046    1.0309    0.0087 C   0  0  0

+   -3.0085    0.6742    1.2042 C   0  0  0

+   -3.0086    0.6938   -1.1928 C   0  0  0

+   -3.6074    1.0264    0.0087 C   0  0  0

+    2.0730   -0.4763    0.0000 H   0  0  0

+    1.5482    0.4562    0.0000 H   0  0  0

+   -0.4545   -2.6832    0.0000 H   0  0  0

+    0.4567   -2.6825    0.0000 H   0  0  0

+    3.2763    0.2197    0.0000 H   0  0  0

+    2.7473    1.1498    0.0000 H   0  0  0

+   -2.0731   -0.4727    0.0000 H   0  0  0

+   -1.5460    0.4575    0.0000 H   0  0  0

+    4.0589    1.2962    0.0000 H   0  0  0

+   -3.2733    0.2196    0.0000 H   0  0  0

+   -2.7494    1.1516    0.0000 H   0  0  0

+   -4.0641    1.2875    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  7 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 12 14  2  0

+  8 11  1  0

+ 13 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1030-27-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+    2.3379    1.0138   -0.0039 C   0  0  0

+    1.0208    0.4918   -0.0036 C   0  0  0

+    2.5154    2.2184   -0.0005 O   0  0  0

+    3.4975    0.0952   -0.0020 C   0  0  0

+   -0.0401    1.3322    0.0003 C   0  0  0

+    4.7964    0.6062   -0.0022 C   0  0  0

+    3.2975   -1.2865    0.0058 C   0  0  0

+   -1.4047    0.7914    0.0006 C   0  0  0

+    5.8735   -0.2560   -0.0005 C   0  0  0

+    4.3830   -2.1374    0.0074 C   0  0  0

+   -2.5044    1.6594    0.0046 C   0  0  0

+   -1.6114   -0.5946   -0.0091 C   0  0  0

+    5.6683   -1.6242    0.0014 C   0  0  0

+   -3.7726    1.1517    0.0049 C   0  0  0

+   -2.8828   -1.0932   -0.0087 C   0  0  0

+   -3.9732   -0.2264    0.0011 C   0  0  0

+   -5.2659   -0.7387    0.0014 N   0  0  0

+   -5.4795   -2.1880   -0.0026 C   0  0  0

+   -6.4143    0.1710    0.0056 C   0  0  0

+    0.8685   -0.5416    0.0000 H   0  0  0

+    0.1122    2.3656    0.0000 H   0  0  0

+    4.9526    1.6390    0.0000 H   0  0  0

+    2.3279   -1.6750    0.0000 H   0  0  0

+    6.8461    0.1251    0.0000 H   0  0  0

+    4.2347   -3.1714    0.0000 H   0  0  0

+   -2.3548    2.6932    0.0000 H   0  0  0

+   -0.7943   -1.2454    0.0000 H   0  0  0

+    6.4871   -2.2728    0.0000 H   0  0  0

+   -4.5931    1.7981    0.0000 H   0  0  0

+   -3.0378   -2.1262    0.0000 H   0  0  0

+   -6.5129   -2.0357    0.0000 H   0  0  0

+   -5.6318   -3.2214    0.0000 H   0  0  0

+   -4.4461   -2.3403    0.0000 H   0  0  0

+   -5.7657    0.9898    0.0000 H   0  0  0

+   -7.2331    0.8196    0.0000 H   0  0  0

+   -7.0629   -0.6478    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  2  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 14  2  0

+ 17 16  1  0

+ 18 17  1  0

+ 19 17  1  0

+ 10 13  1  0

+ 15 16  1  0

+  2 20  1  0

+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+  9 24  1  0

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+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13394-86-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.3113   -0.1883    0.1097 C   0  0  0

+   -0.1661   -0.1051    0.2141 C   0  0  0

+    2.0504    0.9335   -0.2604 C   0  0  0

+    1.9657   -1.3872    0.3870 C   0  0  0

+   -0.9612   -0.3867   -0.8955 C   0  0  0

+   -0.7616    0.2493    1.4240 C   0  0  0

+    3.4250    0.8505   -0.3555 C   0  0  0

+    1.3504    2.2347   -0.5567 C   0  0  0

+    3.3403   -1.4587    0.2887 C   0  0  0

+   -2.3342   -0.3093   -0.7962 C   0  0  0

+   -2.1345    0.3256    1.5191 C   0  0  0

+    4.0686   -0.3432   -0.0843 C   0  0  0

+   -2.9256    0.0494    0.4095 C   0  0  0

+   -3.1942   -0.6132   -1.9958 C   0  0  0

+   -4.3156    0.1276    0.5078 N   0  0  0

+    1.4221   -2.2512    0.0000 H   0  0  0

+   -0.8167   -1.3972    0.0000 H   0  0  0

+   -0.4637    1.2256    0.0000 H   0  0  0

+    3.9744    1.7108    0.0000 H   0  0  0

+    2.2493    2.7183    0.0000 H   0  0  0

+    0.8668    3.1336    0.0000 H   0  0  0

+    0.4515    1.7511    0.0000 H   0  0  0

+    3.8028   -2.3687    0.0000 H   0  0  0

+   -2.2771    1.3363    0.0000 H   0  0  0

+    5.0885   -0.3860    0.0000 H   0  0  0

+   -3.5343    0.3492    0.0000 H   0  0  0

+   -4.1566   -0.9533    0.0000 H   0  0  0

+   -2.8541   -1.5756    0.0000 H   0  0  0

+   -4.7755    1.0389    0.0000 H   0  0  0

+   -4.8748   -0.7263    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  5 10  1  0

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+  7 12  2  0

+ 10 13  2  0

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+  9 12  1  0

+ 11 13  1  0

+  4 16  1  0

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+ 12 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+9003-39-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.4104    0.0489    0.0388 N   0  0  0

+   -0.7145   -0.6869    0.0288 C   0  0  0

+    0.1097    1.4811    0.1493 C   0  0  0

+    1.6958   -0.4801   -0.0397 C   0  0  0

+   -1.9261    0.2137    0.1256 C   0  0  0

+   -0.7525   -1.8968   -0.0474 O   0  0  0

+   -1.3831    1.6188   -0.2236 C   0  0  0

+    2.7419    0.3233   -0.0226 C   0  0  0

+    1.1736    1.5957    0.0000 H   0  0  0

+    0.1015    2.5511    0.0000 H   0  0  0

+    1.8369   -1.5408    0.0000 H   0  0  0

+   -2.8854    0.6877    0.0000 H   0  0  0

+   -2.4845   -0.6991    0.0000 H   0  0  0

+   -1.1871    2.6707    0.0000 H   0  0  0

+   -2.4125    1.9109    0.0000 H   0  0  0

+    3.7307   -0.0858    0.0000 H   0  0  0

+    2.6018    1.3841    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  7  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+148193-29-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    1.1545   -0.0897    0.0289 C   0  0  0

+   -0.1551    0.3477    0.0917 C   0  0  0

+    2.2424    0.8081   -0.0664 C   0  0  0

+    1.9608   -1.6687    0.0423 S   0  0  0

+   -1.1746   -0.5468    0.1833 O   0  0  0

+   -0.4171    1.7067    0.0607 C   0  0  0

+    3.4925    0.1639   -0.1185 C   0  0  0

+    1.9291    2.1882   -0.0955 C   0  0  0

+    3.5801   -1.1315   -0.0781 N   0  0  0

+   -2.3856    0.2105    0.2291 C   0  0  0

+    0.6378    2.6066   -0.0328 C   0  0  0

+   -3.5788   -0.7415    0.3330 C   0  0  0

+   -4.8754    0.0694    0.3821 C   0  0  0

+   -4.4212   -0.5759   -0.8093 O   0  0  0

+   -1.4055    2.0530    0.0000 H   0  0  0

+    4.3678    0.7390    0.0000 H   0  0  0

+    2.7023    2.8947    0.0000 H   0  0  0

+   -1.7338    1.0303    0.0000 H   0  0  0

+   -3.1268    0.9504    0.0000 H   0  0  0

+    0.4334    3.6338    0.0000 H   0  0  0

+   -3.3302   -1.7589    0.0000 H   0  0  0

+   -4.7001    1.1020    0.0000 H   0  0  0

+   -5.8969   -0.1618    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

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+ 10 12  1  0

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+  7  9  2  0

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+ 13 14  1  0

+  6 15  1  0

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+ 10 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+29761-21-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 59                          1 V2000

+   -1.8345   -0.9672    0.2237 P   0  0  0

+   -3.0075   -2.0678    0.2914 O   0  0  0

+   -2.0327    0.1021    1.4109 O   0  0  0

+   -0.4070   -1.6934    0.3883 O   0  0  0

+   -1.8861   -0.2707   -1.0812 O   0  0  0

+   -4.1597   -1.4357   -0.0550 C   0  0  0

+   -2.1151    1.3265    0.8270 C   0  0  0

+    0.5905   -0.7193    0.0752 C   0  0  0

+   -4.4615   -1.2250   -1.3923 C   0  0  0

+   -5.0388   -1.0051    0.9284 C   0  0  0

+   -3.2971    1.7301    0.2227 C   0  0  0

+   -1.0195    2.1772    0.8392 C   0  0  0

+    1.9785   -1.3482    0.2129 C   0  0  0

+   -5.6335   -0.5822   -1.7419 C   0  0  0

+   -6.2091   -0.3629    0.5738 C   0  0  0

+   -3.3783    2.9750   -0.3701 C   0  0  0

+   -1.1059    3.4215    0.2449 C   0  0  0

+    3.0465   -0.3052   -0.1224 C   0  0  0

+   -6.5050   -0.1490   -0.7600 C   0  0  0

+   -2.2829    3.8189   -0.3616 C   0  0  0

+    4.4344   -0.9342    0.0154 C   0  0  0

+    5.5025    0.1088   -0.3199 C   0  0  0

+    6.8904   -0.5201   -0.1822 C   0  0  0

+    7.9585    0.5229   -0.5174 C   0  0  0

+    9.3464   -0.1061   -0.3797 C   0  0  0

+   10.4145    0.9369   -0.7149 C   0  0  0

+    9.5444   -0.5953    1.0564 C   0  0  0

+    1.1136    0.1351    0.0000 H   0  0  0

+   -0.1927   -0.0946    0.0000 H   0  0  0

+   -3.9331   -0.3738    0.0000 H   0  0  0

+   -5.5003   -1.8944    0.0000 H   0  0  0

+   -4.0926    1.1210    0.0000 H   0  0  0

+   -0.1050    1.7681    0.0000 H   0  0  0

+    1.4554   -2.2026    0.0000 H   0  0  0

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+   -5.1695    0.3058    0.0000 H   0  0  0

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+   -4.2912    3.3877    0.0000 H   0  0  0

+   -0.3128    4.0336    0.0000 H   0  0  0

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+   -7.3624    0.3692    0.0000 H   0  0  0

+   -2.4479    4.8071    0.0000 H   0  0  0

+    3.9112   -1.7886    0.0000 H   0  0  0

+    5.2176   -1.5590    0.0000 H   0  0  0

+    6.0256    0.9632    0.0000 H   0  0  0

+    4.7193    0.7336    0.0000 H   0  0  0

+    6.3673   -1.3745    0.0000 H   0  0  0

+    7.6736   -1.1449    0.0000 H   0  0  0

+    8.4817    1.3773    0.0000 H   0  0  0

+    7.1753    1.1477    0.0000 H   0  0  0

+    8.6236   -0.7999    0.0000 H   0  0  0

+   11.1145    0.2201    0.0000 H   0  0  0

+   11.1313    1.6368    0.0000 H   0  0  0

+    9.7146    1.6537    0.0000 H   0  0  0

+    8.6157   -0.9712    0.0000 H   0  0  0

+    9.9203   -1.5240    0.0000 H   0  0  0

+   10.4731   -0.2194    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

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+  9 14  1  0

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+ 12 17  1  0

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+ 16 20  1  0

+ 18 21  1  0

+ 21 22  1  0

+ 22 23  1  0

+ 23 24  1  0

+ 24 25  1  0

+ 25 26  1  0

+ 25 27  1  0

+ 15 19  1  0

+ 17 20  2  0

+  8 28  1  0

+  8 29  1  0

+  9 30  1  0

+ 10 31  1  0

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+ 26 53  1  0

+ 26 54  1  0

+ 26 55  1  0

+ 27 56  1  0

+ 27 57  1  0

+ 27 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16169-16-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.0094   -0.0285    0.0037 C   0  0  0

+   -0.4467   -1.2920    0.0033 C   0  0  0

+   -0.1998    1.0923    0.0025 C   0  0  0

+   -2.4816    0.1241   -0.0006 N   0  3  0

+    0.9264   -1.4379    0.0016 C   0  0  0

+    1.1745    0.9535    0.0008 C   0  0  0

+   -2.9786    1.2360   -0.0002 O   0  0  0

+   -3.1961   -0.8624   -0.0046 O   0  5  0

+    1.7429   -0.3138    0.0003 C   0  0  0

+    3.1321   -0.4578   -0.0014 N   0  0  0

+    3.9628    0.6890   -0.0026 O   0  0  0

+   -1.0569   -2.1309    0.0000 H   0  0  0

+   -0.6250    2.0385    0.0000 H   0  0  0

+    1.3478   -2.3858    0.0000 H   0  0  0

+    1.7814    1.7948    0.0000 H   0  0  0

+    3.5554   -1.4049    0.0000 H   0  0  0

+    4.5713    1.5291    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  1  0

+  6  9  2  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25917-90-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.9795    0.1554    0.0129 C   0  0  0

+   -0.3607   -1.0841   -0.0731 C   0  0  0

+   -0.2176    1.3062    0.0930 C   0  0  0

+   -2.4569    0.2455    0.0128 N   0  3  0

+    1.0255   -1.1701   -0.0793 C   0  0  0

+   -1.1342   -2.2481   -0.1541 N   0  0  0

+    1.1663    1.2245    0.0875 C   0  0  0

+   -3.0247    0.9371   -0.8136 O   0  0  0

+   -3.1047   -0.3718    0.8390 O   0  5  0

+    1.7897   -0.0185    0.0008 C   0  0  0

+    1.9387    2.3928    0.1683 N   0  0  0

+    3.1472   -0.1005   -0.0047 O   0  0  0

+    3.4768   -1.4876   -0.1010 C   0  0  0

+   -0.6825    2.2362    0.0000 H   0  0  0

+    1.4885   -2.1011    0.0000 H   0  0  0

+   -2.1719   -2.1827    0.0000 H   0  0  0

+   -0.6720   -3.1794    0.0000 H   0  0  0

+    2.9765    2.3299    0.0000 H   0  0  0

+    1.4743    3.3230    0.0000 H   0  0  0

+    2.4652   -1.7280    0.0000 H   0  0  0

+    3.7172   -2.4992    0.0000 H   0  0  0

+    4.4884   -1.2472    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 11  1  0

+ 10 12  1  0

+ 12 13  1  0

+  7 10  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-51-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+    1.9623    0.0000   -0.0006 C   0  0  0

+    0.4553   -0.0001   -0.0009 C   0  0  0

+    2.4722    1.4425   -0.0039 C   0  0  0

+    2.4720   -0.7183    1.2505 C   0  0  0

+    2.4725   -0.7243   -1.2480 C   0  0  0

+   -0.2358   -1.1970    0.0018 C   0  0  0

+   -0.2361    1.1973    0.0018 C   0  0  0

+   -1.6184   -1.1971    0.0015 C   0  0  0

+   -1.6182    1.1973    0.0014 C   0  0  0

+   -2.3094   -0.0001   -0.0016 C   0  0  0

+   -3.8164   -0.0001   -0.0020 C   0  0  0

+    3.4499    1.0969    0.0000 H   0  0  0

+    2.8178    2.4202    0.0000 H   0  0  0

+    1.4945    1.7881    0.0000 H   0  0  0

+    1.6263   -1.3184    0.0000 H   0  0  0

+    3.0721   -1.5640    0.0000 H   0  0  0

+    3.3177   -0.1182    0.0000 H   0  0  0

+    1.6248   -1.3214    0.0000 H   0  0  0

+    3.0696   -1.5720    0.0000 H   0  0  0

+    3.3202   -0.1272    0.0000 H   0  0  0

+    0.2827   -2.0950    0.0000 H   0  0  0

+    0.2823    2.0953    0.0000 H   0  0  0

+   -2.1369   -2.0951    0.0000 H   0  0  0

+   -2.1367    2.0953    0.0000 H   0  0  0

+   -3.8164    1.0368    0.0000 H   0  0  0

+   -4.8533   -0.0001    0.0000 H   0  0  0

+   -3.8164   -1.0370    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  7  9  2  0

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+  9 10  1  0

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+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+47165-04-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -1.9418    0.2705    0.0616 C   0  0  0

+   -1.8327   -1.0969   -0.2617 C   0  0  0

+   -0.6605    0.7666    0.1809 N   0  0  0

+   -3.1974    0.8438    0.2008 C   0  0  0

+   -0.4494   -1.3932   -0.3299 C   0  0  0

+   -2.9901   -1.8662   -0.4459 C   0  0  0

+    0.2333   -0.2519   -0.0589 C   0  0  0

+   -4.3353    0.0638    0.0198 C   0  0  0

+   -4.2177   -1.2924   -0.3122 C   0  0  0

+    1.7048   -0.1231   -0.0273 C   0  0  0

+   -5.6754    0.6717    0.1678 C   0  0  0

+    2.4835   -1.1416    0.5272 C   0  0  0

+    2.3181    1.0150   -0.5573 C   0  0  0

+   -6.8049   -0.0980   -0.0108 N   0  0  0

+   -5.7884    1.9352    0.4671 N   0  0  0

+    3.8545   -1.0211    0.5565 C   0  0  0

+    3.6887    1.1347   -0.5276 C   0  0  0

+    4.4666    0.1188    0.0320 C   0  0  0

+    5.9401    0.2479    0.0637 C   0  0  0

+    6.5446    1.3732   -0.4540 N   0  0  0

+    6.6664   -0.7023    0.5810 N   0  0  0

+   -0.4163    1.7622    0.0000 H   0  0  0

+   -3.2858    1.8651    0.0000 H   0  0  0

+   -0.0404   -2.3332    0.0000 H   0  0  0

+   -2.9136   -2.8885    0.0000 H   0  0  0

+   -5.0579   -1.8797    0.0000 H   0  0  0

+    2.0700   -2.0796    0.0000 H   0  0  0

+    1.7547    1.8714    0.0000 H   0  0  0

+   -7.7284    0.3470    0.0000 H   0  0  0

+   -6.7285   -1.1203    0.0000 H   0  0  0

+   -5.8797    2.9562    0.0000 H   0  0  0

+    4.4187   -1.8770    0.0000 H   0  0  0

+    4.1021    2.0728    0.0000 H   0  0  0

+    7.5692    1.4046    0.0000 H   0  0  0

+    6.0051    2.2449    0.0000 H   0  0  0

+    7.2889   -1.5167    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 16 18  2  0

+ 18 19  1  0

+ 19 20  1  0

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+  5  7  2  0

+  8  9  1  0

+ 17 18  1  0

+  3 22  1  0

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+ 12 27  1  0

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+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3475-63-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.5296   -0.5604    0.1503 C   0  0  0

+   -0.7844   -0.3393   -0.0521 N   0  0  0

+    1.4278    0.4002   -0.1443 N   0  0  0

+    0.9041   -1.6243    0.6033 O   0  0  0

+   -1.3462    0.8124    0.3656 C   0  0  0

+   -1.6022   -1.3509   -0.7261 C   0  0  0

+    1.7142    0.7313   -1.5423 C   0  0  0

+    2.1178    1.1133    0.9335 C   0  0  0

+   -2.5281    1.0113    0.1835 O   0  0  0

+   -0.7894    1.5573    0.0000 H   0  0  0

+   -2.3254   -0.7662    0.0000 H   0  0  0

+   -2.1869   -2.0741    0.0000 H   0  0  0

+   -0.8790   -1.9356    0.0000 H   0  0  0

+    2.4176    0.1229    0.0000 H   0  0  0

+    2.3226    1.4347    0.0000 H   0  0  0

+    1.0108    1.3397    0.0000 H   0  0  0

+    2.7861    0.4666    0.0000 H   0  0  0

+    2.7645    1.7816    0.0000 H   0  0  0

+    1.4495    1.7600    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  2  0

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+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14129-84-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.0439   -0.3330   -0.0383 C   0  0  0

+   -1.2660    0.4109    0.0052 C   0  0  0

+    1.2021    0.3454   -0.0193 C   0  0  0

+    0.0530   -1.7447   -0.0931 C   0  0  0

+   -2.2762   -0.0679   -1.4094 Cl  0  0  0

+   -2.1372    0.0053    1.5307 Cl  0  0  0

+    2.7075   -0.5104    0.1034 Cl  0  0  0

+    1.1945    2.0786   -0.1176 Cl  0  0  0

+    1.1082   -2.3441   -0.1281 O   0  0  0

+   -1.2243    1.4428    0.0000 H   0  0  0

+   -0.8379   -2.2671    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  2 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4376-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 42                          1 V2000

+   -2.0292    0.6611    0.4714 C   0  0  0

+   -3.1392   -0.0620   -0.0057 C   0  0  0

+   -0.7698   -0.0403    0.7995 C   0  0  0

+   -2.1231    2.0413    0.6270 C   0  0  0

+   -4.3188    0.6112   -0.3107 C   0  0  0

+   -3.0521   -1.5273   -0.1823 C   0  0  0

+    0.3528    0.2313    0.1062 O   0  0  0

+   -0.7472   -0.8614    1.6941 O   0  0  0

+   -3.3012    2.6936    0.3135 C   0  0  0

+   -4.3953    1.9817   -0.1444 C   0  0  0

+   -4.0696   -2.1982   -0.7559 O   0  0  0

+   -2.0632   -2.1261    0.1899 O   0  0  0

+    1.5897   -0.4576    0.4283 C   0  0  0

+    2.7026    0.0314   -0.5007 C   0  0  0

+    4.0060   -0.6945   -0.1612 C   0  0  0

+    2.3197   -0.2604   -1.9529 C   0  0  0

+    5.0582    0.3255    0.2787 C   0  0  0

+    2.3065    1.0459   -2.7492 C   0  0  0

+    6.3948   -0.3846    0.5022 C   0  0  0

+    7.4469    0.6354    0.9421 C   0  0  0

+   -1.2673    2.5857    0.0000 H   0  0  0

+   -5.1814    0.0776    0.0000 H   0  0  0

+   -3.3373    3.7073    0.0000 H   0  0  0

+   -5.3000    2.4402    0.0000 H   0  0  0

+   -4.9164   -2.7565    0.0000 H   0  0  0

+    0.9176   -1.2172    0.0000 H   0  0  0

+    2.1874   -1.2771    0.0000 H   0  0  0

+    2.7503    1.0446    0.0000 H   0  0  0

+    3.4285   -1.5283    0.0000 H   0  0  0

+    4.7796   -1.3505    0.0000 H   0  0  0

+    1.3307   -0.4855    0.0000 H   0  0  0

+    2.7494   -1.1792    0.0000 H   0  0  0

+    5.6247    1.1669    0.0000 H   0  0  0

+    4.2803    0.9764    0.0000 H   0  0  0

+    3.3208    1.0561    0.0000 H   0  0  0

+    2.2963    2.0602    0.0000 H   0  0  0

+    1.2922    1.0357    0.0000 H   0  0  0

+    5.8283   -1.2260    0.0000 H   0  0  0

+    7.1727   -1.0355    0.0000 H   0  0  0

+    8.1529   -0.0928    0.0000 H   0  0  0

+    8.1751    1.3414    0.0000 H   0  0  0

+    6.7409    1.3636    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  6 12  2  0

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+ 13 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+ 19 20  1  0

+  9 10  2  0

+  4 21  1  0

+  5 22  1  0

+  9 23  1  0

+ 10 24  1  0

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+ 13 26  1  0

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+ 18 37  1  0

+ 19 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+ 20 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-45-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.0002   -1.0001    0.0000 C   0  0  0

+   -1.2009   -0.3048   -0.0002 C   0  0  0

+    1.2009   -0.3046    0.0002 C   0  0  0

+   -1.1973    1.0852   -0.0002 C   0  0  0

+   -2.4118   -1.0007    0.0002 N   0  0  0

+    1.1974    1.0849    0.0001 C   0  0  0

+    2.4118   -1.0007   -0.0001 N   0  0  0

+   -0.0001    1.7742    0.0000 C   0  0  0

+   -0.0002   -2.0416    0.0000 H   0  0  0

+   -2.0983    1.6078    0.0000 H   0  0  0

+   -3.3128   -0.4781    0.0000 H   0  0  0

+   -2.4139   -2.0422    0.0000 H   0  0  0

+    2.0984    1.6074    0.0000 H   0  0  0

+    2.4137   -2.0422    0.0000 H   0  0  0

+    3.3128   -0.4782    0.0000 H   0  0  0

+   -0.0001    2.8157    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  1  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51787-42-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+    0.7846    0.0342    0.0030 C   0  0  0

+    0.4259   -1.3387   -0.0002 C   0  0  0

+    2.2123    0.3911    0.0026 C   0  0  0

+   -0.1329    0.9886    0.0008 N   0  0  0

+   -0.9201   -1.7076   -0.0001 C   0  0  0

+    1.4645   -2.3664   -0.0041 C   0  0  0

+    3.1830   -0.6317   -0.0009 C   0  0  0

+    2.6154    1.7282    0.0051 C   0  0  0

+   -1.4328    0.7064   -0.0042 C   0  0  0

+   -1.8793   -0.6894    0.0033 C   0  0  0

+   -1.3277   -3.1584   -0.0030 C   0  0  0

+    2.7697   -2.0321   -0.0044 C   0  0  0

+    4.5417   -0.2888   -0.0013 C   0  0  0

+    3.9575    2.0339    0.0042 C   0  0  0

+   -2.4070    1.7235   -0.0070 C   0  0  0

+   -3.2586   -0.9671    0.0041 C   0  0  0

+    4.9121    1.0247    0.0017 C   0  0  0

+   -3.7248    1.3905   -0.0125 C   0  0  0

+   -1.9909    3.1720   -0.0033 C   0  0  0

+   -4.1471    0.0624    0.0079 C   0  0  0

+   -5.6234   -0.2401    0.0082 C   0  0  0

+    1.1898   -3.3799    0.0000 H   0  0  0

+    1.8989    2.4958    0.0000 H   0  0  0

+   -2.3386   -2.8744    0.0000 H   0  0  0

+   -1.6117   -4.1693    0.0000 H   0  0  0

+   -0.3168   -3.4424    0.0000 H   0  0  0

+    3.4986   -2.7879    0.0000 H   0  0  0

+    5.2739   -1.0415    0.0000 H   0  0  0

+    4.2624    3.0387    0.0000 H   0  0  0

+   -3.5989   -1.9605    0.0000 H   0  0  0

+    5.9317    1.2757    0.0000 H   0  0  0

+   -4.4446    2.1551    0.0000 H   0  0  0

+   -0.9817    2.8821    0.0000 H   0  0  0

+   -1.7010    4.1812    0.0000 H   0  0  0

+   -3.0001    3.4619    0.0000 H   0  0  0

+   -5.8342    0.7886    0.0000 H   0  0  0

+   -6.6521   -0.4509    0.0000 H   0  0  0

+   -5.4126   -1.2688    0.0000 H   0  0  0

+  1  2  2  0

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+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57470-78-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 60                          1 V2000

+    0.2642    0.6258    0.2517 C   0  0  0

+   -0.8575    1.4700    0.2291 C   0  0  0

+    0.0943   -0.7423    0.4022 C   0  0  0

+    1.5102    1.1463    0.1211 O   0  0  0

+   -2.1390    0.9214    0.3590 C   0  0  0

+   -0.6875    2.9194    0.0708 C   0  0  0

+   -1.1726   -1.2743    0.5295 C   0  0  0

+    2.4245    0.0498    0.1831 C   0  0  0

+   -2.2899   -0.4448    0.5082 C   0  0  0

+   -1.8945    3.8215    0.0471 C   0  0  0

+    0.4244    3.3910   -0.0411 O   0  0  0

+    3.8561    0.5709    0.0413 C   0  0  0

+   -3.5720   -0.9961    0.6388 N   0  0  0

+    4.8350   -0.6031    0.1077 C   0  0  0

+    3.9977    1.2387   -1.2141 O   0  0  0

+   -4.5230   -0.7142   -0.2737 C   0  0  0

+    6.2094   -0.1029   -0.0285 N   0  0  0

+   -5.7980   -1.0935   -0.0575 N   0  0  0

+   -4.2306   -0.1176   -1.2921 O   0  0  0

+    7.0938   -1.2736    0.0433 C   0  0  0

+   -6.6495   -0.3179    0.8479 C   0  0  0

+   -6.3326   -2.2815   -0.7278 C   0  0  0

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+   -7.2870    0.8418    0.0800 C   0  0  0

+   -5.5174   -3.5092   -0.3165 C   0  0  0

+    0.9184   -1.3667    0.0000 H   0  0  0

+   -2.9695    1.5373    0.0000 H   0  0  0

+   -1.2969   -2.3008    0.0000 H   0  0  0

+    1.5595   -0.5166    0.0000 H   0  0  0

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+   -2.5135    2.9933    0.0000 H   0  0  0

+    4.8597    0.8197    0.0000 H   0  0  0

+   -3.5111   -2.0283    0.0000 H   0  0  0

+    3.9700   -1.1695    0.0000 H   0  0  0

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+    6.4075   -3.2163    0.0000 H   0  0  0

+    7.7268   -2.5858    0.0000 H   0  0  0

+   -6.3809    1.3399    0.0000 H   0  0  0

+   -7.7851    1.7479    0.0000 H   0  0  0

+   -8.1931    0.3437    0.0000 H   0  0  0

+   -6.3788   -4.0811    0.0000 H   0  0  0

+   -4.9455   -4.3706    0.0000 H   0  0  0

+   -4.6560   -2.9373    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 26 57  1  0

+ 27 58  1  0

+ 27 59  1  0

+ 27 60  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91575-28-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    0.3892    0.8501    1.3566 C   0  0  0

+   -0.9308    1.4183    1.8101 C   0  0  0

+    1.2270    1.6054    0.5569 C   0  0  0

+    0.7624   -0.4233    1.7458 C   0  0  0

+   -1.9978    1.0761    0.8023 C   0  0  0

+    2.4386    1.0871    0.1397 C   0  0  0

+    1.9717   -0.9473    1.3326 C   0  0  0

+   -2.7197   -0.0959    0.9332 C   0  0  0

+   -2.2565    1.9378   -0.2480 C   0  0  0

+    2.8136   -0.1942    0.5251 C   0  0  0

+    3.4905    2.0358   -0.8638 Cl  0  0  0

+   -3.6992   -0.4123    0.0109 C   0  0  0

+   -3.2338    1.6279   -1.1733 C   0  0  0

+    4.0396   -0.7226    0.1043 N   0  0  0

+   -3.9577    0.4492   -1.0486 C   0  0  0

+   -4.6050   -1.8842    0.1753 Cl  0  0  0

+    4.0786   -1.9091   -0.5338 C   0  0  0

+   -4.9473    0.1328   -1.9833 N   0  0  0

+    5.4049   -2.5403   -0.8708 C   0  0  0

+    3.0461   -2.4689   -0.8368 O   0  0  0

+   -0.3008    2.1798    0.0000 H   0  0  0

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+    1.0649    2.5804    0.0000 H   0  0  0

+    0.0216   -1.0776    0.0000 H   0  0  0

+    2.1296   -1.9230    0.0000 H   0  0  0

+   -2.1094   -0.8733    0.0000 H   0  0  0

+   -1.7948    2.8117    0.0000 H   0  0  0

+   -3.8425    2.4065    0.0000 H   0  0  0

+    4.8562   -0.1659    0.0000 H   0  0  0

+   -5.6787    0.7976    0.0000 H   0  0  0

+   -5.1573   -0.8330    0.0000 H   0  0  0

+    4.9802   -3.4327    0.0000 H   0  0  0

+    6.2973   -2.9650    0.0000 H   0  0  0

+    5.8296   -1.6479    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

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+ 14 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2437-56-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 38                          1 V2000

+    0.0211   -0.4730   -0.0271 C   0  0  0

+   -1.2093    0.4342   -0.0906 C   0  0  0

+    1.2878    0.3765   -0.1482 C   0  0  0

+   -2.4760   -0.4153    0.0305 C   0  0  0

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+   -7.4703   -0.2999    0.1457 C   0  0  0

+    7.1481    0.2460    0.7043 C   0  0  0

+   -0.7588   -1.3098    0.0000 H   0  0  0

+    0.7630   -1.3437    0.0000 H   0  0  0

+   -0.4294    1.2710    0.0000 H   0  0  0

+   -1.9512    1.3049    0.0000 H   0  0  0

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+   -5.7530   -1.1944    0.0000 H   0  0  0

+   -4.2312   -1.2283    0.0000 H   0  0  0

+    4.2355   -1.4252    0.0000 H   0  0  0

+    5.7573   -1.4591    0.0000 H   0  0  0

+   -5.4235    1.3864    0.0000 H   0  0  0

+   -6.9454    1.4204    0.0000 H   0  0  0

+    5.9315    1.3431    0.0000 H   0  0  0

+   -8.1074    0.6502    0.0000 H   0  0  0

+   -8.4204   -0.9370    0.0000 H   0  0  0

+   -6.8332   -1.2500    0.0000 H   0  0  0

+    7.7175   -0.7462    0.0000 H   0  0  0

+    7.7226    1.2352    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 11 34  1  0

+ 12 35  1  0

+ 12 36  1  0

+ 12 37  1  0

+ 13 38  1  0

+ 13 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+102-08-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.9580    0.4091   -0.5041 C   0  0  0

+    0.6345    0.1471   -0.8731 N   0  0  0

+    2.9679   -0.4747   -0.8610 C   0  0  0

+    2.2659    1.5568    0.2153 C   0  0  0

+   -0.0436   -0.8570   -0.2828 C   0  0  0

+    4.2739   -0.2128   -0.4955 C   0  0  0

+    3.5735    1.8127    0.5776 C   0  0  0

+   -1.2901   -1.1620   -0.6946 N   0  0  0

+    0.6786   -1.7452    0.9903 S   0  0  0

+    4.5763    0.9278    0.2251 C   0  0  0

+   -2.3680   -0.3530   -0.3200 C   0  0  0

+   -3.3951   -0.1016   -1.2201 C   0  0  0

+   -2.4160    0.1960    0.9550 C   0  0  0

+   -4.4580    0.6977   -0.8470 C   0  0  0

+   -3.4815    0.9943    1.3217 C   0  0  0

+   -4.5000    1.2473    0.4210 C   0  0  0

+    0.1021    0.9489    0.0000 H   0  0  0

+    2.7200   -1.4047    0.0000 H   0  0  0

+    1.6092    2.2604    0.0000 H   0  0  0

+    4.9333   -0.9139    0.0000 H   0  0  0

+    3.8255    2.7416    0.0000 H   0  0  0

+   -1.4831   -2.1049    0.0000 H   0  0  0

+    5.4974    1.2070    0.0000 H   0  0  0

+   -3.8071   -0.9714    0.0000 H   0  0  0

+   -1.5749    0.6637    0.0000 H   0  0  0

+   -5.3021    0.2353    0.0000 H   0  0  0

+   -3.0687    1.8637    0.0000 H   0  0  0

+   -5.1214    1.9823    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  8 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+  7 10  1  0

+ 15 16  1  0

+  2 17  1  0

+  3 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60516-11-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    0.9368    1.0692   -0.1011 C   0  0  0

+   -0.2531    1.7971    0.0070 N   0  0  0

+    1.4233    0.7153   -1.3529 C   0  0  0

+    1.6350    0.7051    1.0436 C   0  0  0

+   -1.4806    1.1306    0.0232 C   0  0  0

+    2.5976   -0.0031   -1.4593 C   0  0  0

+    2.8088   -0.0131    0.9367 C   0  0  0

+   -2.6661    1.8544    0.0058 C   0  0  0

+   -1.5186   -0.2582    0.0511 C   0  0  0

+    3.2921   -0.3718   -0.3150 C   0  0  0

+   -3.8780    1.1921    0.0220 C   0  0  0

+   -2.7337   -0.9138    0.0671 C   0  0  0

+    4.4836   -1.1013   -0.4232 N   0  0  0

+   -3.9122   -0.1898    0.0555 C   0  0  0

+    5.6106   -0.6407    0.1548 C   0  0  0

+   -5.2129   -0.8961    0.0732 N   0  3  0

+    6.8573   -1.4874    0.1556 C   0  0  0

+    5.6215    0.4553    0.6744 O   0  0  0

+   -5.2446   -2.1133    0.1026 O   0  0  0

+   -6.2515   -0.2600    0.0583 O   0  5  0

+   -0.2264    2.8323    0.0000 H   0  0  0

+    0.8481   -0.1457    0.0000 H   0  0  0

+    2.1449    1.6064    0.0000 H   0  0  0

+    2.0844   -0.9025    0.0000 H   0  0  0

+    3.3882    0.8452    0.0000 H   0  0  0

+   -2.6413    2.8896    0.0000 H   0  0  0

+   -0.6367   -0.8009    0.0000 H   0  0  0

+   -4.7620    1.7313    0.0000 H   0  0  0

+   -2.7628   -1.9489    0.0000 H   0  0  0

+    4.4001   -2.1334    0.0000 H   0  0  0

+    6.2755   -2.3440    0.0000 H   0  0  0

+    7.7139   -2.0692    0.0000 H   0  0  0

+    7.4391   -0.6308    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  2  0

+  5  9  1  0

+  6 10  2  0

+  8 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 13 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+ 15 18  2  0

+ 16 19  2  0

+ 16 20  1  0

+  7 10  1  0

+ 12 14  1  0

+  2 21  1  0

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+  7 25  1  0

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+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+19881-18-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    1.5012    1.3927    0.0471 C   0  0  0

+    0.4309    2.2280    0.0587 O   0  0  0

+    2.0182    0.9411   -1.1598 C   0  0  0

+    2.0848    0.9929    1.2423 C   0  0  0

+   -0.8177    1.7235    0.0210 C   0  0  0

+    3.1071    0.0913   -1.1683 C   0  0  0

+    3.1732    0.1433    1.2273 C   0  0  0

+   -1.9069    2.6028   -0.0975 C   0  0  0

+   -0.9951    0.3323    0.0953 C   0  0  0

+    3.6824   -0.3095    0.0236 C   0  0  0

+   -3.1753    2.1349   -0.1391 C   0  0  0

+   -2.2329   -0.2125    0.0602 C   0  0  0

+    4.8489   -1.2206    0.0110 N   0  3  0

+   -3.4053    0.6780   -0.0581 C   0  0  0

+    5.3565   -1.5745    1.0600 O   0  0  0

+    5.3746   -1.6807   -1.2207 O   0  5  0

+   -4.6157    0.1889   -0.0947 N   0  0  0

+   -4.7930   -1.0465   -0.0250 C   0  0  0

+   -5.0133   -2.5819    0.0616 S   0  0  0

+    1.3724    0.1592    0.0000 H   0  0  0

+    2.6837    1.8113    0.0000 H   0  0  0

+    2.5051   -0.7248    0.0000 H   0  0  0

+    3.8225    0.9223    0.0000 H   0  0  0

+   -1.7424    3.6035    0.0000 H   0  0  0

+   -0.1826   -0.2746    0.0000 H   0  0  0

+   -3.9594    2.7781    0.0000 H   0  0  0

+   -2.3518   -1.2196    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+ 13 15  2  0

+ 13 16  1  0

+ 14 17  1  0

+ 17 18  2  0

+ 18 19  2  0

+  7 10  1  0

+ 12 14  2  0

+  3 20  1  0

+  4 21  1  0

+  6 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3077-12-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    1.3728    0.0197   -0.0039 N   0  0  0

+    2.1179   -0.9815   -0.7711 C   0  0  0

+    2.0924    1.0441    0.7570 C   0  0  0

+   -0.0238    0.0010   -0.0025 C   0  0  0

+    2.2423   -2.2655    0.0516 C   0  0  0

+    2.1395    2.3415   -0.0526 C   0  0  0

+   -0.7262    0.3856   -1.1373 C   0  0  0

+   -0.7135   -0.4078    1.1322 C   0  0  0

+    1.0302   -3.0155   -0.0499 O   0  0  0

+    0.8911    3.0258    0.0713 O   0  0  0

+   -2.1073    0.3655   -1.1327 C   0  0  0

+   -2.0942   -0.4255    1.1300 C   0  0  0

+   -2.7906   -0.0369   -0.0001 C   0  0  0

+   -4.2975   -0.0570    0.0014 C   0  0  0

+    3.0593   -1.2178    0.0000 H   0  0  0

+    2.6567   -0.1742    0.0000 H   0  0  0

+    2.6618    0.2580    0.0000 H   0  0  0

+    3.0210    1.3266    0.0000 H   0  0  0

+    2.6217   -3.1589    0.0000 H   0  0  0

+    3.1829   -2.0262    0.0000 H   0  0  0

+    3.0924    2.1569    0.0000 H   0  0  0

+    2.4690    3.2545    0.0000 H   0  0  0

+   -0.4925    1.3276    0.0000 H   0  0  0

+   -0.4509   -1.3422    0.0000 H   0  0  0

+    0.2048   -3.5262    0.0000 H   0  0  0

+    0.0400    3.4923    0.0000 H   0  0  0

+   -2.3694    1.3001    0.0000 H   0  0  0

+   -2.3325   -1.3664    0.0000 H   0  0  0

+   -4.3104    0.9135    0.0000 H   0  0  0

+   -5.2680   -0.0699    0.0000 H   0  0  0

+   -4.2846   -1.0275    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  9  5  1  0

+ 10  6  1  0

+ 11  7  1  0

+ 12  8  2  0

+ 13 11  2  0

+ 14 13  1  0

+ 12 13  1  0

+  2 15  1  0

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+  5 19  1  0

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+  7 23  1  0

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+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83053-57-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+    0.4498   -0.1261    0.0024 C   0  0  0

+   -0.3025   -1.3215    0.0006 C   0  0  0

+    1.9118   -0.2131    0.0017 C   0  0  0

+   -0.2091    1.1122   -0.0011 C   0  0  0

+   -1.7025   -1.2638    0.0004 C   0  0  0

+    0.3909   -2.6059   -0.0015 C   0  0  0

+    2.5261   -1.4854   -0.0005 C   0  0  0

+    2.7043    0.9386    0.0028 C   0  0  0

+   -1.5826    1.1560   -0.0064 C   0  0  0

+    0.5089    2.2655    0.0013 O   0  0  0

+   -2.3433   -0.0329    0.0021 C   0  0  0

+   -2.7273   -2.3730   -0.0014 C   0  0  0

+    1.7386   -2.6602   -0.0020 C   0  0  0

+    3.9269   -1.5665   -0.0012 C   0  0  0

+    4.0647    0.8251    0.0017 C   0  0  0

+   -0.4342    3.3391   -0.0032 C   0  0  0

+   -3.8061   -0.2086    0.0015 C   0  0  0

+   -4.1012   -1.6888   -0.0007 C   0  0  0

+    4.6728   -0.4249    0.0003 C   0  0  0

+    0.3130    4.6742   -0.0009 C   0  0  0

+   -4.6298    0.6813    0.0026 O   0  0  0

+   -0.1680   -3.5013    0.0000 H   0  0  0

+    2.2524    1.8924    0.0000 H   0  0  0

+   -2.0745    2.0898    0.0000 H   0  0  0

+   -3.2850   -3.2691    0.0000 H   0  0  0

+   -1.8879   -3.0128    0.0000 H   0  0  0

+    2.2166   -3.6012    0.0000 H   0  0  0

+    4.4022   -2.5089    0.0000 H   0  0  0

+    4.6612    1.6958    0.0000 H   0  0  0

+   -1.2911    3.9554    0.0000 H   0  0  0

+   -1.1434    2.5574    0.0000 H   0  0  0

+   -5.1140   -1.3918    0.0000 H   0  0  0

+   -4.4864   -2.6715    0.0000 H   0  0  0

+    5.7262   -0.4913    0.0000 H   0  0  0

+    1.2340    4.1587    0.0000 H   0  0  0

+    0.8285    5.5952    0.0000 H   0  0  0

+   -0.6080    5.1897    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97136-66-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    1.9304    0.3025   -0.0014 C   0  0  0

+    0.4732    0.5226   -0.0014 C   0  0  0

+    2.8052    1.3925   -0.0014 C   0  0  0

+    2.4441   -0.9969    0.0045 C   0  0  0

+   -0.3645   -0.5271   -0.0014 C   0  0  0

+    4.1675    1.1788   -0.0014 C   0  0  0

+    3.8091   -1.1951    0.0044 C   0  0  0

+   -1.8211   -0.3071   -0.0014 C   0  0  0

+    4.6691   -0.1112   -0.0014 C   0  0  0

+   -2.6947   -1.3984   -0.0013 C   0  0  0

+   -2.3334    0.9940    0.0044 C   0  0  0

+    6.1592   -0.3363   -0.0020 C   0  0  0

+   -4.0561   -1.1886   -0.0014 C   0  0  0

+   -3.6957    1.1956    0.0043 C   0  0  0

+   -4.5619    0.1070   -0.0015 C   0  0  0

+   -5.9411    0.3153   -0.0015 N   0  0  0

+    0.0923    1.4940    0.0000 H   0  0  0

+    2.4284    2.3655    0.0000 H   0  0  0

+    1.7968   -1.8152    0.0000 H   0  0  0

+    0.0164   -1.4985    0.0000 H   0  0  0

+    4.8218    1.9916    0.0000 H   0  0  0

+    4.1941   -2.1648    0.0000 H   0  0  0

+   -2.3160   -2.3706    0.0000 H   0  0  0

+   -1.6844    1.8110    0.0000 H   0  0  0

+    6.0034   -1.3680    0.0000 H   0  0  0

+    7.1909   -0.4921    0.0000 H   0  0  0

+    6.3150    0.6954    0.0000 H   0  0  0

+   -4.7087   -2.0027    0.0000 H   0  0  0

+   -4.0787    2.1661    0.0000 H   0  0  0

+   -6.3220    1.2867    0.0000 H   0  0  0

+   -6.5919   -0.5003    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  7  9  2  0

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+ 12 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120812-51-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 44                          1 V2000

+    0.1046   -0.9391   -0.0142 C   0  0  0

+   -0.9415   -0.0010   -0.0007 C   0  0  0

+    1.4397   -0.4883   -0.0069 C   0  0  0

+   -0.1931   -2.3205   -0.0289 C   0  0  0

+   -0.6379    1.3752    0.0174 C   0  0  0

+   -2.2823   -0.4464   -0.0065 C   0  0  0

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+    2.4696   -1.4337   -0.0206 C   0  0  0

+   -1.5458   -2.7397   -0.0303 C   0  0  0

+    0.8636   -3.2342   -0.0421 C   0  0  0

+    0.7200    1.8081    0.0200 C   0  0  0

+   -1.6891    2.2964    0.0321 C   0  0  0

+   -3.3054    0.5053    0.0083 C   0  0  0

+   -2.5527   -1.8363   -0.0280 C   0  0  0

+    3.1765    1.3084    0.0375 C   0  0  0

+    2.1696   -2.7821   -0.0410 C   0  0  0

+    3.8821   -0.9897   -0.0139 N   0  3  0

+    0.9602    3.2965    0.0213 C   0  0  0

+   -2.9976    1.8520    0.0277 C   0  0  0

+   -4.7205    0.0700    0.0029 N   0  3  0

+    3.3471    2.7667   -0.3792 C   0  0  0

+    4.4614   -0.7856   -1.0657 O   0  0  0

+    4.4648   -0.8286    1.0435 O   0  5  0

+    2.3862    3.6181    0.4602 C   0  0  0

+   -5.5162    0.5949   -0.7554 O   0  0  0

+   -5.0890   -0.8130    0.7566 O   0  5  0

+   -1.7705   -3.7666    0.0000 H   0  0  0

+    0.6652   -4.2665    0.0000 H   0  0  0

+   -1.4843    3.3274    0.0000 H   0  0  0

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+    1.9482    4.5737    0.0000 H   0  0  0

+  1  2  1  0

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+  6 14  1  0

+  7 15  1  0

+  8 16  2  0

+  8 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+ 15 21  1  0

+ 17 22  2  0

+ 17 23  1  0

+ 18 24  1  0

+ 20 25  2  0

+ 20 26  1  0

+  7 11  2  0

+  9 14  2  0

+ 10 16  1  0

+ 13 19  2  0

+ 21 24  1  0

+  9 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+623-17-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.1424    0.3307    0.1178 C   0  0  0

+   -0.2872    0.7548    0.3352 C   0  0  0

+    2.0565    0.9924   -0.6145 C   0  0  0

+    1.7217   -0.7688    0.6270 O   0  0  0

+   -1.1792   -0.2744   -0.1683 O   0  0  0

+    3.2545    0.2446   -0.5471 C   0  0  0

+    3.0020   -0.8272    0.2254 C   0  0  0

+   -2.5087   -0.1120   -0.0806 C   0  0  0

+   -3.4345   -1.1801   -0.6031 C   0  0  0

+   -2.9633    0.8907    0.4172 O   0  0  0

+    0.1228    1.6481    0.0000 H   0  0  0

+   -1.1135    1.2870    0.0000 H   0  0  0

+    2.0228    1.9747    0.0000 H   0  0  0

+    4.1633    0.6189    0.0000 H   0  0  0

+    3.5944   -1.6115    0.0000 H   0  0  0

+   -4.1772   -0.5363    0.0000 H   0  0  0

+   -4.0783   -1.9228    0.0000 H   0  0  0

+   -2.6918   -1.8239    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  8 10  2  0

+  6  7  2  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13360-61-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 44                          1 V2000

+    0.0336   -0.4111    0.1054 C   0  0  0

+   -1.2290    0.4467   -0.0002 C   0  0  0

+    1.2687    0.4898    0.0437 C   0  0  0

+   -2.4641   -0.4542    0.0615 C   0  0  0

+    2.5313   -0.3679    0.1493 C   0  0  0

+   -3.7267    0.4035   -0.0440 C   0  0  0

+    3.7664    0.5329    0.0876 C   0  0  0

+   -4.9619   -0.4973    0.0177 C   0  0  0

+    5.0290   -0.3248    0.1932 C   0  0  0

+   -6.2244    0.3604   -0.0879 C   0  0  0

+    6.2641    0.5760    0.1315 C   0  0  0

+   -7.4596   -0.5405   -0.0262 C   0  0  0

+    7.5077   -0.2688    0.2355 C   0  0  0

+   -8.7221    0.3173   -0.1318 C   0  0  0

+    8.3872   -0.2620   -0.7353 C   0  0  0

+   -0.7138   -1.2782    0.0000 H   0  0  0

+    0.8096   -1.2528    0.0000 H   0  0  0

+   -0.4816    1.3138    0.0000 H   0  0  0

+   -2.0050    1.2884    0.0000 H   0  0  0

+    2.0161    1.3570    0.0000 H   0  0  0

+    0.4927    1.3315    0.0000 H   0  0  0

+   -3.2115   -1.3214    0.0000 H   0  0  0

+   -1.6881   -1.2959    0.0000 H   0  0  0

+    1.7839   -1.2351    0.0000 H   0  0  0

+    3.3073   -1.2096    0.0000 H   0  0  0

+   -2.9793    1.2707    0.0000 H   0  0  0

+   -4.5026    1.2452    0.0000 H   0  0  0

+    4.5138    1.4001    0.0000 H   0  0  0

+    2.9904    1.3746    0.0000 H   0  0  0

+   -5.7093   -1.3644    0.0000 H   0  0  0

+   -4.1860   -1.3390    0.0000 H   0  0  0

+    4.2816   -1.1920    0.0000 H   0  0  0

+    5.8050   -1.1665    0.0000 H   0  0  0

+   -5.4770    1.2275    0.0000 H   0  0  0

+   -7.0004    1.2021    0.0000 H   0  0  0

+    7.0115    1.4432    0.0000 H   0  0  0

+    5.4881    1.4177    0.0000 H   0  0  0

+   -8.2070   -1.4076    0.0000 H   0  0  0

+   -6.6837   -1.3822    0.0000 H   0  0  0

+    7.1754   -1.3643    0.0000 H   0  0  0

+   -8.0787    1.2642    0.0000 H   0  0  0

+   -9.6690    0.9607    0.0000 H   0  0  0

+   -9.3655   -0.6296    0.0000 H   0  0  0

+    8.9672   -1.2490    0.0000 H   0  0  0

+    8.9519    0.7338    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  1  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

+  9  7  1  0

+ 10  8  1  0

+ 11  9  1  0

+ 12 10  1  0

+ 13 11  1  0

+ 14 12  1  0

+ 15 13  2  0

+  1 16  1  0

+  1 17  1  0

+  2 18  1  0

+  2 19  1  0

+  3 20  1  0

+  3 21  1  0

+  4 22  1  0

+  4 23  1  0

+  5 24  1  0

+  5 25  1  0

+  6 26  1  0

+  6 27  1  0

+  7 28  1  0

+  7 29  1  0

+  8 30  1  0

+  8 31  1  0

+  9 32  1  0

+  9 33  1  0

+ 10 34  1  0

+ 10 35  1  0

+ 11 36  1  0

+ 11 37  1  0

+ 12 38  1  0

+ 12 39  1  0

+ 13 40  1  0

+ 14 41  1  0

+ 14 42  1  0

+ 14 43  1  0

+ 15 44  1  0

+ 15 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96-91-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.9644   -0.3572   -0.0032 C   0  0  0

+   -0.3157   -0.8803    0.0299 C   0  0  0

+    1.1514    1.0140   -0.0486 C   0  0  0

+    2.1347   -1.2633    0.0160 N   0  3  0

+   -1.4112   -0.0377    0.0178 C   0  0  0

+    0.0474    1.8643   -0.0608 C   0  0  0

+    2.4095    1.5297   -0.0807 O   0  0  0

+    2.1368   -2.2700   -0.6696 O   0  0  0

+    3.0956   -1.0022    0.7175 O   0  5  0

+   -1.2331    1.3327   -0.0274 C   0  0  0

+   -2.7785   -0.6038    0.0529 N   0  3  0

+    0.2304    3.2512   -0.1061 N   0  0  0

+   -3.7449    0.1375    0.0423 O   0  0  0

+   -2.9371   -1.8107    0.0923 O   0  5  0

+   -0.4541   -1.9079    0.0000 H   0  0  0

+    3.3689    1.9230    0.0000 H   0  0  0

+   -2.0565    1.9629    0.0000 H   0  0  0

+    1.1884    3.6477    0.0000 H   0  0  0

+   -0.5920    3.8826    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+  6 10  2  0

+  2 15  1  0

+  7 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88-99-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.1754    0.7808    0.0575 C   0  0  0

+    0.5429   -0.5754   -0.0291 C   0  0  0

+    1.1647    1.7594    0.1078 C   0  0  0

+   -1.2521    1.1640    0.0887 C   0  0  0

+    1.8911   -0.9217   -0.0634 C   0  0  0

+   -0.4963   -1.6256   -0.0827 C   0  0  0

+    2.4980    1.3966    0.0726 C   0  0  0

+   -1.7915    1.8372   -0.9459 O   0  0  0

+   -1.9385    0.8718    1.0471 O   0  0  0

+    2.8592    0.0637   -0.0125 C   0  0  0

+   -0.1435   -2.9250   -0.0424 O   0  0  0

+   -1.6682   -1.3167   -0.1632 O   0  0  0

+    0.9012    2.7615    0.0000 H   0  0  0

+    2.1689   -1.9200    0.0000 H   0  0  0

+    3.2311    2.1289    0.0000 H   0  0  0

+   -2.4394    2.6458    0.0000 H   0  0  0

+    3.8616   -0.1986    0.0000 H   0  0  0

+    0.1280   -3.9250    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  6 12  2  0

+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81-63-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.9379    0.7402    0.0117 C   0  0  0

+   -0.9373   -0.7407   -0.0091 C   0  0  0

+    0.2877    1.4458   -0.0695 C   0  0  0

+   -2.1279    1.4134    0.1684 C   0  0  0

+    0.2884   -1.4454    0.0765 C   0  0  0

+   -2.1261   -1.4145   -0.1718 C   0  0  0

+    1.5619    0.7028   -0.0413 C   0  0  0

+    0.2895    2.6612   -0.1625 O   0  0  0

+   -3.4065    0.6506    0.3904 C   0  0  0

+   -2.1487    2.7730    0.1229 N   0  0  0

+    1.5623   -0.7022    0.0425 C   0  0  0

+    0.2906   -2.6601    0.1782 O   0  0  0

+   -3.4035   -0.6520   -0.4021 C   0  0  0

+   -2.1471   -2.7739   -0.1238 N   0  0  0

+    2.7745    1.3900   -0.0976 C   0  0  0

+    2.7753   -1.3892    0.0928 C   0  0  0

+    3.9637    0.6915   -0.0546 C   0  0  0

+    3.9641   -0.6907    0.0439 C   0  0  0

+   -3.7726    1.6251    0.0000 H   0  0  0

+   -4.4305    0.4634    0.0000 H   0  0  0

+   -1.2552    3.3072    0.0000 H   0  0  0

+   -3.0581    3.2796    0.0000 H   0  0  0

+   -4.4281   -0.4678    0.0000 H   0  0  0

+   -3.7683   -1.6270    0.0000 H   0  0  0

+   -3.0566   -3.2804    0.0000 H   0  0  0

+   -1.2537   -3.3083    0.0000 H   0  0  0

+    2.7826    2.4310    0.0000 H   0  0  0

+    2.7836   -2.4302    0.0000 H   0  0  0

+    4.8671    1.2088    0.0000 H   0  0  0

+    4.8677   -1.2076    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

+ 11 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+  7 11  1  0

+  9 13  1  0

+ 17 18  2  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1192-62-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.0206    0.0354   -0.0013 C   0  0  0

+   -1.3922    0.0038   -0.0004 C   0  0  0

+    0.8093    1.1687   -0.0001 C   0  0  0

+    0.8407   -1.0372    0.0024 O   0  0  0

+   -2.1163   -1.3178   -0.0020 C   0  0  0

+   -2.0228    1.0416    0.0016 O   0  0  0

+    2.1395    0.7283   -0.0016 C   0  0  0

+    2.1138   -0.6243    0.0001 C   0  0  0

+    0.4853    2.1413    0.0000 H   0  0  0

+   -3.0153   -0.8252    0.0000 H   0  0  0

+   -2.6089   -2.2168    0.0000 H   0  0  0

+   -1.2173   -1.8104    0.0000 H   0  0  0

+    2.9762    1.3206    0.0000 H   0  0  0

+    2.9372   -1.2349    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  7  8  2  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+  5 12  1  0

+  7 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+684-93-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.2211   -0.2579   -0.0012 N   0  0  0

+   -1.0672    0.1380   -0.0003 C   0  0  0

+    1.1658    0.6204    0.0000 N   0  0  0

+    0.5486   -1.6859    0.0026 C   0  0  0

+   -1.3685    1.4516    0.0018 N   0  0  0

+   -1.9569   -0.6893   -0.0014 O   0  0  0

+    2.3301    0.2626   -0.0008 O   0  0  0

+   -0.4155   -1.9070    0.0000 H   0  0  0

+    0.7697   -2.6500    0.0000 H   0  0  0

+    1.5127   -1.4648    0.0000 H   0  0  0

+   -0.6442    2.1251    0.0000 H   0  0  0

+   -2.3140    1.7421    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+202-98-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+   -0.3363   -0.2437   -0.0003 C   0  0  0

+   -1.7528   -0.0583   -0.0009 C   0  0  0

+    0.5236    0.8498    0.0017 C   0  0  0

+   -0.0081   -1.5963    0.0039 C   0  0  0

+   -2.4186   -1.2698   -0.0041 C   0  0  0

+   -2.3111    1.2236    0.0016 C   0  0  0

+    1.9421    0.5049   -0.0002 C   0  0  0

+   -0.0569    2.1285    0.0052 C   0  0  0

+   -1.3369   -2.3282    0.0053 C   0  0  0

+    1.3075   -1.9015    0.0049 C   0  0  0

+   -3.7764   -1.1842   -0.0060 C   0  0  0

+   -1.4141    2.3114    0.0046 C   0  0  0

+   -3.7115    1.2613   -0.0003 C   0  0  0

+    2.2878   -0.8737   -0.0002 C   0  0  0

+    2.9437    1.4756   -0.0033 C   0  0  0

+   -4.3916    0.0711   -0.0045 C   0  0  0

+    3.6506   -1.2205   -0.0002 C   0  0  0

+    4.2553    1.0983   -0.0048 C   0  0  0

+    4.6036   -0.2484   -0.0026 C   0  0  0

+    0.5686    2.9699    0.0000 H   0  0  0

+   -2.1397   -3.0026    0.0000 H   0  0  0

+   -0.7440   -3.1929    0.0000 H   0  0  0

+    1.6079   -2.9060    0.0000 H   0  0  0

+   -4.3589   -2.0560    0.0000 H   0  0  0

+   -1.7968    3.2875    0.0000 H   0  0  0

+   -4.2255    2.1751    0.0000 H   0  0  0

+    2.6896    2.4928    0.0000 H   0  0  0

+   -5.4395    0.1044    0.0000 H   0  0  0

+    3.9334   -2.2301    0.0000 H   0  0  0

+    5.0066    1.8296    0.0000 H   0  0  0

+    5.6165   -0.5191    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  6 12  1  0

+  6 13  1  0

+  7 14  2  0

+  7 15  1  0

+ 11 16  1  0

+ 14 17  1  0

+ 15 18  2  0

+ 17 19  2  0

+  5  9  1  0

+  8 12  2  0

+ 10 14  1  0

+ 13 16  2  0

+ 18 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-04-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -1.0999    0.4418   -0.3583 C   0  0  0

+   -0.5463   -0.8104   -0.5922 C   0  0  0

+   -0.2835    1.4983    0.0226 C   0  0  0

+   -2.4766    0.6395   -0.5120 N   0  0  0

+    0.8135   -1.0009   -0.4452 C   0  0  0

+    1.0759    1.3012    0.1679 C   0  0  0

+   -3.3483   -0.1402    0.1579 C   0  0  0

+    1.6239    0.0535   -0.0656 C   0  0  0

+   -4.8271   -0.0139   -0.1034 C   0  0  0

+   -2.9425   -0.9436    0.9709 O   0  0  0

+    3.0811   -0.1542    0.0910 N   0  3  0

+    3.7960    0.7735    0.4252 O   0  0  0

+    3.5652   -1.2528   -0.1144 O   0  5  0

+   -1.1623   -1.6260    0.0000 H   0  0  0

+   -0.6668    2.4457    0.0000 H   0  0  0

+   -2.7723    1.6178    0.0000 H   0  0  0

+    1.2003   -1.9469    0.0000 H   0  0  0

+    1.6948    2.1146    0.0000 H   0  0  0

+   -4.7401    1.0044    0.0000 H   0  0  0

+   -5.8454    0.0731    0.0000 H   0  0  0

+   -4.9141   -1.0322    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  7 10  2  0

+  8 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  6  8  2  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71400-34-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.1777    0.1326   -0.0060 C   0  0  0

+   -1.1777   -1.2588   -0.0032 C   0  0  0

+    0.0000    0.8131   -0.0054 O   0  0  0

+   -2.3785    0.8227   -0.0038 C   0  0  0

+    0.0000   -1.9393    0.0003 O   0  0  0

+   -2.3785   -1.9489   -0.0033 C   0  0  0

+    1.1777    0.1327   -0.0019 C   0  0  0

+   -3.5747    0.1279    0.0014 C   0  0  0

+    1.1777   -1.2588    0.0009 C   0  0  0

+   -3.5747   -1.2542   -0.0064 C   0  0  0

+    2.3785    0.8227   -0.0017 C   0  0  0

+   -4.8576    0.8664    0.0038 N   0  3  0

+    2.3785   -1.9488    0.0040 C   0  0  0

+    3.5747    0.1279    0.0014 C   0  0  0

+   -5.9116    0.2561    0.0083 O   0  0  0

+   -4.8591    2.0844    0.0013 O   0  5  0

+    3.5746   -1.2541    0.0042 C   0  0  0

+    4.8576    0.8664    0.0011 N   0  3  0

+    5.9116    0.2560    0.0038 O   0  0  0

+    4.8592    2.0844   -0.0018 O   0  5  0

+   -2.3809    1.8601    0.0000 H   0  0  0

+   -2.3809   -2.9863    0.0000 H   0  0  0

+   -4.4738   -1.7718    0.0000 H   0  0  0

+    2.3809    1.8601    0.0000 H   0  0  0

+    2.3809   -2.9862    0.0000 H   0  0  0

+    4.4737   -1.7717    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 11 14  2  0

+ 12 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+ 14 18  1  0

+ 18 19  2  0

+ 18 20  1  0

+  7  9  2  0

+  8 10  1  0

+ 14 17  1  0

+  4 21  1  0

+  6 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+56602-33-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+    1.6729    0.1209   -0.0203 P   0  3  0

+    0.3367    1.0002   -0.2034 O   0  0  0

+    1.8486   -0.3020    1.5992 N   0  0  0

+    1.5591   -1.2739   -0.9552 N   0  0  0

+    3.0077    1.0195   -0.5135 N   0  0  0

+   -0.7585    0.1111   -0.0802 N   0  0  0

+    0.8919    0.5169    2.3556 C   0  0  0

+    1.4011   -1.6958    1.7225 C   0  0  0

+    0.8877   -0.8911   -2.2045 C   0  0  0

+    2.9318   -1.6552   -1.3133 C   0  0  0

+    2.5238    2.3795   -0.7857 C   0  0  0

+    3.9043    1.1147    0.6463 C   0  0  0

+   -2.0925    0.4423   -0.0937 C   0  0  0

+   -0.6956   -1.2819    0.0735 N   0  0  0

+   -2.7955   -0.7661    0.0529 C   0  0  0

+   -2.7899    1.6396   -0.2141 C   0  0  0

+   -1.8883   -1.7585    0.1473 N   0  0  0

+   -4.1965   -0.7429    0.0752 C   0  0  0

+   -4.1563    1.6354   -0.1894 C   0  0  0

+   -4.8569    0.4447   -0.0448 C   0  0  0

+    1.5677    1.3064    0.0000 H   0  0  0

+    0.1024    1.1927    0.0000 H   0  0  0

+    0.2161   -0.2726    0.0000 H   0  0  0

+    0.4116   -1.3781    0.0000 H   0  0  0

+    1.0834   -2.6853    0.0000 H   0  0  0

+    2.3906   -2.0135    0.0000 H   0  0  0

+    1.4024    0.0117    0.0000 H   0  0  0

+   -0.0151   -0.3764    0.0000 H   0  0  0

+    0.3730   -1.7939    0.0000 H   0  0  0

+    2.6537   -2.6565    0.0000 H   0  0  0

+    3.9331   -1.9333    0.0000 H   0  0  0

+    3.2099   -0.6539    0.0000 H   0  0  0

+    3.5029    2.7279    0.0000 H   0  0  0

+    2.1754    3.3586    0.0000 H   0  0  0

+    1.5447    2.0311    0.0000 H   0  0  0

+    4.0140    0.0813    0.0000 H   0  0  0

+    4.9377    1.2244    0.0000 H   0  0  0

+    3.7946    2.1481    0.0000 H   0  0  0

+   -2.2734    2.5414    0.0000 H   0  0  0

+   -4.7307   -1.6343    0.0000 H   0  0  0

+   -4.6736    2.5367    0.0000 H   0  0  0

+   -5.8960    0.4573    0.0000 H   0  0  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+ 13 15  2  0

+ 13 16  1  0

+ 14 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 18 20  2  0

+ 15 17  1  0

+ 19 20  1  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  7 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  8 26  1  0

+  9 27  1  0

+  9 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 10 32  1  0

+ 11 33  1  0

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+ 11 35  1  0

+ 12 36  1  0

+ 12 37  1  0

+ 12 38  1  0

+ 16 39  1  0

+ 18 40  1  0

+ 19 41  1  0

+ 20 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+126-98-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.5801   -0.0592   -0.0016 C   0  0  0

+   -0.8500    0.0138   -0.0004 C   0  0  0

+    1.3992    1.2057    0.0007 C   0  0  0

+    1.1858   -1.2439    0.0008 C   0  0  0

+   -1.9845    0.0717    0.0005 N   0  0  0

+    2.2687    0.6426    0.0000 H   0  0  0

+    1.9623    2.0752    0.0000 H   0  0  0

+    0.5297    1.7688    0.0000 H   0  0  0

+    0.6228   -2.1135    0.0000 H   0  0  0

+    2.2204   -1.2967    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  3  0

+  3  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67-21-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    1.6005   -0.4025   -0.5158 C   0  0  1

+    0.3947    0.2960    0.1159 C   0  0  0

+    2.8707    0.2242   -0.0010 C   0  0  0

+    1.5804   -1.8285   -0.1633 N   0  0  0

+   -0.8948   -0.3403   -0.4067 C   0  0  0

+    3.4169    1.2643   -0.6504 O   0  0  0

+    3.3973   -0.2095    0.9962 O   0  0  0

+   -2.3244    0.4879    0.3422 S   0  0  0

+   -3.6719   -0.4447   -0.4356 C   0  0  0

+   -5.0161    0.0927    0.0595 C   0  0  0

+    1.6362    0.6665    0.0000 H   0  0  0

+    1.1007    1.0995    0.0000 H   0  0  0

+   -0.2562    1.1448    0.0000 H   0  0  0

+    0.6466   -2.3502    0.0000 H   0  0  0

+    2.4991   -2.3763    0.0000 H   0  0  0

+   -1.6008   -1.1438    0.0000 H   0  0  0

+   -0.2439   -1.1891    0.0000 H   0  0  0

+    3.9142    2.2113    0.0000 H   0  0  0

+   -4.2539   -1.3421    0.0000 H   0  0  0

+   -2.9043   -1.1896    0.0000 H   0  0  0

+   -4.6190    1.0859    0.0000 H   0  0  0

+   -6.0093    0.4898    0.0000 H   0  0  0

+   -5.4132   -0.9005    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  8  9  1  0

+  9 10  1  0

+  1 11  1  0

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+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1596-84-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    0.7284   -0.2225   -0.0156 C   0  0  0

+   -0.6098    0.4701    0.0076 C   0  0  0

+    1.8635    0.5039    0.0018 N   0  0  0

+    0.7839   -1.4337   -0.0449 O   0  0  0

+   -1.7260   -0.5760   -0.0188 C   0  0  0

+    3.0765   -0.1239   -0.0193 N   0  0  0

+   -3.0642    0.1166    0.0044 C   0  0  0

+    3.8306    0.4521   -1.1407 C   0  0  0

+    3.7783    0.2722    1.2090 C   0  0  0

+   -4.1947   -0.6068   -0.0129 O   0  0  0

+   -3.1195    1.3231    0.0386 O   0  0  0

+   -0.0478    1.3077    0.0000 H   0  0  0

+   -1.3784    1.1233    0.0000 H   0  0  0

+    1.8173    1.5115    0.0000 H   0  0  0

+   -2.2880   -1.4136    0.0000 H   0  0  0

+   -0.9574   -1.2292    0.0000 H   0  0  0

+    4.4429   -0.3495    0.0000 H   0  0  0

+    4.6322    1.0644    0.0000 H   0  0  0

+    3.2183    1.2537    0.0000 H   0  0  0

+    4.2741   -0.6062    0.0000 H   0  0  0

+    4.6567    0.7680    0.0000 H   0  0  0

+    3.2825    1.1506    0.0000 H   0  0  0

+   -5.0443   -1.1505    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  5 15  1  0

+  5 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1646-75-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.3652   -0.7191    0.0000 C   0  0  0

+   -1.1418   -0.7157    0.0000 C   0  0  0

+    0.9737    0.9898    0.0000 S   0  0  0

+    0.8736   -1.4415    1.2493 C   0  0  0

+    0.8736   -1.4415   -1.2492 C   0  0  0

+   -1.7791    0.3938    0.0000 N   0  0  0

+    2.7623    0.6873    0.0000 C   0  0  0

+   -3.1951    0.3970    0.0000 O   0  0  0

+   -1.6749   -1.6342    0.0000 H   0  0  0

+    0.0051   -2.0527    0.0000 H   0  0  0

+    1.4848   -2.3100    0.0000 H   0  0  0

+    1.7421   -0.8303    0.0000 H   0  0  0

+    0.0051   -2.0527    0.0000 H   0  0  0

+    1.4848   -2.3100    0.0000 H   0  0  0

+    1.7421   -0.8303    0.0000 H   0  0  0

+    2.5852   -0.3598    0.0000 H   0  0  0

+    3.8094    0.5102    0.0000 H   0  0  0

+    2.9394    1.7344    0.0000 H   0  0  0

+   -4.2571    0.3994    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  3  7  1  0

+  6  8  1  0

+  2  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104775-36-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 53                          1 V2000

+   -6.9808   -0.5143   -0.4056 C   0  0  0

+   -6.4044   -0.1836    0.8175 C   0  0  0

+   -6.3250   -0.1996   -1.5845 C   0  0  0

+   -8.1825   -1.1499   -0.4430 O   0  0  0

+   -5.1775    0.4587    0.8504 C   0  0  0

+   -7.0444   -0.4901    1.9776 O   0  0  0

+   -5.1005    0.4417   -1.5446 C   0  0  0

+   -8.5021   -1.3482   -1.8216 C   0  0  0

+   -4.5282    0.7700   -0.3302 C   0  0  0

+   -6.2114   -0.0291    3.0432 C   0  0  0

+   -3.1935    1.4689   -0.2925 C   0  0  0

+   -2.0736    0.4273   -0.2492 C   0  0  0

+   -0.7761    1.1067   -0.2125 N   0  0  0

+    0.3614    0.3851   -0.1710 C   0  0  0

+    1.6961    1.0839   -0.1333 C   0  0  0

+    0.3110   -0.8267   -0.1639 O   0  0  0

+    2.7684    0.0866   -0.0918 N   0  0  0

+    4.1032    0.4974   -0.0521 C   0  0  0

+    5.1181   -0.4463   -0.0128 C   0  0  0

+    4.4141    1.8524   -0.0576 C   0  0  0

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+    9.9009   -1.6181    0.1497 C   0  0  0

+   -5.8603   -1.1260    0.0000 H   0  0  0

+   -5.6419    1.3852    0.0000 H   0  0  0

+   -4.6021   -0.4670    0.0000 H   0  0  0

+   -9.0485   -0.4676    0.0000 H   0  0  0

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+   -7.9557   -2.2288    0.0000 H   0  0  0

+   -5.7096   -0.9359    0.0000 H   0  0  0

+   -5.3046    0.4727    0.0000 H   0  0  0

+   -6.7132    0.8777    0.0000 H   0  0  0

+   -2.4066    2.1433    0.0000 H   0  0  0

+   -3.7748    2.3269    0.0000 H   0  0  0

+   -2.8605   -0.2471    0.0000 H   0  0  0

+   -1.4923   -0.4307    0.0000 H   0  0  0

+   -0.7331    2.1422    0.0000 H   0  0  0

+    2.4831    1.7583    0.0000 H   0  0  0

+    1.1148    1.9419    0.0000 H   0  0  0

+    2.5369   -0.9236    0.0000 H   0  0  0

+    4.8886   -1.4570    0.0000 H   0  0  0

+    3.6537    2.5566    0.0000 H   0  0  0

+    5.9586    3.2751    0.0000 H   0  0  0

+    7.7386    1.6442    0.0000 H   0  0  0

+    9.0481    0.3843    0.0000 H   0  0  0

+    9.1996   -2.3812    0.0000 H   0  0  0

+   10.6640   -2.3194    0.0000 H   0  0  0

+   10.6022   -0.8550    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

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+ 20 22  2  0

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+  7  9  2  0

+ 22 23  1  0

+  3 28  1  0

+  5 29  1  0

+  7 30  1  0

+  8 31  1  0

+  8 32  1  0

+  8 33  1  0

+ 10 34  1  0

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+ 15 42  1  0

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+ 17 44  1  0

+ 19 45  1  0

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+ 22 47  1  0

+ 23 48  1  0

+ 25 49  1  0

+ 27 50  1  0

+ 27 51  1  0

+ 27 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88-14-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.1125    0.0633   -0.0013 C   0  0  0

+   -1.3522    0.0621   -0.0003 C   0  0  0

+    0.9146    1.1695   -0.0001 C   0  0  0

+    0.9065   -1.0277    0.0025 O   0  0  0

+   -2.0257   -1.1068   -0.0017 O   0  0  0

+   -1.9612    1.1148    0.0016 O   0  0  0

+    2.2393    0.7071   -0.0017 C   0  0  0

+    2.1894   -0.6437    0.0001 C   0  0  0

+    0.6116    2.1360    0.0000 H   0  0  0

+   -2.5314   -1.9844    0.0000 H   0  0  0

+    3.0758    1.2782    0.0000 H   0  0  0

+    2.9905   -1.2635    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  7  8  2  0

+  3  9  1  0

+  5 10  1  0

+  7 11  1  0

+  8 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-58-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.4569    0.6909    0.0024 C   0  0  0

+   -1.4569   -0.6909    0.0012 C   0  0  0

+   -0.1665    1.4207    0.0022 C   0  0  0

+   -2.6938    1.4124   -0.0023 C   0  0  0

+   -0.1665   -1.4207   -0.0001 C   0  0  0

+   -2.6938   -1.4124    0.0018 C   0  0  0

+    1.1039    0.6719    0.0009 C   0  0  0

+   -0.1556    2.6351    0.0028 O   0  0  0

+   -3.6751    1.9847   -0.0060 N   0  0  0

+    1.1039   -0.6719   -0.0002 C   0  0  0

+   -0.1557   -2.6351   -0.0006 O   0  0  0

+   -3.6751   -1.9847    0.0023 N   0  0  0

+    2.6113    1.5331    0.0002 Cl  0  0  0

+    2.6113   -1.5331   -0.0017 Cl  0  0  0

+  1  2  2  0

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+  5 10  1  0

+  5 11  2  0

+  6 12  3  0

+  7 13  1  0

+ 10 14  1  0

+  7 10  2  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+52101-40-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    0.7536    0.2854    0.0183 C   0  0  0

+   -0.7132    0.2849   -0.0218 C   0  0  0

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+   -1.6049   -0.9006   -0.0475 C   0  0  0

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+    2.5829   -1.0867   -0.9725 C   0  0  0

+    1.5705   -1.8086    1.0955 C   0  0  0

+   -2.4866    2.0806   -0.0684 N   0  3  0

+   -2.5353   -1.0981    0.9713 C   0  0  0

+   -1.5193   -1.8174   -1.0931 C   0  0  0

+    2.7120    3.4675    0.0769 O   0  0  0

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+    3.4164   -2.1860   -0.9403 C   0  0  0

+    2.4094   -2.9036    1.1163 C   0  0  0

+   -2.7140    3.2772   -0.0728 O   0  0  0

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+   -3.3625   -2.2022    0.9421 C   0  0  0

+   -2.3518   -2.9183   -1.1122 C   0  0  0

+    3.3287   -3.0939    0.0997 C   0  0  0

+   -3.2696   -3.1121   -0.0959 C   0  0  0

+    3.1232   -0.2324    0.0000 H   0  0  0

+    0.6000   -2.0912    0.0000 H   0  0  0

+   -3.0795   -0.2463    0.0000 H   0  0  0

+   -0.5471   -2.0940    0.0000 H   0  0  0

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+    1.8720   -3.7597    0.0000 H   0  0  0

+   -4.3365   -1.9320    0.0000 H   0  0  0

+   -1.8100   -3.7716    0.0000 H   0  0  0

+    3.9284   -3.9076    0.0000 H   0  0  0

+   -3.8655   -3.9286    0.0000 H   0  0  0

+  1  2  1  0

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+ 20 31  1  0

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+ 22 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+529-19-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.3967    0.3084    0.0030 C   0  0  0

+    0.2016   -0.9530    0.0010 C   0  0  0

+    0.4028    1.4534    0.0023 C   0  0  0

+   -1.8237    0.4276   -0.0002 C   0  0  0

+    1.5771   -1.0605   -0.0016 C   0  0  0

+   -0.6529   -2.1943    0.0012 C   0  0  0

+    1.7767    1.3314   -0.0003 C   0  0  0

+   -2.9558    0.5221   -0.0027 N   0  0  0

+    2.3631    0.0779   -0.0023 C   0  0  0

+   -0.0358    2.3941    0.0000 H   0  0  0

+    2.0232   -1.9977    0.0000 H   0  0  0

+   -1.5078   -1.6058    0.0000 H   0  0  0

+   -1.2414   -3.0492    0.0000 H   0  0  0

+    0.2020   -2.7828    0.0000 H   0  0  0

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+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58430-01-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+    0.9123    0.0995    0.0033 C   0  0  0

+    0.6034   -1.2854   -0.0004 C   0  0  0

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+   -1.0834   -3.1673   -0.0045 C   0  0  0

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+  1  2  2  0

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+ 21 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+11056-06-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+362372                          1 V2000

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+190358  1  0

+191359  1  0

+193360  1  0

+194361  1  0

+194362  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2922-54-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 13                          1 V2000

+   -0.2556   -1.0286    0.2775 C   0  0  0

+   -1.3214    0.0182    0.4757 C   0  0  0

+    0.9084   -0.9349    0.9393 O   0  0  0

+   -0.4508   -1.9549   -0.4733 O   0  0  0

+   -2.5375   -0.3223   -0.3880 C   0  0  0

+   -3.6033    0.7246   -0.1898 C   0  0  0

+   -3.4076    1.6598    0.5743 O   0  0  0

+   -4.6643    0.6392   -0.7931 O   0  0  0

+    9.3310    0.7289   -0.2637 Na  0  3  0

+   -0.6089    0.5275    0.0000 H   0  0  0

+   -1.6998    0.8080    0.0000 H   0  0  0

+    1.7814   -0.8646    0.0000 H   0  0  0

+   -3.2500   -0.8316    0.0000 H   0  0  0

+   -2.1591   -1.1122    0.0000 H   0  0  0

+   -5.5373    0.5689    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  6  7  2  0

+  6  8  1  0

+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  5 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2782-91-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -0.0034   -0.1161   -0.0036 C   0  0  0

+   -1.1419    0.5955   -0.1218 N   0  0  0

+    1.1772    0.5191    0.1345 N   0  0  0

+   -0.0577   -1.8272   -0.0219 S   0  0  0

+   -2.1922    0.4709    0.8919 C   0  0  0

+   -1.3290    1.4937   -1.2639 C   0  0  0

+    2.1895    0.4211   -0.9198 C   0  0  0

+    1.4481    1.3078    1.3391 C   0  0  0

+   -2.2857    1.2586    0.0000 H   0  0  0

+   -2.9799    0.3775    0.0000 H   0  0  0

+   -2.0987   -0.3168    0.0000 H   0  0  0

+   -0.5524    1.6555    0.0000 H   0  0  0

+   -1.4908    2.2703    0.0000 H   0  0  0

+   -2.1056    1.3319    0.0000 H   0  0  0

+    2.1131   -0.3685    0.0000 H   0  0  0

+    2.9791    0.3447    0.0000 H   0  0  0

+    2.2659    1.2107    0.0000 H   0  0  0

+    2.1983    1.0501    0.0000 H   0  0  0

+    1.7058    2.0580    0.0000 H   0  0  0

+    0.6979    1.5655    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109875-50-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.8316   -0.1111    0.0178 C   0  0  0

+   -0.6456   -0.0529    0.0083 C   0  0  0

+    1.5122    0.9913   -0.1845 N   0  0  0

+    1.4457   -1.3116    0.2428 N   0  0  0

+   -1.3835   -1.0765   -0.5878 C   0  0  0

+   -1.3086    1.0233    0.6007 C   0  0  0

+    2.8556    0.9855   -0.1845 C   0  0  0

+    2.8040   -1.3986    0.2578 C   0  0  0

+   -2.7620   -1.0163   -0.5928 C   0  0  0

+   -2.6870    1.0713    0.5888 C   0  0  0

+    3.5473   -0.2334    0.0381 C   0  0  0

+    3.7923    1.9177   -0.3563 N   0  0  0

+    3.4264   -2.5942    0.4819 N   0  0  0

+   -3.4126    0.0557   -0.0086 C   0  0  0

+    4.8576    0.0585   -0.0169 N   0  0  0

+    4.9844    1.3469   -0.2530 C   0  0  0

+   -4.8917    0.1140   -0.0181 N   0  3  0

+   -5.4673    1.0565    0.4955 O   0  0  0

+   -5.5331   -0.7806   -0.5394 O   0  5  0

+    0.8931   -2.1532    0.0000 H   0  0  0

+   -0.9444   -1.9825    0.0000 H   0  0  0

+   -0.8025    1.8936    0.0000 H   0  0  0

+   -3.2749   -1.8827    0.0000 H   0  0  0

+   -3.1320    1.9744    0.0000 H   0  0  0

+    2.8854   -3.4433    0.0000 H   0  0  0

+    4.4323   -2.6381    0.0000 H   0  0  0

+    5.8616    1.8411    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  8 11  2  0

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+ 15 16  2  0

+  4 20  1  0

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+  6 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5221-17-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+   -0.6594    0.8778   -0.4862 C   0  0  0

+   -1.8038    1.8218   -0.2212 C   0  0  0

+    0.5529    1.2997    0.3466 C   0  0  0

+   -1.1896   -0.9498    0.0075 Br  0  0  0

+   -2.8424    1.4004    0.2284 O   0  0  0

+    2.0459    0.0682    0.0010 Br  0  0  0

+    0.1477    0.1120    0.0000 H   0  0  0

+   -1.6352    2.9216    0.0000 H   0  0  0

+    1.4046    2.0156    0.0000 H   0  0  0

+    0.0030    2.2669    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+602-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.0002   -0.7172   -0.0025 C   0  0  0

+   -1.2046   -0.0160   -0.0013 C   0  0  0

+    1.2042   -0.0158   -0.0015 C   0  0  0

+    0.0005   -2.1989    0.0014 N   0  3  0

+   -1.2047    1.4506    0.0009 C   0  0  0

+   -2.4423   -0.6940   -0.0027 C   0  0  0

+    1.2040    1.4509    0.0007 C   0  0  0

+    2.4425   -0.6936   -0.0031 C   0  0  0

+   -0.0021   -2.8107   -1.0518 O   0  0  0

+    0.0032   -2.8051    1.0578 O   0  5  0

+   -0.0001    2.1521    0.0019 C   0  0  0

+   -2.4423    2.1288    0.0016 C   0  0  0

+   -3.5972    0.0200   -0.0019 C   0  0  0

+    2.4419    2.1294    0.0012 C   0  0  0

+    3.5969    0.0205   -0.0026 C   0  0  0

+   -3.5972    1.4149    0.0002 C   0  0  0

+    3.5966    1.4159   -0.0005 C   0  0  0

+   -2.4698   -1.7391    0.0000 H   0  0  0

+    2.4703   -1.7387    0.0000 H   0  0  0

+   -0.0001    3.1976    0.0000 H   0  0  0

+   -2.4697    3.1739    0.0000 H   0  0  0

+   -4.5104   -0.4891    0.0000 H   0  0  0

+    2.4691    3.1745    0.0000 H   0  0  0

+    4.5102   -0.4883    0.0000 H   0  0  0

+   -4.5104    1.9240    0.0000 H   0  0  0

+    4.5097    1.9252    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-69-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    0.2555   -0.0001   -0.0019 C   0  0  0

+   -1.2281    0.0002   -0.0019 C   0  0  0

+    0.9539    1.1344   -0.4108 C   0  0  0

+    0.9536   -1.1333    0.4126 C   0  0  0

+   -1.9276   -1.1328   -0.4123 C   0  0  0

+   -1.9273    1.1318    0.4141 C   0  0  0

+    2.3331    1.1313   -0.4093 C   0  0  0

+    2.3324   -1.1305    0.4120 C   0  0  0

+   -3.3080   -1.1269   -0.4103 C   0  0  0

+   -3.3073    1.1266    0.4120 C   0  0  0

+    3.0256   -0.0004   -0.0010 C   0  0  0

+   -3.9966    0.0008   -0.0020 C   0  0  0

+    4.3843   -0.0007   -0.0010 O   0  0  0

+    0.4677    2.0070    0.0000 H   0  0  0

+    0.4674   -2.0059    0.0000 H   0  0  0

+   -1.4428   -2.0062    0.0000 H   0  0  0

+   -1.4425    2.0052    0.0000 H   0  0  0

+    2.8225    2.0021    0.0000 H   0  0  0

+    2.8212   -2.0017    0.0000 H   0  0  0

+   -3.7986   -1.9970    0.0000 H   0  0  0

+   -3.7972    1.9971    0.0000 H   0  0  0

+   -4.9955    0.0014    0.0000 H   0  0  0

+    5.3832   -0.0009    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  3 14  1  0

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+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+695-99-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -2.1580   -0.9845   -0.0004 Cl  0  0  0

+   -0.5655   -0.2935   -0.0019 C   0  0  0

+   -0.3964    1.1758    0.0000 C   0  0  0

+    0.5131   -1.0922    0.0007 C   0  0  0

+   -1.3714    1.8996    0.0027 O   0  0  0

+    0.9592    1.7623   -0.0008 C   0  0  0

+    1.8658   -0.5047   -0.0001 C   0  0  0

+    2.0348    0.9633   -0.0033 C   0  0  0

+    2.8417   -1.2279    0.0022 O   0  0  0

+    0.3875   -2.1911    0.0000 H   0  0  0

+    1.0864    2.8610    0.0000 H   0  0  0

+    3.0498    1.4028    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  2  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  6  2  0

+  9  7  2  0

+  7  8  1  0

+  4 10  1  0

+  6 11  1  0

+  8 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-57-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.8454    0.2585   -0.0009 C   0  0  0

+   -0.5882    0.5846    0.0000 C   0  0  0

+    1.7998    1.2822    0.0004 C   0  0  0

+    1.2630   -1.0769    0.0028 C   0  0  0

+   -1.5082   -0.4083   -0.0012 C   0  0  0

+    3.1419    0.9679   -0.0005 C   0  0  0

+    2.6094   -1.3742    0.0019 C   0  0  0

+   -2.8833   -0.0955   -0.0003 C   0  0  0

+    3.5468   -0.3560   -0.0027 C   0  0  0

+   -3.9075   -1.2009   -0.0017 C   0  0  0

+   -3.2420    1.0647    0.0015 O   0  0  0

+   -0.8950    1.5766    0.0000 H   0  0  0

+    1.4977    2.2756    0.0000 H   0  0  0

+    0.5609   -1.8419    0.0000 H   0  0  0

+   -1.2014   -1.4003    0.0000 H   0  0  0

+    3.8512    1.7262    0.0000 H   0  0  0

+    2.9209   -2.3647    0.0000 H   0  0  0

+    4.5593   -0.5863    0.0000 H   0  0  0

+   -4.6691   -0.4952    0.0000 H   0  0  0

+   -4.6132   -1.9625    0.0000 H   0  0  0

+   -3.1459   -1.9066    0.0000 H   0  0  0

+  1  2  1  0

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+  4  7  1  0

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+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16757-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.3791   -0.3568   -0.0014 C   0  0  0

+   -1.7460   -0.0269   -0.0011 C   0  0  0

+    0.5867    0.6653   -0.0002 C   0  0  0

+    0.0284   -1.7626    0.0032 C   0  0  0

+   -2.1326    1.3332   -0.0001 C   0  0  0

+   -2.7221   -1.0481   -0.0023 C   0  0  0

+    1.9987    0.2878   -0.0005 C   0  0  0

+    0.1775    2.0120    0.0017 C   0  0  0

+    1.3747   -2.0873    0.0025 C   0  0  0

+   -1.0072   -2.7964    0.0079 C   0  0  0

+   -1.1394    2.3380    0.0001 C   0  0  0

+   -3.4964    1.6499    0.0002 C   0  0  0

+   -2.3128   -2.4503   -0.0034 C   0  0  0

+   -4.0719   -0.6902   -0.0020 C   0  0  0

+    2.3572   -1.0837   -0.0020 C   0  0  0

+    3.0022    1.2645    0.0002 C   0  0  0

+    1.2149    3.1051    0.0030 C   0  0  0

+   -4.4393    0.6432   -0.0006 C   0  0  0

+    3.7228   -1.4314   -0.0027 C   0  0  0

+    4.3129    0.8905   -0.0005 C   0  0  0

+    4.6706   -0.4555   -0.0020 C   0  0  0

+    1.6658   -3.1009    0.0000 H   0  0  0

+   -0.7333   -3.8148    0.0000 H   0  0  0

+   -1.4250    3.3532    0.0000 H   0  0  0

+   -3.8030    2.6590    0.0000 H   0  0  0

+   -3.0492   -3.2052    0.0000 H   0  0  0

+   -4.8140   -1.4395    0.0000 H   0  0  0

+    2.7444    2.2871    0.0000 H   0  0  0

+    1.9799    2.3791    0.0000 H   0  0  0

+    1.9409    3.8701    0.0000 H   0  0  0

+    0.4499    3.8311    0.0000 H   0  0  0

+   -5.4632    0.8958    0.0000 H   0  0  0

+    4.0095   -2.4463    0.0000 H   0  0  0

+    5.0654    1.6294    0.0000 H   0  0  0

+    5.6910   -0.7221    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+  8 11  2  0

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+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+27758-60-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -0.0001   -1.2717    0.0101 N   0  0  0

+    1.2095   -0.5725    0.0065 C   0  0  0

+   -1.2104   -0.5737    0.0031 C   0  0  0

+    0.0006   -2.6376    0.0149 N   0  0  0

+    1.7938   -0.1861    1.2059 C   0  0  0

+    1.8335   -0.2670   -1.1968 C   0  0  0

+   -1.8281   -0.2388    1.2018 C   0  0  0

+   -1.7962   -0.2081   -1.2022 C   0  0  0

+    2.9899    0.5045    1.1986 C   0  0  0

+    3.0291    0.4237   -1.1968 C   0  0  0

+   -3.0242    0.4510    1.1912 C   0  0  0

+   -2.9927    0.4817   -1.2055 C   0  0  0

+    3.6056    0.8114   -0.0008 C   0  0  0

+   -3.6075    0.8084   -0.0109 C   0  0  0

+    4.9106    1.5651   -0.0048 C   0  0  0

+   -4.9133    1.5608   -0.0185 C   0  0  0

+   -0.8863   -3.1503    0.0000 H   0  0  0

+    0.8880   -3.1494    0.0000 H   0  0  0

+    1.2549    0.6851    0.0000 H   0  0  0

+    2.3152   -1.1711    0.0000 H   0  0  0

+   -2.3282   -1.1329    0.0000 H   0  0  0

+   -1.2691    0.6703    0.0000 H   0  0  0

+    2.5051    1.4069    0.0000 H   0  0  0

+    3.5715   -0.4454    0.0000 H   0  0  0

+   -3.5477   -0.4295    0.0000 H   0  0  0

+   -2.4964    1.3779    0.0000 H   0  0  0

+    5.4229    0.6780    0.0000 H   0  0  0

+    5.7977    2.0774    0.0000 H   0  0  0

+    4.3983    2.4522    0.0000 H   0  0  0

+   -4.4019    2.4484    0.0000 H   0  0  0

+   -5.8009    2.0722    0.0000 H   0  0  0

+   -5.4247    0.6732    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  8 12  1  0

+  9 13  2  0

+ 11 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+ 10 13  1  0

+ 12 14  2  0

+  4 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-40-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 40                          1 V2000

+    2.6691   -0.6593   -0.0123 C   0  0  0

+    3.2894   -0.3790    1.1914 C   0  0  0

+    3.2918   -0.3397   -1.2045 C   0  0  0

+    1.3147   -1.3199   -0.0246 C   0  0  0

+    4.5333    0.2213    1.2053 C   0  0  0

+    4.5361    0.2608   -1.1960 C   0  0  0

+    0.2238   -0.2472   -0.0046 C   0  0  0

+    5.1604    0.5431    0.0101 C   0  0  0

+   -1.1512   -0.9180   -0.0171 C   0  0  0

+    6.3845    1.1333    0.0211 O   0  0  0

+   -2.2421    0.1547    0.0028 C   0  0  0

+   -3.6172   -0.5160   -0.0097 C   0  0  0

+   -4.7080    0.5567    0.0103 C   0  0  0

+   -6.0831   -0.1140   -0.0022 C   0  0  0

+   -7.1739    0.9587    0.0177 C   0  0  0

+   -8.5490    0.2879    0.0052 C   0  0  0

+    3.7714   -1.4108    0.0000 H   0  0  0

+    2.7843    0.6798    0.0000 H   0  0  0

+    0.4295   -2.0364    0.0000 H   0  0  0

+    1.9265   -2.2804    0.0000 H   0  0  0

+    5.0408   -0.7982    0.0000 H   0  0  0

+    4.0540    1.2925    0.0000 H   0  0  0

+    1.1089    0.4693    0.0000 H   0  0  0

+   -0.3880    0.7133    0.0000 H   0  0  0

+   -2.0363   -1.6345    0.0000 H   0  0  0

+   -0.5394   -1.8785    0.0000 H   0  0  0

+    7.4103    1.6279    0.0000 H   0  0  0

+   -1.3569    0.8712    0.0000 H   0  0  0

+   -2.8539    1.1152    0.0000 H   0  0  0

+   -4.5024   -1.2325    0.0000 H   0  0  0

+   -3.0054   -1.4765    0.0000 H   0  0  0

+   -3.8228    1.2732    0.0000 H   0  0  0

+   -5.3198    1.5172    0.0000 H   0  0  0

+   -6.9683   -0.8305    0.0000 H   0  0  0

+   -5.4713   -1.0745    0.0000 H   0  0  0

+   -6.2887    1.6752    0.0000 H   0  0  0

+   -7.7857    1.9192    0.0000 H   0  0  0

+   -9.0483    1.3114    0.0000 H   0  0  0

+   -9.5725   -0.2114    0.0000 H   0  0  0

+   -8.0497   -0.7356    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+  6  8  2  0

+  2 17  1  0

+  3 18  1  0

+  4 19  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+  7 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 14 34  1  0

+ 14 35  1  0

+ 15 36  1  0

+ 15 37  1  0

+ 16 38  1  0

+ 16 39  1  0

+ 16 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+83621-06-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 50                          1 V2000

+   -2.7661    2.4054    0.2178 C   0  0  0

+   -3.8190    1.3702    0.1530 C   0  0  0

+   -2.3494    3.0560   -0.9463 C   0  0  0

+   -2.1881    2.7413    1.4429 C   0  0  0

+   -5.1051    1.7143    0.2902 C   0  0  0

+   -3.4809    0.0678   -0.0460 O   0  0  0

+   -1.3659    4.0222   -0.8786 C   0  0  0

+   -3.0662    2.6497   -2.4743 Cl  0  0  0

+   -1.2061    3.7088    1.4972 C   0  0  0

+   -6.0905    0.7267    0.3386 N   0  0  0

+   -5.4894    3.1679    0.3924 C   0  0  0

+   -3.1017   -0.4596    1.2269 C   0  0  0

+   -0.7932    4.3466    0.3397 C   0  0  0

+   -6.7624    0.3002    1.4545 C   0  0  0

+   -6.5685    0.0113   -0.7121 C   0  0  0

+   -2.5902   -1.8911    1.0538 C   0  0  0

+    0.4436    5.5624    0.4169 Cl  0  0  0

+   -7.6184   -0.6592    1.0518 C   0  0  0

+   -7.4795   -0.8149   -0.2727 N   0  0  0

+   -1.4578   -1.8902    0.1821 O   0  0  0

+   -1.0496   -3.1815    0.0670 C   0  0  0

+    0.0442   -3.4961   -0.7265 C   0  0  0

+   -1.7224   -4.1858    0.7471 C   0  0  0

+    0.4579   -4.8089   -0.8418 C   0  0  0

+   -1.3057   -5.4978    0.6292 C   0  0  0

+   -0.2180   -5.8101   -0.1666 C   0  0  0

+    0.3034   -7.4594   -0.3136 Cl  0  0  0

+   16.4190    0.6690    0.0881 N   0  3  0

+   15.6710   -0.2774    0.2568 O   0  0  0

+   17.5396    0.4884   -0.3535 O   0  0  0

+   16.0444    1.7965    0.3563 O   0  5  0

+   -1.6380    2.0210    0.0000 H   0  0  0

+   -1.9115    4.7459    0.0000 H   0  0  0

+   -0.5035    3.1363    0.0000 H   0  0  0

+   -4.6132    3.3995    0.0000 H   0  0  0

+   -5.7210    4.0441    0.0000 H   0  0  0

+   -6.3656    2.9363    0.0000 H   0  0  0

+   -2.1988   -0.5384    0.0000 H   0  0  0

+   -2.6536    0.3282    0.0000 H   0  0  0

+   -7.3490    0.9911    0.0000 H   0  0  0

+   -5.8821   -0.5806    0.0000 H   0  0  0

+   -3.4728   -2.0969    0.0000 H   0  0  0

+   -2.4863   -2.7914    0.0000 H   0  0  0

+   -8.5247   -0.6592    0.0000 H   0  0  0

+    0.6769   -2.8472    0.0000 H   0  0  0

+   -2.6197   -4.0581    0.0000 H   0  0  0

+    1.3548   -4.9392    0.0000 H   0  0  0

+   -1.9375   -6.1475    0.0000 H   0  0  0

+   15.1090   -0.9884    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+ 10 14  1  0

+ 10 15  1  0

+ 12 16  1  0

+ 13 17  1  0

+ 14 18  2  0

+ 15 19  2  0

+ 16 20  1  0

+ 20 21  1  0

+ 21 22  1  0

+ 21 23  2  0

+ 22 24  2  0

+ 23 25  1  0

+ 24 26  1  0

+ 26 27  1  0

+ 28 29  1  0

+ 28 30  2  0

+ 28 31  1  0

+  9 13  2  0

+ 18 19  1  0

+ 25 26  2  0

+  4 32  1  0

+  7 33  1  0

+  9 34  1  0

+ 11 35  1  0

+ 11 36  1  0

+ 11 37  1  0

+ 12 38  1  0

+ 12 39  1  0

+ 14 40  1  0

+ 15 41  1  0

+ 16 42  1  0

+ 16 43  1  0

+ 18 44  1  0

+ 22 45  1  0

+ 23 46  1  0

+ 24 47  1  0

+ 25 48  1  0

+ 29 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14667-55-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.6653    0.7897    0.0019 C   0  0  0

+   -1.1054   -0.5223    0.0007 C   0  0  0

+    0.6297    1.0521    0.0016 N   0  0  0

+   -1.6630    1.9191   -0.0027 C   0  0  0

+   -0.2307   -1.5125   -0.0008 N   0  0  0

+   -2.5824   -0.8217    0.0006 C   0  0  0

+    1.5045    0.0616    0.0001 C   0  0  0

+    1.0646   -1.2500   -0.0011 C   0  0  0

+    2.9815    0.3608   -0.0003 C   0  0  0

+   -0.8854    2.6060    0.0000 H   0  0  0

+   -2.3499    2.6967    0.0000 H   0  0  0

+   -2.4406    1.2322    0.0000 H   0  0  0

+   -2.7885    0.1952    0.0000 H   0  0  0

+   -3.5993   -1.0278    0.0000 H   0  0  0

+   -2.3763   -1.8386    0.0000 H   0  0  0

+    1.7515   -2.0276    0.0000 H   0  0  0

+    3.1875   -0.6561    0.0000 H   0  0  0

+    3.9984    0.5668    0.0000 H   0  0  0

+    2.7755    1.3777    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  7  9  1  0

+  7  8  2  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+823-86-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -2.8632    0.4638   -0.0003 N   0  0  0

+   -3.7031   -0.6763   -0.0024 O   0  0  0

+   -1.4744    0.3085   -0.0005 C   0  0  0

+   -0.6495    1.4257    0.0015 C   0  0  0

+   -0.9164   -0.9637    0.0031 C   0  0  0

+    0.7229    1.2692    0.0013 C   0  0  0

+    0.4562   -1.1142    0.0028 C   0  0  0

+    1.2759    0.0010   -0.0009 C   0  0  0

+    3.0012   -0.1919   -0.0012 Cl  0  0  0

+   -3.2805    1.4181    0.0000 H   0  0  0

+   -4.3209   -1.5149    0.0000 H   0  0  0

+   -1.0653    2.3807    0.0000 H   0  0  0

+   -1.5328   -1.8033    0.0000 H   0  0  0

+    1.3420    2.1068    0.0000 H   0  0  0

+    0.8751   -2.0678    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

+  9  8  1  0

+  7  8  1  0

+  1 10  1  0

+  2 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+79455-30-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 38                          1 V2000

+    3.3394    0.2345   -0.0733 C   0  0  0

+    2.6430   -1.0205   -0.4278 C   0  0  0

+    4.6357    0.4855   -0.5394 C   0  0  0

+    2.7138    1.1913    0.7265 C   0  0  0

+    1.3953   -1.2505    0.0270 N   0  0  0

+    3.1957   -1.8449   -1.1295 O   0  0  0

+    5.2432    1.6751   -0.1789 C   0  0  0

+    3.3340    2.3093    1.0425 N   0  0  0

+    0.7052   -2.4941   -0.3242 C   0  0  0

+    4.5573    2.5700    0.6227 C   0  0  0

+   -0.6846   -2.5043    0.3153 C   0  0  0

+   -1.4572   -1.3612   -0.1772 N   0  0  0

+   -1.4054   -3.8031   -0.0516 C   0  0  0

+   -2.3976   -0.7958    0.6054 C   0  0  0

+   -3.1772    0.3578    0.1084 C   0  0  0

+   -2.6046   -1.2344    1.7200 O   0  0  0

+   -4.1569    0.9541    0.9116 C   0  0  0

+   -2.9451    0.8742   -1.1668 C   0  0  0

+   -4.8581    2.0313    0.3995 C   0  0  0

+   -3.6392    1.9021   -1.6096 N   0  0  0

+   -4.5718    2.4805   -0.8773 C   0  0  0

+    5.2037   -0.2695    0.0000 H   0  0  0

+    1.7696    1.1570    0.0000 H   0  0  0

+    0.8438   -0.4833    0.0000 H   0  0  0

+    6.1841    1.7609    0.0000 H   0  0  0

+    0.5510   -3.4262    0.0000 H   0  0  0

+    1.5974   -2.8050    0.0000 H   0  0  0

+    4.8843    3.4564    0.0000 H   0  0  0

+   -0.2445   -1.6683    0.0000 H   0  0  0

+   -0.8071   -0.6756    0.0000 H   0  0  0

+   -2.2315   -3.3446    0.0000 H   0  0  0

+   -1.8639   -4.6292    0.0000 H   0  0  0

+   -0.5793   -4.2616    0.0000 H   0  0  0

+   -4.8148    0.2760    0.0000 H   0  0  0

+   -2.0038    0.9551    0.0000 H   0  0  0

+   -5.8029    2.0268    0.0000 H   0  0  0

+   -4.7818    3.4017    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  9 11  1  0

+ 11 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+ 15 17  1  0

+ 15 18  2  0

+ 17 19  2  0

+ 18 20  1  0

+ 19 21  1  0

+  8 10  2  0

+ 20 21  2  0

+  3 22  1  0

+  4 23  1  0

+  5 24  1  0

+  7 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+606-35-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -1.0414   -0.0098    0.0861 C   0  0  0

+   -0.3375   -1.2055    0.0740 C   0  0  0

+   -0.3559    1.1960    0.0762 C   0  0  0

+   -2.4003   -0.0201    0.1020 O   0  0  0

+    1.0435   -1.1923    0.0521 C   0  0  0

+   -1.0659   -2.4940    0.0850 N   0  3  0

+    1.0255    1.2038    0.0543 C   0  0  0

+   -1.1038    2.4734    0.0886 N   0  3  0

+   -2.8296    0.0163   -1.2605 C   0  0  0

+    1.7246    0.0112    0.0423 C   0  0  0

+   -0.7023   -3.4052   -0.6368 O   0  0  0

+   -2.0288   -2.6431    0.8158 O   0  5  0

+   -0.7593    3.3879   -0.6384 O   0  0  0

+   -2.0637    2.6099    0.8259 O   0  5  0

+    3.2046    0.0225    0.0193 N   0  3  0

+    3.8055    1.0819    0.0106 O   0  0  0

+    3.8215   -1.0277    0.0091 O   0  5  0

+    1.5695   -2.0846    0.0000 H   0  0  0

+    1.5379    2.1040    0.0000 H   0  0  0

+   -2.7421    1.0484    0.0000 H   0  0  0

+   -3.8617    0.1038    0.0000 H   0  0  0

+   -2.9171   -1.0158    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+  8 14  1  0

+ 10 15  1  0

+ 15 16  2  0

+ 15 17  1  0

+  7 10  2  0

+  5 18  1  0

+  7 19  1  0

+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+316-49-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.0472   -0.1508   -0.0023 C   0  0  0

+   -1.4641   -0.5431   -0.0018 C   0  0  0

+    0.2856    1.2749   -0.0007 C   0  0  0

+    0.9553   -1.1060    0.0013 C   0  0  0

+   -2.4569    0.4588    0.0003 C   0  0  0

+   -1.8361   -1.8885   -0.0030 C   0  0  0

+    1.6150    1.6814   -0.0007 C   0  0  0

+   -0.7947    2.2600    0.0015 C   0  0  0

+    2.2943   -0.7031    0.0007 C   0  0  0

+   -2.0832    1.8697    0.0014 C   0  0  0

+   -3.8075    0.0826    0.0008 C   0  0  0

+   -3.1707   -2.2260   -0.0020 C   0  0  0

+    2.6308    0.7223   -0.0022 C   0  0  0

+    3.3402   -1.6474    0.0050 C   0  0  0

+   -4.1477   -1.2387   -0.0007 C   0  0  0

+   -4.8835    1.1377    0.0036 C   0  0  0

+    3.9897    1.0980   -0.0023 C   0  0  0

+    4.6299   -1.2192    0.0048 C   0  0  0

+    4.9506    0.1374   -0.0038 C   0  0  0

+    0.7118   -2.1256    0.0000 H   0  0  0

+   -1.1031   -2.6379    0.0000 H   0  0  0

+    1.8540    2.7021    0.0000 H   0  0  0

+   -0.5633    3.2824    0.0000 H   0  0  0

+   -2.8374    2.5978    0.0000 H   0  0  0

+   -3.4518   -3.2359    0.0000 H   0  0  0

+    3.1248   -2.6733    0.0000 H   0  0  0

+   -5.1596   -1.5123    0.0000 H   0  0  0

+   -4.1496    1.8862    0.0000 H   0  0  0

+   -5.6320    1.8716    0.0000 H   0  0  0

+   -5.6174    0.3892    0.0000 H   0  0  0

+    4.2569    2.1116    0.0000 H   0  0  0

+    5.4032   -1.9269    0.0000 H   0  0  0

+    5.9590    0.4238    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 11 16  1  0

+ 13 17  1  0

+ 14 18  2  0

+ 17 19  2  0

+  8 10  2  0

+  9 13  2  0

+ 12 15  1  0

+ 18 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+125-33-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    0.5145    0.0563    0.4137 C   0  0  0

+   -0.9405    0.0573    0.0212 C   0  0  0

+    1.1882   -1.1461   -0.1813 C   0  0  0

+    1.1622    1.3181   -0.0784 C   0  0  0

+    0.6270   -0.0037    1.9384 C   0  0  0

+   -1.4411   -0.9522   -0.7799 C   0  0  0

+   -1.7757    1.0644    0.4667 C   0  0  0

+    2.4109   -1.0844   -0.7180 N   0  0  0

+    0.6035   -2.2086   -0.1753 O   0  0  0

+    2.3858    1.3273   -0.6164 N   0  0  0

+    0.5552    2.3638    0.0158 O   0  0  0

+   -0.1821   -1.1916    2.4630 C   0  0  0

+   -2.7755   -0.9512   -1.1399 C   0  0  0

+   -3.1106    1.0654    0.1065 C   0  0  0

+    3.2041    0.1339   -0.7618 C   0  0  0

+   -3.6097    0.0592   -0.6990 C   0  0  0

+    1.4586   -0.5273    0.0000 H   0  0  0

+    1.1204    0.8462    0.0000 H   0  0  0

+   -0.9234   -1.7875    0.0000 H   0  0  0

+   -1.3575    1.9537    0.0000 H   0  0  0

+    2.9009   -1.9362    0.0000 H   0  0  0

+    2.8406    2.1984    0.0000 H   0  0  0

+   -0.9943   -0.6384    0.0000 H   0  0  0

+   -0.7353   -2.0038    0.0000 H   0  0  0

+    0.6301   -1.7448    0.0000 H   0  0  0

+   -3.1947   -1.8400    0.0000 H   0  0  0

+   -3.6283    1.9007    0.0000 H   0  0  0

+    3.9506   -0.5052    0.0000 H   0  0  0

+    3.9351    0.7906    0.0000 H   0  0  0

+   -4.5859   -0.0534    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  3  9  2  0

+  4 10  1  0

+  4 11  2  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+  8 15  1  0

+ 13 16  1  0

+ 10 15  1  0

+ 14 16  2  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105-39-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+   -0.1747    0.0040   -0.0007 C   0  0  0

+   -1.4309    0.4770    0.0004 O   0  0  0

+    0.9903    0.9600    0.0015 C   0  0  0

+    0.0220   -1.1881    0.0016 O   0  0  0

+   -2.5534   -0.4441   -0.0017 C   0  0  0

+    2.5332    0.0271   -0.0006 Cl  0  0  0

+   -3.8626    0.3476    0.0001 C   0  0  0

+    1.6681    1.8386    0.0000 H   0  0  0

+    0.1939    1.7328    0.0000 H   0  0  0

+   -3.2312   -1.3227    0.0000 H   0  0  0

+   -1.7571   -1.2169    0.0000 H   0  0  0

+   -3.2884    1.2971    0.0000 H   0  0  0

+   -4.8121    0.9218    0.0000 H   0  0  0

+   -4.4368   -0.6019    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+  7 12  1  0

+  7 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+583-78-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.6222    0.9198    0.0019 C   0  0  0

+   -1.2260   -0.3302    0.0006 C   0  0  0

+    0.7611    1.0192    0.0017 C   0  0  0

+   -1.3855    2.0444   -0.0022 O   0  0  0

+   -0.4476   -1.4728   -0.0010 C   0  0  0

+   -2.9573   -0.4586    0.0003 Cl  0  0  0

+    1.5354   -0.1263    0.0002 C   0  0  0

+    0.9310   -1.3713   -0.0012 C   0  0  0

+    3.2670   -0.0028   -0.0001 Cl  0  0  0

+    1.2148    1.9528    0.0000 H   0  0  0

+   -1.9684    2.9032    0.0000 H   0  0  0

+   -0.8987   -2.4076    0.0000 H   0  0  0

+    1.5138   -2.2302    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  8 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25082-33-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -0.2956   -0.0514   -0.0020 C   0  0  0

+   -1.7326   -0.3544   -0.0017 C   0  0  0

+    0.1227    1.3522    0.0003 C   0  0  0

+    0.6476   -1.0650    0.0013 C   0  0  0

+   -2.6617    0.7096    0.0009 C   0  0  0

+   -2.2061   -1.6658   -0.0033 C   0  0  0

+    1.4744    1.6771   -0.0005 C   0  0  0

+   -0.8947    2.4023    0.0028 C   0  0  0

+    2.0085   -0.7439    0.0014 C   0  0  0

+   -2.2064    2.0929    0.0031 C   0  0  0

+   -4.0286    0.3902    0.0017 C   0  0  0

+   -3.5020   -1.8983   -0.0025 N   0  0  0

+    2.4305    0.6586   -0.0033 C   0  0  0

+    2.9955   -1.7496    0.0055 C   0  0  0

+   -4.3974   -0.9246   -0.0001 C   0  0  0

+    3.8096    0.9515   -0.0036 C   0  0  0

+    4.3087   -1.4000    0.0062 C   0  0  0

+    4.7107   -0.0653   -0.0060 C   0  0  0

+    0.3432   -2.0675    0.0000 H   0  0  0

+   -1.5304   -2.4665    0.0000 H   0  0  0

+    1.7745    2.6809    0.0000 H   0  0  0

+   -0.6003    3.4078    0.0000 H   0  0  0

+   -2.9146    2.8650    0.0000 H   0  0  0

+   -4.7530    1.1471    0.0000 H   0  0  0

+    2.7188   -2.7601    0.0000 H   0  0  0

+   -5.4163   -1.1686    0.0000 H   0  0  0

+    4.1374    1.9466    0.0000 H   0  0  0

+    5.0375   -2.1527    0.0000 H   0  0  0

+    5.7340    0.1596    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+ 14 17  2  0

+ 16 18  2  0

+  8 10  2  0

+  9 13  2  0

+ 12 15  1  0

+ 17 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1120-71-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.5526   -0.0954    0.0653 S   0  0  0

+    0.7398   -1.2750    0.6202 C   0  0  0

+    0.2880    0.9418   -0.7093 O   0  0  0

+   -1.3798   -0.6553   -0.9454 O   0  0  0

+   -1.0762    0.6619    1.1477 O   0  0  0

+    2.0120   -0.6078    0.0243 C   0  0  0

+    1.6116    0.8739   -0.1435 C   0  0  0

+   -0.0163   -1.9315    0.0000 H   0  0  0

+    1.3044   -2.1020    0.0000 H   0  0  0

+    2.4111   -1.5261    0.0000 H   0  0  0

+    2.9570   -0.2768    0.0000 H   0  0  0

+    2.6003    1.0323    0.0000 H   0  0  0

+    1.5578    1.8737    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  6  7  1  0

+  2  8  1  0

+  2  9  1  0

+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4543-63-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    1.7099   -0.1024   -0.0560 C   0  0  0

+    0.4872    0.3774   -0.3581 N   0  0  0

+    2.7766    0.7214   -0.0587 N   0  0  0

+    1.8499   -1.2779    0.2240 O   0  0  0

+   -0.4768   -0.3671   -0.3557 O   0  0  0

+    4.1056    0.1999    0.2698 C   0  0  0

+   -1.6950    0.1125   -0.0547 C   0  0  0

+   -2.7617   -0.7113   -0.0520 N   0  0  0

+   -1.8353    1.2894    0.2153 O   0  0  0

+   -4.0903   -0.1884    0.2763 C   0  0  0

+    0.3479    1.3526    0.0000 H   0  0  0

+    2.6373    1.6966    0.0000 H   0  0  0

+    3.7458   -0.7171    0.0000 H   0  0  0

+    5.0226   -0.1599    0.0000 H   0  0  0

+    4.4654    1.1169    0.0000 H   0  0  0

+   -2.6229   -1.6866    0.0000 H   0  0  0

+   -3.7295    0.7283    0.0000 H   0  0  0

+   -5.0070    0.1724    0.0000 H   0  0  0

+   -4.4511   -1.1051    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  7  9  2  0

+  8 10  1  0

+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  8 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74339-99-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 44                          1 V2000

+    0.3079    0.0118    0.0024 C   0  0  0

+   -0.8222   -0.7889    0.0009 C   0  0  0

+   -0.0477    1.4219    0.0038 C   0  0  0

+    1.6269   -0.4578   -0.0028 C   0  0  0

+   -1.9870    0.1126   -0.0008 C   0  0  0

+   -0.6079   -2.1840    0.0016 C   0  0  0

+   -1.5250    1.4516    0.0017 C   0  0  0

+    0.9606    2.3368    0.0057 C   0  0  0

+    2.6875    0.5584   -0.0015 C   0  0  0

+    1.8376   -1.8264   -0.0082 C   0  0  0

+   -3.3604   -0.1347   -0.0048 C   0  0  0

+    0.7232   -2.6871    0.0018 C   0  0  0

+   -1.6864   -3.0818    0.0026 C   0  0  0

+   -2.4439    2.4954    0.0017 C   0  0  0

+    2.3183    1.9260    0.0049 C   0  0  0

+    4.0342    0.2011   -0.0093 C   0  0  0

+   -4.2556    0.9118   -0.0059 C   0  0  0

+    0.9211   -4.0835    0.0019 C   0  0  0

+   -1.4520   -4.4224    0.0031 C   0  0  0

+   -3.8023    2.2264   -0.0014 C   0  0  0

+    3.3328    2.8985    0.0064 C   0  0  0

+    5.0018    1.1810   -0.0072 C   0  0  0

+   -0.1493   -4.9204    0.0025 C   0  0  0

+   -4.6955    3.2507   -0.0016 O   0  0  0

+    4.6431    2.5231    0.0028 C   0  0  0

+    0.7307    3.3575    0.0000 H   0  0  0

+    2.8092   -2.2147    0.0000 H   0  0  0

+   -3.7118   -1.1202    0.0000 H   0  0  0

+   -2.6686   -2.7213    0.0000 H   0  0  0

+   -2.1081    3.4863    0.0000 H   0  0  0

+    4.3094   -0.8083    0.0000 H   0  0  0

+   -5.2835    0.7165    0.0000 H   0  0  0

+    1.8915   -4.4747    0.0000 H   0  0  0

+   -2.2594   -5.0879    0.0000 H   0  0  0

+    3.0814    3.9142    0.0000 H   0  0  0

+    6.0132    0.9131    0.0000 H   0  0  0

+    0.0062   -5.9551    0.0000 H   0  0  0

+   -5.3832    4.0393    0.0000 H   0  0  0

+    5.3895    3.2563    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  2  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  2  0

+ 12 18  1  0

+ 13 19  2  0

+ 14 20  2  0

+ 15 21  1  0

+ 16 22  2  0

+ 18 23  2  0

+ 20 24  1  0

+ 21 25  2  0

+  5  7  2  0

+  9 15  2  0

+ 10 12  1  0

+ 17 20  1  0

+ 19 23  1  0

+ 22 25  1  0

+  8 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+ 25 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55256-55-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 56                          1 V2000

+    3.0125    0.1677   -0.1146 C   0  0  0

+    2.2945   -0.9756    0.1664 C   0  0  0

+    4.4998    0.4288   -0.2264 C   0  0  1

+    2.3584    1.3705   -0.3661 C   0  0  0

+    0.8957   -0.9234    0.1847 C   0  0  0

+    2.9386   -2.1419    0.4227 O   0  0  0

+    4.5275    1.8159   -0.9421 C   0  0  1

+    5.0400    0.7865    1.1456 C   0  0  0

+    0.9685    1.4181   -0.3342 C   0  0  0

+    3.2493    2.3714   -0.6016 O   0  0  0

+    0.2155    0.2844   -0.0380 C   0  0  0

+    0.0950   -2.1417    0.4161 C   0  0  0

+    3.2250   -2.7421   -0.8421 C   0  0  0

+    5.5407    2.5064   -0.1857 O   0  0  0

+    5.5978    1.9739    1.0553 C   0  0  0

+   -1.1145    0.4065    0.0351 O   0  0  0

+   -1.3338   -1.9982    0.0611 C   0  0  0

+    0.5683   -3.1724    0.8600 O   0  0  0

+   -1.8408   -0.7043   -0.1239 C   0  0  0

+   -2.1501   -3.1232   -0.0877 C   0  0  0

+   -3.1831   -0.5736   -0.4907 C   0  0  0

+   -3.4785   -2.9591   -0.4460 C   0  0  0

+   -1.6457   -4.3659    0.1175 O   0  0  0

+   -3.9806   -1.6852   -0.6485 C   0  0  0

+   -3.7639    0.7986   -0.7164 C   0  0  0

+   -4.3338    1.3338    0.5987 C   0  0  0

+   -4.9234    2.7269    0.3696 C   0  0  0

+   -5.4933    3.2621    1.6847 C   0  0  0

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+    4.1425   -2.3043    0.0000 H   0  0  0

+    6.6004    1.8057    0.0000 H   0  0  0

+   -4.1011   -3.7628    0.0000 H   0  0  0

+   -1.2634   -5.3079    0.0000 H   0  0  0

+   -4.9895   -1.5600    0.0000 H   0  0  0

+   -2.7474    0.8145    0.0000 H   0  0  0

+   -3.3970    1.7467    0.0000 H   0  0  0

+   -5.3503    1.3180    0.0000 H   0  0  0

+   -4.7007    0.3857    0.0000 H   0  0  0

+   -4.7973    4.0032    0.0000 H   0  0  0

+   -6.2344    3.9581    0.0000 H   0  0  0

+   -6.1893    2.5210    0.0000 H   0  0  0

+   -3.1644    2.8975    0.0000 H   0  0  0

+   -3.0556    4.3311    0.0000 H   0  0  0

+   -4.4892    4.4399    0.0000 H   0  0  0

+   -6.9799    2.5723    0.0000 H   0  0  0

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+ 28 48  1  0

+ 29 49  1  0

+ 29 50  1  0

+ 29 51  1  0

+ 30 52  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13177-31-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    1.5318   -0.0610    0.0157 C   0  0  0

+    0.2550   -0.7735    0.0109 C   0  0  0

+    1.3512    1.2193   -0.0036 C   0  0  0

+    2.8168   -0.7492    0.0452 C   0  0  0

+   -0.7480    0.3020   -0.0143 C   0  0  0

+    0.3010   -2.0823    0.0290 C   0  0  0

+   -0.1000    1.4611   -0.0232 C   0  0  0

+    2.5703    2.0502   -0.0004 C   0  0  0

+    2.7657   -2.2209    0.0693 C   0  0  0

+    3.9011   -0.0116    0.0474 C   0  0  0

+   -2.2188    0.2808   -0.0287 C   0  0  0

+    1.5819   -2.8070    0.0536 C   0  0  0

+   -0.8723    2.7174   -0.0492 C   0  0  0

+    3.7522    1.4603    0.0216 C   0  0  0

+   -2.9003    1.4054   -0.0508 C   0  0  0

+   -2.8754   -0.9045   -0.0188 N   0  3  0

+   -2.1859    2.6935   -0.0622 C   0  0  0

+   -2.5463   -1.7894   -0.7883 O   0  0  0

+   -3.7946   -1.0850    0.7596 O   0  5  0

+   -0.6007   -2.6296    0.0000 H   0  0  0

+    2.4990    3.1025    0.0000 H   0  0  0

+    3.6521   -2.7926    0.0000 H   0  0  0

+    4.8570   -0.4573    0.0000 H   0  0  0

+    1.5528   -3.8614    0.0000 H   0  0  0

+   -0.3660    3.6427    0.0000 H   0  0  0

+    4.6201    2.0596    0.0000 H   0  0  0

+   -3.9549    1.3851    0.0000 H   0  0  0

+   -2.7294    3.5975    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111901-39-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -0.9485   -0.2093    0.0888 C   0  0  0

+   -1.8374   -1.3256    0.5410 C   0  0  1

+    0.4291   -0.4056   -0.0989 C   0  0  0

+   -1.4732    1.0207   -0.1949 C   0  0  0

+   -3.2479   -0.9663    0.9690 C   0  0  2

+   -2.9624   -1.5381   -0.3079 O   0  0  0

+    1.2707    0.7369   -0.1258 C   0  0  0

+    1.0284   -1.6608   -0.3403 C   0  0  0

+   -2.9595    1.2389   -0.2138 C   0  0  2

+   -0.6432    2.1203   -0.4086 C   0  0  0

+   -3.6302    0.4963    0.9248 C   0  0  1

+    2.7149    0.5604    0.0340 C   0  0  0

+    0.7113    1.9992   -0.3249 C   0  0  0

+    2.3653   -1.8373   -0.2174 C   0  0  0

+    0.2290   -2.8409   -0.8295 C   0  0  0

+   -3.5021    0.8284   -1.4675 O   0  0  0

+   -5.0500    0.6226    0.8186 O   0  0  0

+    3.2357   -0.7536    0.0298 C   0  0  0

+    3.5783    1.6458    0.1903 C   0  0  0

+    4.6065   -0.9475    0.2443 C   0  0  0

+    4.9146    1.4256    0.3686 C   0  0  0

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+   -0.3549   -3.7029    0.0000 H   0  0  0

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+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+580-17-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.2840    0.6531   -0.0028 C   0  0  0

+   -0.4945   -0.7486   -0.0009 C   0  0  0

+    1.0327    1.1468   -0.0024 C   0  0  0

+   -1.3886    1.5212    0.0007 C   0  0  0

+    0.5502   -1.5823    0.0017 N   0  0  0

+   -1.8117   -1.2409   -0.0014 C   0  0  0

+    2.0690    0.2323   -0.0001 C   0  0  0

+   -2.6488    1.0066    0.0059 C   0  0  0

+    1.7825   -1.1382    0.0026 C   0  0  0

+   -2.8582   -0.3713   -0.0036 C   0  0  0

+    3.3945    0.6728    0.0001 N   0  0  0

+    1.2223    2.1759    0.0000 H   0  0  0

+   -1.2434    2.5575    0.0000 H   0  0  0

+   -1.9865   -2.2726    0.0000 H   0  0  0

+   -3.4710    1.6539    0.0000 H   0  0  0

+    2.5723   -1.8247    0.0000 H   0  0  0

+   -3.8363   -0.7432    0.0000 H   0  0  0

+    4.1768   -0.0222    0.0000 H   0  0  0

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+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112965-21-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 73                          1 V2000

+   -0.0631   -1.8565   -1.2229 C   0  0  2

+   -0.9772   -2.2687   -0.0343 C   0  0  1

+    1.3390   -1.9671   -0.7026 C   0  0  0

+   -0.5744   -0.4441   -1.5158 C   0  0  0

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+   -5.8428    3.8179    0.1977 C   0  0  0

+    0.1084   -2.8413    0.0000 H   0  0  0

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+ 30 69  1  0

+ 30 70  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2498-76-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.0984    0.1197   -0.0020 C   0  0  0

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+  8 10  2  0

+  9 13  2  0

+ 12 15  1  0

+ 18 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5910-89-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.5564    0.6919    0.0019 C   0  0  0

+   -0.5565   -0.6919    0.0007 C   0  0  0

+    0.5878    1.3525    0.0014 N   0  0  0

+   -1.8615    1.4455   -0.0027 C   0  0  0

+    0.5878   -1.3525   -0.0008 N   0  0  0

+   -1.8615   -1.4455    0.0008 C   0  0  0

+    1.7323    0.6917   -0.0001 C   0  0  0

+    1.7323   -0.6917   -0.0013 C   0  0  0

+   -1.3543    2.3239    0.0000 H   0  0  0

+   -2.7399    1.9527    0.0000 H   0  0  0

+   -2.3687    0.5671    0.0000 H   0  0  0

+   -2.3688   -0.5671    0.0000 H   0  0  0

+   -2.7399   -1.9528    0.0000 H   0  0  0

+   -1.3542   -2.3239    0.0000 H   0  0  0

+    2.6108    1.1989    0.0000 H   0  0  0

+    2.6108   -1.1989    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  7  8  2  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97-41-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    1.0053   -0.2391   -0.1306 C   0  0  0

+   -0.1893    0.1420    0.7461 C   0  0  0

+    0.3487    1.1340   -0.2871 C   0  0  0

+    2.2772   -0.0999    0.6654 C   0  0  0

+   -1.4354   -0.5148    0.2104 C   0  0  0

+    1.1189    2.3488    0.2343 C   0  0  0

+   -0.4940    1.3754   -1.5410 C   0  0  0

+    3.4229   -0.4516    0.1363 C   0  0  0

+   -2.6380    0.0308    0.4507 O   0  0  0

+   -1.3519   -1.5326   -0.4354 O   0  0  0

+    4.6949   -0.3124    0.9324 C   0  0  0

+    3.4688   -0.9953   -1.2684 C   0  0  0

+   -3.8386   -0.6021   -0.0655 C   0  0  0

+   -5.0640    0.2157    0.3475 C   0  0  0

+    0.9096   -1.1940    0.0000 H   0  0  0

+   -0.8638    0.8246    0.0000 H   0  0  0

+    2.3677    0.8555    0.0000 H   0  0  0

+    1.9294    1.8349    0.0000 H   0  0  0

+    1.6328    3.1593    0.0000 H   0  0  0

+    0.3084    2.8627    0.0000 H   0  0  0

+   -0.2297    2.2980    0.0000 H   0  0  0

+   -1.4166    1.6397    0.0000 H   0  0  0

+   -0.7583    0.4528    0.0000 H   0  0  0

+    4.7993   -1.2664    0.0000 H   0  0  0

+    5.6489   -0.2080    0.0000 H   0  0  0

+    4.5905    0.6416    0.0000 H   0  0  0

+    2.5125   -1.0760    0.0000 H   0  0  0

+    3.5495   -1.9516    0.0000 H   0  0  0

+    4.4251   -0.9146    0.0000 H   0  0  0

+   -4.4957   -1.3015    0.0000 H   0  0  0

+   -3.2572   -1.3656    0.0000 H   0  0  0

+   -4.5313    1.0139    0.0000 H   0  0  0

+   -5.8622    0.7484    0.0000 H   0  0  0

+   -5.5967   -0.5825    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  2  3  1  0

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+ 13 30  1  0

+ 13 31  1  0

+ 14 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+604-75-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+    1.4627   -3.8689    0.3751 Cl  0  0  0

+    0.3057   -2.6374   -0.0231 C   0  0  0

+    0.5835   -1.3176    0.2517 C   0  0  0

+   -0.8953   -2.9828   -0.6229 C   0  0  0

+   -0.3433   -0.3129   -0.0665 C   0  0  0

+   -1.8144   -2.0075   -0.9405 C   0  0  0

+    0.0184    1.0760    0.2572 C   0  0  0

+   -1.5513   -0.6639   -0.6654 C   0  0  0

+   -0.7892    1.9536    0.7378 N   0  0  0

+    1.4181    1.4945    0.0115 C   0  0  0

+   -2.5232    0.2602   -1.0180 N   0  0  0

+   -2.1923    1.6445    1.0104 C   0  0  0

+    1.9130    1.5531   -1.2909 C   0  0  0

+    2.2447    1.8372    1.0817 C   0  0  0

+   -2.8790    1.3140   -0.2867 C   0  0  0

+   -2.2703    0.5214    1.8904 O   0  0  0

+    3.2177    1.9437   -1.5134 C   0  0  0

+    3.5473    2.2261    0.8465 C   0  0  0

+   -3.7802    2.0261   -0.6762 O   0  0  0

+    4.0342    2.2767   -0.4477 C   0  0  0

+    1.5228   -1.0588    0.0000 H   0  0  0

+   -1.1528   -3.9224    0.0000 H   0  0  0

+   -2.7504   -2.2779    0.0000 H   0  0  0

+   -3.3444   -0.2640    0.0000 H   0  0  0

+   -2.5105    2.5654    0.0000 H   0  0  0

+    2.1107    0.5991    0.0000 H   0  0  0

+    1.9183    2.7552    0.0000 H   0  0  0

+   -2.3378   -0.4505    0.0000 H   0  0  0

+    3.5418    1.0249    0.0000 H   0  0  0

+    3.3568    3.1816    0.0000 H   0  0  0

+    4.9793    2.5134    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

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+  7  5  1  0

+  8  5  2  0

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+ 10  7  1  0

+ 11  8  1  0

+ 12  9  1  0

+ 13 10  2  0

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+ 16 12  1  0

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+ 18 14  2  0

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+ 20 17  2  0

+  6  8  1  0

+ 12 15  1  0

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+ 11 24  1  0

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+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 20 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+74-97-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  5  4                          1 V2000

+   -0.6629   -0.9597    0.0000 C   0  0  0

+   -2.0622    0.1773    0.0000 Cl  0  0  0

+    1.0146    0.0656    0.0000 Br  0  0  0

+   -1.6725   -1.9488    0.0000 H   0  0  0

+    0.2058   -2.0746    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3083-23-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+    0.2013    0.0010    0.0952 C   0  0  0

+   -0.8535    0.0059    1.2035 C   0  0  0

+    1.6328   -0.9546    0.6321 Cl  0  0  0

+   -0.4940   -0.7428   -1.3929 Cl  0  0  0

+    0.7080    1.6945   -0.2598 Cl  0  0  0

+   -2.0682    0.8168    0.7478 C   0  0  0

+   -2.0499   -0.6119    0.7251 O   0  0  0

+   -0.6029   -1.0360    0.0000 H   0  0  0

+   -1.6626    1.8087    0.0000 H   0  0  0

+   -3.1210    1.0167    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  6  7  1  0

+  2  8  1  0

+  6  9  1  0

+  6 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-35-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.9329    0.0000   -0.6840 C   0  0  0

+   -0.7194    0.0000    0.0648 S   0  0  0

+    1.9928    0.0000    0.4194 C   0  0  0

+   -1.6469    0.0000   -1.1419 O   0  0  0

+   -1.0122   -1.2434    0.6872 O   0  0  0

+   -1.0122    1.2434    0.6872 O   0  0  0

+    3.3308    0.0000   -0.1869 N   0  0  0

+    1.4119    0.8297    0.0000 H   0  0  0

+    0.4539    0.8297    0.0000 H   0  0  0

+    2.4718    0.8297    0.0000 H   0  0  0

+    1.5138    0.8297    0.0000 H   0  0  0

+   -2.6050    0.0000    0.0000 H   0  0  0

+    3.8098   -0.8297    0.0000 H   0  0  0

+    3.8098    0.8297    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

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+  2  6  2  0

+  3  7  1  0

+  1  8  1  0

+  1  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23491-44-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 61                          1 V2000

+    0.7834    0.2192    0.1595 C   0  0  0

+   -0.6322    0.6451    0.1372 C   0  0  0

+    1.7618    0.8206   -0.4726 N   0  0  0

+    1.2701   -0.8588    0.8479 N   0  0  0

+   -1.6415   -0.3081    0.0668 C   0  0  0

+   -0.9521    2.0074    0.1928 C   0  0  0

+    2.9264    0.1687   -0.2363 C   0  0  0

+    2.6323   -0.9143    0.6104 C   0  0  0

+   -2.9757    0.1030    0.0461 C   0  0  0

+   -2.2555    2.4140    0.1729 C   0  0  0

+    4.2449    0.3787   -0.6535 C   0  0  0

+    3.6457   -1.7664    1.0267 C   0  0  0

+   -3.2784    1.4765    0.0969 C   0  0  0

+   -4.1540   -0.5651   -0.0168 N   0  0  0

+    5.2416   -0.4809   -0.2328 C   0  0  0

+    4.9405   -1.5523    0.6065 C   0  0  0

+   -4.6555    1.5682    0.0612 N   0  0  0

+   -5.1459    0.2917   -0.0082 C   0  0  0

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+   -8.8411    0.2944    0.6546 C   0  0  0

+   -8.3460   -1.4296   -0.9520 C   0  0  0

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+  -10.5812   -1.0667   -0.2261 O   0  0  0

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+   -6.3555   -1.8603    0.0000 H   0  0  0

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+    9.8358   -1.2747    0.0000 H   0  0  0

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+   -8.5469   -2.4128    0.0000 H   0  0  0

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+   10.5143    1.3694    0.0000 H   0  0  0

+  -11.5547   -1.3102    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 23 27  2  0

+ 24 28  1  0

+ 25 29  1  0

+ 27 30  1  0

+ 29 31  1  0

+ 30 32  1  0

+  7  8  2  0

+ 10 13  1  0

+ 15 16  1  0

+ 17 18  1  0

+ 26 29  1  0

+ 28 30  2  0

+  4 33  1  0

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+  6 35  1  0

+ 10 36  1  0

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+ 16 39  1  0

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+ 21 41  1  0

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+ 27 51  1  0

+ 28 52  1  0

+ 31 53  1  0

+ 31 54  1  0

+ 31 55  1  0

+ 32 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2902-96-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.1862   -0.8494   -0.3483 C   0  0  0

+   -0.8959    0.0788   -0.0109 N   0  3  0

+    1.3640   -0.0682   -0.9342 C   0  0  0

+    0.6396   -1.5847    0.9146 C   0  0  0

+   -0.7037    0.9707    0.7960 O   0  0  0

+   -1.9876   -0.0414   -0.5373 O   0  5  0

+    1.8321    0.8799    0.0270 O   0  0  0

+   -0.4283   -1.3746    0.0000 H   0  0  0

+    1.5542   -0.8539    0.0000 H   0  0  0

+    2.1674   -0.1574    0.0000 H   0  0  0

+   -0.0485   -2.0090    0.0000 H   0  0  0

+    1.0639   -2.2728    0.0000 H   0  0  0

+    1.3277   -1.1604    0.0000 H   0  0  0

+    2.1900    1.6047    0.0000 H   0  0  0

+  2  1  1  0

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+  4  1  1  0

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+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57775-29-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    2.0903    0.6141    0.0389 C   0  0  0

+    2.8232   -0.6647    0.0438 C   0  0  0

+    3.0576    1.6276   -0.0093 C   0  0  0

+    0.7328    0.9446    0.0660 C   0  0  0

+    4.1875   -0.3415   -0.0018 C   0  0  0

+    2.4238   -1.9987    0.0830 C   0  0  0

+    4.3081    1.0366   -0.0331 N   0  0  0

+    2.6510    2.9592   -0.0250 C   0  0  0

+    0.3509    2.2743    0.0511 C   0  0  0

+   -0.2074   -0.0352    0.1063 O   0  0  0

+    5.1306   -1.3646   -0.0072 C   0  0  0

+    3.3728   -2.9981    0.0767 C   0  0  0

+    1.3094    3.2739    0.0066 C   0  0  0

+   -1.4801    0.6143    0.1256 C   0  0  0

+    4.7216   -2.6802    0.0321 C   0  0  0

+   -2.5893   -0.4386    0.1714 C   0  0  0

+   -3.9520    0.2568    0.1921 C   0  0  0

+   -2.4993   -1.2757   -0.9832 O   0  0  0

+   -5.0169   -0.7541    0.2360 N   0  0  0

+   -6.2915   -0.0240    0.2539 C   0  0  0

+   -6.7691    0.2037   -1.1817 C   0  0  0

+   -7.3368   -0.8415    1.0154 C   0  0  0

+    1.4108   -2.2405    0.0000 H   0  0  0

+    5.2114    1.5550    0.0000 H   0  0  0

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+   -0.6601    2.5243    0.0000 H   0  0  0

+    6.1466   -1.1356    0.0000 H   0  0  0

+    3.0751   -3.9961    0.0000 H   0  0  0

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+   -0.9050    1.4825    0.0000 H   0  0  0

+   -2.2778    1.2838    0.0000 H   0  0  0

+    5.4318   -3.4419    0.0000 H   0  0  0

+   -1.6118   -0.7978    0.0000 H   0  0  0

+   -3.3769    1.1251    0.0000 H   0  0  0

+   -4.7497    0.9263    0.0000 H   0  0  0

+   -2.3880   -2.3112    0.0000 H   0  0  0

+   -4.8926   -1.7881    0.0000 H   0  0  0

+   -5.8082    0.8985    0.0000 H   0  0  0

+   -6.3209    1.1438    0.0000 H   0  0  0

+   -7.7092    0.6519    0.0000 H   0  0  0

+   -7.2173   -0.7364    0.0000 H   0  0  0

+   -7.9784   -0.0211    0.0000 H   0  0  0

+   -8.1572   -1.4831    0.0000 H   0  0  0

+   -6.6952   -1.6619    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  4 10  1  0

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+  6 12  2  0

+  8 13  2  0

+ 10 14  1  0

+ 11 15  2  0

+ 14 16  1  0

+ 16 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+ 19 20  1  0

+ 20 21  1  0

+ 20 22  1  0

+  5  7  1  0

+  9 13  1  0

+ 12 15  1  0

+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

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+ 21 39  1  0

+ 21 40  1  0

+ 21 41  1  0

+ 22 42  1  0

+ 22 43  1  0

+ 22 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+818-61-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    1.0264   -0.1222    0.0213 C   0  0  0

+   -0.2662    0.1768    0.2597 O   0  0  0

+    2.0600    0.9111    0.1747 C   0  0  0

+    1.3376   -1.2476   -0.3157 O   0  0  0

+   -1.2874   -0.8441    0.1081 C   0  0  0

+    3.3361    0.6159   -0.0607 C   0  0  0

+   -2.6576   -0.2476    0.4364 C   0  0  0

+   -2.9312    0.8358   -0.4543 O   0  0  0

+    1.7860    1.8677    0.0000 H   0  0  0

+   -1.7952   -1.6998    0.0000 H   0  0  0

+   -0.5017   -1.4546    0.0000 H   0  0  0

+    3.6266   -0.3358    0.0000 H   0  0  0

+    4.0150    1.3433    0.0000 H   0  0  0

+   -3.6523   -0.2755    0.0000 H   0  0  0

+   -2.8468   -1.2245    0.0000 H   0  0  0

+   -3.1748    1.8006    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2160-93-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+    0.0910   -0.0577   -0.0551 N   0  0  0

+    1.5346   -0.2254    0.1585 C   0  0  0

+   -0.0705    1.0729   -0.9790 C   0  0  0

+   -0.3722   -1.2554   -0.7685 C   0  0  0

+    2.0857    0.9945    0.8994 C   0  0  0

+    1.7840   -1.4839    0.9921 C   0  0  0

+    2.2378   -0.3616   -1.1935 C   0  0  0

+   -1.2949    1.8944   -0.5706 C   0  0  0

+   -1.2730   -2.0810    0.1523 C   0  0  0

+   -1.0446    2.5308    0.6842 O   0  0  0

+   -2.5116   -1.3953    0.3468 O   0  0  0

+    0.8871    0.9745    0.0000 H   0  0  0

+    0.2566    1.9783    0.0000 H   0  0  0

+   -0.0227   -2.1524    0.0000 H   0  0  0

+    0.5905   -1.2542    0.0000 H   0  0  0

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+    1.2084    1.3908    0.0000 H   0  0  0

+    0.8397   -1.6710    0.0000 H   0  0  0

+    1.9711   -2.4282    0.0000 H   0  0  0

+    2.7283   -1.2968    0.0000 H   0  0  0

+    2.0547   -1.3067    0.0000 H   0  0  0

+    3.1829   -0.5447    0.0000 H   0  0  0

+    2.4209    0.5835    0.0000 H   0  0  0

+   -2.1631    2.3104    0.0000 H   0  0  0

+   -1.7723    1.0584    0.0000 H   0  0  0

+   -1.8271   -2.8682    0.0000 H   0  0  0

+   -0.5500   -2.7166    0.0000 H   0  0  0

+   -0.6922    3.4267    0.0000 H   0  0  0

+   -3.3538   -0.9290    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

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+  8 25  1  0

+  8 26  1  0

+  9 27  1  0

+  9 28  1  0

+ 10 29  1  0

+ 11 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64431-93-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 48                          1 V2000

+   -1.9803    0.0594    0.0084 C   0  0  0

+   -1.8303   -1.3333   -0.1494 C   0  0  0

+   -0.7143    0.6032    0.0698 N   0  0  0

+   -3.2522    0.6083    0.0760 C   0  0  0

+   -0.4387   -1.5952   -0.1794 C   0  0  0

+   -2.9639   -2.1522   -0.2423 C   0  0  0

+    0.2095   -0.4104   -0.0453 C   0  0  0

+   -4.3666   -0.2206   -0.0126 C   0  0  0

+   -4.2085   -1.6024   -0.1802 C   0  0  0

+    1.6765   -0.2361   -0.0259 C   0  0  0

+   -5.7243    0.3614    0.0591 C   0  0  0

+    2.4810   -1.1589    0.6477 C   0  0  0

+    2.2600    0.8481   -0.6857 C   0  0  0

+   -6.7629   -0.0711   -0.7254 N   0  0  0

+   -6.0365    1.3184    0.8708 N   0  0  0

+    3.8473   -0.9961    0.6655 C   0  0  0

+    3.6268    1.0101   -0.6673 C   0  0  0

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+   -0.4961    1.6121    0.0000 H   0  0  0

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+   -2.8559   -3.1788    0.0000 H   0  0  0

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+   -8.4996   -0.1547    0.0000 H   0  0  0

+   -7.1187    2.6556    0.0000 H   0  0  0

+   -8.3994    2.0876    0.0000 H   0  0  0

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+    9.0686    0.7632    0.0000 H   0  0  0

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+    8.1600   -0.7236    0.0000 H   0  0  0

+    9.0654    0.3620    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+ 12 16  2  0

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+ 23 25  1  0

+  5  7  2  0

+  8  9  2  0

+ 17 20  2  0

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+ 22 40  1  0

+ 24 41  1  0

+ 24 42  1  0

+ 25 43  1  0

+ 25 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+528-75-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.7413    0.4495    0.0080 C   0  0  0

+   -1.1405   -0.8902   -0.0413 C   0  0  0

+    0.6006    0.7646    0.0348 C   0  0  0

+   -1.7569    1.5262    0.0253 N   0  3  0

+   -0.1734   -1.8999   -0.0631 C   0  0  0

+   -2.5708   -1.2352   -0.0706 C   0  0  0

+    1.5519   -0.2408    0.0130 C   0  0  0

+   -1.6470    2.4790   -0.7254 O   0  0  0

+   -2.7023    1.4594    0.7903 O   0  5  0

+    1.1650   -1.5685   -0.0358 C   0  0  0

+   -2.9134   -2.3975   -0.1134 O   0  0  0

+    2.9905    0.1062    0.0415 N   0  3  0

+    3.8302   -0.7758    0.0224 O   0  0  0

+    3.3346    1.2738    0.0840 O   0  5  0

+    0.8979    1.7567    0.0000 H   0  0  0

+   -0.4617   -2.8946    0.0000 H   0  0  0

+   -3.2846   -0.4848    0.0000 H   0  0  0

+    1.8822   -2.3156    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 14  1  0

+  7 10  2  0

+  3 15  1  0

+  5 16  1  0

+  6 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71-36-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.1337   -0.3464    0.0000 C   0  0  0

+   -1.3863    0.5322    0.0000 C   0  0  0

+    1.1121    0.5417    0.0000 C   0  0  0

+   -2.6322   -0.3559    0.0000 C   0  0  0

+    2.2820   -0.2789    0.0000 O   0  0  0

+   -0.8946   -1.2053    0.0000 H   0  0  0

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+   -0.6254    1.3911    0.0000 H   0  0  0

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+   -3.5666   -1.0220    0.0000 H   0  0  0

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+    3.2214   -0.9378    0.0000 H   0  0  0

+  1  2  1  0

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+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+482-44-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    0.3903    0.5068   -0.4565 C   0  0  0

+    0.6420   -0.8312   -0.1866 C   0  0  0

+    1.3810    1.4587   -0.2408 C   0  0  0

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+   -3.0128    1.6039   -0.2710 C   0  0  0

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+   -4.4300   -0.4641    0.0000 H   0  0  0

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+  1  2  2  0

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+  7 10  1  0

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+ 13 25  1  0

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+ 19 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+36536-46-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -1.0780   -0.0420    0.5203 C   0  0  0

+   -0.1525   -1.1300   -0.0617 C   0  0  0

+   -0.0913    0.8914   -0.0352 O   0  0  0

+   -2.3653    0.0268   -0.3037 C   0  0  0

+    0.9040   -0.0363   -0.0470 C   0  0  0

+    2.1118   -0.0046   -0.0458 O   0  0  0

+   -1.4296    0.9150    0.0000 H   0  0  0

+   -0.9071   -1.8156    0.0000 H   0  0  0

+    0.5573   -1.8619    0.0000 H   0  0  0

+   -2.3109    1.0449    0.0000 H   0  0  0

+   -3.3834    0.0812    0.0000 H   0  0  0

+   -2.4197   -0.9913    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  2  0

+  3  5  1  0

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+  2  8  1  0

+  2  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+478-08-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.3068    0.4115    0.1072 C   0  0  0

+   -0.1393   -0.9864    0.0549 C   0  0  0

+    0.8681    1.2969    0.0798 C   0  0  0

+   -1.5956    0.9528    0.1912 C   0  0  0

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+    2.2267    0.7194   -0.0028 C   0  0  0

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+    2.3971   -0.6753   -0.0552 C   0  0  0

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+   -2.5301   -1.2648    0.1600 C   0  0  0

+    3.3422    1.5510   -0.0286 C   0  0  0

+   -4.0857    0.6911    0.3127 C   0  0  0

+    3.6798   -1.2109   -0.1334 C   0  0  0

+   -3.6154   -2.0792    0.1855 O   0  0  0

+    4.6102    1.0022   -0.1056 C   0  0  0

+   -4.5941    0.9170   -1.0035 O   0  0  0

+    4.7779   -0.3696   -0.1590 C   0  0  0

+   -1.1317   -2.8507    0.0000 H   0  0  0

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+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+159092-76-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    1.2703    0.1548    0.0135 C   0  0  0

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+   -1.4848    0.7670   -0.0052 C   0  0  0

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+ 15 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24140-30-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 52                          1 V2000

+   -1.5971    0.9279    0.0997 C   0  0  0

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+ 26 50  1  0

+ 26 51  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120-12-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -1.2042    0.7334   -0.0028 C   0  0  0

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+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1421-63-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+    0.1475    0.0664    0.2406 C   0  0  0

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+    4.9631    0.3101   -1.3127 C   0  0  0

+   -0.3443    2.1148    0.0000 H   0  0  0

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+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+155798-37-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 65 68                          1 V2000

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+ 32 65  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77191-36-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+    2.0957   -0.0102    0.4299 C   0  0  0

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+   -0.3226    0.2116   -0.6525 O   0  0  0

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+   -2.6949    0.2999    0.4624 N   0  0  0

+   -3.3608   -0.7392   -0.0703 C   0  0  0

+   -3.2687    1.5794    0.0293 C   0  0  0

+   -4.4788   -0.2401   -0.9590 C   0  0  0

+   -3.1026   -1.9068    0.1317 O   0  0  0

+   -4.1302    1.2466   -1.2091 C   0  0  0

+    0.8575   -0.9017    0.0000 H   0  0  0

+    4.4514    1.8981    0.0000 H   0  0  0

+    3.0660    2.8459    0.0000 H   0  0  0

+    1.8556    3.3443    0.0000 H   0  0  0

+    1.3572    2.1339    0.0000 H   0  0  0

+    4.2333   -2.0561    0.0000 H   0  0  0

+    1.0842   -2.0581    0.0000 H   0  0  0

+    1.4426   -3.3171    0.0000 H   0  0  0

+    2.7016   -2.9587    0.0000 H   0  0  0

+   -2.0756   -0.5888    0.0000 H   0  0  0

+   -1.1299   -0.6545    0.0000 H   0  0  0

+    5.3553   -0.1267    0.0000 H   0  0  0

+   -2.4176    1.9432    0.0000 H   0  0  0

+   -3.6174    2.4368    0.0000 H   0  0  0

+   -5.3648    0.0277    0.0000 H   0  0  0

+   -4.8020   -1.1075    0.0000 H   0  0  0

+   -4.2859    2.1590    0.0000 H   0  0  0

+   -5.0554    1.2750    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+ 10 13  1  0

+ 13 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+ 14 17  2  0

+ 15 18  1  0

+  8 12  2  0

+ 16 18  1  0

+  2 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

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+ 15 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104485-01-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 61 63                          1 V2000

+    4.9198    0.0078    0.0765 C   0  0  2

+    3.6798   -0.8780   -0.0599 C   0  0  2

+    4.7107    1.2600   -0.6628 N   0  0  0

+    6.1353   -0.7249   -0.4950 C   0  0  0

+    2.5262   -0.1826    0.4824 O   0  0  0

+    3.8975   -2.1821    0.7100 C   0  0  0

+    3.5309    1.9124   -0.0659 C   0  0  0

+    5.8959    2.1065   -0.4084 C   0  0  0

+    6.3530   -2.0290    0.2749 C   0  0  0

+    1.2996   -0.4203   -0.0194 C   0  0  0

+    5.1130   -2.9148    0.1386 C   0  0  0

+    4.0110    3.2363    0.5652 C   0  0  0

+    5.3266    3.5323   -0.2018 C   0  0  0

+    0.2289    0.2252    0.4840 N   0  0  0

+    1.1579   -1.2168   -0.9261 O   0  0  0

+   -1.0581   -0.2806    0.2685 C   0  0  0

+   -2.1613    0.5530    0.3883 C   0  0  0

+   -1.2326   -1.6159   -0.0711 C   0  0  0

+   -3.4342    0.0485    0.1742 C   0  0  0

+   -2.5032   -2.1152   -0.2838 C   0  0  0

+   -3.6030   -1.2883   -0.1593 C   0  0  0

+   -4.5165    0.8620    0.2912 O   0  0  0

+   -5.6671    0.0610    0.0146 C   0  0  0

+   -6.9271    0.9212    0.1299 C   0  0  0

+   -8.1590    0.0636   -0.1663 C   0  0  0

+   -9.4190    0.9238   -0.0510 C   0  0  0

+  -10.6509    0.0662   -0.3471 C   0  0  0

+    5.7733    0.5879    0.0000 H   0  0  0

+    2.8262   -1.4580    0.0000 H   0  0  0

+    7.1647   -0.7976    0.0000 H   0  0  0

+    6.4467    0.2590    0.0000 H   0  0  0

+    2.8681   -2.1094    0.0000 H   0  0  0

+    3.5861   -3.1660    0.0000 H   0  0  0

+    2.5805    2.3146    0.0000 H   0  0  0

+    3.0795    0.9844    0.0000 H   0  0  0

+    6.4266    1.2214    0.0000 H   0  0  0

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+    5.0472    4.5257    0.0000 H   0  0  0

+    0.3155    1.2535    0.0000 H   0  0  0

+   -2.0225    1.5756    0.0000 H   0  0  0

+   -0.4193   -2.2512    0.0000 H   0  0  0

+   -2.6422   -3.1378    0.0000 H   0  0  0

+   -4.5534   -1.6904    0.0000 H   0  0  0

+   -6.3478   -0.7147    0.0000 H   0  0  0

+   -4.9794   -0.7085    0.0000 H   0  0  0

+   -6.2464    1.6969    0.0000 H   0  0  0

+   -7.6148    1.6907    0.0000 H   0  0  0

+   -8.8397   -0.7121    0.0000 H   0  0  0

+   -7.4713   -0.7059    0.0000 H   0  0  0

+   -8.7383    1.6995    0.0000 H   0  0  0

+  -10.1067    1.6933    0.0000 H   0  0  0

+  -11.2405    0.9132    0.0000 H   0  0  0

+  -11.4979   -0.5234    0.0000 H   0  0  0

+  -10.0613   -0.7808    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+ 16 18  2  0

+ 17 19  2  0

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+ 19 21  1  0

+ 19 22  1  0

+ 22 23  1  0

+ 23 24  1  0

+ 24 25  1  0

+ 25 26  1  0

+ 26 27  1  0

+  9 11  1  0

+ 12 13  1  0

+ 20 21  2  0

+  1 28  1  0

+  2 29  1  0

+  4 30  1  0

+  4 31  1  0

+  6 32  1  0

+  6 33  1  0

+  7 34  1  0

+  7 35  1  0

+  8 36  1  0

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+  9 38  1  0

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+ 11 40  1  0

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+ 25 56  1  0

+ 26 57  1  0

+ 26 58  1  0

+ 27 59  1  0

+ 27 60  1  0

+ 27 61  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4463-22-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.0992   -0.0875    0.0705 C   0  0  0

+    2.5774    0.0172    0.0022 C   0  0  0

+    0.3696    0.8206    0.8365 C   0  0  0

+    0.4371   -1.0904   -0.6357 C   0  0  0

+    3.3614   -1.1346    0.0167 C   0  0  0

+    3.1868    1.2678   -0.0825 C   0  0  0

+   -1.0039    0.7216    0.8982 C   0  0  0

+   -0.9369   -1.1855   -0.5711 C   0  0  0

+    4.7364   -1.0313   -0.0476 C   0  0  0

+    4.5622    1.3592   -0.1462 C   0  0  0

+   -1.6616   -0.2825    0.1973 C   0  0  0

+    5.3360    0.2125   -0.1262 C   0  0  0

+   -3.0549   -0.3809    0.2613 N   0  0  0

+   -3.8244    0.5300   -0.3669 C   0  0  0

+   -3.6575   -1.4376    0.9861 O   0  0  0

+   -4.3610    1.7156    0.3929 C   0  0  0

+   -4.0849    0.3955   -1.5438 O   0  0  0

+    0.7823    1.7675    0.0000 H   0  0  0

+    0.9577   -1.9825    0.0000 H   0  0  0

+    2.9130   -2.0651    0.0000 H   0  0  0

+    2.6105    2.1250    0.0000 H   0  0  0

+   -1.5273    1.6120    0.0000 H   0  0  0

+   -1.3512   -2.1317    0.0000 H   0  0  0

+    5.3182   -1.8848    0.0000 H   0  0  0

+    5.0165    2.2868    0.0000 H   0  0  0

+    6.3662    0.2870    0.0000 H   0  0  0

+   -4.1692   -2.3348    0.0000 H   0  0  0

+   -3.4200    2.1415    0.0000 H   0  0  0

+   -4.7869    2.6566    0.0000 H   0  0  0

+   -5.3020    1.2897    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  9 12  2  0

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+ 14 17  2  0

+  8 11  2  0

+ 10 12  1  0

+  3 18  1  0

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+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

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+ 10 25  1  0

+ 12 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+537-92-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.0725    0.5547   -0.2923 C   0  0  0

+    0.5816   -0.6656   -0.3979 C   0  0  0

+    0.6344    1.6874    0.0904 C   0  0  0

+   -1.4397    0.6442   -0.5765 N   0  0  0

+    1.9325   -0.7495   -0.1222 C   0  0  0

+    1.9847    1.5968    0.3647 C   0  0  0

+   -2.3148   -0.1565    0.0634 C   0  0  0

+    2.6333    0.3799    0.2586 C   0  0  0

+    2.6431   -2.0735   -0.2360 C   0  0  0

+   -3.7690   -0.1515   -0.3320 C   0  0  0

+   -1.9320   -0.8810    0.9576 O   0  0  0

+    0.0335   -1.5200    0.0000 H   0  0  0

+    0.1720    2.5911    0.0000 H   0  0  0

+   -1.7762    1.6019    0.0000 H   0  0  0

+    2.5360    2.4492    0.0000 H   0  0  0

+    3.6479    0.3466    0.0000 H   0  0  0

+    1.7487   -2.5536    0.0000 H   0  0  0

+    3.1232   -2.9679    0.0000 H   0  0  0

+    3.5375   -1.5934    0.0000 H   0  0  0

+   -3.7655    0.8636    0.0000 H   0  0  0

+   -4.7841   -0.1480    0.0000 H   0  0  0

+   -3.7725   -1.1666    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  7 10  1  0

+  7 11  2  0

+  6  8  1  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96918-15-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 33                          1 V2000

+   -0.1144   -0.2366   -0.0018 C   0  0  0

+   -1.4913    0.0528   -0.0014 C   0  0  0

+    0.8184    0.8236   -0.0004 C   0  0  0

+    0.3245   -1.5836    0.0024 C   0  0  0

+   -1.9237    1.3992    0.0004 C   0  0  0

+   -2.4385   -0.9959   -0.0023 C   0  0  0

+    2.1912    0.5271   -0.0007 C   0  0  0

+    0.3584    2.1604    0.0018 C   0  0  0

+    1.6895   -1.8588    0.0020 C   0  0  0

+   -0.6593   -2.6645    0.0074 C   0  0  0

+   -0.9652    2.4398    0.0022 C   0  0  0

+   -3.2953    1.6724    0.0008 C   0  0  0

+   -1.9816   -2.3831   -0.0037 C   0  0  0

+   -3.7993   -0.6826   -0.0014 C   0  0  0

+    2.6116   -0.8125   -0.0024 C   0  0  0

+    3.2982    1.2957    0.0004 O   0  0  0

+   -4.2086    0.6377   -0.0006 C   0  0  0

+    4.0809   -0.7602   -0.0022 C   0  0  0

+    4.4085    0.5385   -0.0005 C   0  0  0

+    1.0557    2.9495    0.0000 H   0  0  0

+    2.0255   -2.8568    0.0000 H   0  0  0

+   -0.3367   -3.6669    0.0000 H   0  0  0

+   -1.2856    3.4429    0.0000 H   0  0  0

+   -3.6320    2.6701    0.0000 H   0  0  0

+   -2.6847   -3.1670    0.0000 H   0  0  0

+   -4.5157   -1.4543    0.0000 H   0  0  0

+   -5.2382    0.8585    0.0000 H   0  0  0

+    4.7427   -1.5792    0.0000 H   0  0  0

+    5.3930    0.9120    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+ 12 17  2  0

+ 15 18  1  0

+ 16 19  1  0

+  8 11  1  0

+  9 15  1  0

+ 10 13  2  0

+ 14 17  1  0

+ 18 19  2  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+125974-08-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.1520    0.8233    0.2306 C   0  0  0

+    0.2200   -0.4949    0.0572 C   0  0  0

+    1.5702    1.3206    0.3850 C   0  0  0

+   -1.1006    1.6606    0.2607 C   0  0  0

+    1.6230   -0.9204    0.0862 C   0  0  0

+   -1.1419   -1.5475   -0.1685 Cl  0  0  0

+    2.4221    0.1456    0.2791 O   0  0  0

+    1.8752    2.2273   -0.6766 O   0  0  0

+   -2.5387    0.5996    0.0222 Cl  0  0  0

+    2.0074   -2.0660   -0.0438 O   0  0  0

+    0.7917    2.0892    0.0000 H   0  0  0

+   -0.3920    2.4942    0.0000 H   0  0  0

+   -1.8471    2.4604    0.0000 H   0  0  0

+    2.2240    3.2642    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5  7  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7364-25-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -2.3016   -1.3376    0.0005 O   0  0  0

+   -1.5479   -0.3833    0.0014 C   0  0  0

+   -0.0750   -0.4321    0.0005 C   0  0  0

+   -1.9036    0.9173   -0.0024 N   0  0  0

+    0.3696    0.9004    0.0016 C   0  0  0

+    0.8502   -1.4739   -0.0008 C   0  0  0

+   -0.7535    1.7129   -0.0002 N   0  0  0

+    1.7318    1.1669    0.0011 C   0  0  0

+    2.1995   -1.1896   -0.0009 C   0  0  0

+    2.6376    0.1255   -0.0005 C   0  0  0

+   -2.8804    1.2731    0.0000 H   0  0  0

+    0.5247   -2.4613    0.0000 H   0  0  0

+   -0.7425    2.7525    0.0000 H   0  0  0

+    2.0695    2.1502    0.0000 H   0  0  0

+    2.8916   -1.9654    0.0000 H   0  0  0

+    3.6571    0.3291    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  5  1  0

+  9  6  2  0

+ 10  8  2  0

+  5  7  1  0

+  9 10  1  0

+  4 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93535-04-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    2.4245    0.3612   -0.0015 C   0  0  0

+    1.0206    0.8073   -0.0016 C   0  0  0

+    3.4590    1.3020   -0.0020 C   0  0  0

+    2.7261   -1.0039    0.0050 C   0  0  0

+    0.0284   -0.0978   -0.0011 C   0  0  0

+    4.7702    0.8810   -0.0019 C   0  0  0

+    4.0402   -1.4171    0.0051 C   0  0  0

+   -1.3761    0.3485   -0.0012 C   0  0  0

+    5.0662   -0.4783   -0.0013 C   0  0  0

+   -2.4111   -0.5905   -0.0007 C   0  0  0

+   -1.6791    1.7126    0.0039 C   0  0  0

+    6.3956   -0.9007   -0.0017 N   0  0  0

+   -3.7240   -0.1648   -0.0008 C   0  0  0

+   -2.9959    2.1236    0.0037 C   0  0  0

+   -4.0161    1.1892   -0.0016 C   0  0  0

+   -5.0119   -1.3288   -0.0007 Cl  0  0  0

+    0.7971    1.8264    0.0000 H   0  0  0

+    3.2378    2.3216    0.0000 H   0  0  0

+    1.9569   -1.7088    0.0000 H   0  0  0

+    0.2519   -1.1169    0.0000 H   0  0  0

+    5.5426    1.5824    0.0000 H   0  0  0

+    4.2661   -2.4357    0.0000 H   0  0  0

+   -2.1919   -1.6106    0.0000 H   0  0  0

+   -0.9110    2.4188    0.0000 H   0  0  0

+    6.6192   -1.9198    0.0000 H   0  0  0

+    7.1664   -0.1975    0.0000 H   0  0  0

+   -3.2231    3.1419    0.0000 H   0  0  0

+   -5.0102    1.5059    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  4  7  1  0

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+  7  9  2  0

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+  2 17  1  0

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+  4 19  1  0

+  5 20  1  0

+  6 21  1  0

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+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+41934-47-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -0.5030    0.0844    0.0070 C   0  0  0

+    0.2436   -1.1047   -0.0951 C   0  0  0

+   -1.9646    0.0063    0.0020 C   0  0  0

+    0.1524    1.3169    0.1171 C   0  0  0

+    1.6281   -1.0420   -0.0913 C   0  0  0

+   -0.3929   -2.2915   -0.1951 O   0  0  0

+   -2.5419   -1.2196   -0.1018 C   0  0  0

+   -2.8065    1.2517    0.1086 C   0  0  0

+    1.5154    1.3620    0.1251 C   0  0  0

+    2.2618    0.1877    0.0128 C   0  0  0

+   -1.7329   -2.3696   -0.1998 C   0  0  0

+   -4.1610    0.9027    0.0805 F   0  0  0

+   -2.5188    1.9076    1.3103 F   0  0  0

+   -2.5213    2.1008   -0.9661 F   0  0  0

+    3.6520    0.2501    0.0171 N   0  0  0

+   -2.2633   -3.4621   -0.2920 O   0  0  0

+    4.3713    0.4744    1.2734 C   0  0  0

+    4.3961    0.0914   -1.2348 C   0  0  0

+    4.4563   -0.8388    2.0539 C   0  0  0

+    4.3587    1.4038   -2.0203 C   0  0  0

+   -0.3888    2.1848    0.0000 H   0  0  0

+    2.1801   -1.9030    0.0000 H   0  0  0

+   -3.5609   -1.3079    0.0000 H   0  0  0

+    1.9929    2.2665    0.0000 H   0  0  0

+    5.3835    0.6210    0.0000 H   0  0  0

+    4.1450    1.4719    0.0000 H   0  0  0

+    4.2629   -0.9227    0.0000 H   0  0  0

+    5.4176    0.0392    0.0000 H   0  0  0

+    3.4356   -0.9049    0.0000 H   0  0  0

+    4.5224   -1.8595    0.0000 H   0  0  0

+    5.4770   -0.7727    0.0000 H   0  0  0

+    5.3811    1.4329    0.0000 H   0  0  0

+    4.3296    2.4262    0.0000 H   0  0  0

+    3.3363    1.3747    0.0000 H   0  0  0

+  1  2  2  0

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+ 19 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+535-11-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -0.9416    0.9478   -0.1991 C   0  0  0

+   -1.4491   -0.2791   -0.0020 O   0  0  0

+    0.5509    1.1427   -0.2739 C   0  0  0

+   -1.6814    1.8951   -0.3217 O   0  0  0

+   -2.8871   -0.4669    0.0701 C   0  0  0

+    0.9965    2.0988    0.8344 C   0  0  0

+    1.4504   -0.5904   -0.0449 Br  0  0  0

+   -3.1972   -1.9476    0.2987 C   0  0  0

+    1.6383    1.1659    0.0000 H   0  0  0

+   -2.9064    0.6206    0.0000 H   0  0  0

+   -3.9699   -0.3644    0.0000 H   0  0  0

+    1.9823    1.6393    0.0000 H   0  0  0

+    1.4560    3.0846    0.0000 H   0  0  0

+    0.0107    2.5583    0.0000 H   0  0  0

+   -4.2618   -1.7247    0.0000 H   0  0  0

+   -3.4201   -3.0122    0.0000 H   0  0  0

+   -2.1326   -2.1705    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+148193-35-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -1.1331    0.9737    0.0191 C   0  0  0

+   -1.4466   -0.4052    0.0319 C   0  0  0

+    0.1676    1.4274    0.0657 C   0  0  0

+   -2.7286    1.7399   -0.0701 S   0  0  0

+   -2.8777   -0.6573   -0.0240 C   0  0  0

+   -0.3630   -1.3095    0.0953 C   0  0  0

+    1.2039    0.5110    0.1269 C   0  0  0

+   -3.7086    0.3410   -0.0879 N   0  0  0

+   -3.3451   -1.9332   -0.0197 O   0  0  0

+    0.9161   -0.8535    0.1413 C   0  0  0

+    2.4930    0.9386    0.1731 O   0  0  0

+   -4.7704   -1.8511   -0.0817 C   0  0  0

+    3.3139   -0.2298    0.2301 C   0  0  0

+    4.7860    0.1834    0.2843 C   0  0  0

+    5.6649   -1.0675    0.3452 C   0  0  0

+    5.4672   -0.3295   -0.8624 O   0  0  0

+    0.3707    2.4598    0.0000 H   0  0  0

+   -0.5477   -2.3454    0.0000 H   0  0  0

+    1.7085   -1.5458    0.0000 H   0  0  0

+   -4.7099   -0.8006    0.0000 H   0  0  0

+   -5.8209   -1.7906    0.0000 H   0  0  0

+   -4.8309   -2.9016    0.0000 H   0  0  0

+    2.3903   -0.7338    0.0000 H   0  0  0

+    3.7106   -1.2044    0.0000 H   0  0  0

+    4.9804    1.2175    0.0000 H   0  0  0

+    5.1135   -1.9636    0.0000 H   0  0  0

+    6.7061   -1.2195    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5836-85-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.4634    0.1071    0.0023 C   0  0  0

+   -0.2706   -1.0996    0.0007 C   0  0  0

+    1.9265    0.0423    0.0017 C   0  0  0

+   -0.2143    1.3353   -0.0012 C   0  0  0

+   -1.6714   -1.0631    0.0005 C   0  0  0

+    0.4421   -2.3733   -0.0014 C   0  0  0

+    2.5601   -1.2205   -0.0005 C   0  0  0

+    2.7014    1.2059    0.0026 C   0  0  0

+   -1.5883    1.3582   -0.0065 C   0  0  0

+    0.4861    2.4993    0.0010 O   0  0  0

+   -2.3309    0.1580    0.0021 C   0  0  0

+   -2.6793   -2.1878   -0.0012 C   0  0  0

+    1.7905   -2.4071   -0.0019 C   0  0  0

+    3.9619   -1.2803   -0.0012 C   0  0  0

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+   -0.4731    3.5585   -0.0036 C   0  0  0

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+   -4.0633   -1.5244   -0.0005 C   0  0  0

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+   -4.6279    0.8373    0.0026 O   0  0  0

+   -0.1015   -3.2743    0.0000 H   0  0  0

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+   -2.0928    2.2817    0.0000 H   0  0  0

+   -3.2217   -3.0895    0.0000 H   0  0  0

+   -1.8328   -2.8129    0.0000 H   0  0  0

+    2.2813   -3.3380    0.0000 H   0  0  0

+    4.4500   -2.2126    0.0000 H   0  0  0

+    4.6449    1.9902    0.0000 H   0  0  0

+    0.3069    4.2649    0.0000 H   0  0  0

+   -1.1795    4.3385    0.0000 H   0  0  0

+   -1.2531    2.8521    0.0000 H   0  0  0

+   -5.0775   -1.2437    0.0000 H   0  0  0

+   -4.4325   -2.5098    0.0000 H   0  0  0

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+  1  2  2  0

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+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+135086-94-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+   -2.9212   -0.5722   -0.0006 C   0  0  0

+   -4.3911   -0.5343   -0.0010 C   0  0  0

+   -2.4937    0.7547    0.0007 C   0  0  0

+   -2.0238   -1.5702    0.0037 N   0  0  0

+   -4.7537    0.8235    0.0001 C   0  0  0

+   -5.3791   -1.5193   -0.0021 C   0  0  0

+   -3.5998    1.5776    0.0011 N   0  0  0

+   -1.1031    1.0168    0.0013 C   0  0  0

+   -0.7590   -1.3387    0.0029 N   0  0  0

+   -6.1037    1.1667   -0.0004 C   0  0  0

+   -6.6978   -1.1606   -0.0022 C   0  0  0

+   -0.2533   -0.0340    0.0007 N   0  0  0

+   -0.6821    2.1618    0.0020 O   0  0  0

+   -7.0627    0.1784   -0.0019 C   0  0  0

+    1.1309    0.1825    0.0008 N   0  0  0

+    1.9470   -0.8294    0.0001 C   0  0  0

+    3.4020   -0.6018    0.0002 C   0  0  0

+    4.2820   -1.6888   -0.0005 C   0  0  0

+    3.9080    0.7015   -0.0048 C   0  0  0

+    5.6419   -1.4710   -0.0003 C   0  0  0

+    5.2698    0.9094   -0.0047 C   0  0  0

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+   -5.1121   -2.5265    0.0000 H   0  0  0

+   -3.5681    2.6191    0.0000 H   0  0  0

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+   -7.4344   -1.8976    0.0000 H   0  0  0

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+    6.6463    1.5950    0.0000 H   0  0  0

+  1  2  1  0

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+ 20 33  1  0

+ 21 34  1  0

+ 24 35  1  0

+ 24 36  1  0

+ 24 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+22008-60-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 42                          1 V2000

+   -3.2573   -0.1124   -0.8417 C   0  0  0

+   -2.6161   -1.4751   -0.8945 C   0  0  0

+   -2.8106    0.8946   -1.6771 C   0  0  0

+   -4.2957    0.1291    0.0379 C   0  0  0

+   -1.5566   -1.5831    0.2040 C   0  0  2

+   -3.3987    2.1445   -1.6286 C   0  0  0

+   -4.8840    1.3793    0.0864 C   0  0  0

+   -0.4383   -0.6891   -0.1065 N   0  0  0

+   -1.0577   -3.0030    0.2828 C   0  0  0

+   -4.4336    2.3877   -0.7447 C   0  0  0

+    0.2837   -0.1415    0.8911 C   0  0  0

+    0.2009   -3.2511    0.6781 O   0  0  0

+   -1.7905   -3.9180   -0.0099 O   0  0  0

+    1.4341    0.7781    0.5717 C   0  0  2

+    0.0078   -0.3889    2.0459 O   0  0  0

+    2.7192   -0.0409    0.4355 C   0  0  0

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+    5.1609   -0.3528   -0.7571 S   0  0  0

+    0.1779    3.1630    0.6764 O   0  0  0

+    6.0319    0.6331   -2.0061 C   0  0  0

+   -3.5060   -1.7112    0.0000 H   0  0  0

+   -2.5436   -2.3929    0.0000 H   0  0  0

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+   -4.8744   -0.5869    0.0000 H   0  0  0

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+   -4.8423    3.2127    0.0000 H   0  0  0

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+    0.6386    1.2416    0.0000 H   0  0  0

+    2.1301   -0.7484    0.0000 H   0  0  0

+    3.3465   -0.7148    0.0000 H   0  0  0

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+ 18 37  1  0

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+ 19 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96346-61-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 72 76                          1 V2000

+    0.5389   -1.1870   -0.0177 C   0  0  0

+   -0.5166   -1.9048   -0.8093 C   0  0  2

+    0.0934   -0.0079    0.8294 C   0  0  2

+    1.8250   -1.5063   -0.0509 C   0  0  0

+   -1.7065   -2.2218    0.0994 C   0  0  1

+   -0.0206   -3.1981   -1.4380 C   0  0  0

+   -1.3799    0.2549    0.4936 C   0  0  0

+    0.9211    1.2065    0.4960 C   0  0  0

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+    2.8410   -0.7646    0.7859 C   0  0  0

+   -2.2108   -0.9761    0.8307 C   0  0  1

+   -2.8753   -2.7282   -0.7729 C   0  0  0

+    1.3805   -3.0451   -2.0268 C   0  0  0

+    1.2289    1.4910   -0.8220 C   0  0  0

+    1.3663    2.0369    1.5079 C   0  0  0

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+   -3.6675   -0.7493    0.3745 C   0  0  2

+   -2.1741   -1.2140    2.3416 C   0  0  0

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+    4.3353   -2.7010    0.3294 C   0  0  0

+   -3.9514    0.7453    0.2116 C   0  0  0

+   -4.5804   -1.3320    1.3068 O   0  0  0

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+    5.4834   -3.0922    0.3949 O   0  0  0

+   -5.3996    0.9430   -0.2405 C   0  0  0

+    3.2084    4.5616   -0.4253 N   0  0  0

+   -5.6835    2.4376   -0.4034 C   0  0  0

+    3.6860    5.4392    0.6461 C   0  0  0

+    3.5358    4.8642   -1.8208 C   0  0  0

+   -7.0361    2.6223   -0.8257 O   0  0  0

+   -0.9146   -1.0341    0.0000 H   0  0  0

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+   -6.3539    0.8666    0.0000 H   0  0  0

+   -5.4263   -0.0140    0.0000 H   0  0  0

+   -4.7292    2.5140    0.0000 H   0  0  0

+   -5.6568    3.3946    0.0000 H   0  0  0

+    4.5269    4.9816    0.0000 H   0  0  0

+    4.1436    6.2801    0.0000 H   0  0  0

+    2.8451    5.8968    0.0000 H   0  0  0

+    4.1856    4.1612    0.0000 H   0  0  0

+    4.2388    5.5140    0.0000 H   0  0  0

+    2.8860    5.5672    0.0000 H   0  0  0

+   -7.9846    2.7518    0.0000 H   0  0  0

+  1  2  1  0

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+ 31 67  1  0

+ 31 68  1  0

+ 32 69  1  0

+ 32 70  1  0

+ 32 71  1  0

+ 33 72  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1456-28-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.8506   -0.4647   -0.2453 N   0  0  0

+   -0.3246   -1.3508   -0.1863 C   0  0  0

+    0.6742    0.8560   -0.8733 C   0  0  0

+    1.9892   -0.8292    0.2392 N   0  0  0

+   -1.5152   -0.5316    0.3238 C   0  0  0

+   -0.6010    1.4884   -0.3051 C   0  0  0

+    2.9459   -0.0778    0.1778 O   0  0  0

+   -1.7049    0.6085   -0.5130 O   0  0  0

+   -2.7769   -1.3968    0.3006 C   0  0  0

+   -0.4225    1.7373    1.1939 C   0  0  0

+   -0.9954   -2.1312    0.0000 H   0  0  0

+    0.3794   -2.1013    0.0000 H   0  0  0

+    1.7011    0.7892    0.0000 H   0  0  0

+    0.9414    1.8497    0.0000 H   0  0  0

+   -0.6469    0.0207    0.0000 H   0  0  0

+   -1.3469    2.1973    0.0000 H   0  0  0

+   -3.3589   -0.5481    0.0000 H   0  0  0

+   -3.6256   -1.9788    0.0000 H   0  0  0

+   -2.1949   -2.2455    0.0000 H   0  0  0

+    0.4137    1.1376    0.0000 H   0  0  0

+    0.1772    2.5735    0.0000 H   0  0  0

+   -1.2587    2.3370    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3029-19-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -0.0008   -0.3092   -0.0020 C   0  0  0

+   -1.2371    0.1080   -0.0014 C   0  0  0

+    1.1105    0.6609   -0.0007 C   0  0  0

+    0.3041   -1.7513    0.0022 C   0  0  0

+   -1.5335    1.5530    0.0005 C   0  0  0

+   -2.3534   -0.8546   -0.0022 C   0  0  0

+    2.4835    0.1264   -0.0008 C   0  0  0

+    0.8521    1.9469    0.0000 C   0  0  0

+   -0.8061   -2.7188    0.0060 C   0  0  0

+    1.5583   -2.1376    0.0021 C   0  0  0

+   -0.5487    2.4196    0.0015 C   0  0  0

+   -2.9496    1.9597    0.0018 C   0  0  0

+   -2.0564   -2.2969   -0.0048 C   0  0  0

+   -3.5853   -0.4020   -0.0010 C   0  0  0

+    2.6685   -1.1765   -0.0021 C   0  0  0

+    3.6378    1.0415    0.0000 C   0  0  0

+   -3.8862    1.0353    0.0010 C   0  0  0

+    4.7606    0.5971   -0.0001 O   0  0  0

+    1.6788    2.6746    0.0000 H   0  0  0

+   -0.5919   -3.7991    0.0000 H   0  0  0

+    1.7851   -3.2153    0.0000 H   0  0  0

+   -0.7654    3.4994    0.0000 H   0  0  0

+   -3.2216    3.0269    0.0000 H   0  0  0

+   -2.8813   -3.0266    0.0000 H   0  0  0

+   -4.4187   -1.1220    0.0000 H   0  0  0

+    3.7000   -1.5625    0.0000 H   0  0  0

+    3.4768    2.1310    0.0000 H   0  0  0

+   -4.9407    1.3532    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-48-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.5047   -0.2377    0.1385 C   0  0  0

+   -1.8394   -0.7819    0.1240 C   0  0  0

+    0.6798   -1.1090    0.1973 C   0  0  0

+   -0.3869    1.1360    0.0890 C   0  0  0

+   -2.8593    0.0970    0.0686 C   0  0  0

+    1.6901   -0.9328   -0.6773 N   0  0  0

+    0.7472   -1.9883    1.0352 O   0  0  0

+   -2.0317    1.6735    0.0248 S   0  0  0

+   -4.3131   -0.1806    0.0420 N   0  3  0

+    2.8428   -0.2447   -0.2848 C   0  0  0

+    1.5808   -1.4619   -2.0390 C   0  0  0

+   -5.1081    0.7408   -0.0093 O   0  0  0

+   -4.7143   -1.3302    0.0714 O   0  5  0

+    2.9536    1.1192   -0.5215 C   0  0  0

+    3.8768   -0.9230    0.3478 C   0  0  0

+    4.0933    1.7957   -0.1327 C   0  0  0

+    5.0136   -0.2407    0.7340 C   0  0  0

+    5.1232    1.1165    0.4916 C   0  0  0

+   -2.0019   -1.7756    0.0000 H   0  0  0

+    0.4527    1.6917    0.0000 H   0  0  0

+    0.5948   -1.2582    0.0000 H   0  0  0

+    1.3771   -2.4479    0.0000 H   0  0  0

+    2.5668   -1.6656    0.0000 H   0  0  0

+    2.0995    1.6524    0.0000 H   0  0  0

+    3.8567   -1.9296    0.0000 H   0  0  0

+    4.1171    2.8023    0.0000 H   0  0  0

+    5.8691   -0.7716    0.0000 H   0  0  0

+    6.0282    1.5577    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  4 20  1  0

+ 11 21  1  0

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+ 11 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26328-53-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.5226    1.4033    0.0741 C   0  0  0

+    0.4218    2.2563    0.0997 N   0  0  0

+    2.0679    1.0049   -1.1417 C   0  0  0

+    2.0832    0.9521    1.2647 C   0  0  0

+   -0.8398    1.7428    0.0450 C   0  0  0

+    3.1593    0.1597   -1.1627 C   0  0  0

+    3.1742    0.1073    1.2350 C   0  0  0

+   -1.9328    2.6205   -0.0968 C   0  0  0

+   -1.0173    0.3478    0.1259 C   0  0  0

+    3.7104   -0.2909    0.0232 C   0  0  0

+   -3.1966    2.1481   -0.1550 C   0  0  0

+   -2.2523   -0.1969    0.0748 C   0  0  0

+    4.8806   -1.1970   -0.0040 N   0  3  0

+   -3.4238    0.6911   -0.0679 C   0  0  0

+    5.3672   -1.5947    1.0393 O   0  0  0

+    5.4342   -1.6014   -1.2429 O   0  5  0

+   -4.6323    0.1992   -0.1207 N   0  0  0

+   -4.8081   -1.0361   -0.0456 C   0  0  0

+   -5.0266   -2.5714    0.0477 S   0  0  0

+    0.5600    3.2638    0.0000 H   0  0  0

+    2.6793    1.8176    0.0000 H   0  0  0

+    1.4530    0.1539    0.0000 H   0  0  0

+    3.7925    0.9554    0.0000 H   0  0  0

+    2.5597   -0.7030    0.0000 H   0  0  0

+   -1.7713    3.6246    0.0000 H   0  0  0

+   -0.2022   -0.2603    0.0000 H   0  0  0

+   -3.9849    2.7906    0.0000 H   0  0  0

+   -2.3706   -1.2070    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

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+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129-44-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -1.4256    0.2947    0.0395 C   0  0  0

+   -1.0070   -1.0508    0.0387 C   0  0  0

+   -0.4295    1.3697    0.1928 C   0  0  0

+   -2.7835    0.5970   -0.1111 C   0  0  0

+    0.4295   -1.3700    0.1914 C   0  0  0

+   -1.9448   -2.0646   -0.1063 C   0  0  0

+    1.0067    1.0504    0.0375 C   0  0  0

+   -0.7837    2.5055    0.4434 O   0  0  0

+   -3.7070   -0.4386   -0.2605 C   0  0  0

+   -3.2088    1.9164   -0.1116 N   0  0  0

+    1.4252   -0.2948    0.0372 C   0  0  0

+    0.7841   -2.5058    0.4415 O   0  0  0

+   -3.2888   -1.7518   -0.2503 C   0  0  0

+    1.9445    2.0646   -0.1085 C   0  0  0

+    2.7840   -0.5967   -0.1100 C   0  0  0

+    3.2879    1.7521   -0.2536 C   0  0  0

+    3.7074    0.4388   -0.2549 C   0  0  0

+    3.2092   -1.9162   -0.1121 N   0  0  0

+   -1.6396   -3.0590    0.0000 H   0  0  0

+   -4.7243   -0.2218    0.0000 H   0  0  0

+   -2.5110    2.6878    0.0000 H   0  0  0

+   -4.2257    2.1350    0.0000 H   0  0  0

+   -3.9944   -2.5160    0.0000 H   0  0  0

+    1.6391    3.0589    0.0000 H   0  0  0

+    3.9932    2.5166    0.0000 H   0  0  0

+    4.7248    0.2225    0.0000 H   0  0  0

+    2.5113   -2.6875    0.0000 H   0  0  0

+    4.2261   -2.1349    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

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+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-56-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.7736    0.1219    0.0035 C   0  0  0

+    0.0770   -0.9682    0.0031 C   0  0  0

+   -0.2593    1.4052    0.0017 C   0  0  0

+   -2.2390   -0.0858   -0.0003 N   0  3  0

+    1.4503   -0.7759    0.0008 C   0  0  0

+    1.1087    1.6061   -0.0005 C   0  0  0

+   -2.9900    0.8731    0.0001 O   0  0  0

+   -2.6940   -1.2156   -0.0038 O   0  5  0

+    1.9691    0.5187   -0.0010 C   0  0  0

+    2.3136   -1.8783    0.0008 N   0  0  0

+    3.3547    0.7198   -0.0029 N   0  0  0

+   -0.3131   -1.9322    0.0000 H   0  0  0

+   -0.9032    2.2218    0.0000 H   0  0  0

+    1.4923    2.5727    0.0000 H   0  0  0

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+    3.9987   -0.0968    0.0000 H   0  0  0

+    3.7399    1.6858    0.0000 H   0  0  0

+  1  2  2  0

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+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+119-47-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 58                          1 V2000

+   -1.1065   -0.5388    1.0112 C   0  0  0

+   -2.1401    0.2959    0.6124 C   0  0  0

+    0.0005   -0.0047    1.8832 C   0  0  0

+   -1.0956   -1.8618    0.6128 C   0  0  0

+   -3.1578   -0.1989   -0.1906 C   0  0  0

+   -2.1562    1.5959    1.0079 O   0  0  0

+    1.1081    0.5344    1.0151 C   0  0  0

+   -2.1138   -2.3538   -0.1825 C   0  0  0

+   -3.1393   -1.5207   -0.5908 C   0  0  0

+   -4.2825    0.7050   -0.6252 C   0  0  0

+    2.1423   -0.2982    0.6122 C   0  0  0

+    1.0916    1.8564    0.6152 C   0  0  0

+   -2.0994   -3.7971   -0.6155 C   0  0  0

+   -5.2628   -0.0832   -1.4962 C   0  0  0

+   -5.0126    1.2400    0.6084 C   0  0  0

+   -3.7140    1.8761   -1.4291 C   0  0  0

+    3.1601    0.2010   -0.1872 C   0  0  0

+    2.1583   -1.6004    1.0005 O   0  0  0

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+   -0.0706   -0.9786    0.0000 H   0  0  0

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+    2.1703   -2.5769    0.0000 H   0  0  0

+    4.0187    1.9548    0.0000 H   0  0  0

+    3.0633    3.8082    0.0000 H   0  0  0

+    2.0730    4.7707    0.0000 H   0  0  0

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+    5.8800   -0.6665    0.0000 H   0  0  0

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+    4.4325   -2.0261    0.0000 H   0  0  0

+    5.7987   -1.8243    0.0000 H   0  0  0

+    5.5969   -0.4581    0.0000 H   0  0  0

+    2.8392   -1.4396    0.0000 H   0  0  0

+    3.2897   -2.7451    0.0000 H   0  0  0

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+  8  9  1  0

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+ 24 54  1  0

+ 25 55  1  0

+ 25 56  1  0

+ 25 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90243-66-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 54                          1 V2000

+   -3.1464    0.7618    0.7098 N   0  0  0

+   -3.4919    1.7454   -0.3270 C   0  0  1

+   -2.0468   -0.0174    0.7181 C   0  0  0

+   -4.1989    0.7736    1.7420 C   0  0  0

+   -4.8437    2.3747    0.0707 C   0  0  0

+   -2.4300    2.8126   -0.3951 C   0  0  0

+   -1.1242   -0.0313   -0.4734 C   0  0  2

+   -1.7998   -0.7073    1.6844 O   0  0  0

+   -5.4577    1.3141    1.0188 C   0  0  0

+   -2.5442    3.8212   -1.2817 N   0  0  0

+   -1.4727    2.7638    0.3479 O   0  0  0

+   -1.6960   -0.9554   -1.5504 C   0  0  0

+    0.1956   -0.5174   -0.0634 N   0  0  0

+   -2.0550   -2.2830   -0.9343 C   0  0  0

+    1.3011   -0.0854   -0.7019 C   0  0  0

+   -3.2235   -2.5891   -0.3389 C   0  0  0

+   -1.2689   -3.3688   -0.8880 N   0  0  0

+    2.6587   -0.5854   -0.2802 C   0  0  1

+    1.2033    0.7057   -1.6159 O   0  0  0

+   -3.1275   -3.8897    0.0768 N   0  0  0

+   -1.9040   -4.3345   -0.2822 C   0  0  0

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+    4.5732   -0.7070    1.6503 S   0  0  0

+    5.4548    0.4789    0.5941 C   0  0  2

+    5.5757    0.8592   -1.6870 O   0  0  0

+    5.3135    1.8855    1.1794 C   0  0  0

+   -4.1680    1.1325    0.0000 H   0  0  0

+   -4.8521    0.1363    0.0000 H   0  0  0

+   -3.8596   -0.0735    0.0000 H   0  0  0

+   -4.4342    3.1902    0.0000 H   0  0  0

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+   -2.5965   -1.1033    0.0000 H   0  0  0

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+   -3.9660   -2.0585    0.0000 H   0  0  0

+    2.7468   -1.4937    0.0000 H   0  0  0

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+   -1.6168   -5.2007    0.0000 H   0  0  0

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+    3.1913    0.5886    0.0000 H   0  0  0

+    2.0546    0.1487    0.0000 H   0  0  0

+    6.3344    0.2359    0.0000 H   0  0  0

+    6.2215    1.9767    0.0000 H   0  0  0

+    5.2223    2.7935    0.0000 H   0  0  0

+    4.4055    1.7943    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 23 48  1  0

+ 26 49  1  0

+ 28 50  1  0

+ 28 51  1  0

+ 28 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3070-86-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 38                          1 V2000

+   -0.0019    2.0495   -0.0097 O   0  0  0

+   -1.0850    1.2355    0.1020 C   0  0  0

+    1.0859    1.2424   -0.1252 C   0  0  0

+   -1.5168    0.8238    1.3545 C   0  0  0

+   -1.7618    0.8214   -1.0366 C   0  0  0

+    1.5115    0.8276   -1.3788 C   0  0  0

+    1.7736    0.8385    1.0104 C   0  0  0

+   -2.6169   -0.0031    1.4685 C   0  0  0

+   -2.8617   -0.0052   -0.9238 C   0  0  0

+    2.6168    0.0081   -1.4968 C   0  0  0

+    2.8786    0.0192    0.8937 C   0  0  0

+   -3.2909   -0.4223    0.3294 C   0  0  0

+    3.3020   -0.4006   -0.3606 C   0  0  0

+   -4.4071   -1.2611    0.4445 N   0  0  0

+    4.4231   -1.2324   -0.4797 N   0  0  0

+   -5.5963   -0.8731   -0.0574 C   0  0  0

+    5.5895   -0.8775    0.0948 C   0  0  0

+   -6.7611   -1.8293   -0.0602 C   0  0  0

+   -5.7289    0.2456   -0.5068 O   0  0  0

+    6.7789   -1.7997    0.0172 C   0  0  0

+    5.6820    0.1841    0.6741 O   0  0  0

+   -0.9179    0.1172    0.0000 H   0  0  0

+   -2.2824    1.5876    0.0000 H   0  0  0

+    0.9110    0.1223    0.0000 H   0  0  0

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+   -2.0935   -0.7673    0.0000 H   0  0  0

+   -3.4639    0.6986    0.0000 H   0  0  0

+    2.1031   -0.7627    0.0000 H   0  0  0

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+   -4.2554   -2.1749    0.0000 H   0  0  0

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+   -6.1734   -2.5452    0.0000 H   0  0  0

+    6.2113   -2.5317    0.0000 H   0  0  0

+    7.5109   -2.3673    0.0000 H   0  0  0

+    7.3465   -1.0677    0.0000 H   0  0  0

+  2  1  1  0

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+ 18 32  1  0

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+ 20 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3060-89-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.7070   -0.1726    0.4987 C   0  0  0

+   -2.0926   -0.2286    0.6891 N   0  0  0

+   -0.0726    1.0549    0.3636 C   0  0  0

+    0.0365   -1.3447    0.4502 C   0  0  0

+   -2.9187    0.3689   -0.1924 C   0  0  0

+    1.2949    1.1073    0.1757 C   0  0  0

+    1.4033   -1.2866    0.2622 C   0  0  0

+   -4.2459    0.3972    0.0403 N   0  0  0

+   -2.4666    0.8823   -1.1975 O   0  0  0

+    2.0323   -0.0620    0.1220 C   0  0  0

+   -5.1026   -0.5054   -0.6353 O   0  0  0

+   -4.8023    1.3620    0.9922 C   0  0  0

+    3.9041    0.0137   -0.1353 Br  0  0  0

+   -4.7619   -1.8167   -0.1810 C   0  0  0

+   -2.3889   -1.2111    0.0000 H   0  0  0

+   -0.6229    1.9210    0.0000 H   0  0  0

+   -0.4388   -2.2542    0.0000 H   0  0  0

+    1.7733    2.0152    0.0000 H   0  0  0

+    1.9565   -2.1509    0.0000 H   0  0  0

+   -3.9133    1.8747    0.0000 H   0  0  0

+   -5.3150    2.2510    0.0000 H   0  0  0

+   -5.6913    0.8493    0.0000 H   0  0  0

+   -5.7551   -2.0748    0.0000 H   0  0  0

+   -4.5038   -2.8099    0.0000 H   0  0  0

+   -3.7687   -1.5586    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+530-75-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -2.0363   -0.0188    0.8862 C   0  0  0

+   -2.8827    0.2326   -0.2025 C   0  0  0

+   -0.8290    0.5953    0.9670 O   0  0  0

+   -2.4408   -0.8936    1.8833 C   0  0  0

+   -4.1235   -0.4060   -0.2743 C   0  0  0

+   -2.4664    1.1658   -1.2655 C   0  0  0

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+   -3.6720   -1.5135    1.8028 C   0  0  0

+   -4.5067   -1.2766    0.7226 C   0  0  0

+   -3.2831    1.4046   -2.3103 O   0  0  0

+   -1.3868    1.7195   -1.1993 O   0  0  0

+    1.5422    0.7552    0.3927 C   0  0  0

+    0.0836   -0.8672   -0.4329 O   0  0  0

+    2.6388    0.2508   -0.3201 C   0  0  0

+    1.7056    1.8793    1.2066 C   0  0  0

+    3.8751    0.8684   -0.2062 C   0  0  0

+    2.4913   -0.8372   -1.1177 O   0  0  0

+    2.9415    2.4803    1.3079 C   0  0  0

+    4.0240    1.9751    0.6061 C   0  0  0

+    2.6611   -2.0694   -0.6109 C   0  0  0

+    2.6152   -3.2707   -1.5196 C   0  0  0

+    2.8506   -2.2146    0.5735 O   0  0  0

+   -1.8157   -1.4982    0.0000 H   0  0  0

+   -4.7568    0.1900    0.0000 H   0  0  0

+   -3.5895   -2.3793    0.0000 H   0  0  0

+   -5.2936   -1.6469    0.0000 H   0  0  0

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+    3.4842   -3.3039    0.0000 H   0  0  0

+  1  2  2  0

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+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25155-23-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 58                          1 V2000

+   -0.0201   -0.0234   -0.0266 P   0  0  0

+    0.0651   -1.5590   -0.5030 O   0  0  0

+    1.2759    0.7742   -0.5523 O   0  0  0

+   -1.3492    0.6535   -0.6326 O   0  0  0

+   -0.0679    0.0326    1.4515 O   0  0  0

+    1.2806   -2.0246   -0.1121 C   0  0  0

+    1.1250    2.0679   -0.1642 C   0  0  0

+   -2.4014   -0.0879   -0.1966 C   0  0  0

+    2.2811   -2.2286   -1.0510 C   0  0  0

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+    1.2902    2.4174    1.1684 C   0  0  0

+   -3.0676   -0.9316   -1.0732 C   0  0  0

+   -2.8076   -0.0064    1.1277 C   0  0  0

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+    2.0213   -1.9345   -2.5060 C   0  0  0

+    2.7607   -2.7646    1.6221 C   0  0  0

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+    0.6143    2.6630   -2.5459 C   0  0  0

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+   -4.1371   -1.6842   -0.6274 C   0  0  0

+   -2.6255   -1.0268   -2.5108 C   0  0  0

+   -3.8773   -0.7609    1.5684 C   0  0  0

+    3.7547   -2.9726    0.6835 C   0  0  0

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+   -4.5434   -1.5970    0.6911 C   0  0  0

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+   -3.9762   -2.4742    0.0000 H   0  0  0

+   -2.7952   -1.8150    0.0000 H   0  0  0

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+   -4.4305   -0.1744    0.0000 H   0  0  0

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+   -0.1500    6.0425    0.0000 H   0  0  0

+   -6.1746   -1.7600    0.0000 H   0  0  0

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+   -5.2458   -3.0782    0.0000 H   0  0  0

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+ 28 52  1  0

+ 28 53  1  0

+ 29 54  1  0

+ 29 55  1  0

+ 29 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+585-08-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 28                          1 V2000

+    0.7681   -1.9601   -0.3417 C   0  0  0

+   -0.7681   -1.9599   -0.3425 C   0  0  0

+    1.4758   -0.6357   -0.1814 C   0  0  0

+   -0.0006   -2.2300    0.8323 O   0  0  0

+   -1.4758   -0.6354   -0.1821 C   0  0  0

+    0.7417    0.5365   -0.0402 C   0  0  0

+    2.8558   -0.5974   -0.1767 C   0  0  0

+   -0.7416    0.5365   -0.0394 C   0  0  0

+   -2.8558   -0.5969   -0.1778 C   0  0  0

+    1.4165    1.7516    0.1066 C   0  0  0

+    3.5163    0.6089   -0.0310 C   0  0  0

+   -1.4162    1.7516    0.1081 C   0  0  0

+   -3.5161    0.6093   -0.0314 C   0  0  0

+    2.7947    1.7809    0.1098 C   0  0  0

+   -2.7944    1.7810    0.1110 C   0  0  0

+    1.4421   -2.7461    0.0000 H   0  0  0

+   -1.4424   -2.7456    0.0000 H   0  0  0

+    3.3959   -1.4808    0.0000 H   0  0  0

+   -3.3960   -1.4802    0.0000 H   0  0  0

+    0.8819    2.6383    0.0000 H   0  0  0

+    4.5514    0.6353    0.0000 H   0  0  0

+   -0.8815    2.6383    0.0000 H   0  0  0

+   -4.5512    0.6358    0.0000 H   0  0  0

+    3.2900    2.6901    0.0000 H   0  0  0

+   -3.2896    2.6903    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63390-12-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.3278    0.2494    0.1478 C   0  0  0

+   -1.1323    0.4880    0.2539 C   0  0  0

+    1.1917    1.3123   -0.1127 C   0  0  0

+    0.8385   -1.0368    0.3142 C   0  0  0

+   -2.0309   -0.4280   -0.2918 C   0  0  0

+   -1.6081    1.6253    0.9041 C   0  0  0

+    2.5495    1.0884   -0.2106 C   0  0  0

+    2.1974   -1.2568    0.2156 C   0  0  0

+   -3.3883   -0.2039   -0.1919 C   0  0  0

+   -2.9661    1.8457    1.0018 C   0  0  0

+    3.0567   -0.1965   -0.0495 C   0  0  0

+    3.6256    2.4114   -0.5355 Cl  0  0  0

+    2.8341   -2.8585    0.4228 Cl  0  0  0

+   -3.8603    0.9351    0.4526 C   0  0  0

+   -4.5081   -1.3433   -0.8713 Cl  0  0  0

+    4.4327   -0.4212   -0.1489 N   0  0  0

+   -5.2353    1.1605    0.5529 N   0  0  0

+    0.8257    2.2775    0.0000 H   0  0  0

+    0.1921   -1.8416    0.0000 H   0  0  0

+   -1.7104   -1.4093    0.0000 H   0  0  0

+   -0.9689    2.4359    0.0000 H   0  0  0

+   -3.2877    2.8266    0.0000 H   0  0  0

+    4.7980   -1.3867    0.0000 H   0  0  0

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+   -5.6000    2.1262    0.0000 H   0  0  0

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+  1  2  1  0

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+  3 18  1  0

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+  6 21  1  0

+ 10 22  1  0

+ 16 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+62613-82-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.1032    0.3405   -0.6883 N   0  0  0

+    0.9572   -0.7091   -1.2566 C   0  0  0

+    0.8040    1.1579    0.1163 C   0  0  0

+   -1.3280    0.4828   -0.9672 C   0  0  0

+    2.2266   -0.7289   -0.3765 C   0  0  0

+    2.2492    0.7148    0.1769 C   0  0  0

+    0.3447    2.1123    0.7073 O   0  0  0

+   -2.1177   -0.3094    0.0426 C   0  0  0

+    2.0446   -1.6494    0.7013 O   0  0  0

+   -3.4640   -0.3265   -0.0181 N   0  0  0

+   -1.5418   -0.9317    0.9098 O   0  0  0

+    0.0999   -1.1234    0.0000 H   0  0  0

+    1.1625   -1.6389    0.0000 H   0  0  0

+   -1.0219    1.3844    0.0000 H   0  0  0

+   -2.1370    0.9850    0.0000 H   0  0  0

+    3.1735   -0.8291    0.0000 H   0  0  0

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+    2.4417    1.6473    0.0000 H   0  0  0

+    1.8599   -2.5835    0.0000 H   0  0  0

+   -3.9505    0.4920    0.0000 H   0  0  0

+   -3.9296   -1.1571    0.0000 H   0  0  0

+  1  2  1  0

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+  6 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4698-96-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -1.3403    0.2257   -0.0312 C   0  0  0

+   -2.7942   -0.0688   -0.0057 C   0  0  0

+   -0.8914    1.4971   -0.3851 C   0  0  0

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+   -3.2677   -1.2948   -0.4696 C   0  0  0

+   -3.6907    0.8770    0.4875 C   0  0  0

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+   -5.5072   -0.6184    0.0419 C   0  0  0

+    2.7057    1.0458   -0.1008 O   0  0  0

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+    4.8890    0.0801    0.2747 C   0  0  0

+    5.6082   -1.2072    0.6826 C   0  0  0

+    5.5035   -0.7881   -0.6795 O   0  0  0

+   -1.5561    2.2634    0.0000 H   0  0  0

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+   -2.6149   -2.0713    0.0000 H   0  0  0

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+    2.4397   -0.5435    0.0000 H   0  0  0

+    3.6512   -1.1332    0.0000 H   0  0  0

+    5.2838    1.0145    0.0000 H   0  0  0

+    5.0139   -2.0293    0.0000 H   0  0  0

+    6.6042   -1.3993    0.0000 H   0  0  0

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+ 12 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13889-92-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.3534   -0.4662    0.0000 S   0  0  0

+   -1.1212    0.4037   -0.0001 C   0  0  0

+    1.9293    0.4242    0.0001 C   0  0  0

+   -1.1098    1.6175   -0.0001 O   0  0  0

+   -2.6326   -0.4502   -0.0002 Cl  0  0  0

+    3.0828   -0.5809    0.0003 C   0  0  0

+    4.4150    0.1716    0.0003 C   0  0  0

+    2.8265    1.2447    0.0000 H   0  0  0

+    1.2154    1.4083    0.0000 H   0  0  0

+    2.1856   -1.4014    0.0000 H   0  0  0

+    3.7966   -1.5651    0.0000 H   0  0  0

+    5.0129   -0.8870    0.0000 H   0  0  0

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+  1  2  1  0

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+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2212-99-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+   -0.1068    0.9801    0.4481 C   0  0  0

+   -1.3383    0.0618    0.7160 C   0  0  0

+   -0.4647    0.5446    1.8661 C   0  0  0

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+    2.4153    0.8913   -0.1318 C   0  0  0

+   -2.0079    2.1701   -0.2245 O   0  0  0

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+   -0.0394   -1.9275    0.0358 C   0  0  0

+   -2.4664   -2.1458    0.0147 C   0  0  0

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+   -2.3945   -3.2627   -0.4538 O   0  0  0

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+   -0.3539   -0.4846    0.0000 H   0  0  0

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+    0.0422   -2.9594    0.0000 H   0  0  0

+   -3.3895   -1.6775    0.0000 H   0  0  0

+   -3.9134   -0.5072    0.0000 H   0  0  0

+    2.0663   -2.5304    0.0000 H   0  0  0

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+ 18 32  1  0

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+ 18 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+62-55-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.4677   -0.0042    0.0016 C   0  0  0

+    1.2365   -1.3003   -0.0005 C   0  0  0

+    1.1278    1.1709   -0.0005 N   0  0  0

+   -1.1312   -0.0230   -0.0002 S   0  0  0

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+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13925-00-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.5491    0.0064   -0.2815 C   0  0  0

+    0.1712   -1.1698   -0.1676 C   0  0  0

+    0.0592    1.1703   -0.1367 N   0  0  0

+   -2.0262   -0.0403   -0.5769 C   0  0  0

+    1.4673   -1.1286    0.0860 N   0  0  0

+    1.3555    1.2113    0.1170 C   0  0  0

+   -2.8077   -0.0917    0.7374 C   0  0  0

+    2.0756    0.0356    0.2309 C   0  0  0

+   -0.2965   -2.0367    0.0000 H   0  0  0

+   -1.5708    0.8332    0.0000 H   0  0  0

+   -2.5643    0.7848    0.0000 H   0  0  0

+    1.8233    2.0782    0.0000 H   0  0  0

+   -2.8723    0.8912    0.0000 H   0  0  0

+   -3.7906   -0.1563    0.0000 H   0  0  0

+   -2.7431   -1.0746    0.0000 H   0  0  0

+    3.0601    0.0691    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  6  8  2  0

+  2  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7132-67-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.8508    0.3728   -0.0041 C   0  0  0

+   -0.6985   -1.0380   -0.0029 C   0  0  0

+    0.2875    1.2043   -0.0033 C   0  0  0

+   -2.1409    0.9334   -0.0003 C   0  0  0

+    0.5086   -1.6043   -0.0005 N   0  0  0

+   -1.8542   -1.8481   -0.0038 C   0  0  0

+    1.5505    0.5843   -0.0012 C   0  0  0

+    0.1673    2.5784   -0.0040 N   0  0  0

+   -3.2335    0.1165    0.0045 C   0  0  0

+    1.6232   -0.8785    0.0005 C   0  0  0

+   -3.0852   -1.2749   -0.0059 C   0  0  0

+    2.7406    1.3296   -0.0001 C   0  0  0

+   -4.4796    0.6601    0.0086 O   0  0  0

+    2.8940   -1.4869    0.0036 C   0  0  0

+    3.9367    0.6803    0.0019 C   0  0  0

+    4.0101   -0.7106    0.0049 C   0  0  0

+   -2.2621    1.9734    0.0000 H   0  0  0

+   -1.7624   -2.8911    0.0000 H   0  0  0

+    1.0250    3.1789    0.0000 H   0  0  0

+   -0.7816    3.0209    0.0000 H   0  0  0

+   -3.9370   -1.8838    0.0000 H   0  0  0

+    2.7081    2.3761    0.0000 H   0  0  0

+   -5.4393    1.0788    0.0000 H   0  0  0

+    2.9783   -2.5305    0.0000 H   0  0  0

+    4.8221    1.2392    0.0000 H   0  0  0

+    4.9505   -1.1709    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  2  0

+  9 13  1  0

+ 10 14  2  0

+ 12 15  1  0

+ 14 16  1  0

+  7 10  1  0

+  9 11  1  0

+ 15 16  2  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6375-16-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.4316    0.5484   -0.3300 C   0  0  0

+    0.2001   -0.6820   -0.4367 C   0  0  0

+    0.3029    1.6777    0.0105 C   0  0  0

+   -1.8059    0.6532   -0.5708 N   0  0  0

+    1.5647   -0.7807   -0.2026 C   0  0  0

+    1.6608    1.5763    0.2429 C   0  0  0

+   -2.6707   -0.1240    0.1108 C   0  0  0

+    2.2933    0.3523    0.1376 C   0  0  0

+    2.2046   -2.0178   -0.3085 N   0  0  0

+   -4.1369   -0.1043   -0.2369 C   0  0  0

+   -2.2689   -0.8393    1.0041 O   0  0  0

+    3.7748    0.2462    0.3924 C   0  0  0

+   -0.3679   -1.5409    0.0000 H   0  0  0

+   -0.1541    2.6005    0.0000 H   0  0  0

+   -2.1376    1.6280    0.0000 H   0  0  0

+    2.2287    2.4353    0.0000 H   0  0  0

+    1.6491   -2.8848    0.0000 H   0  0  0

+    3.2332   -2.0654    0.0000 H   0  0  0

+   -4.1231    0.9253    0.0000 H   0  0  0

+   -5.1665   -0.0905    0.0000 H   0  0  0

+   -4.1507   -1.1339    0.0000 H   0  0  0

+    3.7012   -0.7809    0.0000 H   0  0  0

+    4.8019    0.1726    0.0000 H   0  0  0

+    3.8484    1.2733    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  7 10  1  0

+  7 11  2  0

+  8 12  1  0

+  6  8  1  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84174-21-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.1101    0.5909    0.5427 C   0  0  0

+   -1.2752    1.0491    0.9195 C   0  0  0

+    1.0356    1.5040    0.0733 C   0  0  0

+    0.4561   -0.7415    0.6721 C   0  0  0

+   -2.2567    0.4143    0.0364 N   0  0  0

+    2.3065    1.0849   -0.2726 C   0  0  0

+    1.7259   -1.1628    0.3269 C   0  0  0

+   -2.6788   -0.7775    0.2922 N   0  0  0

+   -2.7587    1.1330   -1.1374 C   0  0  0

+    2.6523   -0.2499   -0.1489 C   0  0  0

+   -3.4948   -1.3053   -0.4421 O   0  0  0

+    3.8942   -0.6606   -0.4867 F   0  0  0

+   -0.7679    1.8855    0.0000 H   0  0  0

+   -1.9769    1.7308    0.0000 H   0  0  0

+    0.8125    2.4565    0.0000 H   0  0  0

+   -0.2582   -1.4099    0.0000 H   0  0  0

+    3.0204    1.7538    0.0000 H   0  0  0

+    1.9478   -2.1155    0.0000 H   0  0  0

+   -1.9567    1.6932    0.0000 H   0  0  0

+   -3.3189    1.9350    0.0000 H   0  0  0

+   -3.5607    0.5728    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

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+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+65002-17-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    1.4981    0.0734    0.2229 C   0  0  2

+    0.1004    0.0116   -0.2117 N   0  0  0

+    2.1233    1.3507   -0.2761 C   0  0  0

+    2.2622   -1.1242   -0.3452 C   0  0  0

+   -0.8710    0.5266    0.5678 C   0  0  0

+    3.4075    1.6232    0.0035 O   0  0  0

+    1.4685    2.1294   -0.9278 O   0  0  0

+    1.5097   -2.6616    0.2554 S   0  0  0

+   -2.3088    0.4630    0.1209 C   0  0  0

+   -0.5880    1.0412    1.6290 O   0  0  0

+   -3.2210    0.3855    1.3467 C   0  0  0

+   -2.6472    1.7167   -0.6882 C   0  0  0

+   -2.5566   -1.0080   -0.9113 S   0  0  0

+    2.5134    0.1307    0.0000 H   0  0  0

+   -0.1232   -0.9805    0.0000 H   0  0  0

+    3.0793   -1.7297    0.0000 H   0  0  0

+    3.0060   -0.4307    0.0000 H   0  0  0

+    4.4023    1.8343    0.0000 H   0  0  0

+    1.0626   -3.5750    0.0000 H   0  0  0

+   -3.3071    1.3988    0.0000 H   0  0  0

+   -4.2343    0.2994    0.0000 H   0  0  0

+   -3.1349   -0.6278    0.0000 H   0  0  0

+   -1.6654    1.9817    0.0000 H   0  0  0

+   -2.9122    2.6985    0.0000 H   0  0  0

+   -3.6290    1.4517    0.0000 H   0  0  0

+   -2.7255   -2.0108    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  5 10  2  0

+  9 11  1  0

+  9 12  1  0

+  9 13  1  0

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+  4 16  1  0

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+  6 18  1  0

+  8 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5802-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    2.2664    0.1605    0.4418 C   0  0  0

+    1.0983    0.9175    1.0192 C   0  0  0

+    3.4740    0.8019    0.2402 C   0  0  0

+    2.1319   -1.1772    0.1191 C   0  0  0

+    0.0057    0.9547    0.0379 N   0  0  0

+    4.5457    0.1074   -0.2895 C   0  0  0

+    3.2032   -1.8715   -0.4103 C   0  0  0

+   -1.2143    1.3045    0.7775 C   0  0  0

+    0.2852    2.0664   -0.8567 N   0  0  0

+    4.4095   -1.2284   -0.6174 C   0  0  0

+   -2.3410    0.4029    0.3431 C   0  0  0

+   -2.5520   -0.8001    0.9900 C   0  0  0

+   -3.1670    0.7818   -0.6988 C   0  0  0

+   -3.5857   -1.6273    0.5914 C   0  0  0

+   -4.2004   -0.0451   -1.0973 C   0  0  0

+   -4.4079   -1.2512   -0.4539 C   0  0  0

+    1.8593    1.4991    0.0000 H   0  0  0

+    0.8068    1.8299    0.0000 H   0  0  0

+    3.5155    1.7588    0.0000 H   0  0  0

+    1.2685   -1.5919    0.0000 H   0  0  0

+    5.4093    0.5215    0.0000 H   0  0  0

+    3.1624   -2.8284    0.0000 H   0  0  0

+   -0.7679    2.1519    0.0000 H   0  0  0

+   -1.9528    1.9144    0.0000 H   0  0  0

+    1.2064    2.3286    0.0000 H   0  0  0

+   -0.4025    2.7331    0.0000 H   0  0  0

+    5.2047   -1.7623    0.0000 H   0  0  0

+   -1.7279   -1.2882    0.0000 H   0  0  0

+   -3.2839    1.7324    0.0000 H   0  0  0

+   -3.4683   -2.5779    0.0000 H   0  0  0

+   -5.0253    0.4417    0.0000 H   0  0  0

+   -5.2549   -1.6983    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

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+ 10 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+114607-46-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -1.5909   -0.7126    0.0227 C   0  0  0

+   -2.7121    0.2500   -0.0651 C   0  0  0

+   -0.2910   -0.2991   -0.2616 C   0  0  0

+   -1.8318   -2.0354    0.3961 C   0  0  0

+   -3.9516    0.0011   -0.5553 N   0  0  0

+   -2.6959    1.5075    0.3231 N   0  0  0

+    0.7548   -1.2064   -0.1768 C   0  0  0

+   -0.7851   -2.9313    0.4779 C   0  0  0

+   -4.6499    1.2144   -0.4253 N   0  0  0

+   -3.8346    2.0600    0.1054 N   0  0  0

+    0.5039   -2.5232    0.1909 C   0  0  0

+    2.0602   -0.7969   -0.4614 N   0  0  0

+    2.5950    0.2527    0.1934 C   0  0  0

+    3.9401    0.7701   -0.1978 C   0  0  0

+    1.9834    0.7774    1.1011 O   0  0  0

+    4.4740    1.8180    0.4559 O   0  0  0

+    4.5511    0.2459   -1.1046 O   0  0  0

+   -0.0877    0.6871    0.0000 H   0  0  0

+   -2.7806   -2.3725    0.0000 H   0  0  0

+   -4.3669   -0.9161    0.0000 H   0  0  0

+   -0.9858   -3.9180    0.0000 H   0  0  0

+    1.2567   -3.1918    0.0000 H   0  0  0

+    2.7102   -1.5659    0.0000 H   0  0  0

+    4.9311    2.7152    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  1  0

+  7 11  2  0

+  7 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+ 14 16  1  0

+ 14 17  2  0

+  8 11  1  0

+  9 10  2  0

+  3 18  1  0

+  4 19  1  0

+  5 20  1  0

+  8 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 16 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+839-90-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+   -2.2422   -1.8110   -0.6386 C   0  0  0

+   -3.1669   -1.7615    0.5793 C   0  0  0

+   -1.0714   -0.9640   -0.3976 N   0  0  0

+   -3.5907   -0.4149    0.8012 O   0  0  0

+    0.0303   -1.4850    0.1778 C   0  0  0

+   -1.0941    0.3349   -0.7564 C   0  0  0

+    0.0526   -2.6574    0.4968 O   0  0  0

+    1.1075   -0.7059    0.3992 N   0  0  0

+   -2.0856    0.8035   -1.2798 O   0  0  0

+   -0.0172    1.1143   -0.5343 N   0  0  0

+    2.3053   -1.2723    1.0243 C   0  0  0

+    1.0827    0.5945    0.0459 C   0  0  0

+   -0.0420    2.5263   -0.9238 C   0  0  0

+    3.2389   -1.8139   -0.0602 C   0  0  0

+    2.0538    1.2971    0.2458 O   0  0  0

+   -0.5713    3.3671    0.2397 C   0  0  0

+    3.6167   -0.7512   -0.9376 O   0  0  0

+    0.2815    3.2009    1.3742 O   0  0  0

+   -2.5558   -2.6687    0.0000 H   0  0  0

+   -1.5138   -2.3618    0.0000 H   0  0  0

+   -4.0645   -1.9299    0.0000 H   0  0  0

+   -3.1067   -2.6727    0.0000 H   0  0  0

+   -3.8648    0.4562    0.0000 H   0  0  0

+    3.0841   -0.7954    0.0000 H   0  0  0

+    2.2561   -0.3604    0.0000 H   0  0  0

+    0.8235    2.2350    0.0000 H   0  0  0

+    0.5228    3.2439    0.0000 H   0  0  0

+    2.8300   -2.6304    0.0000 H   0  0  0

+    4.0790   -2.1720    0.0000 H   0  0  0

+   -0.6251    4.2787    0.0000 H   0  0  0

+   -1.4409    3.0882    0.0000 H   0  0  0

+    3.9226    0.1093    0.0000 H   0  0  0

+    1.1778    3.0262    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  5  2  0

+  8  5  1  0

+  9  6  2  0

+ 10  6  1  0

+ 11  8  1  0

+ 12  8  1  0

+ 13 10  1  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 13  1  0

+ 17 14  1  0

+ 18 16  1  0

+ 10 12  1  0

+  1 19  1  0

+  1 20  1  0

+  2 21  1  0

+  2 22  1  0

+  4 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 13 26  1  0

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+ 14 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-91-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.2222   -0.3952    0.0131 C   0  0  0

+   -2.4859    0.3536   -0.0291 C   0  0  0

+   -0.0542    0.2614    0.1603 O   0  0  0

+   -1.2306   -1.6070   -0.0797 O   0  0  0

+   -2.4760    1.8557    0.0922 C   0  0  0

+   -3.6390   -0.2946   -0.1744 C   0  0  0

+    1.1944   -0.4786    0.2020 C   0  0  0

+    2.3600    0.4974    0.3746 C   0  0  0

+    3.6757   -0.2824    0.4186 C   0  0  0

+    3.2314    0.4029   -0.7540 O   0  0  0

+   -1.4293    1.8488    0.0000 H   0  0  0

+   -2.4691    2.9024    0.0000 H   0  0  0

+   -3.5227    1.8626    0.0000 H   0  0  0

+   -4.5394    0.2391    0.0000 H   0  0  0

+   -3.6510   -1.3413    0.0000 H   0  0  0

+    0.5627   -1.3132    0.0000 H   0  0  0

+    1.9525   -1.2003    0.0000 H   0  0  0

+    2.0561    1.4991    0.0000 H   0  0  0

+    3.5038   -1.3149    0.0000 H   0  0  0

+    4.7005   -0.0692    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  7  8  1  0

+  8  9  1  0

+  8 10  1  0

+  9 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5989-27-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.6818    0.0620   -0.4013 C   0  0  1

+   -2.1590    0.0080   -0.1081 C   0  0  0

+   -0.0347    1.1729    0.4353 C   0  0  0

+   -0.0366   -1.2713   -0.0172 C   0  0  0

+   -2.6395   -0.2652    1.2938 C   0  0  0

+   -3.0255    0.1987   -1.0720 C   0  0  0

+    1.4238    1.3218   -0.0030 C   0  0  0

+    1.4588   -1.1484   -0.0433 C   0  0  0

+    2.0941   -0.0206   -0.0327 C   0  0  0

+    3.6005   -0.0579   -0.0514 C   0  0  0

+    0.4215    0.0196    0.0000 H   0  0  0

+    0.0843    2.2706    0.0000 H   0  0  0

+   -1.0835    1.5178    0.0000 H   0  0  0

+   -1.0819   -1.6268    0.0000 H   0  0  0

+    0.1880   -2.3523    0.0000 H   0  0  0

+   -3.1852    0.6946    0.0000 H   0  0  0

+   -3.5993   -0.8109    0.0000 H   0  0  0

+   -2.0938   -1.2250    0.0000 H   0  0  0

+   -3.3591    1.2512    0.0000 H   0  0  0

+   -3.7702   -0.6165    0.0000 H   0  0  0

+    2.4637    1.6928    0.0000 H   0  0  0

+    1.1805    2.3988    0.0000 H   0  0  0

+    2.0545   -2.0780    0.0000 H   0  0  0

+    3.5732   -1.1617    0.0000 H   0  0  0

+    4.7043   -0.0852    0.0000 H   0  0  0

+    3.6278    1.0459    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  7  9  1  0

+  9 10  1  0

+  8  9  2  0

+  1 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84434-42-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -0.9378   -0.0802   -0.0010 C   0  0  0

+   -1.9202    0.9272    0.0003 C   0  0  0

+    0.3821    0.2523    0.0002 N   0  0  0

+   -1.3236   -1.4254    0.0022 C   0  0  0

+   -3.2606    0.5793   -0.0005 C   0  0  0

+   -1.5464    2.2672    0.0028 N   0  0  0

+    1.2804   -0.6734   -0.0011 N   0  0  0

+   -2.6584   -1.7576    0.0067 C   0  0  0

+   -3.6309   -0.7595   -0.0030 C   0  0  0

+   -4.3177    1.6533    0.0010 C   0  0  0

+    2.6065   -0.3394    0.0001 C   0  0  0

+   -4.9795   -1.1056   -0.0042 N   0  0  0

+    3.5825   -1.3397   -0.0012 C   0  0  0

+    2.9920    1.0034   -0.0031 C   0  0  0

+    4.9177   -0.9953    0.0001 C   0  0  0

+    4.3315    1.3328   -0.0018 C   0  0  0

+    5.2923    0.3371    0.0027 C   0  0  0

+   -0.6012   -2.1738    0.0000 H   0  0  0

+   -0.5389    2.5261    0.0000 H   0  0  0

+   -2.2744    3.0102    0.0000 H   0  0  0

+   -2.9431   -2.7581    0.0000 H   0  0  0

+   -3.5764    2.3830    0.0000 H   0  0  0

+   -5.0474    2.3946    0.0000 H   0  0  0

+   -5.0590    0.9236    0.0000 H   0  0  0

+   -5.7072   -0.3623    0.0000 H   0  0  0

+   -5.2593   -2.1075    0.0000 H   0  0  0

+    3.3024   -2.3415    0.0000 H   0  0  0

+    2.2707    1.7529    0.0000 H   0  0  0

+    5.6452   -1.7387    0.0000 H   0  0  0

+    4.6200    2.3322    0.0000 H   0  0  0

+    6.3010    0.5912    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+ 11 13  1  0

+ 11 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+  8  9  2  0

+ 16 17  2  0

+  4 18  1  0

+  6 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+82414-02-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.3787   -0.2271   -0.0031 C   0  0  0

+    0.0444   -0.6820   -0.0026 C   0  0  0

+    1.6388    1.1584   -0.0010 C   0  0  0

+    2.3894   -1.1027    0.0002 N   0  0  0

+   -0.9850    0.2313   -0.0001 C   0  0  0

+    0.5999    2.0447    0.0014 C   0  0  0

+    3.0598    1.6602   -0.0011 C   0  0  0

+    2.1591   -2.2987    0.0035 O   0  0  0

+   -0.7102    1.5904    0.0018 C   0  0  0

+   -2.3887   -0.2382   -0.0001 N   0  3  0

+   -3.3009    0.5690    0.0021 O   0  0  0

+   -2.6317   -1.4317   -0.0022 O   0  5  0

+   -0.1600   -1.6977    0.0000 H   0  0  0

+    0.7918    3.0628    0.0000 H   0  0  0

+    3.4048    0.6833    0.0000 H   0  0  0

+    4.0367    2.0052    0.0000 H   0  0  0

+    2.7148    2.6371    0.0000 H   0  0  0

+   -1.4903    2.2722    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  9  1  0

+  2 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10387-13-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.6932   -1.2039    0.2413 C   0  0  0

+   -0.6927   -1.2049   -0.2378 C   0  0  0

+    1.3555    0.0011    0.4696 C   0  0  0

+    1.3367   -2.4414    0.4582 C   0  0  0

+   -1.3561   -0.0008   -0.4678 C   0  0  0

+   -1.3329   -2.4433   -0.4590 C   0  0  0

+    0.6923    1.2048    0.2396 C   0  0  0

+    2.7797    0.0022    0.9625 C   0  0  0

+    0.6644   -3.5965    0.2206 C   0  0  0

+   -0.6939    1.2038   -0.2396 C   0  0  0

+   -2.7802   -0.0018   -0.9607 C   0  0  0

+   -0.6577   -3.5974   -0.2254 C   0  0  0

+    1.3327    2.4434    0.4598 C   0  0  0

+    3.9035    0.0014   -0.4474 Cl  0  0  0

+   -1.3355    2.4414   -0.4621 C   0  0  0

+   -3.9041   -0.0016    0.4491 Cl  0  0  0

+    0.6576    3.5975    0.2254 C   0  0  0

+   -0.6615    3.5965   -0.2297 C   0  0  0

+    2.3674   -2.4659    0.0000 H   0  0  0

+   -2.3636   -2.4702    0.0000 H   0  0  0

+    3.2954    0.8950    0.0000 H   0  0  0

+    2.2639    0.8949    0.0000 H   0  0  0

+    1.1786   -4.4901    0.0000 H   0  0  0

+   -3.2956   -0.8947    0.0000 H   0  0  0

+   -2.2643   -0.8945    0.0000 H   0  0  0

+   -1.1703   -4.4919    0.0000 H   0  0  0

+    2.3634    2.4703    0.0000 H   0  0  0

+   -2.3662    2.4671    0.0000 H   0  0  0

+    1.1702    4.4920    0.0000 H   0  0  0

+   -1.1753    4.4904    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 13 17  2  0

+ 15 18  2  0

+  7 10  1  0

+  9 12  1  0

+ 17 18  1  0

+  4 19  1  0

+  6 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+82-68-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.2459   -0.0001    0.0025 C   0  0  0

+   -0.5546   -1.1980    0.0021 C   0  0  0

+   -0.5543    1.1982    0.0022 C   0  0  0

+   -2.7260    0.0000   -0.0028 N   0  3  0

+    0.8300   -1.1986    0.0008 C   0  0  0

+   -1.4231   -2.7011    0.0026 Cl  0  0  0

+    0.8299    1.1987    0.0013 C   0  0  0

+   -1.4227    2.7013    0.0022 Cl  0  0  0

+   -3.3388   -0.0026    1.0498 O   0  0  0

+   -3.3312    0.0026   -1.0598 O   0  5  0

+    1.5223   -0.0002    0.0004 C   0  0  0

+    1.6975   -2.7023   -0.0009 Cl  0  0  0

+    1.6975    2.7023    0.0003 Cl  0  0  0

+    3.2583   -0.0002   -0.0018 Cl  0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  7 13  1  0

+ 11 14  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15625-89-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 40                          1 V2000

+    0.0000   -0.8425   -0.3046 C   0  0  0

+   -1.2493   -1.0114    0.5624 C   0  0  0

+    0.0000    0.5526   -0.9328 C   0  0  0

+    1.2492   -1.0114    0.5624 C   0  0  0

+    0.0000   -1.8998   -1.4105 C   0  0  0

+   -2.4348   -0.8511   -0.2604 O   0  0  0

+    0.0000    1.5559    0.1167 O   0  0  0

+    2.4348   -0.8512   -0.2604 O   0  0  0

+   -0.0001   -3.2949   -0.7823 C   0  0  0

+   -3.6591   -0.9589    0.2932 C   0  0  0

+    0.0001    2.8655   -0.2028 C   0  0  0

+    3.6591   -0.9590    0.2932 C   0  0  0

+   -4.8589   -0.7966   -0.5396 C   0  0  0

+   -3.7707   -1.1903    1.4811 O   0  0  0

+    0.0001    3.8810    0.8594 C   0  0  0

+    0.0001    3.2064   -1.3694 O   0  0  0

+    4.8589   -0.7969   -0.5396 C   0  0  0

+    3.7706   -1.1904    1.4811 O   0  0  0

+   -6.0677   -0.9031    0.0070 C   0  0  0

+    0.0001    5.1739    0.5439 C   0  0  0

+    6.0676   -0.9033    0.0070 C   0  0  0

+   -1.7386   -1.7775    0.0000 H   0  0  0

+   -0.7600   -1.7775    0.0000 H   0  0  0

+   -0.7873    1.0071    0.0000 H   0  0  0

+   -0.7873    0.0981    0.0000 H   0  0  0

+    0.7599   -1.7775    0.0000 H   0  0  0

+    1.7385   -1.7775    0.0000 H   0  0  0

+    0.7872   -2.3544    0.0000 H   0  0  0

+    0.7873   -1.4453    0.0000 H   0  0  0

+   -0.9091   -3.2948    0.0000 H   0  0  0

+   -0.0002   -4.2039    0.0000 H   0  0  0

+    0.9089   -3.2950    0.0000 H   0  0  0

+   -4.8377    0.1122    0.0000 H   0  0  0

+   -0.9089    3.8810    0.0000 H   0  0  0

+    4.8378    0.1119    0.0000 H   0  0  0

+   -6.5896   -0.1588    0.0000 H   0  0  0

+   -6.4514   -1.7272    0.0000 H   0  0  0

+    0.7874    5.6284    0.0000 H   0  0  0

+   -0.7872    5.6284    0.0000 H   0  0  0

+    6.4513   -1.7274    0.0000 H   0  0  0

+    6.5894   -0.1589    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+  8 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 11 15  1  0

+ 11 16  2  0

+ 12 17  1  0

+ 12 18  2  0

+ 13 19  2  0

+ 15 20  2  0

+ 17 21  2  0

+  2 22  1  0

+  2 23  1  0

+  3 24  1  0

+  3 25  1  0

+  4 26  1  0

+  4 27  1  0

+  5 28  1  0

+  5 29  1  0

+  9 30  1  0

+  9 31  1  0

+  9 32  1  0

+ 13 33  1  0

+ 15 34  1  0

+ 17 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 21 40  1  0

+ 21 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+587-04-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -2.4421   -1.0869   -0.0003 C   0  0  0

+   -3.5546   -0.6046    0.0006 O   0  0  0

+   -1.2600   -0.2101    0.0010 C   0  0  0

+    0.0244   -0.7626    0.0000 C   0  0  0

+   -1.4159    1.1799   -0.0026 C   0  0  0

+    1.1279    0.0666    0.0012 C   0  0  0

+   -0.3041    1.9951   -0.0014 C   0  0  0

+    2.7241   -0.6160   -0.0007 Cl  0  0  0

+    0.9646    1.4418    0.0034 C   0  0  0

+   -2.3234   -2.1187    0.0000 H   0  0  0

+    0.1478   -1.7939    0.0000 H   0  0  0

+   -2.3671    1.5970    0.0000 H   0  0  0

+   -0.4189    3.0274    0.0000 H   0  0  0

+    1.7984    2.0611    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  1  0

+  9  6  2  0

+  7  9  1  0

+  1 10  1  0

+  4 11  1  0

+  5 12  1  0

+  7 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-59-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.2803    0.6222   -0.0029 C   0  0  0

+   -0.5138   -0.7759   -0.0009 C   0  0  0

+    1.0397    1.1016   -0.0023 C   0  0  0

+   -1.3752    1.5042    0.0004 C   0  0  0

+    0.5783   -1.6615    0.0016 C   0  0  0

+   -1.8358   -1.2525   -0.0010 C   0  0  0

+    2.0865    0.2063    0.0002 C   0  0  0

+   -2.6415    1.0057    0.0055 C   0  0  0

+    1.8466   -1.1734    0.0021 C   0  0  0

+   -2.8710   -0.3690   -0.0030 C   0  0  0

+    3.4002    0.6792    0.0003 N   0  0  0

+    1.2270    2.1335    0.0000 H   0  0  0

+   -1.2169    2.5409    0.0000 H   0  0  0

+    0.4143   -2.6973    0.0000 H   0  0  0

+   -2.0238   -2.2842    0.0000 H   0  0  0

+   -3.4566    1.6656    0.0000 H   0  0  0

+    2.6569   -1.8392    0.0000 H   0  0  0

+   -3.8564   -0.7281    0.0000 H   0  0  0

+    4.2012    0.0023    0.0000 H   0  0  0

+    3.5860    1.7114    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  7  9  1  0

+  8 10  1  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-47-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.0894    0.2249   -0.0299 C   0  0  0

+    1.0101   -0.8046   -0.0226 C   0  0  0

+    0.5189    1.5389   -0.0044 C   0  0  0

+   -1.6345   -0.1365   -0.0792 S   0  0  0

+    2.3689   -0.5187    0.0103 C   0  0  0

+    1.8713    1.8271    0.0284 C   0  0  0

+   -2.1164   -0.2524    1.3599 O   0  0  0

+   -2.2583    1.0280   -0.6026 O   0  0  0

+   -1.7395   -1.4431   -0.6279 O   0  0  0

+    2.7971    0.8027    0.0359 C   0  0  0

+    3.3027   -1.5574    0.0183 N   0  0  0

+    0.6870   -1.7898    0.0000 H   0  0  0

+   -0.1744    2.3098    0.0000 H   0  0  0

+    2.1905    2.8135    0.0000 H   0  0  0

+   -3.1245   -0.4948    0.0000 H   0  0  0

+    3.8110    1.0196    0.0000 H   0  0  0

+    2.9815   -2.5432    0.0000 H   0  0  0

+    4.3170   -1.3426    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 10  2  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+543-67-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.7723   -0.4661    0.0000 C   0  0  0

+   -0.5002    0.2333    0.0000 O   0  0  0

+    1.9140    0.5524    0.0000 C   0  0  0

+   -1.5419   -0.3978    0.0000 N   0  0  0

+    3.2549   -0.1846    0.0000 C   0  0  0

+   -2.6093    0.1889    0.0000 O   0  0  0

+    0.1432   -1.3551    0.0000 H   0  0  0

+    1.5845   -1.1916    0.0000 H   0  0  0

+    2.5431    1.4414    0.0000 H   0  0  0

+    1.1018    1.2779    0.0000 H   0  0  0

+    2.7303   -1.1390    0.0000 H   0  0  0

+    4.2093   -0.7092    0.0000 H   0  0  0

+    3.7795    0.7698    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  2  0

+  1  7  1  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4648-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    1.3248   -0.3415    0.0074 C   0  0  0

+    2.1426   -1.4750    0.0065 C   0  0  0

+    1.9045    0.9298    0.0045 C   0  0  0

+   -0.1418   -0.4866    0.0052 C   0  0  0

+    3.5140   -1.3314    0.0027 C   0  0  0

+    3.2779    1.0577    0.0007 C   0  0  0

+   -0.9244    0.6045    0.0061 C   0  0  0

+    4.0811   -0.0689   -0.0001 C   0  0  0

+   -2.3907    0.4595    0.0039 C   0  0  0

+    5.5543    0.0768   -0.0041 N   0  3  0

+   -3.2073    1.5937    0.0048 C   0  0  0

+   -2.9694   -0.8131   -0.0049 C   0  0  0

+    6.0565    1.1865   -0.0066 O   0  0  0

+    6.2642   -0.9129   -0.0049 O   0  5  0

+   -4.5782    1.4530    0.0023 C   0  0  0

+   -4.3409   -0.9437   -0.0073 C   0  0  0

+   -5.1485    0.1867   -0.0011 C   0  0  0

+   -6.5005    0.0529   -0.0031 O   0  0  0

+   -6.7768   -1.3491   -0.0064 C   0  0  0

+    1.7179   -2.4241    0.0000 H   0  0  0

+    1.3021    1.7773    0.0000 H   0  0  0

+   -0.5705   -1.4339    0.0000 H   0  0  0

+    4.1236   -2.1737    0.0000 H   0  0  0

+    3.7107    2.0032    0.0000 H   0  0  0

+   -0.4957    1.5518    0.0000 H   0  0  0

+   -2.7812    2.5422    0.0000 H   0  0  0

+   -2.3657   -1.6597    0.0000 H   0  0  0

+   -5.1866    2.2963    0.0000 H   0  0  0

+   -4.7722   -1.8898    0.0000 H   0  0  0

+   -7.7970   -1.1480    0.0000 H   0  0  0

+   -6.9779   -2.3693    0.0000 H   0  0  0

+   -5.7566   -1.5502    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

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+  6  8  2  0

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+ 15 28  1  0

+ 16 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6377-12-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    1.0059   -0.4624   -0.0011 C   0  0  0

+   -0.4524   -0.2434   -0.0005 C   0  0  0

+    1.6001    0.8082   -0.0004 C   0  0  0

+    1.8031   -1.6048    0.0029 C   0  0  0

+   -0.6465    1.1458    0.0005 C   0  0  0

+   -1.5492   -1.1017   -0.0008 C   0  0  0

+    0.5963    1.7598    0.0006 N   0  0  0

+    2.9881    0.9117   -0.0008 C   0  0  0

+    3.1757   -1.4820    0.0009 C   0  0  0

+   -1.9408    1.6557    0.0009 C   0  0  0

+   -2.8308   -0.5781    0.0000 C   0  0  0

+    3.7647   -0.2267   -0.0018 C   0  0  0

+   -3.0214    0.8006    0.0002 C   0  0  0

+   -3.9365   -1.4365   -0.0007 N   0  0  0

+    1.3622   -2.5507    0.0000 H   0  0  0

+   -1.4056   -2.1354    0.0000 H   0  0  0

+    0.7522    2.7917    0.0000 H   0  0  0

+    3.4409    1.8519    0.0000 H   0  0  0

+    3.7741   -2.3370    0.0000 H   0  0  0

+   -2.0937    2.6880    0.0000 H   0  0  0

+    4.8050   -0.1433    0.0000 H   0  0  0

+   -3.9898    1.1896    0.0000 H   0  0  0

+   -4.9029   -1.0426    0.0000 H   0  0  0

+   -3.7944   -2.4704    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  4  9  2  0

+  5 10  2  0

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+ 10 13  1  0

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+  4 15  1  0

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+  9 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+645-49-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.8852    0.2415   -0.0019 C   0  0  0

+    0.4360    0.5103   -0.0018 C   0  0  0

+    2.7957    1.3012   -0.0019 C   0  0  0

+    2.3552   -1.0746    0.0039 C   0  0  0

+   -0.4360   -0.5103   -0.0018 C   0  0  0

+    4.1505    1.0420   -0.0016 C   0  0  0

+    3.7124   -1.3184    0.0042 C   0  0  0

+   -1.8852   -0.2415   -0.0017 C   0  0  0

+    4.6085   -0.2636   -0.0012 C   0  0  0

+   -2.7957   -1.3012   -0.0016 C   0  0  0

+   -2.3552    1.0746    0.0042 C   0  0  0

+   -4.1505   -1.0420   -0.0016 C   0  0  0

+   -3.7124    1.3184    0.0042 C   0  0  0

+   -4.6085    0.2636   -0.0015 C   0  0  0

+    0.0897    1.4889    0.0000 H   0  0  0

+    2.4535    2.2812    0.0000 H   0  0  0

+    1.6843   -1.8667    0.0000 H   0  0  0

+   -0.0897   -1.4889    0.0000 H   0  0  0

+    4.8281    1.8284    0.0000 H   0  0  0

+    4.0629   -2.2955    0.0000 H   0  0  0

+    5.6291   -0.4529    0.0000 H   0  0  0

+   -2.4535   -2.2812    0.0000 H   0  0  0

+   -1.6843    1.8667    0.0000 H   0  0  0

+   -4.8281   -1.8284    0.0000 H   0  0  0

+   -4.0629    2.2955    0.0000 H   0  0  0

+   -5.6291    0.4529    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  4  7  2  0

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+  7  9  1  0

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+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+54965-24-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 78 79                          1 V2000

+   -7.8927   -1.9461   -0.1861 C   0  0  0

+   -9.2105   -2.1151   -0.4556 C   0  0  0

+   -7.3510   -0.5871    0.0338 C   0  0  0

+   -6.9971   -3.1215   -0.1059 C   0  0  0

+  -10.1636   -1.0311   -0.1741 C   0  0  0

+   -9.6989   -3.4139   -1.0435 C   0  0  0

+   -7.0442   -0.1568    1.3256 C   0  0  0

+   -7.1400    0.2662   -1.0509 C   0  0  0

+   -6.2496   -3.5101   -1.2186 C   0  0  0

+   -6.8922   -3.8424    1.0840 C   0  0  0

+  -10.6405   -0.2263   -1.2144 C   0  0  0

+  -10.6024   -0.8029    1.1343 C   0  0  0

+  -10.3148   -4.2743    0.0615 C   0  0  0

+   -6.5392    1.1102    1.5265 C   0  0  0

+   -6.6348    1.5313   -0.8420 C   0  0  0

+   -5.4167   -4.6067   -1.1374 C   0  0  0

+   -6.0554   -4.9374    1.1522 C   0  0  0

+  -11.5337    0.7879   -0.9422 C   0  0  0

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+   -6.3357    1.9578    0.4456 C   0  0  0

+   -5.3214   -5.3209    0.0440 C   0  0  0

+  -11.9587    1.0110    0.3562 C   0  0  0

+   -5.8383    3.2058    0.6476 O   0  0  0

+   -5.7439    3.8256   -0.6366 C   0  0  0

+   -5.1873    5.2421   -0.4795 C   0  0  0

+   -6.1728    6.0812    0.2152 N   0  0  0

+   -5.5011    6.6262    1.4025 C   0  0  0

+   -6.4562    7.2194   -0.6692 C   0  0  0

+   14.4967    0.3113   -0.0335 C   0  0  0

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+   15.6071    0.4543    1.0093 C   0  0  0

+   13.7557   -0.9808    0.1958 C   0  0  0

+   15.0703    0.3056   -1.3423 O   0  0  0

+   12.4308    1.3450   -0.9349 C   0  0  0

+   16.5646   -0.7027    0.8854 C   0  0  0

+   13.1329   -1.1990    1.3647 O   0  0  0

+   13.7222   -1.8203   -0.6725 O   0  0  0

+   11.4586    2.2673   -1.0109 O   0  0  0

+   12.4291    0.4018   -1.6900 O   0  0  0

+   17.6248   -0.7872    1.7044 O   0  0  0

+   16.3781   -1.5544    0.0489 O   0  0  0

+   -9.3001   -4.1216    0.0000 H   0  0  0

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+  1  2  2  0

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+ 33 75  1  0

+ 36 76  1  0

+ 38 77  1  0

+ 40 78  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+85-44-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+   -0.2856    0.7050   -0.0019 C   0  0  0

+   -0.2856   -0.7050   -0.0012 C   0  0  0

+    1.1344    1.1106   -0.0006 C   0  0  0

+   -1.4886    1.3941    0.0016 C   0  0  0

+    1.1344   -1.1106    0.0005 C   0  0  0

+   -1.4886   -1.3941   -0.0022 C   0  0  0

+    1.8980    0.0000    0.0007 O   0  0  0

+    1.5451    2.2531   -0.0013 O   0  0  0

+   -2.6829    0.6913    0.0056 C   0  0  0

+    1.5451   -2.2530    0.0020 O   0  0  0

+   -2.6829   -0.6913   -0.0038 C   0  0  0

+   -1.4947    2.4334    0.0000 H   0  0  0

+   -1.4947   -2.4334    0.0000 H   0  0  0

+   -3.5851    1.2072    0.0000 H   0  0  0

+   -3.5851   -1.2072    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  5  7  1  0

+  9 11  1  0

+  4 12  1  0

+  6 13  1  0

+  9 14  1  0

+ 11 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+134-20-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.1863    0.1867   -0.1107 C   0  0  0

+    0.9991   -0.9251    0.1622 C   0  0  0

+    0.7714    1.4457   -0.2741 C   0  0  0

+   -1.2730    0.0264   -0.2302 C   0  0  0

+    2.3751   -0.7613    0.2667 C   0  0  0

+    0.4313   -2.1812    0.3272 N   0  0  0

+    2.1371    1.5877   -0.1667 C   0  0  0

+   -2.0939    0.6752    0.6192 O   0  0  0

+   -1.7368   -0.6908   -1.0946 O   0  0  0

+    2.9369    0.4879    0.1028 C   0  0  0

+   -3.5325    0.5173    0.5015 C   0  0  0

+    0.1715    2.2866    0.0000 H   0  0  0

+    2.9864   -1.5939    0.0000 H   0  0  0

+   -0.5966   -2.2833    0.0000 H   0  0  0

+    1.0337   -3.0203    0.0000 H   0  0  0

+    2.5575    2.5312    0.0000 H   0  0  0

+    3.9643    0.5942    0.0000 H   0  0  0

+   -3.6452    1.5441    0.0000 H   0  0  0

+   -4.5593    0.4046    0.0000 H   0  0  0

+   -3.4198   -0.5095    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  2  0

+  8 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+114-26-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+   -0.2664   -0.8109    0.4486 C   0  0  0

+   -1.1545   -0.0752   -0.3301 C   0  0  0

+    0.9187   -0.2643    0.8316 O   0  0  0

+   -0.5946   -2.0998    0.8378 C   0  0  0

+   -2.3607   -0.6368   -0.7177 C   0  0  0

+   -0.8393    1.1917   -0.7102 O   0  0  0

+    1.9759   -0.2971   -0.0018 C   0  0  0

+   -1.8019   -2.6518    0.4526 C   0  0  0

+   -2.6793   -1.9249   -0.3308 C   0  0  0

+   -1.2965    2.0603    0.3283 C   0  0  0

+    3.1756    0.1551    0.4135 N   0  0  0

+    1.8481   -0.7346   -1.1283 O   0  0  0

+   -0.1083    2.8281    0.9110 C   0  0  0

+   -2.3117    3.0508   -0.2455 C   0  0  0

+    4.3258    0.1194   -0.4932 C   0  0  0

+    0.1568   -2.7271    0.0000 H   0  0  0

+   -3.1164   -0.0147    0.0000 H   0  0  0

+   -1.9303   -3.6222    0.0000 H   0  0  0

+   -3.6090   -2.2312    0.0000 H   0  0  0

+   -2.0809    1.4749    0.0000 H   0  0  0

+    3.0151    1.1207    0.0000 H   0  0  0

+    0.4229    2.0060    0.0000 H   0  0  0

+    0.7138    3.3593    0.0000 H   0  0  0

+   -0.6395    3.6502    0.0000 H   0  0  0

+   -1.6282    3.7514    0.0000 H   0  0  0

+   -3.0123    3.7343    0.0000 H   0  0  0

+   -2.9952    2.3502    0.0000 H   0  0  0

+    4.2954   -0.8589    0.0000 H   0  0  0

+    5.3041    0.0890    0.0000 H   0  0  0

+    4.3562    1.0977    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7 12  2  0

+ 10 13  1  0

+ 10 14  1  0

+ 11 15  1  0

+  8  9  1  0

+  4 16  1  0

+  5 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121808-62-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -1.0443   -0.6269    0.2188 N   0  0  0

+   -1.4952    0.5679   -0.4746 C   0  0  2

+    0.2652   -0.8911    0.3975 C   0  0  0

+   -2.0971   -1.5349    0.7237 C   0  0  0

+   -0.9792    1.7744    0.2664 C   0  0  0

+   -3.0334    0.6912   -0.6038 C   0  0  0

+    1.3059   -0.0175   -0.2542 C   0  0  1

+    0.6060   -1.8319    1.0829 O   0  0  0

+   -3.5195   -1.0731   -0.3606 S   0  0  0

+   -1.2630    3.0081   -0.1798 O   0  0  0

+   -0.3101    1.6311    1.2623 O   0  0  0

+    2.4918    0.0863    0.6043 N   0  0  0

+    1.8022   -0.6652   -1.5660 C   0  0  0

+    3.6237   -0.0443   -0.1088 C   0  0  0

+    3.2962   -0.2665   -1.5689 C   0  0  0

+    4.7446    0.0090    0.3514 O   0  0  0

+   -0.5376    0.5472    0.0000 H   0  0  0

+   -2.5526   -2.3774    0.0000 H   0  0  0

+   -1.3508   -2.1352    0.0000 H   0  0  0

+   -2.8970    1.6392    0.0000 H   0  0  0

+   -3.9710    0.8870    0.0000 H   0  0  0

+    0.9393    0.8673    0.0000 H   0  0  0

+   -1.4777    3.9415    0.0000 H   0  0  0

+    2.5050    1.0440    0.0000 H   0  0  0

+    0.9724   -1.1434    0.0000 H   0  0  0

+    2.1679   -1.5504    0.0000 H   0  0  0

+    3.1521   -1.2134    0.0000 H   0  0  0

+    4.1062   -0.7776    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  7  3  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  7 12  1  0

+  7 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+  6  9  1  0

+ 14 15  1  0

+  2 17  1  0

+  4 18  1  0

+  4 19  1  0

+  6 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18691-97-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -1.8987    0.7077   -0.0024 C   0  0  0

+   -1.9768   -0.7036   -0.0016 C   0  0  0

+   -0.6509    1.2247   -0.0019 N   0  0  0

+   -3.1312    1.4011    0.0021 C   0  0  0

+   -0.2644   -1.1771   -0.0003 S   0  0  0

+   -3.1713   -1.3795   -0.0015 C   0  0  0

+    0.4246    0.4721   -0.0009 C   0  0  0

+   -4.3190    0.7178    0.0069 C   0  0  0

+   -4.3577   -0.6691   -0.0022 C   0  0  0

+    1.7549    0.8578   -0.0007 N   0  0  0

+    2.7271   -0.0756    0.0005 C   0  0  0

+    2.1051    2.2803   -0.0018 C   0  0  0

+    4.0216    0.2997    0.0007 N   0  0  0

+    2.4365   -1.2561    0.0015 O   0  0  0

+    5.0784   -0.7148    0.0020 C   0  0  0

+   -3.1362    2.4391    0.0000 H   0  0  0

+   -3.1841   -2.4174    0.0000 H   0  0  0

+   -5.2102    1.2500    0.0000 H   0  0  0

+   -5.2678   -1.1683    0.0000 H   0  0  0

+    3.1130    2.0322    0.0000 H   0  0  0

+    2.3532    3.2882    0.0000 H   0  0  0

+    1.0972    2.5284    0.0000 H   0  0  0

+    4.2697    1.3076    0.0000 H   0  0  0

+    4.3596   -1.4636    0.0000 H   0  0  0

+    5.8272   -1.4336    0.0000 H   0  0  0

+    5.7972    0.0340    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  6  9  2  0

+  7 10  1  0

+ 10 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 11 14  2  0

+ 13 15  1  0

+  5  7  1  0

+  8  9  1  0

+  4 16  1  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-64-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 47                          1 V2000

+   -1.1578   -0.5719    0.4048 C   0  0  0

+   -2.2185   -0.3385   -0.3920 O   0  0  0

+   -0.9420    0.1516    1.3561 O   0  0  0

+   -0.2598   -1.7126    0.1250 C   0  0  0

+   -3.1038    0.7782   -0.1137 C   0  0  0

+    1.1187   -1.4988   -0.0640 C   0  0  0

+   -0.7715   -3.0055    0.0524 C   0  0  0

+   -3.7043    1.2918   -1.4239 C   0  0  0

+   -4.2280    0.3181    0.8167 C   0  0  0

+    1.6773   -0.1322    0.0157 C   0  0  0

+    1.9529   -2.5822   -0.3269 C   0  0  0

+    0.0720   -4.0688   -0.2096 C   0  0  0

+   -4.6372    2.4684   -1.1306 C   0  0  0

+   -5.1609    1.4948    1.1099 C   0  0  0

+    3.0099    0.0553   -0.0437 O   0  0  0

+    0.9346    0.8213    0.1348 O   0  0  0

+    1.4261   -3.8580   -0.4010 C   0  0  0

+   -5.7613    2.0084   -0.2002 C   0  0  0

+    3.5584    1.3974    0.0346 C   0  0  0

+    5.0843    1.3308   -0.0563 C   0  0  0

+    5.6623    2.7450    0.0262 C   0  0  0

+    7.1881    2.6784   -0.0647 C   0  0  0

+   -2.3583    1.4965    0.0000 H   0  0  0

+   -1.7956   -3.1570    0.0000 H   0  0  0

+   -4.7165    1.0749    0.0000 H   0  0  0

+   -3.9587    0.2883    0.0000 H   0  0  0

+   -5.0960   -0.2461    0.0000 H   0  0  0

+   -3.7477   -0.5990    0.0000 H   0  0  0

+    2.9791   -2.4457    0.0000 H   0  0  0

+   -0.3051   -5.0329    0.0000 H   0  0  0

+   -3.7692    3.0326    0.0000 H   0  0  0

+   -5.1175    3.3855    0.0000 H   0  0  0

+   -4.1486    1.7116    0.0000 H   0  0  0

+   -4.9065    2.4983    0.0000 H   0  0  0

+    2.0664   -4.6715    0.0000 H   0  0  0

+   -6.2995    2.8927    0.0000 H   0  0  0

+   -6.5498    1.3376    0.0000 H   0  0  0

+    3.7217    2.4197    0.0000 H   0  0  0

+    2.5616    1.6767    0.0000 H   0  0  0

+    4.9210    0.3085    0.0000 H   0  0  0

+    6.0811    1.0515    0.0000 H   0  0  0

+    5.8256    3.7673    0.0000 H   0  0  0

+    4.6655    3.0243    0.0000 H   0  0  0

+    7.1430    1.6442    0.0000 H   0  0  0

+    8.2223    2.6333    0.0000 H   0  0  0

+    7.2332    3.7126    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  1  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  5  1  0

+ 10  6  1  0

+ 11  6  1  0

+ 12  7  2  0

+ 13  8  1  0

+ 14  9  1  0

+ 15 10  1  0

+ 16 10  2  0

+ 17 11  2  0

+ 18 13  1  0

+ 19 15  1  0

+ 20 19  1  0

+ 21 20  1  0

+ 22 21  1  0

+ 12 17  1  0

+ 14 18  1  0

+  5 23  1  0

+  7 24  1  0

+  8 25  1  0

+  8 26  1  0

+  9 27  1  0

+  9 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 19 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+ 21 42  1  0

+ 21 43  1  0

+ 22 44  1  0

+ 22 45  1  0

+ 22 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+133591-33-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.3570   -0.0699    0.0000 C   0  0  0

+   -1.7564   -0.5339    0.0174 C   0  0  0

+   -0.4029    1.3317   -0.0307 C   0  0  0

+    0.8712   -0.7270    0.0133 C   0  0  0

+   -2.5576    0.6172   -0.0039 C   0  0  0

+   -2.3480   -1.7946    0.0483 C   0  0  0

+   -1.7293    1.7249   -0.0327 N   0  0  0

+    0.7874    2.0525   -0.0527 C   0  0  0

+    2.0392    0.0040   -0.0104 C   0  0  0

+    0.9225   -2.2325    0.0541 C   0  0  0

+   -3.9429    0.4838    0.0061 C   0  0  0

+   -3.7215   -1.9064    0.0578 C   0  0  0

+    1.9955    1.3895   -0.0438 C   0  0  0

+    0.7553    3.5588   -0.0859 C   0  0  0

+    3.3453   -0.6923    0.0042 N   0  3  0

+   -4.5150   -0.7695    0.0367 C   0  0  0

+    4.0739   -0.5999    0.9758 O   0  0  0

+    3.6913   -1.3579   -0.9555 O   0  5  0

+   -1.7541   -2.6505    0.0000 H   0  0  0

+   -2.0573    2.7137    0.0000 H   0  0  0

+   -0.1186   -2.2680    0.0000 H   0  0  0

+    0.9580   -3.2736    0.0000 H   0  0  0

+    1.9636   -2.1970    0.0000 H   0  0  0

+   -4.5476    1.3321    0.0000 H   0  0  0

+   -4.1653   -2.8489    0.0000 H   0  0  0

+    2.8835    1.9342    0.0000 H   0  0  0

+    1.7968    3.5810    0.0000 H   0  0  0

+    0.7331    4.6003    0.0000 H   0  0  0

+   -0.2862    3.5366    0.0000 H   0  0  0

+   -5.5525   -0.8637    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  2  0

+ 15 17  2  0

+ 15 18  1  0

+  5  7  1  0

+  9 13  1  0

+ 12 16  1  0

+  6 19  1  0

+  7 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-86-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.1728   -0.7486   -0.2518 C   0  0  0

+   -1.2716   -0.6477    0.2427 C   0  0  0

+    0.9436    0.3163    0.3087 O   0  0  0

+   -1.8267    0.6057   -0.1608 O   0  0  0

+    2.2753    0.1680   -0.1879 C   0  0  0

+   -0.0840   -1.7322    0.0000 H   0  0  0

+    1.0921   -1.1824    0.0000 H   0  0  0

+   -2.2553   -0.9038    0.0000 H   0  0  0

+   -1.1777   -1.6599    0.0000 H   0  0  0

+   -2.2383    1.5352    0.0000 H   0  0  0

+    2.1628   -0.8423    0.0000 H   0  0  0

+    3.2856    0.0555    0.0000 H   0  0  0

+    2.3878    1.1783    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+102-50-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    1.1579   -0.2604   -0.0022 C   0  0  0

+    0.1289   -1.1902   -0.0017 C   0  0  0

+    0.8680    1.0962   -0.0016 C   0  0  0

+    2.4519   -0.6789    0.0024 O   0  0  0

+   -1.1856   -0.7660   -0.0005 C   0  0  0

+   -0.4456    1.5219   -0.0004 C   0  0  0

+    3.2659    0.4957    0.0006 C   0  0  0

+   -1.4767    0.5915    0.0001 C   0  0  0

+   -2.3036   -1.7765    0.0005 C   0  0  0

+   -2.8082    1.0221    0.0017 N   0  0  0

+    0.3472   -2.2079    0.0000 H   0  0  0

+    1.6409    1.7934    0.0000 H   0  0  0

+   -0.6629    2.5398    0.0000 H   0  0  0

+    4.1214   -0.0972    0.0000 H   0  0  0

+    3.8588    1.3512    0.0000 H   0  0  0

+    2.4104    1.0886    0.0000 H   0  0  0

+   -3.0015   -1.0043    0.0000 H   0  0  0

+   -3.0758   -2.4744    0.0000 H   0  0  0

+   -1.6057   -2.5487    0.0000 H   0  0  0

+   -3.0260    2.0399    0.0000 H   0  0  0

+   -3.5807    0.3246    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  8 10  1  0

+  6  8  1  0

+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3234-28-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 43                          1 V2000

+   -6.2008    0.3885   -0.3548 C   0  0  0

+   -7.4539   -0.4753   -0.1988 C   0  0  0

+   -6.9926    0.3970    0.8348 O   0  0  0

+   -4.9563   -0.4734   -0.1330 C   0  0  0

+   -3.7032    0.3904   -0.2890 C   0  0  0

+   -2.4588   -0.4716   -0.0672 C   0  0  0

+   -1.2056    0.3923   -0.2232 C   0  0  0

+    0.0388   -0.4697   -0.0014 C   0  0  0

+    1.2920    0.3941   -0.1574 C   0  0  0

+    2.5364   -0.4678    0.0644 C   0  0  0

+    3.7896    0.3960   -0.0917 C   0  0  0

+    5.0340   -0.4660    0.1301 C   0  0  0

+    6.2872    0.3979   -0.0259 C   0  0  0

+    7.5316   -0.4641    0.1959 C   0  0  0

+    8.7847    0.3998    0.0399 C   0  0  0

+   -5.8564    1.4704    0.0000 H   0  0  0

+   -8.5807   -0.3359    0.0000 H   0  0  0

+   -7.1838   -1.5781    0.0000 H   0  0  0

+   -5.7103   -1.3223    0.0000 H   0  0  0

+   -4.2042   -1.3239    0.0000 H   0  0  0

+   -2.9492    1.2392    0.0000 H   0  0  0

+   -4.4553    1.2410    0.0000 H   0  0  0

+   -3.2128   -1.3204    0.0000 H   0  0  0

+   -1.7067   -1.3222    0.0000 H   0  0  0

+   -0.4516    1.2411    0.0000 H   0  0  0

+   -1.9577    1.2429    0.0000 H   0  0  0

+   -0.7152   -1.3185    0.0000 H   0  0  0

+    0.7908   -1.3203    0.0000 H   0  0  0

+    2.0460    1.2430    0.0000 H   0  0  0

+    0.5399    1.2447    0.0000 H   0  0  0

+    1.7824   -1.3167    0.0000 H   0  0  0

+    3.2885   -1.3184    0.0000 H   0  0  0

+    4.5436    1.2448    0.0000 H   0  0  0

+    3.0376    1.2466    0.0000 H   0  0  0

+    4.2800   -1.3148    0.0000 H   0  0  0

+    5.7861   -1.3166    0.0000 H   0  0  0

+    7.0412    1.2467    0.0000 H   0  0  0

+    5.5351    1.2485    0.0000 H   0  0  0

+    6.7776   -1.3130    0.0000 H   0  0  0

+    8.2837   -1.3146    0.0000 H   0  0  0

+    9.4291   -0.5350    0.0000 H   0  0  0

+    9.7195    1.0442    0.0000 H   0  0  0

+    8.1403    1.3346    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+  2  3  1  0

+  1 16  1  0

+  2 17  1  0

+  2 18  1  0

+  4 19  1  0

+  4 20  1  0

+  5 21  1  0

+  5 22  1  0

+  6 23  1  0

+  6 24  1  0

+  7 25  1  0

+  7 26  1  0

+  8 27  1  0

+  8 28  1  0

+  9 29  1  0

+  9 30  1  0

+ 10 31  1  0

+ 10 32  1  0

+ 11 33  1  0

+ 11 34  1  0

+ 12 35  1  0

+ 12 36  1  0

+ 13 37  1  0

+ 13 38  1  0

+ 14 39  1  0

+ 14 40  1  0

+ 15 41  1  0

+ 15 42  1  0

+ 15 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+205-99-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+    0.1547    0.5828   -0.0039 C   0  0  0

+    0.4205   -0.8442   -0.0035 C   0  0  0

+    1.3395    1.3170   -0.0013 C   0  0  0

+   -1.1205    1.1397   -0.0011 C   0  0  0

+    1.8934   -0.9675   -0.0012 C   0  0  0

+   -0.6472   -1.6909   -0.0044 C   0  0  0

+    2.4437    0.3366    0.0008 C   0  0  0

+    1.2140    2.7000   -0.0017 C   0  0  0

+   -2.2471    0.2033    0.0039 C   0  0  0

+   -1.2158    2.5321   -0.0018 C   0  0  0

+    2.7423   -2.0696   -0.0008 C   0  0  0

+   -1.9718   -1.1882   -0.0045 C   0  0  0

+    3.8279    0.4899    0.0046 C   0  0  0

+   -0.0507    3.2778   -0.0042 C   0  0  0

+   -3.5676    0.6503    0.0063 C   0  0  0

+    4.1106   -1.8927    0.0021 C   0  0  0

+   -3.0524   -2.0875   -0.0025 C   0  0  0

+    4.6505   -0.6174    0.0060 C   0  0  0

+   -4.5925   -0.2533    0.0119 C   0  0  0

+   -4.3316   -1.6183   -0.0046 C   0  0  0

+   -0.4872   -2.7226    0.0000 H   0  0  0

+    2.0659    3.3035    0.0000 H   0  0  0

+   -2.1483    3.0017    0.0000 H   0  0  0

+    2.3425   -3.0341    0.0000 H   0  0  0

+    4.2448    1.4471    0.0000 H   0  0  0

+   -0.1241    4.3193    0.0000 H   0  0  0

+   -3.7731    1.6739    0.0000 H   0  0  0

+    4.7420   -2.7242    0.0000 H   0  0  0

+   -2.8745   -3.1163    0.0000 H   0  0  0

+    5.6871   -0.4932    0.0000 H   0  0  0

+   -5.5803    0.0847    0.0000 H   0  0  0

+   -5.1274   -2.2941    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  6 12  1  0

+  7 13  2  0

+  8 14  2  0

+  9 15  2  0

+ 11 16  1  0

+ 12 17  2  0

+ 13 18  1  0

+ 15 19  1  0

+ 17 20  1  0

+  5  7  1  0

+  9 12  1  0

+ 10 14  1  0

+ 16 18  2  0

+ 19 20  2  0

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+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

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+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-05-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    1.3365    0.0118   -0.4613 C   0  0  0

+    0.2037   -0.7950    0.1190 C   0  0  0

+    2.3692    0.3207    0.2831 C   0  0  0

+   -1.3244    0.1567    0.0201 Cl  0  0  0

+    0.8783    0.9488    0.0000 H   0  0  0

+   -0.4592   -1.6003    0.0000 H   0  0  0

+    0.9151   -1.5578    0.0000 H   0  0  0

+    3.1277   -0.3953    0.0000 H   0  0  0

+    2.6100    1.3356    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16238-56-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+    1.3702   -0.4519    0.1137 C   0  0  0

+    0.3141    0.4712    0.5330 C   0  0  0

+    2.7408    0.0619   -0.0237 C   0  0  0

+    1.0802   -1.7816   -0.1415 C   0  0  0

+   -0.9930    0.0190    0.6735 C   0  0  0

+    0.6520    1.8682    0.8010 C   0  0  0

+    2.9982    1.4214    0.2507 C   0  0  0

+    3.7848   -0.7756   -0.4199 C   0  0  0

+   -0.2317   -2.2434    0.0032 C   0  0  0

+    2.1726   -2.7261   -0.5724 C   0  0  0

+   -1.2926   -1.3203    0.4125 C   0  0  0

+   -2.0807    0.9684    1.1056 C   0  0  0

+    1.9169    2.3091    0.6663 C   0  0  0

+    4.3060    1.9094    0.1191 C   0  0  0

+    5.0583   -0.2668   -0.5396 C   0  0  0

+   -0.5630   -3.5898   -0.2479 C   0  0  0

+   -2.6068   -1.8136    0.5442 C   0  0  0

+   -2.8901    1.8028   -0.4798 Br  0  0  0

+    5.3107    1.0723   -0.2701 C   0  0  0

+   -1.8487   -4.0030   -0.0969 C   0  0  0

+   -2.8609   -3.1222    0.2813 C   0  0  0

+   -0.1167    2.5650    0.0000 H   0  0  0

+    3.6318   -1.8018    0.0000 H   0  0  0

+    1.4940   -3.5110    0.0000 H   0  0  0

+    2.9575   -3.4047    0.0000 H   0  0  0

+    2.8512   -1.9412    0.0000 H   0  0  0

+   -3.0795    0.6874    0.0000 H   0  0  0

+   -2.3088   -0.0437    0.0000 H   0  0  0

+    2.0986    3.3306    0.0000 H   0  0  0

+    4.4803    2.9322    0.0000 H   0  0  0

+    5.8595   -0.9260    0.0000 H   0  0  0

+    0.1958   -4.2974    0.0000 H   0  0  0

+   -3.3992   -1.1438    0.0000 H   0  0  0

+    6.2871    1.4231    0.0000 H   0  0  0

+   -2.0574   -5.0193    0.0000 H   0  0  0

+   -3.8420   -3.4598    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+  8 15  2  0

+  9 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 14 19  2  0

+ 16 20  2  0

+ 17 21  2  0

+  7 13  1  0

+  9 11  2  0

+ 15 19  1  0

+ 20 21  1  0

+  6 22  1  0

+  8 23  1  0

+ 10 24  1  0

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+ 10 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-31-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.0000    0.0247   -0.0009 C   0  0  0

+   -1.1672    0.6986    0.0009 N   0  0  0

+    1.1672    0.6986    0.0008 N   0  0  0

+    0.0000   -1.1911    0.0009 O   0  0  0

+   -2.4359   -0.0339   -0.0010 C   0  0  0

+    2.4359   -0.0339   -0.0012 C   0  0  0

+   -1.1672    1.7094    0.0000 H   0  0  0

+    1.1672    1.7094    0.0000 H   0  0  0

+   -2.9413    0.8415    0.0000 H   0  0  0

+   -3.3113   -0.5393    0.0000 H   0  0  0

+   -1.9305   -0.9093    0.0000 H   0  0  0

+    1.9305   -0.9093    0.0000 H   0  0  0

+    3.3113   -0.5393    0.0000 H   0  0  0

+    2.9413    0.8415    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  2  7  1  0

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+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1785-51-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    0.7213   -0.1718   -0.0019 C   0  0  0

+   -0.6779    0.2857   -0.0008 C   0  0  0

+    1.7022    0.6989   -0.0008 C   0  0  0

+    0.9850   -1.6220    0.0021 C   0  0  0

+   -1.7406   -0.7379   -0.0017 C   0  0  0

+   -0.9651    1.5649    0.0003 C   0  0  0

+    3.0946    0.2196   -0.0014 C   0  0  0

+    1.3915    2.1382    0.0014 C   0  0  0

+   -0.0239   -2.4626    0.0067 C   0  0  0

+    2.3786   -2.0981    0.0014 C   0  0  0

+   -3.1415   -0.2732   -0.0007 C   0  0  0

+   -1.4226   -2.0075   -0.0029 C   0  0  0

+    0.1382    2.5459    0.0006 C   0  0  0

+   -2.3620    2.0226    0.0019 C   0  0  0

+    3.3685   -1.2291   -0.0029 C   0  0  0

+    4.0068    1.0085   -0.0001 O   0  0  0

+   -3.3746    1.1872    0.0012 C   0  0  0

+   -4.0605   -1.0542   -0.0018 O   0  0  0

+    2.2103    2.8775    0.0000 H   0  0  0

+    0.1845   -3.5459    0.0000 H   0  0  0

+    2.5930   -3.1802    0.0000 H   0  0  0

+   -2.2291   -2.7601    0.0000 H   0  0  0

+   -0.0876    3.6257    0.0000 H   0  0  0

+   -2.5666    3.1066    0.0000 H   0  0  0

+    4.4115   -1.5884    0.0000 H   0  0  0

+   -4.4065    1.5772    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  2  0

+ 11 17  1  0

+ 11 18  2  0

+  8 13  2  0

+  9 12  1  0

+ 10 15  2  0

+ 14 17  2  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+918-00-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.0950   -0.0105    0.0000 C   0  0  0

+   -1.4108    0.0498    0.0000 C   0  0  0

+    0.7635    1.6640    0.0000 Cl  0  0  0

+    0.6615   -0.8838    1.4721 Cl  0  0  0

+    0.6615   -0.8838   -1.4721 Cl  0  0  0

+   -2.2159   -1.2241    0.0000 C   0  0  0

+   -1.9723    1.1189    0.0000 O   0  0  0

+   -3.0764   -0.6803    0.0000 H   0  0  0

+   -2.7597   -2.0846    0.0000 H   0  0  0

+   -1.3554   -1.7679    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  6  8  1  0

+  6  9  1  0

+  6 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+528-45-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.4199    0.5022   -0.0340 C   0  0  0

+   -0.8424   -0.8113    0.0725 C   0  0  0

+    0.9273    0.7959   -0.0684 C   0  0  0

+   -1.4160    1.5939   -0.1174 N   0  3  0

+    0.0818   -1.8382    0.1458 C   0  0  0

+   -2.2898   -1.1189    0.1088 N   0  3  0

+    1.8656   -0.2358    0.0047 C   0  0  0

+   -2.4150    1.4558   -0.8003 O   0  0  0

+   -1.2366    2.6302    0.4968 O   0  5  0

+    1.4324   -1.5585    0.1125 C   0  0  0

+   -2.7281   -2.0618   -0.5255 O   0  0  0

+   -3.0425   -0.4291    0.7730 O   0  5  0

+    3.3102    0.0712   -0.0321 C   0  0  0

+    4.2128   -0.9263    0.0386 O   0  0  0

+    3.6841    1.2231   -0.1260 O   0  0  0

+    1.2419    1.7813    0.0000 H   0  0  0

+   -0.2405   -2.8211    0.0000 H   0  0  0

+    2.1217   -2.3299    0.0000 H   0  0  0

+    4.9069   -1.6933    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

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+  6 11  2  0

+  6 12  1  0

+  7 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+  7 10  2  0

+  3 16  1  0

+  5 17  1  0

+ 10 18  1  0

+ 14 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101-70-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    1.1811    1.0379    0.0443 C   0  0  0

+   -0.0208    1.7356    0.2079 N   0  0  0

+    1.7080    0.8498   -1.2272 C   0  0  0

+    1.8509    0.5380    1.1533 C   0  0  0

+   -1.2408    1.0537    0.1381 C   0  0  0

+    2.8942    0.1617   -1.3877 C   0  0  0

+    3.0374   -0.1500    0.9908 C   0  0  0

+   -2.4345    1.7632    0.1401 C   0  0  0

+   -1.2584   -0.3332    0.0608 C   0  0  0

+    3.5599   -0.3418   -0.2795 C   0  0  0

+   -3.6381    1.0893    0.0711 C   0  0  0

+   -2.4626   -1.0051   -0.0081 C   0  0  0

+    4.7282   -1.0195   -0.4386 O   0  0  0

+   -3.6548   -0.2957   -0.0002 C   0  0  0

+    5.1629   -1.4053    0.8669 C   0  0  0

+   -4.8404   -0.9584   -0.0680 O   0  0  0

+   -4.5315   -2.3522   -0.1305 C   0  0  0

+   -0.0124    2.7670    0.0000 H   0  0  0

+    2.1420    1.7855    0.0000 H   0  0  0

+    1.2828   -0.3229    0.0000 H   0  0  0

+    3.4651    1.0207    0.0000 H   0  0  0

+    2.5993   -1.0838    0.0000 H   0  0  0

+   -2.4212    2.7946    0.0000 H   0  0  0

+   -0.3723   -0.8611    0.0000 H   0  0  0

+   -4.5248    1.6163    0.0000 H   0  0  0

+   -2.4769   -2.0364    0.0000 H   0  0  0

+    4.4782   -2.1767    0.0000 H   0  0  0

+    5.9343   -2.0900    0.0000 H   0  0  0

+    5.8476   -0.6339    0.0000 H   0  0  0

+   -5.5385   -2.5754    0.0000 H   0  0  0

+   -4.3083   -3.3592    0.0000 H   0  0  0

+   -3.5245   -2.1290    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 13 15  1  0

+ 14 16  1  0

+ 16 17  1  0

+  7 10  2  0

+ 12 14  1  0

+  2 18  1  0

+  3 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20268-51-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    0.8047    0.5167    0.0036 C   0  0  0

+    0.0907   -0.7613    0.0013 C   0  0  0

+    2.2748    0.5020    0.0022 C   0  0  0

+    0.1055    1.7119    0.0013 C   0  0  0

+   -1.2993   -0.7844    0.0020 C   0  0  0

+    0.8564   -2.0068   -0.0022 C   0  0  0

+    2.9519   -0.7355   -0.0012 C   0  0  0

+    3.0044    1.6919    0.0038 C   0  0  0

+   -1.2927    1.6950   -0.0033 C   0  0  0

+   -2.0103    0.4182    0.0049 C   0  0  0

+   -2.0223   -2.0766   -0.0008 N   0  3  0

+    2.2026   -1.9879   -0.0034 C   0  0  0

+    4.3539   -0.7474   -0.0026 C   0  0  0

+    4.3803    1.6473    0.0020 C   0  0  0

+   -2.0367    2.8917   -0.0062 C   0  0  0

+   -3.4201    0.4330    0.0062 C   0  0  0

+   -2.3191   -2.6107    1.0528 O   0  0  0

+   -2.3203   -2.6054   -1.0568 O   0  5  0

+    5.0462    0.4284   -0.0005 C   0  0  0

+   -3.3945    2.8368   -0.0110 C   0  0  0

+   -4.0778    1.6218    0.0095 C   0  0  0

+    0.6211    2.6235    0.0000 H   0  0  0

+    0.3517   -2.9245    0.0000 H   0  0  0

+    2.5077    2.6139    0.0000 H   0  0  0

+    2.7256   -2.8953    0.0000 H   0  0  0

+    4.8698   -1.6588    0.0000 H   0  0  0

+    4.9291    2.5393    0.0000 H   0  0  0

+   -1.5465    3.8172    0.0000 H   0  0  0

+   -3.9567   -0.4664    0.0000 H   0  0  0

+    6.0934    0.4116    0.0000 H   0  0  0

+   -3.9414    3.7300    0.0000 H   0  0  0

+   -5.1251    1.6255    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  2  0

+ 11 18  1  0

+ 13 19  2  0

+ 15 20  2  0

+ 16 21  2  0

+  7 12  1  0

+  9 10  2  0

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+ 20 21  1  0

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+  6 23  1  0

+  8 24  1  0

+ 12 25  1  0

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+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+524-89-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 30                          1 V2000

+   -0.0817    0.4090   -0.1428 C   0  0  0

+   -0.1432   -0.9990    0.0135 C   0  0  0

+    1.1788    1.0375   -0.2095 C   0  0  0

+   -1.2688    1.1554   -0.2230 C   0  0  0

+    0.9784   -1.7228    0.0942 N   0  0  0

+   -1.4012   -1.6222    0.0838 C   0  0  0

+    2.3095    0.2309   -0.1167 C   0  0  0

+    1.2858    2.3805   -0.3592 O   0  0  0

+   -2.4746    0.5218   -0.1463 C   0  0  0

+    2.1738   -1.1657    0.0361 C   0  0  0

+   -2.5405   -0.8740    0.0017 C   0  0  0

+    3.7554    0.4880   -0.1403 C   0  0  0

+    1.4464    2.9305    0.9499 C   0  0  0

+   -3.7493    1.0115   -0.1961 O   0  0  0

+    3.4219   -1.6766    0.0953 O   0  0  0

+   -3.8555   -1.2403    0.0454 O   0  0  0

+    4.3472   -0.7050   -0.0083 C   0  0  0

+   -4.5827   -0.0303    0.3442 C   0  0  0

+   -1.2291    2.1784    0.0000 H   0  0  0

+   -1.4632   -2.6441    0.0000 H   0  0  0

+    4.2165    1.4021    0.0000 H   0  0  0

+    2.4292    2.6435    0.0000 H   0  0  0

+    1.7334    3.9133    0.0000 H   0  0  0

+    0.4636    3.2175    0.0000 H   0  0  0

+    5.3595   -0.8582    0.0000 H   0  0  0

+   -5.3011    0.6991    0.0000 H   0  0  0

+   -5.3918   -0.6576    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

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+ 12 17  2  0

+ 14 18  1  0

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+ 15 17  1  0

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+  4 19  1  0

+  6 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105596-43-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 33                          1 V2000

+    0.2468   -0.6020    0.0449 C   0  0  0

+   -0.9355    0.1401    0.0888 C   0  0  0

+    1.5676    0.0341    0.0615 C   0  0  0

+    0.1748   -2.0132   -0.0118 C   0  0  0

+   -0.8775    1.6479    0.1555 C   0  0  0

+   -2.1434   -0.4941    0.0720 C   0  0  0

+    1.7236    1.4206    0.1229 C   0  0  0

+    2.7168   -0.7888    0.0132 C   0  0  0

+   -1.0809   -2.6367   -0.0210 C   0  0  0

+    1.3625   -2.7796   -0.0589 C   0  0  0

+    0.5073    2.3147    0.1738 C   0  0  0

+   -0.2501    2.1489   -1.0266 O   0  0  0

+   -2.2157   -1.8811    0.0113 C   0  0  0

+   -3.3898    0.3030    0.1194 N   0  3  0

+    2.9725    1.9695    0.1369 C   0  0  0

+    2.5765   -2.1947   -0.0499 C   0  0  0

+    3.9871   -0.1956    0.0290 C   0  0  0

+   -3.5258    1.1711    0.9629 O   0  0  0

+   -4.2794    0.0908   -0.6850 O   0  5  0

+    4.1031    1.1618    0.0899 C   0  0  0

+   -1.8118    2.1198    0.0000 H   0  0  0

+   -1.1471   -3.6813    0.0000 H   0  0  0

+    1.2976   -3.8243    0.0000 H   0  0  0

+    0.7247    3.3386    0.0000 H   0  0  0

+   -3.1509   -2.3511    0.0000 H   0  0  0

+    3.0802    3.0106    0.0000 H   0  0  0

+    3.4340   -2.7949    0.0000 H   0  0  0

+    4.8453   -0.7949    0.0000 H   0  0  0

+    5.0534    1.6006    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

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+  6 13  1  0

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+  7 15  2  0

+  8 16  1  0

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+  5 21  1  0

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+ 11 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 20 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57564-91-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+   -1.3554    0.0858   -0.0041 C   0  0  1

+   -2.5290    0.9580    0.3605 C   0  0  0

+   -0.1440    0.6046    0.6359 N   0  0  0

+   -1.6137   -1.3437    0.4761 C   0  0  0

+   -3.7562    0.6708   -0.1171 N   0  0  0

+   -2.3693    1.9183    1.0838 O   0  0  0

+    1.0561    0.4306    0.0478 C   0  0  0

+   -0.2041   -2.3912    0.0381 S   0  0  0

+   -4.8971    1.5186    0.2375 C   0  0  0

+    2.3023    0.9643    0.7061 C   0  0  0

+    1.1333   -0.1553   -1.0113 O   0  0  0

+   -0.2105   -3.9051    0.4147 N   0  0  0

+   -6.1432    0.9850   -0.4209 C   0  0  0

+    3.5185    0.6350   -0.1618 C   0  0  0

+    0.7381   -4.6100    0.1200 O   0  0  0

+   -7.3186    1.6064   -0.2362 O   0  0  0

+   -6.0843   -0.0022   -1.1150 O   0  0  0

+    4.7837    1.1768    0.5066 C   0  0  1

+    5.9817    0.8524   -0.3482 C   0  0  0

+    4.6712    2.6335    0.6595 N   0  0  0

+    6.6469   -0.2985   -0.1624 O   0  0  0

+    6.3433    1.6284   -1.2008 O   0  0  0

+   -0.5755   -0.5352    0.0000 H   0  0  0

+   -0.2736    1.5931    0.0000 H   0  0  0

+   -2.5562   -1.0186    0.0000 H   0  0  0

+   -2.0791   -2.2254    0.0000 H   0  0  0

+   -3.9588   -0.3054    0.0000 H   0  0  0

+   -4.1717    2.2026    0.0000 H   0  0  0

+   -5.4437    2.3524    0.0000 H   0  0  0

+    2.8361    1.8063    0.0000 H   0  0  0

+    1.6561    1.7235    0.0000 H   0  0  0

+    2.9847   -0.2070    0.0000 H   0  0  0

+    4.1647   -0.1242    0.0000 H   0  0  0

+   -8.2000    2.0724    0.0000 H   0  0  0

+    4.8535    0.1823    0.0000 H   0  0  0

+    5.4937    3.1970    0.0000 H   0  0  0

+    3.7720    3.0640    0.0000 H   0  0  0

+    7.1458   -1.1617    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  5 27  1  0

+  9 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 14 32  1  0

+ 14 33  1  0

+ 16 34  1  0

+ 18 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+40277-05-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    0.5226    0.6963    0.0762 P   0  0  0

+   -0.6385   -0.4870    0.3665 N   0  0  0

+    1.9852    0.3432    0.8221 N   0  0  0

+    1.0903    0.6306   -1.4241 O   0  0  0

+    0.0293    2.0465    0.4285 O   0  0  0

+   -1.8580   -0.0626   -0.3339 C   0  0  0

+   -0.1717   -1.7092   -0.3016 C   0  0  0

+    2.8578    1.5085    0.6447 C   0  0  0

+    1.8877    1.7925   -1.6365 C   0  0  0

+   -2.8787    0.4498    0.6843 C   0  0  0

+    0.2198   -2.7481    0.7512 C   0  0  0

+    3.1885    1.6794   -0.8395 C   0  0  0

+    2.1920    2.6793    1.1222 O   0  0  0

+   -4.3755    0.9707   -0.1752 Cl  0  0  0

+    0.7926   -4.2482   -0.0687 Cl  0  0  0

+    2.3274   -0.6072    0.0000 H   0  0  0

+   -2.6770   -0.6540    0.0000 H   0  0  0

+   -1.7118   -1.0621    0.0000 H   0  0  0

+    0.8253   -1.8719    0.0000 H   0  0  0

+    0.4665   -0.9262    0.0000 H   0  0  0

+    3.5105    0.7375    0.0000 H   0  0  0

+    2.1457    2.7691    0.0000 H   0  0  0

+    0.9695    2.2135    0.0000 H   0  0  0

+   -2.0597    1.0412    0.0000 H   0  0  0

+   -3.0249    1.4493    0.0000 H   0  0  0

+   -0.7772   -2.5854    0.0000 H   0  0  0

+   -0.4184   -3.5311    0.0000 H   0  0  0

+    3.9220    0.9849    0.0000 H   0  0  0

+    3.6026    2.6008    0.0000 H   0  0  0

+    1.6926    3.5574    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

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+  3 16  1  0

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+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2516-93-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -0.0804   -0.1845    0.0000 O   0  0  0

+   -1.1757    0.7334    0.0000 C   0  0  0

+    1.1148    0.5987    0.0000 C   0  0  0

+   -2.4733   -0.0329    0.0000 C   0  0  0

+    2.3320   -0.3283    0.0000 C   0  0  0

+   -2.4613   -1.2411    0.0000 O   0  0  0

+   -3.6423    0.6267    0.0000 O   0  0  0

+    3.6117    0.5103    0.0000 C   0  0  0

+    4.8289   -0.4168    0.0000 C   0  0  0

+   -0.3777    1.4919    0.0000 H   0  0  0

+   -1.8391    1.6121    0.0000 H   0  0  0

+    1.8766    1.3936    0.0000 H   0  0  0

+    0.4111    1.4455    0.0000 H   0  0  0

+    1.5702   -1.1232    0.0000 H   0  0  0

+    3.0357   -1.1751    0.0000 H   0  0  0

+   -4.6012    1.1678    0.0000 H   0  0  0

+    4.3735    1.3052    0.0000 H   0  0  0

+    2.9080    1.3571    0.0000 H   0  0  0

+    4.1618   -1.2927    0.0000 H   0  0  0

+    5.7048   -1.0839    0.0000 H   0  0  0

+    5.4960    0.4591    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  1  0

+  6  4  2  0

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+  8  5  1  0

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+  2 10  1  0

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+  5 14  1  0

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+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+27093-62-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+    0.7317    0.4855   -0.0029 C   0  0  0

+   -0.7317    0.4855   -0.0011 C   0  0  0

+    1.1331    1.8244   -0.0014 C   0  0  0

+    1.7479   -0.5604   -0.0004 C   0  0  0

+   -1.1330    1.8244    0.0015 C   0  0  0

+   -1.7479   -0.5604   -0.0014 C   0  0  0

+    0.0000    2.6124    0.0012 N   0  0  0

+    2.4987    2.1427   -0.0027 C   0  0  0

+    3.1129   -0.1834   -0.0036 C   0  0  0

+    1.4069   -1.9179    0.0055 C   0  0  0

+   -2.4987    2.1427    0.0033 C   0  0  0

+   -3.1129   -0.1834    0.0010 C   0  0  0

+   -1.4069   -1.9179   -0.0044 C   0  0  0

+    0.0000    4.0774    0.0034 C   0  0  0

+    3.4550    1.1827   -0.0053 C   0  0  0

+    4.1004   -1.1813   -0.0012 C   0  0  0

+    2.3915   -2.8614    0.0080 C   0  0  0

+   -3.4550    1.1827    0.0027 C   0  0  0

+   -4.1004   -1.1813    0.0007 C   0  0  0

+   -2.3915   -2.8613   -0.0051 C   0  0  0

+    3.7339   -2.4934    0.0041 C   0  0  0

+   -3.7340   -2.4934   -0.0019 C   0  0  0

+    2.7880    3.1518    0.0000 H   0  0  0

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+   -0.3981   -2.2083    0.0000 H   0  0  0

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+    0.0000    5.1272    0.0000 H   0  0  0

+   -1.0498    4.0774    0.0000 H   0  0  0

+    4.4670    1.4617    0.0000 H   0  0  0

+    5.1165   -0.9176    0.0000 H   0  0  0

+    2.1336   -3.8790    0.0000 H   0  0  0

+   -4.4670    1.4617    0.0000 H   0  0  0

+   -5.1165   -0.9176    0.0000 H   0  0  0

+   -2.1335   -3.8789    0.0000 H   0  0  0

+    4.4744   -3.2375    0.0000 H   0  0  0

+   -4.4745   -3.2375    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  6 13  1  0

+  7 14  1  0

+  8 15  2  0

+  9 16  1  0

+ 10 17  2  0

+ 11 18  2  0

+ 12 19  1  0

+ 13 20  2  0

+ 16 21  2  0

+ 19 22  2  0

+  5  7  1  0

+  9 15  1  0

+ 12 18  1  0

+ 17 21  1  0

+ 20 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23250-39-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.4180    0.2671   -0.0053 C   0  0  0

+   -0.1851   -1.1333   -0.0035 C   0  0  0

+    0.6789    1.1516   -0.0040 C   0  0  0

+   -1.7368    0.7529   -0.0024 C   0  0  0

+    1.0563   -1.6170   -0.0002 N   0  0  0

+   -1.2916   -2.0072   -0.0047 C   0  0  0

+    1.9721    0.5931   -0.0010 C   0  0  0

+    0.4927    2.5175   -0.0061 N   0  0  0

+   -2.7782   -0.1241    0.0020 C   0  0  0

+    2.1224   -0.8189    0.0011 C   0  0  0

+   -2.5531   -1.5018   -0.0077 C   0  0  0

+    3.1131    1.4138    0.0005 C   0  0  0

+   -4.4063    0.4784    0.0061 Cl  0  0  0

+    3.4227   -1.3644    0.0046 C   0  0  0

+    4.3502    0.8477    0.0034 C   0  0  0

+    4.5024   -0.5390    0.0064 C   0  0  0

+   -1.9181    1.7877    0.0000 H   0  0  0

+   -1.1411   -3.0469    0.0000 H   0  0  0

+    1.3232    3.1608    0.0000 H   0  0  0

+   -0.4797    2.9151    0.0000 H   0  0  0

+   -3.3727   -2.1590    0.0000 H   0  0  0

+    3.0112    2.4594    0.0000 H   0  0  0

+    3.5565   -2.4064    0.0000 H   0  0  0

+    5.2018    1.4628    0.0000 H   0  0  0

+    5.4682   -0.9523    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+  7 10  1  0

+  9 11  1  0

+ 15 16  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-51-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.3200    0.9466    0.0017 C   0  0  0

+   -0.2969   -0.2989    0.0001 C   0  0  0

+    1.7062    1.0312    0.0019 C   0  0  0

+   -0.4528    2.1110   -0.0026 N   0  0  0

+    0.4708   -1.4481   -0.0014 C   0  0  0

+   -2.0293   -0.4108    0.0005 Cl  0  0  0

+    2.4672   -0.1214    0.0004 C   0  0  0

+    1.8507   -1.3593   -0.0012 C   0  0  0

+    2.1706    1.9611    0.0000 H   0  0  0

+    0.0098    3.0418    0.0000 H   0  0  0

+   -1.4902    2.0462    0.0000 H   0  0  0

+    0.0105   -2.3800    0.0000 H   0  0  0

+    3.5047   -0.0583    0.0000 H   0  0  0

+    2.4259   -2.2250    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  7 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-95-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    0.7344   -0.1031    0.1125 C   0  0  0

+   -0.7344    0.1031    0.1125 C   0  0  0

+    1.5831    0.9239   -0.2976 C   0  0  0

+    1.2676   -1.3221    0.5279 C   0  0  0

+   -1.5831   -0.9240   -0.2976 C   0  0  0

+   -1.2676    1.3221    0.5279 C   0  0  0

+    2.9535    0.7280   -0.2964 C   0  0  0

+    2.6343   -1.5150    0.5283 C   0  0  0

+   -2.9535   -0.7280   -0.2964 C   0  0  0

+   -2.6343    1.5150    0.5282 C   0  0  0

+    3.4815   -0.4966    0.1151 C   0  0  0

+    3.8090    1.7572   -0.7081 N   0  0  0

+   -3.4815    0.4966    0.1152 C   0  0  0

+   -3.8090   -1.7572   -0.7081 N   0  0  0

+    4.8667   -0.6957    0.1167 N   0  0  0

+   -4.8667    0.6957    0.1167 N   0  0  0

+    1.2210    1.8601    0.0000 H   0  0  0

+    0.6607   -2.1216    0.0000 H   0  0  0

+   -1.2210   -1.8602    0.0000 H   0  0  0

+   -0.6607    2.1216    0.0000 H   0  0  0

+    2.9957   -2.4514    0.0000 H   0  0  0

+   -2.9957    2.4514    0.0000 H   0  0  0

+    4.7983    1.5875    0.0000 H   0  0  0

+    3.4613    2.6988    0.0000 H   0  0  0

+   -4.7983   -1.5875    0.0000 H   0  0  0

+   -3.4613   -2.6988    0.0000 H   0  0  0

+    5.2398   -1.6275    0.0000 H   0  0  0

+    5.4871    0.0933    0.0000 H   0  0  0

+   -5.2398    1.6275    0.0000 H   0  0  0

+   -5.4871   -0.0933    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  7 12  1  0

+  9 13  2  0

+  9 14  1  0

+ 11 15  1  0

+ 13 16  1  0

+  8 11  1  0

+ 10 13  1  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87-59-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.0241   -0.7362   -0.0014 C   0  0  0

+   -1.2300   -0.0626   -0.0006 C   0  0  0

+    1.1678   -0.0233   -0.0009 C   0  0  0

+   -0.0018   -2.2431    0.0035 C   0  0  0

+   -1.2514    1.3199    0.0007 C   0  0  0

+   -2.5238   -0.8353   -0.0016 C   0  0  0

+    1.1427    1.3658    0.0005 C   0  0  0

+    2.3890   -0.7013   -0.0012 N   0  0  0

+   -0.0663    2.0329    0.0012 C   0  0  0

+   -1.0433   -2.2585    0.0000 H   0  0  0

+    0.0136   -3.2846    0.0000 H   0  0  0

+    1.0397   -2.2277    0.0000 H   0  0  0

+   -2.1621    1.8255    0.0000 H   0  0  0

+   -3.0579    0.0590    0.0000 H   0  0  0

+   -3.4181   -1.3694    0.0000 H   0  0  0

+   -1.9897   -1.7296    0.0000 H   0  0  0

+    2.0349    1.9034    0.0000 H   0  0  0

+    2.4065   -1.7428    0.0000 H   0  0  0

+    3.2822   -0.1654    0.0000 H   0  0  0

+   -0.0858    3.0743    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  7  9  2  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+39081-15-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+   -0.1086    0.5401   -0.0044 C   0  0  0

+    0.0716   -0.8649   -0.0031 C   0  0  0

+    1.0673    1.4309   -0.0033 C   0  0  0

+   -1.3837    1.0813   -0.0010 C   0  0  0

+    1.4349   -1.4291   -0.0005 C   0  0  0

+   -1.0262   -1.7090   -0.0038 C   0  0  0

+    2.3630    0.8871   -0.0007 C   0  0  0

+    0.8999    2.8166   -0.0042 C   0  0  0

+   -2.4991    0.2367    0.0033 C   0  0  0

+    2.5509   -0.5749    0.0007 C   0  0  0

+    1.6247   -2.8118    0.0012 C   0  0  0

+   -2.3197   -1.1714   -0.0061 C   0  0  0

+    3.4683    1.7397    0.0008 C   0  0  0

+    2.0035    3.6411   -0.0026 C   0  0  0

+   -3.8089    0.7655    0.0065 C   0  0  0

+    3.8362   -1.1194    0.0037 C   0  0  0

+    2.9012   -3.3297    0.0042 C   0  0  0

+   -3.4511   -2.0095   -0.0064 C   0  0  0

+    3.2825    3.1046   -0.0001 C   0  0  0

+   -4.8788   -0.0829    0.0103 C   0  0  0

+   -4.0030    2.1095    0.0063 O   0  0  0

+    4.0026   -2.4868    0.0054 C   0  0  0

+   -4.6975   -1.4644   -0.0081 C   0  0  0

+   -1.5125    2.1202    0.0000 H   0  0  0

+   -0.8897   -2.7469    0.0000 H   0  0  0

+   -0.0625    3.2286    0.0000 H   0  0  0

+    0.7983   -3.4544    0.0000 H   0  0  0

+    4.4368    1.3425    0.0000 H   0  0  0

+    1.8759    4.6801    0.0000 H   0  0  0

+    4.6724   -0.4896    0.0000 H   0  0  0

+    3.0409   -4.3672    0.0000 H   0  0  0

+   -3.3334   -3.0497    0.0000 H   0  0  0

+    4.1130    3.7418    0.0000 H   0  0  0

+   -5.8490    0.3102    0.0000 H   0  0  0

+   -4.1526    3.1456    0.0000 H   0  0  0

+    4.9675   -2.8928    0.0000 H   0  0  0

+   -5.5343   -2.0933    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  2  0

+ 12 18  1  0

+ 13 19  2  0

+ 15 20  2  0

+ 15 21  1  0

+ 16 22  2  0

+ 18 23  2  0

+  7 10  1  0

+  9 12  2  0

+ 14 19  1  0

+ 17 22  1  0

+ 20 23  1  0

+  4 24  1  0

+  6 25  1  0

+  8 26  1  0

+ 11 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-01-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -1.0318    0.0001   -0.3684 N   0  0  0

+   -0.3556   -1.1792    0.1861 C   0  0  0

+   -0.3556    1.1792    0.1864 C   0  0  0

+   -2.3958    0.0000    0.1770 C   0  0  0

+    1.1122   -1.1792   -0.2423 C   0  0  0

+    1.1122    1.1792   -0.2420 C   0  0  0

+    1.7883    0.0000    0.3125 N   0  0  0

+   -1.3144   -1.5260    0.0000 H   0  0  0

+   -0.1796   -2.1834    0.0000 H   0  0  0

+   -0.1795    2.1834    0.0000 H   0  0  0

+   -1.3143    1.5261    0.0000 H   0  0  0

+   -2.3959    1.0196    0.0000 H   0  0  0

+   -3.4154   -0.0001    0.0000 H   0  0  0

+   -2.3957   -1.0196    0.0000 H   0  0  0

+    0.9362   -2.1834    0.0000 H   0  0  0

+    2.0710   -1.5260    0.0000 H   0  0  0

+    2.0710    1.5260    0.0000 H   0  0  0

+    0.9362    2.1834    0.0000 H   0  0  0

+    2.8079    0.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105-45-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.7514    0.1433   -0.0007 C   0  0  0

+   -0.4862    1.0031    0.0006 C   0  0  0

+    1.9658    0.7150   -0.0001 O   0  0  0

+    0.6505   -1.0608    0.0028 O   0  0  0

+   -1.7094    0.1228   -0.0004 C   0  0  0

+    3.1583   -0.1135   -0.0013 C   0  0  0

+   -3.0833    0.7420    0.0007 C   0  0  0

+   -1.5886   -1.0787   -0.0020 O   0  0  0

+    0.2323    1.8215    0.0000 H   0  0  0

+   -1.2182    1.8095    0.0000 H   0  0  0

+    2.5369   -1.0079    0.0000 H   0  0  0

+    4.0527   -0.7349    0.0000 H   0  0  0

+    3.7797    0.7809    0.0000 H   0  0  0

+   -2.6358    1.7349    0.0000 H   0  0  0

+   -4.0762    1.1895    0.0000 H   0  0  0

+   -3.5308   -0.2509    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  5  8  2  0

+  2  9  1  0

+  2 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+126572-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.1747    0.6660    0.4600 C   0  0  0

+    0.7882   -0.4095   -0.0296 C   0  0  0

+   -1.3260    0.7787    0.3813 C   0  0  0

+    0.9806    1.7679    1.0984 C   0  0  0

+    2.2569   -0.4572   -0.0842 C   0  0  0

+   -0.1458   -1.7556   -0.6034 Cl  0  0  0

+   -1.8445    0.7060   -1.3440 Cl  0  0  0

+   -2.0794   -0.5822    1.2931 Cl  0  0  0

+    1.0642    2.8776    0.2019 O   0  0  0

+    2.9431   -1.1619    0.8375 O   0  0  0

+    2.8521    0.1388   -0.9603 O   0  0  0

+   -1.3574    1.7544    0.0000 H   0  0  0

+    1.5328    0.9628    0.0000 H   0  0  0

+    1.9233    2.0217    0.0000 H   0  0  0

+    1.1375    3.8511    0.0000 H   0  0  0

+    3.6242   -1.8613    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  9 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+136-35-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    2.3738    0.4377   -0.0012 C   0  0  0

+    1.1685    1.1438   -0.0006 N   0  0  0

+    3.5825    1.1233   -0.0019 C   0  0  0

+    2.3669   -0.9515    0.0046 C   0  0  0

+   -0.0492    0.4510    0.0000 N   0  0  0

+    4.7720    0.4222   -0.0020 C   0  0  0

+    3.5605   -1.6463    0.0045 C   0  0  0

+   -1.1623    1.1030    0.0006 N   0  0  0

+    4.7614   -0.9609   -0.0015 C   0  0  0

+   -2.3542    0.4249    0.0012 C   0  0  0

+   -3.5601    1.1272    0.0018 C   0  0  0

+   -2.3666   -0.9709   -0.0046 C   0  0  0

+   -4.7559    0.4388    0.0020 C   0  0  0

+   -3.5689   -1.6470   -0.0044 C   0  0  0

+   -4.7611   -0.9445    0.0015 C   0  0  0

+    1.1751    2.1812    0.0000 H   0  0  0

+    3.5911    2.1607    0.0000 H   0  0  0

+    1.4663   -1.4664    0.0000 H   0  0  0

+    5.6747    0.9334    0.0000 H   0  0  0

+    3.5561   -2.6837    0.0000 H   0  0  0

+    5.6565   -1.4853    0.0000 H   0  0  0

+   -3.5575    2.1646    0.0000 H   0  0  0

+   -1.4735   -1.4987    0.0000 H   0  0  0

+   -5.6530    0.9598    0.0000 H   0  0  0

+   -3.5794   -2.6844    0.0000 H   0  0  0

+   -5.6628   -1.4575    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  6  9  1  0

+  8 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+ 11 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+  7  9  2  0

+ 14 15  1  0

+  2 16  1  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  9 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+151-67-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    1.2651    0.5904   -0.0208 C   0  0  0

+    0.2031   -0.3469   -0.5989 C   0  0  0

+    1.0300    1.8946   -0.4693 F   0  0  0

+    1.2034    0.5596    1.3765 F   0  0  0

+    2.5330    0.1742   -0.4409 F   0  0  0

+    0.5060   -2.0276   -0.0208 Cl  0  0  0

+   -1.5786    0.2380   -0.0085 Br  0  0  0

+    1.1775   -0.6858    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+145438-97-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.0463    0.8989    0.3102 C   0  0  0

+   -1.3135    0.5578   -0.1442 C   0  0  0

+    0.0723    2.2643    0.1174 N   0  0  0

+    0.9254    0.0273    0.8641 C   0  0  0

+   -1.8969    1.6805   -0.5791 N   0  0  0

+   -1.8727   -0.7152   -0.1466 N   0  0  0

+   -1.0816    2.6910   -0.4264 C   0  0  0

+    1.2368    3.0906    0.4449 C   0  0  0

+    1.7574   -0.6566    0.0538 N   0  0  0

+    1.0080   -0.1032    2.0710 O   0  0  0

+   -1.2394   -1.6989    0.3970 N   0  0  0

+   -3.1810   -0.9394   -0.7664 C   0  0  0

+    1.7424   -0.4394   -1.2176 N   0  0  0

+    2.6787   -1.6467    0.6170 C   0  0  0

+   -1.7292   -2.8140    0.3949 O   0  0  0

+    2.5660   -0.9759   -1.9369 O   0  0  0

+   -1.3370    3.6178    0.0000 H   0  0  0

+    1.7931    2.3066    0.0000 H   0  0  0

+    2.0208    3.6469    0.0000 H   0  0  0

+    0.6805    3.8746    0.0000 H   0  0  0

+   -3.3434    0.0081    0.0000 H   0  0  0

+   -4.1285   -1.1018    0.0000 H   0  0  0

+   -3.0186   -1.8869    0.0000 H   0  0  0

+    1.9749   -2.3016    0.0000 H   0  0  0

+    3.3336   -2.3505    0.0000 H   0  0  0

+    3.3825   -0.9918    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  6 11  1  0

+  6 12  1  0

+  9 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  2  0

+  5  7  2  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-83-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.4164    0.0000    0.0000 C   0  0  0

+   -0.8328   -0.7255   -0.5040 C   0  0  0

+    0.4164    0.0127    1.5299 C   0  0  0

+    1.6657   -0.7255   -0.5040 C   0  0  0

+    0.4164    1.4382   -0.5220 C   0  0  0

+   -2.0821    0.0000    0.0000 C   0  0  0

+   -1.5299   -1.5549    0.0000 H   0  0  0

+   -0.1357   -1.5549    0.0000 H   0  0  0

+    1.4998    0.0127    0.0000 H   0  0  0

+    0.4164    1.0961    0.0000 H   0  0  0

+   -0.6670    0.0127    0.0000 H   0  0  0

+    1.1216   -1.6624    0.0000 H   0  0  0

+    2.6026   -1.2696    0.0000 H   0  0  0

+    2.2098    0.2114    0.0000 H   0  0  0

+    1.4998    1.4382    0.0000 H   0  0  0

+    0.4164    2.5216    0.0000 H   0  0  0

+   -0.6670    1.4382    0.0000 H   0  0  0

+   -1.5380    0.9369    0.0000 H   0  0  0

+   -3.0190    0.5441    0.0000 H   0  0  0

+   -2.6262   -0.9369    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  1  1  0

+  6  2  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

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+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2453-44-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+   -1.1608    1.4987    0.1019 C   0  0  0

+   -2.2556    0.5318    0.0302 C   0  0  0

+   -1.4040    2.6882    0.1912 O   0  0  0

+    0.2408    1.0313    0.0721 C   0  0  0

+   -3.5367    0.9586    0.0631 C   0  0  0

+    1.2873    1.9547    0.1406 C   0  0  0

+    0.5206   -0.3351   -0.0188 C   0  0  0

+   -4.6380   -0.0140   -0.0090 C   0  0  0

+    2.5925    1.5181    0.1132 C   0  0  0

+    1.8262   -0.7692   -0.0460 C   0  0  0

+   -5.9661    0.4239    0.0247 C   0  0  0

+   -4.3626   -1.3816   -0.1175 C   0  0  0

+    2.8706    0.1543    0.0171 C   0  0  0

+   -6.9927   -0.4942   -0.0433 C   0  0  0

+   -5.4003   -2.2866   -0.1845 C   0  0  0

+    4.2768   -0.3145   -0.0128 C   0  0  0

+   -6.7120   -1.8455   -0.1447 C   0  0  0

+    4.6447   -1.4676    0.6788 C   0  0  0

+    5.2352    0.3930   -0.7374 C   0  0  0

+    5.9553   -1.8992    0.6474 C   0  0  0

+    6.5423   -0.0481   -0.7615 C   0  0  0

+    6.9028   -1.1901   -0.0685 C   0  0  0

+   -2.0490   -0.4824    0.0000 H   0  0  0

+   -3.7433    1.9728    0.0000 H   0  0  0

+    1.0816    2.9690    0.0000 H   0  0  0

+   -0.2535   -1.0221    0.0000 H   0  0  0

+    3.3675    2.2041    0.0000 H   0  0  0

+    2.0334   -1.7832    0.0000 H   0  0  0

+   -6.1774    1.4371    0.0000 H   0  0  0

+   -3.3826   -1.7145    0.0000 H   0  0  0

+   -7.9758   -0.1704    0.0000 H   0  0  0

+   -5.1983   -3.3017    0.0000 H   0  0  0

+   -7.4863   -2.5323    0.0000 H   0  0  0

+    3.9095   -2.1960    0.0000 H   0  0  0

+    5.0752    1.4155    0.0000 H   0  0  0

+    6.1224   -2.9206    0.0000 H   0  0  0

+    7.2813    0.6765    0.0000 H   0  0  0

+    7.8881   -1.5071    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  2  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 13  1  0

+ 17 14  2  0

+ 18 16  2  0

+ 19 16  1  0

+ 20 18  1  0

+ 21 19  2  0

+ 22 20  2  0

+ 10 13  1  0

+ 15 17  1  0

+ 21 22  1  0

+  2 23  1  0

+  5 24  1  0

+  6 25  1  0

+  7 26  1  0

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+ 10 28  1  0

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+ 12 30  1  0

+ 14 31  1  0

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+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-21-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    1.2273    0.1025   -0.2298 C   0  0  0

+    0.0289   -0.5744    0.2326 O   0  0  0

+    1.7074    1.0803    0.8446 C   0  0  0

+    2.3221   -0.9302   -0.5054 C   0  0  0

+   -1.1796   -0.0494   -0.0238 C   0  0  0

+   -2.4235   -0.7520    0.4561 C   0  0  0

+   -1.2702    0.9863   -0.6393 O   0  0  0

+    0.4926    0.7959    0.0000 H   0  0  0

+    2.6142    0.6350    0.0000 H   0  0  0

+    2.1527    1.9871    0.0000 H   0  0  0

+    0.8006    1.5256    0.0000 H   0  0  0

+    1.6289   -1.6651    0.0000 H   0  0  0

+    3.0570   -1.6234    0.0000 H   0  0  0

+    3.0153   -0.1953    0.0000 H   0  0  0

+   -2.9203    0.1276    0.0000 H   0  0  0

+   -3.3031   -1.2488    0.0000 H   0  0  0

+   -1.9267   -1.6316    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  5  7  2  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+39515-41-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 51                          1 V2000

+    4.1618   -0.1712    0.0481 C   0  0  0

+    3.7032   -1.2790    0.9985 C   0  0  0

+    4.3321   -1.6389   -0.3491 C   0  0  0

+    2.9660    0.4064   -0.6643 C   0  0  0

+    4.5400   -1.5222    2.2561 C   0  0  0

+    2.1968   -1.4959    1.1560 C   0  0  0

+    3.4066   -2.1886   -1.4363 C   0  0  0

+    5.7497   -2.2143   -0.3364 C   0  0  0

+    1.9709    0.9670    0.0408 O   0  0  0

+    2.9030    0.3649   -1.8702 O   0  0  0

+    0.8187    1.5235   -0.6456 C   0  0  0

+   -0.3966    1.4078    0.2380 C   0  0  0

+    1.0684    2.9412   -0.9532 C   0  0  0

+   -1.6492    1.2670   -0.3266 C   0  0  0

+   -0.2560    1.4368    1.6135 C   0  0  0

+    1.2612    4.0353   -1.1905 N   0  0  0

+   -2.7679    1.1605    0.4877 C   0  0  0

+   -1.3689    1.3308    2.4269 C   0  0  0

+   -4.0015    1.0224   -0.0653 O   0  0  0

+   -2.6248    1.1956    1.8672 C   0  0  0

+   -4.2087   -0.3097   -0.2356 C   0  0  0

+   -5.3645   -0.7594   -0.8583 C   0  0  0

+   -3.2624   -1.2224    0.2076 C   0  0  0

+   -5.5724   -2.1139   -1.0306 C   0  0  0

+   -3.4753   -2.5762    0.0328 C   0  0  0

+   -4.6301   -3.0218   -0.5832 C   0  0  0

+    4.9202    0.3681    0.0000 H   0  0  0

+    4.2803   -2.4158    0.0000 H   0  0  0

+    5.4336   -1.7819    0.0000 H   0  0  0

+    4.7997   -0.6286    0.0000 H   0  0  0

+    2.0642   -0.5748    0.0000 H   0  0  0

+    1.2757   -1.6285    0.0000 H   0  0  0

+    2.3294   -2.4170    0.0000 H   0  0  0

+    2.9314   -1.3885    0.0000 H   0  0  0

+    2.6065   -2.6638    0.0000 H   0  0  0

+    3.8818   -2.9887    0.0000 H   0  0  0

+    5.3997   -3.0765    0.0000 H   0  0  0

+    6.6119   -2.5643    0.0000 H   0  0  0

+    6.0997   -1.3521    0.0000 H   0  0  0

+    0.6544    0.6076    0.0000 H   0  0  0

+   -1.5531    0.3414    0.0000 H   0  0  0

+    0.6642    1.5751    0.0000 H   0  0  0

+   -1.4628    2.2566    0.0000 H   0  0  0

+   -2.7858    2.1121    0.0000 H   0  0  0

+   -6.0904   -0.1772    0.0000 H   0  0  0

+   -2.3802   -0.9264    0.0000 H   0  0  0

+   -6.4540   -2.4118    0.0000 H   0  0  0

+   -2.7513   -3.1608    0.0000 H   0  0  0

+   -4.8143   -3.9340    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

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+ 14 17  1  0

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+ 24 26  1  0

+  2  3  1  0

+ 18 20  1  0

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+  1 27  1  0

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+ 20 44  1  0

+ 22 45  1  0

+ 23 46  1  0

+ 24 47  1  0

+ 25 48  1  0

+ 26 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13171-00-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+    1.1966    0.2798   -0.0187 C   0  0  0

+    0.7305   -1.0176   -0.0172 C   0  0  0

+    0.2869    1.3450   -0.0077 C   0  0  0

+    2.7100    0.2822   -0.0268 C   0  0  0

+    1.8981   -1.9814   -0.0307 C   0  0  0

+   -0.6348   -1.2630   -0.0041 C   0  0  0

+   -1.0864    1.0872    0.0048 C   0  0  0

+    0.7765    2.7329   -0.0089 C   0  0  0

+    3.1179   -1.1411    0.4095 C   0  0  0

+    1.6590   -3.1192    0.9638 C   0  0  0

+    2.1066   -2.5430   -1.4386 C   0  0  0

+   -1.5376   -0.2160    0.0074 C   0  0  0

+    0.7553    3.5383   -1.2825 C   0  0  0

+    1.1970    3.2283    1.0148 O   0  0  0

+   -3.0177   -0.4993    0.0210 C   0  0  0

+   -3.7897    0.8216    0.0319 C   0  0  0

+   -3.3951   -1.3003   -1.2267 C   0  0  0

+   -3.3708   -1.3068    1.2716 C   0  0  0

+    3.7323    0.4752    0.0000 H   0  0  0

+    2.6123    1.3180    0.0000 H   0  0  0

+   -0.9824   -2.2436    0.0000 H   0  0  0

+   -1.7658    1.8752    0.0000 H   0  0  0

+    3.6123   -2.0565    0.0000 H   0  0  0

+    4.0813   -0.7483    0.0000 H   0  0  0

+    0.6409   -2.9052    0.0000 H   0  0  0

+    1.4450   -4.1373    0.0000 H   0  0  0

+    2.6771   -3.3332    0.0000 H   0  0  0

+    1.1313   -2.9051    0.0000 H   0  0  0

+    2.4687   -3.5183    0.0000 H   0  0  0

+    3.0819   -2.1809    0.0000 H   0  0  0

+    1.7953    3.5657    0.0000 H   0  0  0

+    0.7279    4.5783    0.0000 H   0  0  0

+   -0.2847    3.5109    0.0000 H   0  0  0

+   -2.8915    1.3466    0.0000 H   0  0  0

+   -4.3147    1.7198    0.0000 H   0  0  0

+   -4.6879    0.2966    0.0000 H   0  0  0

+   -4.3363   -0.8569    0.0000 H   0  0  0

+   -3.8385   -2.2415    0.0000 H   0  0  0

+   -2.4539   -1.7437    0.0000 H   0  0  0

+   -4.3240   -0.8900    0.0000 H   0  0  0

+   -3.7876   -2.2600    0.0000 H   0  0  0

+   -2.4176   -1.7236    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  5  9  1  0

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+  4 19  1  0

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+  9 23  1  0

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+ 13 31  1  0

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+ 13 33  1  0

+ 16 34  1  0

+ 16 35  1  0

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+ 17 37  1  0

+ 17 38  1  0

+ 17 39  1  0

+ 18 40  1  0

+ 18 41  1  0

+ 18 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+116539-70-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 35                          1 V2000

+   -1.2206    0.5373    0.1455 C   0  0  0

+   -2.0360   -0.4401    0.7061 C   0  0  0

+    0.1841    0.7042    0.6649 C   0  0  0

+   -1.6621    1.3617   -0.8847 C   0  0  0

+   -3.3110   -0.6244    0.2661 C   0  0  0

+    1.1797    0.4705   -0.4731 C   0  0  0

+    0.3484    2.0281    1.1771 O   0  0  0

+   -2.9214    1.2403   -1.3867 C   0  0  0

+   -3.8206    0.2278   -0.8166 C   0  0  0

+   -4.0369   -1.5055    0.7753 N   0  3  0

+    2.5454    0.6328    0.0318 N   0  0  0

+   -4.9563    0.0923   -1.2372 O   0  0  0

+   -4.6897   -2.2977    1.2331 N   0  5  0

+    3.2682   -0.5209    0.5728 C   0  0  0

+    3.1114    1.7915   -0.0001 N   0  0  0

+    4.0401   -1.2127   -0.5526 C   0  0  0

+    4.2468    1.9265    0.4197 O   0  0  0

+    4.7950   -2.4175    0.0124 C   0  0  0

+    5.5668   -3.1093   -1.1130 C   0  0  0

+   -1.5732   -1.2684    0.0000 H   0  0  0

+    0.1309   -0.2432    0.0000 H   0  0  0

+   -1.2143    2.1982    0.0000 H   0  0  0

+    0.6147   -0.2918    0.0000 H   0  0  0

+    1.6558   -0.3503    0.0000 H   0  0  0

+    0.4653    2.9697    0.0000 H   0  0  0

+   -3.3514    2.0861    0.0000 H   0  0  0

+    2.3273   -0.6435    0.0000 H   0  0  0

+    2.9873   -1.4272    0.0000 H   0  0  0

+    4.9810   -1.0901    0.0000 H   0  0  0

+    4.3210   -0.3064    0.0000 H   0  0  0

+    3.8541   -2.5401    0.0000 H   0  0  0

+    4.5140   -3.3238    0.0000 H   0  0  0

+    4.9335   -3.8159    0.0000 H   0  0  0

+    6.2734   -3.7426    0.0000 H   0  0  0

+    6.2001   -2.4027    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  8  9  1  0

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+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24191-98-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 43                          1 V2000

+    0.5716    0.3283   -0.0497 C   0  0  0

+   -0.7285   -0.1616   -0.1874 C   0  0  0

+    0.8006    1.6985    0.0617 C   0  0  0

+    1.7066   -0.6252   -0.0294 C   0  0  0

+   -1.7890    0.7192   -0.2369 C   0  0  0

+   -0.9597   -1.6462   -0.2756 C   0  0  1

+   -0.2778    2.5772    0.0334 C   0  0  0

+    1.9496    2.4197    0.2048 O   0  0  0

+    1.4560   -1.9652    0.2625 C   0  0  0

+    3.0034   -0.1996   -0.2962 C   0  0  0

+   -1.5619    2.0829   -0.1157 C   0  0  0

+   -3.1982    0.2397   -0.4490 C   0  0  1

+    0.0532   -2.4094    0.5746 C   0  0  0

+   -2.3136   -1.9589    0.2019 N   0  0  0

+    0.1950    3.8512    0.1658 O   0  0  0

+    1.5999    3.7731   -0.1404 C   0  0  0

+    2.4988   -2.8688    0.2750 C   0  0  0

+    4.0398   -1.1122   -0.2771 C   0  0  0

+   -3.2517   -1.2630   -0.6784 C   0  0  0

+   -3.9924    0.5762    0.6903 O   0  0  0

+   -2.5168   -3.3972   -0.0172 C   0  0  0

+    3.7872   -2.4425    0.0071 C   0  0  0

+   -1.1751   -2.6598    0.0000 H   0  0  0

+    3.2117    0.8155    0.0000 H   0  0  0

+   -2.3650    2.7379    0.0000 H   0  0  0

+   -3.1605    1.2753    0.0000 H   0  0  0

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+    5.0200   -0.7758    0.0000 H   0  0  0

+   -4.2591   -1.0202    0.0000 H   0  0  0

+   -3.6906   -2.2017    0.0000 H   0  0  0

+   -4.9466    0.9805    0.0000 H   0  0  0

+   -3.5429   -3.2522    0.0000 H   0  0  0

+   -2.6618   -4.4233    0.0000 H   0  0  0

+   -1.4907   -3.5422    0.0000 H   0  0  0

+    4.5667   -3.1254    0.0000 H   0  0  0

+  1  2  2  0

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+ 20 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6441-91-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

+   -0.2675    0.1764   -1.0147 N   0  0  0

+   -1.2714    0.5461   -0.2939 N   0  0  0

+    0.8461    0.9506   -1.0756 C   0  0  0

+   -2.4288   -0.1804   -0.3104 C   0  0  0

+    2.1460    0.4242   -0.6622 C   0  0  0

+    0.7766    2.2692   -1.5412 C   0  0  0

+   -3.5423    0.2562    0.4125 C   0  0  0

+   -2.5066   -1.3608   -1.0552 C   0  0  0

+    3.2822    1.2640   -0.7411 C   0  0  0

+    2.2864   -0.8911   -0.1917 C   0  0  0

+   -0.4432    2.7960   -1.9461 N   0  0  0

+    1.9276    3.0572   -1.5999 C   0  0  0

+   -3.4587    1.7466    1.3486 S   0  0  0

+   -4.7070   -0.4824    0.3910 C   0  0  0

+   -3.6777   -2.0885   -1.0671 C   0  0  0

+    4.5352    0.7655   -0.3456 C   0  0  0

+    3.1401    2.5818   -1.2138 C   0  0  0

+    1.2048   -1.7091   -0.1107 O   0  0  0

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+   -4.5116    1.6649    2.2994 O   0  0  0

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+   -4.7746   -1.6528   -0.3439 C   0  0  0

+    4.6449   -0.5142    0.1077 C   0  0  0

+   -6.0282   -2.4400   -0.3614 N   0  3  0

+    6.2216   -1.1271    0.6005 S   0  0  0

+   -6.0911   -3.4708   -1.0073 O   0  0  0

+   -6.9967   -2.0570    0.2700 O   0  5  0

+    6.1932   -2.5229    0.3357 O   0  0  0

+    7.1729   -0.2100    0.0778 O   0  0  0

+    6.3083   -0.9950    2.1143 O   0  0  0

+   -1.6540   -1.8723    0.0000 H   0  0  0

+   -0.5582    3.7836    0.0000 H   0  0  0

+   -1.2410    2.2026    0.0000 H   0  0  0

+    1.8152    4.0451    0.0000 H   0  0  0

+   -5.5640    0.0217    0.0000 H   0  0  0

+   -3.5894   -3.0789    0.0000 H   0  0  0

+    5.3334    1.3583    0.0000 H   0  0  0

+    3.9303    3.1853    0.0000 H   0  0  0

+    0.4118   -2.3089    0.0000 H   0  0  0

+    3.6763   -2.3292    0.0000 H   0  0  0

+   -4.1386    3.8363    0.0000 H   0  0  0

+    6.8539   -0.1638    0.0000 H   0  0  0

+  2  1  2  0

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+ 11  6  1  0

+ 12  6  2  0

+ 13  7  1  0

+ 14  7  1  0

+ 15  8  2  0

+ 16  9  1  0

+ 17  9  2  0

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+ 20 13  2  0

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+ 22 13  1  0

+ 23 14  2  0

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+ 25 23  1  0

+ 26 24  1  0

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+ 12 17  1  0

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+ 17 39  1  0

+ 18 40  1  0

+ 19 41  1  0

+ 22 42  1  0

+ 31 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+290-37-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+    0.6919   -1.1443    0.0000 C   0  0  0

+   -0.6919   -1.1443    0.0000 C   0  0  0

+    1.3525   -0.0001    0.0000 N   0  0  0

+   -1.3525   -0.0001    0.0000 N   0  0  0

+    0.6917    1.1444    0.0000 C   0  0  0

+   -0.6917    1.1444    0.0000 C   0  0  0

+    1.1875   -2.0027    0.0000 H   0  0  0

+   -1.1875   -2.0027    0.0000 H   0  0  0

+    1.1873    2.0028    0.0000 H   0  0  0

+   -1.1873    2.0028    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  3  5  1  0

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+  5  6  2  0

+  1  7  1  0

+  2  8  1  0

+  5  9  1  0

+  6 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98-46-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.8361    0.3545   -0.0037 C   0  0  0

+   -0.3294   -0.3893   -0.0031 C   0  0  0

+    0.7746    1.7352   -0.0021 C   0  0  0

+    2.1734   -0.3403    0.0003 C   0  0  0

+   -1.5559    0.2478   -0.0010 C   0  0  0

+   -0.4523    2.3726    0.0000 C   0  0  0

+    3.1953    0.6152   -0.0011 F   0  0  0

+    2.2815   -1.1371    1.1451 F   0  0  0

+    2.2848   -1.1439   -1.1394 F   0  0  0

+   -1.6173    1.6290    0.0006 C   0  0  0

+   -2.8036   -0.5485    0.0001 N   0  3  0

+   -3.8844    0.0130    0.0020 O   0  0  0

+   -2.7494   -1.7653   -0.0009 O   0  5  0

+   -0.2833   -1.4248    0.0000 H   0  0  0

+    1.6484    2.2929    0.0000 H   0  0  0

+   -0.4984    3.4081    0.0000 H   0  0  0

+   -2.5371    2.1069    0.0000 H   0  0  0

+  1  2  1  0

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+  6 10  2  0

+  2 14  1  0

+  3 15  1  0

+  6 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2486-04-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.5546   -1.8927    0.2060 N   0  3  0

+    1.4997   -1.9250    0.9736 O   0  5  0

+    0.2706   -2.8774   -0.4521 O   0  0  0

+   -0.2526   -0.6586    0.0774 C   0  0  0

+    0.3775    0.5758   -0.0645 C   0  0  0

+   -1.6311   -0.7293    0.0924 C   0  0  0

+   -0.3886    1.7337   -0.1850 C   0  0  0

+    1.8590    0.6575   -0.0869 C   0  0  0

+   -2.3865    0.4229   -0.0276 C   0  0  0

+   -1.7660    1.6520   -0.1631 C   0  0  0

+    2.5319    1.4152    0.8691 C   0  0  0

+    2.5825   -0.0281   -1.0609 C   0  0  0

+   -3.8644    0.3409   -0.0109 N   0  3  0

+    3.9102    1.4876    0.8435 C   0  0  0

+    3.9601    0.0514   -1.0770 C   0  0  0

+   -4.5318    1.3542   -0.1164 O   0  0  0

+   -4.4130   -0.7400    0.1083 O   0  5  0

+    4.6229    0.8099   -0.1287 C   0  0  0

+   -2.0987   -1.6507    0.0000 H   0  0  0

+    0.0734    2.6580    0.0000 H   0  0  0

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+    4.4143   -0.8767    0.0000 H   0  0  0

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+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52-28-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 54                          1 V2000

+   -3.2081   -0.6642   -1.0229 C   0  0  2

+   -4.1557   -0.1060    0.0098 C   0  0  0

+   -2.1684   -1.4881   -0.2996 C   0  0  2

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+   -4.0048   -1.5934   -1.9439 C   0  0  0

+   -4.6082    1.1145   -0.4765 C   0  0  0

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+   -2.8895   -2.5048    0.5721 C   0  0  1

+   -1.1641   -0.6599    0.4120 C   0  0  0

+   -4.0056    1.3927   -1.6555 O   0  0  0

+   -1.8254    1.4202   -0.7745 C   0  0  2

+   -4.6574   -2.6523   -1.0413 C   0  0  0

+   -5.5271    1.8218    0.3043 C   0  0  0

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+   -5.3715    0.0583    1.9950 C   0  0  0

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+   -1.4942   -2.1150    0.0000 H   0  0  0

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+ 26 51  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+554-14-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.9673   -0.2012    0.0018 C   0  0  0

+   -0.2279   -1.3372    0.0010 C   0  0  0

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+  1  2  2  0

+  1  3  1  0

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+  2  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88266-67-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+272283                          1 V2000

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+146272  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+475-38-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.7048    0.0405    0.0021 C   0  0  0

+   -0.7048    0.0405    0.0008 C   0  0  0

+    1.3969    1.2523    0.0008 C   0  0  0

+    1.4270   -1.2434   -0.0014 C   0  0  0

+   -1.3969    1.2523   -0.0007 C   0  0  0

+   -1.4270   -1.2435    0.0017 C   0  0  0

+    0.6872    2.4567   -0.0017 C   0  0  0

+    2.7521    1.2615    0.0025 O   0  0  0

+    0.6702   -2.5084   -0.0062 C   0  0  0

+    2.6429   -1.2597   -0.0007 O   0  0  0

+   -0.6872    2.4567   -0.0011 C   0  0  0

+   -2.7521    1.2615   -0.0015 O   0  0  0

+   -0.6701   -2.5085    0.0038 C   0  0  0

+   -2.6428   -1.2598    0.0011 O   0  0  0

+    1.2065    3.3654    0.0000 H   0  0  0

+    3.7987    1.2686    0.0000 H   0  0  0

+    1.1865   -3.4188    0.0000 H   0  0  0

+   -1.2065    3.3654    0.0000 H   0  0  0

+   -3.7987    1.2686    0.0000 H   0  0  0

+   -1.1863   -3.4190    0.0000 H   0  0  0

+  1  2  2  0

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+ 11 18  1  0

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+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74340-04-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 47                          1 V2000

+    0.5644    0.2411   -0.0561 C   0  0  0

+   -0.8200    0.4133   -0.1021 C   0  0  0

+    1.2481    1.5172    0.0399 C   0  0  0

+    1.2131   -0.9909   -0.0912 C   0  0  0

+   -1.0666    1.8682   -0.0332 C   0  0  0

+   -1.5868   -0.7351   -0.1933 C   0  0  0

+    0.1774    2.5362    0.0520 C   0  0  0

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+    2.6775   -0.9657   -0.0310 C   0  0  0

+    0.4256   -2.1366   -0.1782 C   0  0  0

+   -2.2415    2.6166   -0.0389 C   0  0  0

+   -0.9626   -1.9932   -0.2334 C   0  0  0

+   -3.0886   -0.6520   -0.2507 C   0  0  2

+    0.2056    3.9255    0.1277 C   0  0  0

+    3.3307    0.2895    0.0605 C   0  0  0

+    3.4286   -2.1399   -0.0603 C   0  0  0

+   -2.1899    3.9925    0.0380 C   0  0  0

+   -1.8137   -3.2009   -0.3279 C   0  0  0

+   -3.7023   -1.8419    0.4844 C   0  0  1

+   -3.5145   -0.6637   -1.6148 O   0  0  0

+   -0.9710    4.6455    0.1205 C   0  0  0

+    4.7356    0.3137    0.1221 C   0  0  0

+    4.7920   -2.0777    0.0000 C   0  0  0

+   -3.0939   -3.1299    0.0039 C   0  0  0

+   -3.4756   -1.7028    1.8885 O   0  0  0

+    5.4406   -0.8515    0.0878 C   0  0  0

+    3.1311    2.4145    0.0000 H   0  0  0

+    0.8638   -3.0850    0.0000 H   0  0  0

+   -3.1667    2.1313    0.0000 H   0  0  0

+   -3.0741    0.3927    0.0000 H   0  0  0

+    1.1221    4.4270    0.0000 H   0  0  0

+    2.9479   -3.0675    0.0000 H   0  0  0

+   -3.0761    4.5459    0.0000 H   0  0  0

+   -1.3586   -4.1413    0.0000 H   0  0  0

+   -4.7469   -1.8237    0.0000 H   0  0  0

+   -4.5589   -0.6924    0.0000 H   0  0  0

+   -0.9411    5.6898    0.0000 H   0  0  0

+    5.2408    1.2282    0.0000 H   0  0  0

+    5.3513   -2.9601    0.0000 H   0  0  0

+   -3.6773   -3.9966    0.0000 H   0  0  0

+   -2.5851   -1.1564    0.0000 H   0  0  0

+    6.4849   -0.8214    0.0000 H   0  0  0

+  1  2  2  0

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+ 25 41  1  0

+ 26 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+484-29-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    1.3658   -0.2769   -0.1304 C   0  0  0

+    0.1961   -1.0259   -0.2143 C   0  0  0

+    1.3009    1.1230    0.0431 C   0  0  0

+    2.7968   -0.6025   -0.1873 C   0  0  0

+   -1.0314   -0.3363   -0.1198 C   0  0  0

+    0.2345   -2.3703   -0.3812 O   0  0  0

+    0.1355    1.7369    0.1274 N   0  0  0

+    2.5731    1.5715    0.0891 O   0  0  0

+    3.4480    0.5580   -0.0452 C   0  0  0

+   -1.0204    1.0704    0.0540 C   0  0  0

+   -2.2559   -1.0191   -0.1956 C   0  0  0

+    0.3864   -2.9437    0.9188 C   0  0  0

+   -2.2473    1.7535    0.1477 C   0  0  0

+   -3.4220   -0.3227   -0.1012 C   0  0  0

+   -3.4153    1.0604    0.0707 C   0  0  0

+    3.2102   -1.5335    0.0000 H   0  0  0

+    4.4615    0.6601    0.0000 H   0  0  0

+   -2.2710   -2.0377    0.0000 H   0  0  0

+   -0.5983   -3.2046    0.0000 H   0  0  0

+    0.6473   -3.9284    0.0000 H   0  0  0

+    1.3711   -2.6828    0.0000 H   0  0  0

+   -2.2613    2.7721    0.0000 H   0  0  0

+   -4.3091   -0.8234    0.0000 H   0  0  0

+   -4.2993    1.5666    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+509-93-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -1.5978    0.2052    1.8602 C   0  0  0

+   -0.9963    0.4727    0.4791 C   0  0  0

+    0.4717    0.3034    0.5436 C   0  0  0

+   -1.6701   -0.4379   -0.5486 C   0  0  0

+   -1.4761    1.8230   -0.0227 C   0  0  0

+    0.9704   -0.9906   -0.1113 C   0  0  0

+    1.3033    1.3122   -0.0850 O   0  0  0

+   -1.8123   -1.8695   -0.1178 C   0  0  0

+   -2.9694    0.2680   -0.8382 C   0  0  0

+   -0.8854    2.8827   -0.0073 O   0  0  0

+   -2.8326    1.5403   -0.5345 C   0  0  0

+    2.4524   -0.7129   -0.2074 C   0  0  0

+    0.5577   -2.1952    0.6354 C   0  0  0

+    2.5513    0.7687   -0.1762 C   0  0  0

+   -1.5077   -2.7907   -1.3007 C   0  0  0

+   -0.9219   -2.2447    1.0607 C   0  0  0

+    3.4442   -1.5956   -0.2985 C   0  0  0

+    3.5877    1.4015   -0.2252 O   0  0  0

+   -2.0075    1.1265    0.0000 H   0  0  0

+   -2.5191   -0.2045    0.0000 H   0  0  0

+   -1.1881   -0.7161    0.0000 H   0  0  0

+    0.0946    1.2386    0.0000 H   0  0  0

+   -0.7293   -0.8007    0.0000 H   0  0  0

+   -0.0378   -1.0096    0.0000 H   0  0  0

+   -2.8145   -1.9804    0.0000 H   0  0  0

+   -3.8624   -0.2003    0.0000 H   0  0  0

+   -3.5798    2.2174    0.0000 H   0  0  0

+    0.4694   -3.1997    0.0000 H   0  0  0

+    1.5441   -2.4043    0.0000 H   0  0  0

+   -2.4651   -3.1073    0.0000 H   0  0  0

+   -1.1911   -3.7481    0.0000 H   0  0  0

+   -0.5503   -2.4741    0.0000 H   0  0  0

+   -1.6298   -2.9627    0.0000 H   0  0  0

+   -0.5172   -3.1683    0.0000 H   0  0  0

+    3.2403   -2.5831    0.0000 H   0  0  0

+    4.4014   -1.2785    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

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+  7  3  1  0

+  8  4  1  0

+  9  4  1  0

+ 10  5  2  0

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+ 12  6  1  0

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+ 15  8  1  0

+ 16  8  1  0

+ 17 12  2  0

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+  9 11  2  0

+ 12 14  1  0

+ 13 16  1  0

+  1 19  1  0

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+ 15 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88-75-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.0892    0.2833    0.0358 C   0  0  0

+    0.5888   -0.9187   -0.1050 C   0  0  0

+    0.6182    1.4622    0.1721 C   0  0  0

+   -1.5691    0.3035    0.0337 N   0  3  0

+    1.9762   -0.9336   -0.1084 C   0  0  0

+   -0.1048   -2.0797   -0.2388 O   0  0  0

+    2.0005    1.4447    0.1684 C   0  0  0

+   -2.1655    1.1646   -0.5879 O   0  0  0

+   -2.1906   -0.5409    0.6537 O   0  5  0

+    2.6788    0.2477    0.0283 C   0  0  0

+    0.1157    2.3630    0.0000 H   0  0  0

+    2.4813   -1.8330    0.0000 H   0  0  0

+   -0.6338   -2.9652    0.0000 H   0  0  0

+    2.5255    2.3326    0.0000 H   0  0  0

+    3.7102    0.2369    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+634-91-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.0009   -2.1717    0.0032 Cl  0  0  0

+    0.0003   -0.4357    0.0031 C   0  0  0

+    1.1996    0.2559    0.0004 C   0  0  0

+   -1.1999    0.2553    0.0000 C   0  0  0

+    2.7022   -0.6135   -0.0029 Cl  0  0  0

+    1.2016    1.6384   -0.0002 C   0  0  0

+   -2.7019   -0.6151   -0.0027 Cl  0  0  0

+   -1.2028    1.6374   -0.0006 C   0  0  0

+   -0.0007    2.3334    0.0020 C   0  0  0

+   -0.0012    3.7307    0.0019 N   0  0  0

+    2.1042    2.1583    0.0000 H   0  0  0

+   -2.1058    2.1567    0.0000 H   0  0  0

+    0.9007    4.2519    0.0000 H   0  0  0

+   -0.9035    4.2512    0.0000 H   0  0  0

+  2  1  1  0

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+ 10  9  1  0

+  8  9  1  0

+  6 11  1  0

+  8 12  1  0

+ 10 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90-30-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.3911   -0.9712    0.5825 C   0  0  0

+   -1.2737    0.1036    0.3407 C   0  0  0

+    0.8348   -0.7477    1.2060 N   0  0  0

+   -0.7559   -2.2454    0.2012 C   0  0  0

+   -2.5150   -0.1476   -0.2942 C   0  0  0

+   -0.9446    1.4151    0.7167 C   0  0  0

+    1.9205   -0.2771    0.4635 C   0  0  0

+   -1.9801   -2.4799   -0.4168 C   0  0  0

+   -2.8457   -1.4600   -0.6721 C   0  0  0

+   -3.3939    0.9228   -0.5350 C   0  0  0

+   -1.8201    2.4276    0.4673 C   0  0  0

+    3.1417   -0.0478    1.0847 C   0  0  0

+    1.7830   -0.0428   -0.8992 C   0  0  0

+   -3.0417    2.1817   -0.1563 C   0  0  0

+    4.2131    0.4171    0.3475 C   0  0  0

+    2.8583    0.4220   -1.6301 C   0  0  0

+    4.0713    0.6542   -1.0074 C   0  0  0

+    1.1063   -1.6422    0.0000 H   0  0  0

+   -0.1251   -2.9354    0.0000 H   0  0  0

+   -0.0351    1.6315    0.0000 H   0  0  0

+   -2.2909   -3.3616    0.0000 H   0  0  0

+   -3.7563   -1.6717    0.0000 H   0  0  0

+   -4.3087    0.7304    0.0000 H   0  0  0

+   -1.5175    3.3121    0.0000 H   0  0  0

+    3.4157   -0.9416    0.0000 H   0  0  0

+    0.8945    0.2478    0.0000 H   0  0  0

+   -3.6778    2.8668    0.0000 H   0  0  0

+    5.1030    0.1308    0.0000 H   0  0  0

+    2.5833    1.3155    0.0000 H   0  0  0

+    4.4536    1.5073    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  2  0

+  7 13  1  0

+ 10 14  2  0

+ 12 15  1  0

+ 13 16  2  0

+ 15 17  2  0

+  8  9  1  0

+ 11 14  1  0

+ 16 17  1  0

+  3 18  1  0

+  4 19  1  0

+  6 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+885-82-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    2.7423   -1.1587    0.1816 N   0  3  0

+    2.6358   -2.2341   -0.3802 O   0  5  0

+    3.7161   -0.9282    0.8760 O   0  0  0

+    1.6914   -0.1296    0.0156 C   0  0  0

+    0.3612   -0.4872    0.0784 C   0  0  0

+    2.0461    1.1959   -0.1975 C   0  0  0

+   -0.6279    0.4825   -0.0776 C   0  0  0

+    3.3576    1.5461   -0.2542 O   0  0  0

+    1.0633    2.1638   -0.3532 C   0  0  0

+   -0.2689    1.8112   -0.2966 C   0  0  0

+   -2.0601    0.1009   -0.0110 C   0  0  0

+   -2.9749    0.9286    0.6366 C   0  0  0

+   -2.4963   -1.0841   -0.6010 C   0  0  0

+   -4.3062    0.5685    0.6955 C   0  0  0

+   -3.8295   -1.4342   -0.5360 C   0  0  0

+   -4.7325   -0.6114    0.1132 C   0  0  0

+    0.0994   -1.4857    0.0000 H   0  0  0

+    4.3549    1.8124    0.0000 H   0  0  0

+    1.3282    3.1615    0.0000 H   0  0  0

+   -0.9969    2.5430    0.0000 H   0  0  0

+   -2.7339    1.9323    0.0000 H   0  0  0

+   -1.8022   -1.8482    0.0000 H   0  0  0

+   -5.0054    1.3279    0.0000 H   0  0  0

+   -4.0760   -2.4366    0.0000 H   0  0  0

+   -5.7345   -0.8593    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

+  9  6  2  0

+ 10  7  2  0

+ 11  7  1  0

+ 12 11  2  0

+ 13 11  1  0

+ 14 12  1  0

+ 15 13  2  0

+ 16 14  2  0

+  9 10  1  0

+ 15 16  1  0

+  5 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+35089-70-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+   -0.6138   -1.2978   -0.1900 N   0  0  0

+   -1.7140   -0.5067    0.1014 C   0  0  0

+    0.5390   -0.7215   -0.8865 C   0  0  0

+   -0.6028   -2.5402    0.1568 N   0  0  0

+   -1.7948    0.7701   -0.4012 N   0  0  0

+   -2.6697   -0.9724    0.8503 N   0  0  0

+    1.6219   -0.3601    0.1321 C   0  0  0

+    0.3640   -3.2355   -0.0993 O   0  0  0

+   -2.8915    1.5809   -0.0808 N   0  3  0

+    2.8258    0.2418   -0.5953 C   0  0  0

+   -3.9421    1.0738    0.2694 O   0  0  0

+   -2.7944    2.7929   -0.1526 O   0  5  0

+    3.9087    0.6031    0.4234 C   0  0  0

+    5.1127    1.2050   -0.3040 C   0  0  0

+    6.1956    1.5664    0.7146 C   0  0  0

+    0.6807    0.1894    0.0000 H   0  0  0

+   -0.2055   -0.1778    0.0000 H   0  0  0

+   -0.9852    1.2110    0.0000 H   0  0  0

+   -3.4984   -1.3762    0.0000 H   0  0  0

+    1.4802   -1.2710    0.0000 H   0  0  0

+    2.3664   -0.9038    0.0000 H   0  0  0

+    2.9676    1.1527    0.0000 H   0  0  0

+    2.0813    0.7855    0.0000 H   0  0  0

+    3.7669   -0.3078    0.0000 H   0  0  0

+    4.6532    0.0594    0.0000 H   0  0  0

+    5.2544    2.1159    0.0000 H   0  0  0

+    4.3682    1.7487    0.0000 H   0  0  0

+    6.4874    0.6919    0.0000 H   0  0  0

+    7.0701    1.8582    0.0000 H   0  0  0

+    5.9038    2.4409    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  7 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+  3 16  1  0

+  3 17  1  0

+  5 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110-21-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    1.7053    0.0429   -0.0014 C   0  0  0

+    0.5747   -0.4015    0.5823 N   0  0  0

+    1.7303    1.2581   -0.5838 N   0  0  0

+    2.7042   -0.6504    0.0017 O   0  0  0

+   -0.5746    0.3997    0.5837 N   0  0  0

+   -1.7057   -0.0435    0.0002 C   0  0  0

+   -1.7313   -1.2575   -0.5846 N   0  0  0

+   -2.7031    0.6518    0.0014 O   0  0  0

+    0.4682   -1.3068    0.0000 H   0  0  0

+    2.5290    1.6976    0.0000 H   0  0  0

+    0.9504    1.7300    0.0000 H   0  0  0

+   -0.4676    1.3050    0.0000 H   0  0  0

+   -2.5302   -1.6966    0.0000 H   0  0  0

+   -0.9516   -1.7298    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  6  8  2  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+  7 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1528-74-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.7420    0.0001   -0.0013 C   0  0  0

+   -0.7420    0.0002   -0.0014 C   0  0  0

+    1.4412    1.1333   -0.4107 C   0  0  0

+    1.4411   -1.1317    0.4138 C   0  0  0

+   -1.4411   -1.1332   -0.4108 C   0  0  0

+   -1.4412    1.1320    0.4134 C   0  0  0

+    2.8216    1.1277   -0.4087 C   0  0  0

+    2.8211   -1.1263    0.4119 C   0  0  0

+   -2.8215   -1.1277   -0.4085 C   0  0  0

+   -2.8212    1.1264    0.4117 C   0  0  0

+    3.5104   -0.0002   -0.0011 C   0  0  0

+   -3.5104    0.0001   -0.0008 C   0  0  0

+    4.9906   -0.0003   -0.0010 N   0  3  0

+   -4.9906    0.0002   -0.0009 N   0  3  0

+    5.5995   -0.9924    0.3574 O   0  0  0

+    5.5997    0.9917   -0.3594 O   0  5  0

+   -5.5996    0.9922    0.3577 O   0  0  0

+   -5.5997   -0.9917   -0.3597 O   0  5  0

+    0.9568    2.0056    0.0000 H   0  0  0

+    0.9568   -2.0041    0.0000 H   0  0  0

+   -0.9566   -2.0054    0.0000 H   0  0  0

+   -0.9570    2.0044    0.0000 H   0  0  0

+    3.3116    1.9969    0.0000 H   0  0  0

+    3.3106   -1.9958    0.0000 H   0  0  0

+   -3.3114   -1.9969    0.0000 H   0  0  0

+   -3.3108    1.9958    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  9 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  2  0

+ 13 16  1  0

+ 14 17  2  0

+ 14 18  1  0

+  8 11  1  0

+ 10 12  1  0

+  3 19  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+131-14-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -1.1574    0.8858    0.0747 C   0  0  0

+   -1.3646   -0.5079    0.0738 C   0  0  0

+    0.2094    1.4204    0.2296 C   0  0  0

+   -2.2416    1.7487   -0.0762 C   0  0  0

+   -0.2094   -1.4208    0.2277 C   0  0  0

+   -2.6482   -1.0140   -0.0722 C   0  0  0

+    1.3645    0.5079    0.0732 C   0  0  0

+    0.3846    2.5964    0.4823 O   0  0  0

+   -3.5141    1.2359   -0.2260 C   0  0  0

+    1.1573   -0.8862    0.0726 C   0  0  0

+   -0.3846   -2.5970    0.4793 O   0  0  0

+   -3.7241   -0.1393   -0.2177 C   0  0  0

+    2.6476    1.0142   -0.0729 C   0  0  0

+    2.2418   -1.7486   -0.0752 C   0  0  0

+   -5.0110   -0.6437   -0.3644 N   0  0  0

+    3.7239    0.1396   -0.2193 C   0  0  0

+    3.5151   -1.2354   -0.2206 C   0  0  0

+    5.0107    0.6443   -0.3665 N   0  0  0

+   -2.0918    2.7775    0.0000 H   0  0  0

+   -2.8072   -2.0414    0.0000 H   0  0  0

+   -4.3292    1.8812    0.0000 H   0  0  0

+    2.8063    2.0416    0.0000 H   0  0  0

+    2.0923   -2.7774    0.0000 H   0  0  0

+   -5.8235    0.0048    0.0000 H   0  0  0

+   -5.1664   -1.6716    0.0000 H   0  0  0

+    4.3305   -1.8803    0.0000 H   0  0  0

+    5.8233   -0.0041    0.0000 H   0  0  0

+    5.1659    1.6723    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  2  0

+  7 13  2  0

+ 10 14  2  0

+ 12 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+ 16 18  1  0

+  7 10  1  0

+  9 12  1  0

+ 16 17  2  0

+  4 19  1  0

+  6 20  1  0

+  9 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-17-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    2.7726   -0.0652   -0.0006 C   0  0  0

+    1.3078    0.2891   -0.0011 C   0  0  0

+    3.5360    1.1071   -0.0013 F   0  0  0

+    3.0706   -0.8151    1.1423 F   0  0  0

+    3.0709   -0.8167   -1.1423 F   0  0  0

+    0.3548   -0.7120   -0.0005 C   0  0  0

+    0.9177    1.6156    0.0037 C   0  0  0

+   -0.9889   -0.3876   -0.0005 C   0  0  0

+   -0.4253    1.9412    0.0037 C   0  0  0

+   -2.0092   -1.4598    0.0006 N   0  3  0

+   -1.3798    0.9393   -0.0011 C   0  0  0

+   -3.1931   -1.1738    0.0006 O   0  0  0

+   -1.6649   -2.6281    0.0014 O   0  5  0

+   -3.0671    1.3475   -0.0017 Cl  0  0  0

+    0.6479   -1.7066    0.0000 H   0  0  0

+    1.6330    2.3662    0.0000 H   0  0  0

+   -0.7177    2.9360    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  7  9  2  0

+  8 10  1  0

+  8 11  2  0

+ 10 12  2  0

+ 10 13  1  0

+ 11 14  1  0

+  9 11  1  0

+  6 15  1  0

+  7 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80214-83-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+134136                          1 V2000

+    0.7318    1.9398    1.2282 C   0  0  2

+    0.8720    0.9762    2.4579 C   0  0  1

+    2.0499    2.6216    1.1774 O   0  0  0

+   -0.2702    2.9380    1.6853 C   0  0  2

+    0.8860   -0.5262    1.8065 C   0  0  1

+    2.4017    1.1457    2.8653 C   0  0  0

+    2.5204    2.5114   -0.1675 C   0  0  1

+   -1.4733    2.8250    0.6805 C   0  0  0

+    0.3497    4.3058    1.3657 C   0  0  0

+    2.1502   -1.0802    2.1326 O   0  0  0

+   -0.1708   -1.3037    2.6976 C   0  0  2

+    3.9056    3.1487   -0.2788 C   0  0  0

+    2.6090    1.1376   -0.5315 O   0  0  0

+   -2.7085    2.8278    1.2202 O   0  0  0

+   -1.1990    2.6710   -0.4121 O   0  0  0

+    2.6676   -1.6623    0.9344 C   0  0  1

+   -1.5703   -0.8522    2.3908 C   0  0  0

+    0.1963   -1.1300    4.1603 C   0  0  0

+    0.0027   -2.7048    2.3987 O   0  0  0

+    4.3584    3.1238   -1.7399 C   0  0  2

+    2.8938    1.0455   -1.9085 C   0  0  2

+   -3.7759    2.6527    0.2192 C   0  0  1

+    4.0785   -2.1950    1.1940 C   0  0  1

+    1.8172   -2.7293    0.5186 O   0  0  0

+   -2.5708   -2.0048    2.5470 C   0  0  2

+    4.1544    1.7440   -2.3468 C   0  0  2

+    5.7578    3.4523   -1.7885 O   0  0  0

+    3.5905    4.1840   -2.5350 C   0  0  0

+    1.6899    1.3983   -2.7679 C   0  0  0

+   -4.7685    1.6382    0.9192 C   0  0  1

+   -4.5635    3.9674    0.2737 C   0  0  0

+    4.6371   -2.7839   -0.1063 C   0  0  2

+    4.9186   -1.1251    1.6318 O   0  0  0

+    2.2616   -3.1595   -0.7666 C   0  0  1

+   -3.5480   -1.8236    1.4484 C   0  0  0

+   -3.2194   -1.8722    3.9026 C   0  0  0

+    5.3001    0.9253   -2.1040 O   0  0  0

+    5.8953    4.7586   -1.2258 C   0  0  0

+   -4.4926    0.2293    0.3903 C   0  0  1

+   -4.5209    1.6811    2.4658 C   0  0  0

+   -6.1001    1.9446    0.6834 O   0  0  0

+   -3.6886    5.1081   -0.2499 C   0  0  0

+    3.6393   -3.8147   -0.6462 C   0  0  0

+    5.9218   -3.4421    0.1664 N   0  0  0

+    1.2649   -4.1693   -1.3392 C   0  0  0

+   -4.6423   -0.7485    1.5906 C   0  0  1

+   -3.5162   -2.6277    0.4413 N   0  0  0

+   -5.5273   -0.1671   -0.5560 O   0  0  0

+    5.6326   -4.5862    1.0412 C   0  0  0

+    6.3921   -3.9954   -1.1106 C   0  0  0

+   -6.0108   -1.5041    1.3833 C   0  0  0

+   -3.8609   -2.1594   -0.8498 O   0  0  0

+   -3.8408   -3.2932   -1.7194 C   0  0  0

+   -4.1824   -2.8829   -3.0449 O   0  0  0

+   -2.9598   -2.5343   -3.6974 C   0  0  0

+   -3.2563   -2.0835   -5.1291 C   0  0  0

+   -4.1220   -0.9469   -5.1009 O   0  0  0

+   -4.3604   -0.5756   -6.4601 C   0  0  0

+   -0.1640    1.4894    0.0000 H   0  0  0

+   -0.1277    0.8992    0.0000 H   0  0  0

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+ 58134  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92433-40-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.0536   -0.3074    0.0669 C   0  0  0

+   -2.5320   -0.2581   -0.0489 C   0  0  0

+   -0.5665    0.9703    0.3310 C   0  0  0

+   -0.1600   -1.3761   -0.0392 C   0  0  0

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+   -4.3136    1.3491    0.0814 C   0  0  0

+   -4.8106   -0.9542   -0.3622 C   0  0  0

+    1.6733    0.1182    0.3707 C   0  0  0

+    2.3011   -2.4916   -0.0204 Cl  0  0  0

+   -5.2352    0.3486   -0.1713 C   0  0  0

+    3.0470    0.3330    0.5233 N   0  0  0

+    3.6672    1.2771   -0.2119 C   0  0  0

+    5.1173    1.5986    0.0430 C   0  0  0

+    3.0583    1.8680   -1.0785 O   0  0  0

+   -0.5226   -2.3437    0.0000 H   0  0  0

+   -3.1648   -2.2508    0.0000 H   0  0  0

+   -1.0352    2.6494    0.0000 H   0  0  0

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+    4.8936    2.6074    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2481-94-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+   -2.7951    0.0387   -0.0339 C   0  0  0

+   -4.1759   -0.1076    0.0698 N   0  0  0

+   -2.2621    1.0804   -0.7873 C   0  0  0

+   -1.9513   -0.8542    0.6211 C   0  0  0

+   -4.9432   -0.6379   -1.0600 C   0  0  0

+   -4.8615    0.2688    1.3086 C   0  0  0

+   -0.8976    1.2286   -0.8918 C   0  0  0

+   -0.5861   -0.7127    0.5215 C   0  0  0

+   -4.7314   -2.1501   -1.1553 C   0  0  0

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+   -0.0462    0.3303   -0.2394 C   0  0  0

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+    4.2977   -1.1078    0.8111 C   0  0  0

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+  1  2  1  0

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+ 15 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 19 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75-17-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+   -0.1835   -0.4400    0.0000 N   0  0  0

+   -1.2409    0.2806    0.0000 C   0  0  0

+    1.0921    0.1746    0.0000 O   0  0  0

+   -1.1656    1.2886    0.0000 H   0  0  0

+   -2.1515   -0.1582    0.0000 H   0  0  0

+    2.0027    0.6134    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+211-91-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+    0.5798   -0.7421    0.0029 C   0  0  0

+   -0.4645    0.1975    0.0025 C   0  0  0

+    1.8788   -0.2323    0.0012 C   0  0  0

+    0.7186   -2.1963   -0.0009 C   0  0  0

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+   -2.2012   -1.5902    0.0050 C   0  0  0

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+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+611-36-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.4549    0.9046   -0.0024 C   0  0  0

+   -0.0197   -0.4426   -0.0012 C   0  0  0

+    0.4426    1.8961   -0.0016 N   0  0  0

+   -1.8342    1.1763    0.0013 C   0  0  0

+    1.3675   -0.7134    0.0004 C   0  0  0

+   -0.9655   -1.4782   -0.0021 C   0  0  0

+    1.7328    1.6564    0.0003 C   0  0  0

+   -2.7254    0.1476    0.0061 C   0  0  0

+    2.2376    0.3621    0.0007 C   0  0  0

+    1.8310   -1.9875    0.0021 O   0  0  0

+   -2.2939   -1.1769   -0.0041 C   0  0  0

+   -2.1723    2.1595    0.0000 H   0  0  0

+   -0.6544   -2.4703    0.0000 H   0  0  0

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+   -3.7445    0.3536    0.0000 H   0  0  0

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+    2.1865   -2.9646    0.0000 H   0  0  0

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+  1  2  1  0

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+  8 15  1  0

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+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13132-28-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    0.9244   -0.0015   -0.0017 C   0  0  0

+   -0.3665   -0.6878   -0.0013 C   0  0  0

+    0.6722    1.4385   -0.0001 C   0  0  0

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+   -1.3701    0.3832    0.0002 C   0  0  0

+   -0.3331   -2.0021   -0.0020 C   0  0  0

+   -0.7895    1.5719    0.0009 C   0  0  0

+    1.7294    2.2201   -0.0003 C   0  0  0

+    2.1207   -2.0383    0.0062 C   0  0  0

+    3.2664    0.3068    0.0000 C   0  0  0

+   -2.7101    0.1817    0.0004 N   0  3  0

+    0.9715   -2.6954   -0.0030 C   0  0  0

+    3.0782    1.6172   -0.0022 C   0  0  0

+   -3.4692    1.1342    0.0017 O   0  0  0

+   -3.1554   -0.9519   -0.0008 O   0  5  0

+   -1.1975   -2.5367    0.0000 H   0  0  0

+   -1.2880    2.4575    0.0000 H   0  0  0

+    1.6197    3.2305    0.0000 H   0  0  0

+    3.0062   -2.5370    0.0000 H   0  0  0

+    4.2041   -0.0851    0.0000 H   0  0  0

+    0.9872   -3.7116    0.0000 H   0  0  0

+    3.8894    2.2295    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  8 13  1  0

+ 11 14  2  0

+ 11 15  1  0

+  5  7  2  0

+  9 12  2  0

+ 10 13  2  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1805-02-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.5307    0.6002    0.0019 C   0  0  0

+    0.2567   -0.7771    0.0005 C   0  0  0

+    1.9129    0.7179    0.0014 N   0  0  0

+   -0.5110    1.5153   -0.0016 C   0  0  0

+   -1.0699   -1.2155    0.0002 C   0  0  0

+    1.4525   -1.4230   -0.0008 N   0  0  0

+    2.4263   -0.5470   -0.0003 C   0  0  0

+    2.6788    1.9667    0.0024 C   0  0  0

+   -1.8168    1.0713   -0.0064 C   0  0  0

+   -2.0966   -0.2916    0.0013 C   0  0  0

+    3.7702   -0.8565   -0.0013 N   0  0  0

+   -3.3883   -0.7166    0.0006 O   0  0  0

+   -4.2082    0.4539    0.0021 C   0  0  0

+   -0.3083    2.5332    0.0000 H   0  0  0

+   -1.2830   -2.2313    0.0000 H   0  0  0

+    3.5636    1.4241    0.0000 H   0  0  0

+    3.2214    2.8515    0.0000 H   0  0  0

+    1.7940    2.5093    0.0000 H   0  0  0

+   -2.5952    1.7578    0.0000 H   0  0  0

+    4.0742   -1.8489    0.0000 H   0  0  0

+    4.4776   -0.0970    0.0000 H   0  0  0

+   -3.3581    1.0494    0.0000 H   0  0  0

+   -4.8037    1.3040    0.0000 H   0  0  0

+   -5.0583   -0.1416    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  7 11  1  0

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+ 12 13  1  0

+  6  7  2  0

+  9 10  1  0

+  4 14  1  0

+  5 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+140-31-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+    0.0774   -0.2934    0.3590 N   0  0  0

+   -0.8509   -1.2994   -0.1714 C   0  0  0

+   -0.3132    0.9962   -0.2238 C   0  0  0

+    1.4043   -0.6165   -0.1820 C   0  0  0

+   -2.2793   -0.9552    0.2523 C   0  0  0

+   -1.7415    1.3405    0.1999 C   0  0  0

+    2.4264    0.3986    0.3336 C   0  0  0

+   -2.6698    0.3344   -0.3305 N   0  0  0

+    3.7533    0.0754   -0.2074 N   0  0  0

+   -1.2564   -2.2426    0.0000 H   0  0  0

+    0.0103   -1.8583    0.0000 H   0  0  0

+    0.7064    1.1163    0.0000 H   0  0  0

+   -0.2520    2.0210    0.0000 H   0  0  0

+    0.9836   -1.5530    0.0000 H   0  0  0

+    2.2484   -1.2008    0.0000 H   0  0  0

+   -3.2989   -1.0752    0.0000 H   0  0  0

+   -2.3405   -1.9800    0.0000 H   0  0  0

+   -1.3359    2.2836    0.0000 H   0  0  0

+   -2.6027    1.8994    0.0000 H   0  0  0

+    2.8471    1.3351    0.0000 H   0  0  0

+    1.5823    0.9830    0.0000 H   0  0  0

+   -3.6704    0.5640    0.0000 H   0  0  0

+    4.0416   -0.9099    0.0000 H   0  0  0

+    4.4625    0.8178    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

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+  2 10  1  0

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+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+486-25-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    0.7431   -0.7114   -0.0013 C   0  0  0

+   -0.7431   -0.7112   -0.0005 C   0  0  0

+    1.1921    0.6199   -0.0011 C   0  0  0

+    1.6688   -1.7450    0.0029 C   0  0  0

+   -1.1919    0.6197    0.0003 C   0  0  0

+   -1.6690   -1.7451   -0.0011 C   0  0  0

+    0.0000    1.5005    0.0000 C   0  0  0

+    2.5551    0.8912   -0.0011 C   0  0  0

+    3.0258   -1.4610    0.0014 C   0  0  0

+   -2.5553    0.8911    0.0009 C   0  0  0

+   -3.0256   -1.4612   -0.0009 C   0  0  0

+   -0.0001    2.7148    0.0009 O   0  0  0

+    3.4665   -0.1522   -0.0013 C   0  0  0

+   -3.4664   -0.1519    0.0005 C   0  0  0

+    1.3443   -2.7339    0.0000 H   0  0  0

+   -1.3445   -2.7340    0.0000 H   0  0  0

+    2.8906    1.8764    0.0000 H   0  0  0

+    3.7169   -2.2392    0.0000 H   0  0  0

+   -2.8907    1.8763    0.0000 H   0  0  0

+   -3.7167   -2.2394    0.0000 H   0  0  0

+    4.4872    0.0511    0.0000 H   0  0  0

+   -4.4871    0.0514    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

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+  5  7  1  0

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+ 11 14  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+54150-69-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+   -2.1974   -1.1605   -0.0012 C   0  0  0

+   -3.1655   -0.2343   -0.3505 C   0  0  0

+   -1.0058   -0.7335    0.5811 C   0  0  0

+   -2.4116   -2.4854   -0.2211 O   0  0  0

+   -2.9475    1.1163   -0.1203 C   0  0  0

+   -0.7925    0.6172    0.8093 C   0  0  0

+   -0.0236   -1.6691    0.9364 N   0  0  0

+   -3.7063   -2.6016   -0.8145 C   0  0  0

+   -1.7613    1.5396    0.4593 C   0  0  0

+   -3.8982    2.0260   -0.4638 O   0  0  0

+   -3.3875    3.3120   -0.1068 C   0  0  0

+    9.2819    0.2385   -0.2156 Cl  0  0  0

+   -4.1181   -0.5540    0.0000 H   0  0  0

+    0.1592    0.9396    0.0000 H   0  0  0

+   -0.2600   -2.6457    0.0000 H   0  0  0

+    0.9404   -1.3855    0.0000 H   0  0  0

+   -3.7961   -1.6008    0.0000 H   0  0  0

+   -4.7071   -2.6914    0.0000 H   0  0  0

+   -3.6165   -3.6024    0.0000 H   0  0  0

+   -1.5528    2.5226    0.0000 H   0  0  0

+   -2.4536    2.9411    0.0000 H   0  0  0

+   -3.0166    4.2459    0.0000 H   0  0  0

+   -4.3214    3.6829    0.0000 H   0  0  0

+   10.2868    0.2385    0.0000 H   0  0  0

+  1  2  2  0

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+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120-37-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.4098   -0.2287    0.0027 C   0  0  0

+    0.2151   -1.4695    0.0004 C   0  0  0

+    0.3536    0.9309    0.0025 C   0  0  0

+   -1.8042   -0.1480   -0.0007 N   0  0  0

+    1.5944   -1.5490   -0.0015 C   0  0  0

+   -0.6119   -2.7293    0.0006 C   0  0  0

+    1.7367    0.8467    0.0000 C   0  0  0

+   -2.4622    1.1610    0.0016 C   0  0  0

+    2.3556   -0.3959   -0.0017 C   0  0  0

+    2.4869    1.9798   -0.0006 O   0  0  0

+   -3.9800    0.9687   -0.0030 C   0  0  0

+   -0.1123    1.8621    0.0000 H   0  0  0

+   -2.3761   -1.0182    0.0000 H   0  0  0

+    2.0612   -2.4797    0.0000 H   0  0  0

+   -1.4823   -2.1579    0.0000 H   0  0  0

+   -1.1833   -3.5997    0.0000 H   0  0  0

+    0.2585   -3.3007    0.0000 H   0  0  0

+   -1.4850    1.5205    0.0000 H   0  0  0

+   -2.7090    2.1726    0.0000 H   0  0  0

+    3.3949   -0.4590    0.0000 H   0  0  0

+    3.0617    2.8480    0.0000 H   0  0  0

+   -4.1109    2.0017    0.0000 H   0  0  0

+   -5.0130    0.8378    0.0000 H   0  0  0

+   -3.8491   -0.0643    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2223-82-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 30                          1 V2000

+    0.0000   -0.3883    0.0000 C   0  0  0

+   -1.2492    0.4950    0.0000 C   0  0  0

+    1.2492    0.4950    0.0000 C   0  0  0

+    0.0000   -1.2717    1.2493 C   0  0  0

+    0.0000   -1.2717   -1.2492 C   0  0  0

+   -2.4348   -0.3433    0.0000 O   0  0  0

+    2.4348   -0.3433    0.0000 O   0  0  0

+   -3.6591    0.2207    0.0000 C   0  0  0

+    3.6591    0.2207    0.0000 C   0  0  0

+   -4.8589   -0.6278    0.0000 C   0  0  0

+   -3.7706    1.4309    0.0000 O   0  0  0

+    4.8589   -0.6278    0.0000 C   0  0  0

+    3.7706    1.4309    0.0000 O   0  0  0

+   -6.0677   -0.0709    0.0000 C   0  0  0

+    6.0677   -0.0709    0.0000 C   0  0  0

+   -0.5759    1.2492    0.0000 H   0  0  0

+   -1.9224    1.2492    0.0000 H   0  0  0

+    1.9224    1.2492    0.0000 H   0  0  0

+    0.5759    1.2492    0.0000 H   0  0  0

+   -1.0110   -1.2717    0.0000 H   0  0  0

+    0.0000   -2.2827    0.0000 H   0  0  0

+    1.0110   -1.2717    0.0000 H   0  0  0

+   -1.0110   -1.2717    0.0000 H   0  0  0

+    0.0000   -2.2827    0.0000 H   0  0  0

+    1.0110   -1.2717    0.0000 H   0  0  0

+   -4.7661   -1.6345    0.0000 H   0  0  0

+    4.7661   -1.6345    0.0000 H   0  0  0

+   -6.1605    0.9358    0.0000 H   0  0  0

+   -6.8932   -0.6546    0.0000 H   0  0  0

+    6.8932   -0.6546    0.0000 H   0  0  0

+    6.1605    0.9358    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 10 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2322-45-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    0.6738    0.1321   -0.6571 N   0  0  0

+   -0.1035   -0.8546   -0.1686 C   0  0  0

+    2.0285    0.1917   -0.3117 C   0  0  0

+   -1.5886   -0.8401   -0.4236 C   0  0  0

+    0.3924   -1.7542    0.4763 O   0  0  0

+    2.7991    1.2785   -0.7028 C   0  0  0

+    2.6037   -0.8334    0.4282 C   0  0  0

+   -2.3678    0.7979    0.3347 Br  0  0  0

+   -1.8476   -0.8776   -1.9311 C   0  0  0

+   -2.2311   -2.0627    0.2348 C   0  0  0

+    4.1360    1.3345   -0.3598 C   0  0  0

+    3.9408   -0.7714    0.7679 C   0  0  0

+    4.7069    0.3099    0.3722 C   0  0  0

+    0.2179    1.0213    0.0000 H   0  0  0

+    2.3219    2.1564    0.0000 H   0  0  0

+    2.1189   -1.7071    0.0000 H   0  0  0

+   -1.9908    0.1113    0.0000 H   0  0  0

+   -2.8365   -1.0208    0.0000 H   0  0  0

+   -1.7044   -1.8665    0.0000 H   0  0  0

+   -3.1156   -1.5979    0.0000 H   0  0  0

+   -2.6959   -2.9472    0.0000 H   0  0  0

+   -1.3466   -2.5275    0.0000 H   0  0  0

+    4.6240    2.2064    0.0000 H   0  0  0

+    4.4202   -1.6481    0.0000 H   0  0  0

+    5.7046    0.2559    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  2  2  0

+  6  3  2  0

+  7  3  1  0

+  8  4  1  0

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+ 10  4  1  0

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+ 12  7  2  0

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+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+70951-83-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -1.1205    0.1305   -0.1035 C   0  0  0

+   -1.5767   -1.1527   -0.0589 C   0  0  0

+    0.2573    0.3906   -0.0800 C   0  0  0

+   -2.0955    1.2762   -0.1651 C   0  0  2

+   -3.0486   -1.4507   -0.1015 C   0  0  1

+   -0.6754   -2.2143    0.0236 C   0  0  0

+    1.1625   -0.6911   -0.0015 C   0  0  0

+    0.7475    1.7165   -0.1333 C   0  0  0

+   -3.2920    0.9733    0.7310 C   0  0  1

+   -2.5409    1.4507   -1.5116 O   0  0  0

+   -3.9701   -0.3200    0.3117 C   0  0  1

+   -3.7488   -0.6546   -1.0597 O   0  0  0

+    0.6706   -1.9962    0.0526 C   0  0  0

+    2.6000   -0.4074    0.0192 C   0  0  0

+    2.0699    1.9780   -0.1135 C   0  0  0

+   -2.8557    0.8643    2.0874 O   0  0  0

+    3.0263    0.9388   -0.0381 C   0  0  0

+    3.5469   -1.4306    0.0931 C   0  0  0

+    4.3994    1.2222   -0.0201 C   0  0  0

+    4.8772   -1.1218    0.1088 C   0  0  0

+    5.3006    0.2009    0.0516 C   0  0  0

+   -1.4884    2.1274    0.0000 H   0  0  0

+   -3.3823   -2.4416    0.0000 H   0  0  0

+   -1.0370   -3.1954    0.0000 H   0  0  0

+    0.0692    2.5122    0.0000 H   0  0  0

+   -3.9396    1.7942    0.0000 H   0  0  0

+   -3.5144    1.8321    0.0000 H   0  0  0

+   -5.0143   -0.3730    0.0000 H   0  0  0

+    1.3325   -2.8056    0.0000 H   0  0  0

+    2.3947    2.9719    0.0000 H   0  0  0

+   -1.8413    0.6109    0.0000 H   0  0  0

+    3.2399   -2.4301    0.0000 H   0  0  0

+    4.7304    2.2140    0.0000 H   0  0  0

+    5.5857   -1.8907    0.0000 H   0  0  0

+    6.3239    0.4154    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 16 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107673-65-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.1459    0.0025   -0.0010 C   0  0  0

+   -1.1465    0.9756   -0.0035 C   0  0  0

+    1.1803    0.4647    0.0016 C   0  0  0

+   -0.8363   -1.2848    0.0037 C   0  0  0

+   -2.4171    0.3800   -0.0072 C   0  0  0

+   -0.9228    2.3565   -0.0025 C   0  0  0

+    1.4402    1.8615    0.0066 C   0  0  0

+    2.3027   -0.4748   -0.0022 C   0  0  0

+   -2.1796   -1.0634    0.0032 C   0  0  0

+   -3.5080    1.2410   -0.0110 C   0  0  0

+    0.4024    2.8035    0.0035 C   0  0  0

+   -2.0582    3.1906   -0.0080 C   0  0  0

+    2.8259    2.3319    0.0148 C   0  0  0

+    3.6240    0.0243    0.0045 C   0  0  0

+    2.0869   -1.8565   -0.0133 C   0  0  0

+   -3.2265   -2.1101    0.0072 N   0  3  0

+   -3.3016    2.6186   -0.0108 C   0  0  0

+    3.8563    1.4645    0.0145 C   0  0  0

+    4.6971   -0.8763    0.0011 C   0  0  0

+    3.1540   -2.7087   -0.0171 C   0  0  0

+   -2.9114   -3.2866    0.0119 O   0  0  0

+   -4.4030   -1.7947    0.0059 O   0  5  0

+    4.4545   -2.2196   -0.0093 C   0  0  0

+   -0.3728   -2.2260    0.0000 H   0  0  0

+   -4.4835    0.8548    0.0000 H   0  0  0

+    0.6169    3.8305    0.0000 H   0  0  0

+   -1.9522    4.2344    0.0000 H   0  0  0

+    3.0202    3.3629    0.0000 H   0  0  0

+    1.1091   -2.2369    0.0000 H   0  0  0

+   -4.1405    3.2487    0.0000 H   0  0  0

+    4.8398    1.8298    0.0000 H   0  0  0

+    5.6838   -0.5195    0.0000 H   0  0  0

+    2.9899   -3.7450    0.0000 H   0  0  0

+    5.2604   -2.8914    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+766-40-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    0.7165    0.1071   -0.1743 C   0  0  0

+   -0.5220   -0.3715   -0.0381 C   0  0  0

+    0.5919    1.6028   -0.3488 C   0  0  0

+    2.1891   -0.8119   -0.1484 Cl  0  0  0

+   -1.4820    0.7307   -0.1121 C   0  0  0

+   -0.9310   -2.0431    0.1905 Cl  0  0  0

+   -0.8325    1.8957   -0.2950 O   0  0  0

+    1.2555    2.2651    0.7296 O   0  0  0

+   -2.6885    0.6116   -0.0224 O   0  0  0

+    1.6158    1.2271    0.0000 H   0  0  0

+    2.0275    3.0356    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

+  3  8  1  0

+  5  9  2  0

+  5  7  1  0

+  3 10  1  0

+  8 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3771-19-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 47                          1 V2000

+   -2.4410   -1.0897   -0.6230 C   0  0  0

+   -3.0311    0.2681   -0.3454 C   0  0  0

+   -0.9578   -1.0564   -0.3587 C   0  0  0

+   -3.0923   -2.1499    0.2628 C   0  0  0

+   -4.2314    0.4350    0.3078 C   0  0  0

+   -2.3208    1.3821   -0.7744 C   0  0  0

+   -0.4851   -0.6333    0.8695 C   0  0  0

+   -0.0721   -1.4546   -1.3433 C   0  0  0

+   -4.6145   -2.0228    0.1296 C   0  0  0

+   -5.0506   -0.7258    0.8082 C   0  0  0

+   -4.7232    1.7156    0.5267 C   0  0  0

+   -2.8097    2.6529   -0.5541 C   0  0  0

+    0.8744   -0.6023    1.1145 C   0  0  0

+    1.2878   -1.4254   -1.1034 C   0  0  0

+   -4.0170    2.8204    0.0986 C   0  0  0

+    1.7650   -0.9961    0.1267 C   0  0  0

+    3.1026   -0.9662    0.3651 O   0  0  0

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+    3.1009    0.7339   -1.3525 C   0  0  0

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+   -3.4294   -1.0199    0.0000 H   0  0  0

+   -3.3270   -3.1126    0.0000 H   0  0  0

+   -2.1777   -2.5312    0.0000 H   0  0  0

+   -1.3349    1.2830    0.0000 H   0  0  0

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+   -0.2695   -2.4256    0.0000 H   0  0  0

+   -5.5878   -2.2085    0.0000 H   0  0  0

+   -4.5624   -3.0123    0.0000 H   0  0  0

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+   -5.9030   -1.2310    0.0000 H   0  0  0

+   -5.7090    1.8155    0.0000 H   0  0  0

+   -2.1938    3.4291    0.0000 H   0  0  0

+    1.0681    0.3695    0.0000 H   0  0  0

+    1.6526   -2.3467    0.0000 H   0  0  0

+   -4.4320    3.7202    0.0000 H   0  0  0

+    3.7398    1.4913    0.0000 H   0  0  0

+    2.3435    1.3728    0.0000 H   0  0  0

+    2.4620   -0.0235    0.0000 H   0  0  0

+    3.7850    1.8606    0.0000 H   0  0  0

+    2.4217    2.1849    0.0000 H   0  0  0

+    2.0974    0.8216    0.0000 H   0  0  0

+    6.1753    2.4330    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 21 44  1  0

+ 22 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+22755-15-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.5502   -0.3643   -0.1454 C   0  0  0

+   -1.7379    0.1596   -0.0123 C   0  0  0

+    0.6322    0.5046   -0.2965 C   0  0  0

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+   -0.8592    2.4017   -0.1460 C   0  0  0

+   -3.2739    2.1540    0.1430 C   0  0  0

+   -2.7540   -2.1641    0.1385 C   0  0  0

+   -4.1046   -0.1428    0.2721 C   0  0  0

+    2.0169   -1.4620   -0.4325 C   0  0  0

+    3.0676    0.5974   -0.5848 N   0  0  0

+   -4.2795    1.3152    0.2733 C   0  0  0

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+    5.3985    1.1579    0.0248 C   0  0  0

+    3.9911   -0.3176    1.2129 O   0  0  0

+    1.3690    2.4564    0.0000 H   0  0  0

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+    0.9686   -3.4092    0.0000 H   0  0  0

+   -0.9807    3.4900    0.0000 H   0  0  0

+   -3.4514    3.2346    0.0000 H   0  0  0

+   -3.6350   -2.8146    0.0000 H   0  0  0

+   -4.9933   -0.7827    0.0000 H   0  0  0

+    3.0062   -1.9316    0.0000 H   0  0  0

+    2.8383    1.6682    0.0000 H   0  0  0

+   -5.2973    1.7195    0.0000 H   0  0  0

+    5.9371    0.2044    0.0000 H   0  0  0

+    6.3520    1.6965    0.0000 H   0  0  0

+    4.8599    2.1114    0.0000 H   0  0  0

+  1  2  2  0

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+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89459-25-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+   -1.1600   -0.6426   -0.0017 C   0  0  0

+   -2.1682   -1.7051    0.0617 C   0  0  0

+    0.2528   -1.0365   -0.0225 C   0  0  0

+   -1.5150    0.6317   -0.0444 N   0  0  0

+   -3.5239   -1.3670    0.0836 C   0  0  0

+   -1.7472   -3.0490    0.0998 C   0  0  0

+    0.5665   -2.3864    0.0185 C   0  0  0

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+   -0.4240   -3.3578    0.0782 C   0  0  0

+    2.6099   -0.3966   -0.1046 N   0  0  0

+    1.0268    1.1617   -0.1221 O   0  0  0

+   -3.1611    2.3570   -0.0778 C   0  0  0

+   -5.2020    0.4139    0.0617 C   0  0  0

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+    6.0380    1.6886    1.0227 C   0  0  0

+    7.3714    0.2156   -0.2456 C   0  0  0

+   -4.2660   -2.1069    0.0000 H   0  0  0

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+    8.2830   -0.3014    0.0000 H   0  0  0

+    7.8884    1.1272    0.0000 H   0  0  0

+  1  2  1  0

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+  7 11  1  0

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+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+710-25-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.2118    0.0889   -0.0034 C   0  0  0

+   -0.9240   -0.6397   -0.0027 O   0  0  0

+   -0.1427    1.4221   -0.0009 C   0  0  0

+    1.5319   -0.4235   -0.0008 C   0  0  0

+   -1.9818    0.1831    0.0001 C   0  0  0

+   -1.5453    1.4622    0.0013 C   0  0  0

+    2.5891    0.4261   -0.0019 C   0  0  0

+   -3.4002   -0.2408    0.0008 N   0  3  0

+    3.9087   -0.0861    0.0007 C   0  0  0

+   -4.2858    0.5955    0.0035 O   0  0  0

+   -3.6817   -1.4258   -0.0012 O   0  5  0

+    4.9592    0.7582   -0.0003 N   0  0  0

+    4.0947   -1.2895    0.0038 O   0  0  0

+    0.4866    2.2168    0.0000 H   0  0  0

+    1.6867   -1.4253    0.0000 H   0  0  0

+   -2.1232    2.2950    0.0000 H   0  0  0

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+  1  2  1  0

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+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+28860-95-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    2.0956    0.4246    0.3948 C   0  0  1

+    1.0603    0.6313    1.5022 C   0  0  0

+    1.9284   -0.9503   -0.1990 C   0  0  0

+    1.9017    1.4369   -0.6519 N   0  0  0

+    3.5026    0.5596    0.9804 C   0  0  0

+   -0.3255    0.5520    0.9154 C   0  0  0

+    2.3993   -2.0248    0.4532 O   0  0  0

+    1.3704   -1.0855   -1.2622 O   0  0  0

+    2.5368    0.9218   -1.8542 N   0  0  0

+   -0.9203   -0.6797    0.7153 C   0  0  0

+   -1.0014    1.7116    0.5836 C   0  0  0

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+   -2.8729    0.4125   -0.1626 C   0  0  0

+   -2.7811   -1.9653   -0.0217 O   0  0  0

+   -4.1237    0.3445   -0.6919 O   0  0  0

+    1.6436    1.4214    0.0000 H   0  0  0

+    0.5929    1.4950    0.0000 H   0  0  0

+    1.3974    2.2796    0.0000 H   0  0  0

+    3.5964   -0.4180    0.0000 H   0  0  0

+    4.4802    0.6534    0.0000 H   0  0  0

+    3.4088    1.5372    0.0000 H   0  0  0

+    2.7935   -2.9243    0.0000 H   0  0  0

+    2.3824   -0.0480    0.0000 H   0  0  0

+    3.4539    1.2730    0.0000 H   0  0  0

+   -0.3742   -1.4959    0.0000 H   0  0  0

+   -0.5348    2.5757    0.0000 H   0  0  0

+   -2.8155    2.4628    0.0000 H   0  0  0

+   -3.2091   -2.8492    0.0000 H   0  0  0

+   -5.1043    0.2912    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  6 10  2  0

+  6 11  1  0

+ 10 12  1  0

+ 11 13  2  0

+ 12 14  2  0

+ 12 15  1  0

+ 14 16  1  0

+ 13 14  1  0

+  2 17  1  0

+  2 18  1  0

+  4 19  1  0

+  5 20  1  0

+  5 21  1  0

+  5 22  1  0

+  7 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51483-39-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.0000    0.8026   -0.1162 C   0  0  0

+   -1.2492    1.3751    0.5565 C   0  0  0

+    1.2492    1.3751    0.5565 C   0  0  0

+    0.0000   -1.1555    0.0599 Br  0  0  0

+   -2.7214    0.7004   -0.2363 Cl  0  0  0

+    2.7214    0.7004   -0.2363 Cl  0  0  0

+    0.0000    2.0172    0.0000 H   0  0  0

+   -0.4980    2.3295    0.0000 H   0  0  0

+   -2.0004    2.3295    0.0000 H   0  0  0

+    2.0004    2.3295    0.0000 H   0  0  0

+    0.4980    2.3295    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134-09-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 46                          1 V2000

+    2.7067   -0.6126   -0.0505 C   0  0  0

+    1.5979    0.1306   -0.7982 C   0  0  0

+    2.8046   -0.0776    1.3796 C   0  0  0

+    2.3841   -2.1078   -0.0146 C   0  0  0

+    0.3325   -0.0753   -0.1166 O   0  0  0

+    1.9205    1.6258   -0.8340 C   0  0  0

+    3.1272    1.4176    1.3438 C   0  0  0

+    2.2862   -2.6428   -1.4447 C   0  0  0

+    3.4930   -2.8510    0.7330 C   0  0  0

+   -0.8185   -0.0736   -0.8176 C   0  0  0

+    2.0184    2.1608    0.5960 C   0  0  0

+   -2.1022   -0.2825   -0.1261 C   0  0  0

+   -0.7974    0.1002   -2.0201 O   0  0  0

+    2.3410    3.6559    0.5602 C   0  0  0

+   -3.0888    0.7162   -0.1510 C   0  0  0

+   -2.3483   -1.4786    0.5543 C   0  0  0

+   -4.2955    0.5066    0.5054 C   0  0  0

+   -2.8598    1.9068   -0.8273 N   0  0  0

+   -3.5507   -1.6675    1.1988 C   0  0  0

+   -4.5205   -0.6771    1.1771 C   0  0  0

+    3.6497   -0.8006    0.0000 H   0  0  0

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+    2.8295    1.9393    0.0000 H   0  0  0

+    4.0342    1.0983    0.0000 H   0  0  0

+    3.5579    2.2773    0.0000 H   0  0  0

+    1.3404   -2.4697    0.0000 H   0  0  0

+    2.1131   -3.5886    0.0000 H   0  0  0

+    3.2320   -2.8159    0.0000 H   0  0  0

+    2.9577   -3.6497    0.0000 H   0  0  0

+    4.2917   -3.3863    0.0000 H   0  0  0

+    4.0283   -2.0523    0.0000 H   0  0  0

+    1.0754    2.3488    0.0000 H   0  0  0

+    3.2809    3.4531    0.0000 H   0  0  0

+    2.5438    4.5958    0.0000 H   0  0  0

+    1.4011    3.8587    0.0000 H   0  0  0

+   -1.6846   -2.1743    0.0000 H   0  0  0

+   -4.9700    1.1919    0.0000 H   0  0  0

+   -1.9513    2.2216    0.0000 H   0  0  0

+   -3.5867    2.5362    0.0000 H   0  0  0

+   -3.8532   -2.5802    0.0000 H   0  0  0

+   -5.4409   -0.9553    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 16 40  1  0

+ 17 41  1  0

+ 18 42  1  0

+ 18 43  1  0

+ 19 44  1  0

+ 20 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+79-94-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    0.2685   -1.1640   -1.8178 C   0  0  0

+   -1.0593   -0.7662   -1.2265 C   0  0  0

+    1.3827   -0.6323   -0.9536 C   0  0  0

+    0.3598   -2.6897   -1.8862 C   0  0  0

+    0.3941   -0.5819   -3.2272 C   0  0  0

+   -1.6029    0.4703   -1.5207 C   0  0  0

+   -1.7345   -1.6411   -0.3953 C   0  0  0

+    2.6994   -0.8605   -1.3077 C   0  0  0

+    1.0862    0.0878    0.1891 C   0  0  0

+   -2.8212    0.8377   -0.9800 C   0  0  0

+   -2.9527   -1.2791    0.1481 C   0  0  0

+    3.7236   -0.3735   -0.5169 C   0  0  0

+    2.1061    0.5770    0.9834 C   0  0  0

+   -3.4983   -0.0361   -0.1413 C   0  0  0

+   -3.5636    2.5296   -1.3824 Br  0  0  0

+   -3.8755   -2.4764    1.2842 Br  0  0  0

+    3.4290    0.3449    0.6331 C   0  0  0

+    5.5244   -0.6866   -1.0018 Br  0  0  0

+    1.6996    1.5621    2.5455 Br  0  0  0

+   -4.6963    0.3225    0.3917 O   0  0  0

+    4.4340    0.8248    1.4124 O   0  0  0

+   -0.5840   -2.7462    0.0000 H   0  0  0

+    0.4163   -3.6335    0.0000 H   0  0  0

+    1.3036   -2.6332    0.0000 H   0  0  0

+    1.3183   -0.7813    0.0000 H   0  0  0

+    0.5935    0.3423    0.0000 H   0  0  0

+   -0.5301   -0.3825    0.0000 H   0  0  0

+   -0.9761    1.1782    0.0000 H   0  0  0

+   -1.4440   -2.5409    0.0000 H   0  0  0

+    2.8277   -1.7973    0.0000 H   0  0  0

+    0.2035    0.4266    0.0000 H   0  0  0

+   -5.6021    0.5936    0.0000 H   0  0  0

+    5.2872    1.2322    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

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+ 11 14  1  0

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+  6 28  1  0

+  7 29  1  0

+  8 30  1  0

+  9 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2381-40-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    0.6390    0.0916    0.0036 C   0  0  0

+    0.3561   -1.2992    0.0001 C   0  0  0

+    2.0448    0.5262    0.0024 C   0  0  0

+   -0.3296    0.9942    0.0025 N   0  0  0

+   -0.9677   -1.7413    0.0010 C   0  0  0

+    1.4493   -2.2682   -0.0049 C   0  0  0

+    3.0703   -0.4420   -0.0021 C   0  0  0

+    2.3740    1.8834    0.0052 C   0  0  0

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+   -1.9813   -0.7773    0.0054 C   0  0  0

+   -1.2951   -3.2123   -0.0031 C   0  0  0

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+    4.4082   -0.0251   -0.0033 C   0  0  0

+    3.6973    2.2622    0.0035 C   0  0  0

+   -2.6405    1.6031   -0.0035 C   0  0  0

+   -3.3433   -1.1302    0.0070 C   0  0  0

+    4.7058    1.3068   -0.0001 C   0  0  0

+   -3.9381    1.1982   -0.0083 C   0  0  0

+   -4.2869   -0.1511    0.0118 C   0  0  0

+   -5.0298    2.2372   -0.0101 C   0  0  0

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+   -1.5230   -4.2364    0.0000 H   0  0  0

+   -0.2710   -3.4402    0.0000 H   0  0  0

+    3.5030   -2.5768    0.0000 H   0  0  0

+    5.1799   -0.7358    0.0000 H   0  0  0

+    3.9465    3.2813    0.0000 H   0  0  0

+   -2.4066    2.6258    0.0000 H   0  0  0

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+   -5.3016   -0.4177    0.0000 H   0  0  0

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+   -5.7897    2.9605    0.0000 H   0  0  0

+   -5.7531    1.4773    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 30  1  0

+ 17 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87-10-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    1.1937   -0.2719    0.2268 C   0  0  0

+   -0.2650   -0.4364    0.3725 C   0  0  0

+    1.7549    1.0105    0.1593 C   0  0  0

+    2.0239   -1.3936    0.1612 C   0  0  0

+   -1.0739   -0.2456   -0.6885 N   0  0  0

+   -0.7375   -0.7442    1.4498 O   0  0  0

+    3.1281    1.1539    0.0223 C   0  0  0

+    0.9588    2.1071    0.2273 O   0  0  0

+    3.3868   -1.2333    0.0250 C   0  0  0

+   -2.4608   -0.1999   -0.5113 C   0  0  0

+    3.9374    0.0363   -0.0477 C   0  0  0

+    3.8928    2.8809   -0.0695 Br  0  0  0

+    4.5091   -2.7527   -0.0631 Br  0  0  0

+   -3.2098   -1.3670   -0.5815 C   0  0  0

+   -3.0905    1.0123   -0.2592 C   0  0  0

+   -4.5790   -1.3190   -0.4057 C   0  0  0

+   -4.4595    1.0544   -0.0843 C   0  0  0

+   -5.2042   -0.1096   -0.1600 C   0  0  0

+   -7.0788   -0.0479    0.0801 Br  0  0  0

+    1.6126   -2.3444    0.0000 H   0  0  0

+   -0.9373    0.7813    0.0000 H   0  0  0

+    0.3502    2.9454    0.0000 H   0  0  0

+    4.9672    0.1488    0.0000 H   0  0  0

+   -2.7290   -2.2846    0.0000 H   0  0  0

+   -2.5392    1.8893    0.0000 H   0  0  0

+   -5.1331   -2.1943    0.0000 H   0  0  0

+   -4.9429    1.9707    0.0000 H   0  0  0

+  1  2  1  0

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+  8 22  1  0

+ 11 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+603-35-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    0.0001   -0.0009    0.0047 P   0  0  0

+   -1.6136   -0.9456   -0.0124 C   0  0  0

+    1.6249   -0.9262    0.0332 C   0  0  0

+   -0.0108    1.8690   -0.0146 C   0  0  0

+   -2.2889   -1.1966    1.1796 C   0  0  0

+   -2.1473   -1.3956   -1.2180 C   0  0  0

+    2.1955   -1.3732   -1.1561 C   0  0  0

+    2.2716   -1.1657    1.2437 C   0  0  0

+    1.1557    2.5715   -0.3067 C   0  0  0

+   -1.1872    2.5639    0.2575 C   0  0  0

+   -3.4797   -1.8944    1.1616 C   0  0  0

+   -3.3383   -2.0923   -1.2251 C   0  0  0

+    3.3948   -2.0557   -1.1296 C   0  0  0

+    3.4703   -1.8490    1.2594 C   0  0  0

+    1.1423    3.9516   -0.3201 C   0  0  0

+   -1.1901    3.9436    0.2415 C   0  0  0

+   -4.0025   -2.3441   -0.0376 C   0  0  0

+    4.0301   -2.2960    0.0755 C   0  0  0

+   -0.0272    4.6370   -0.0441 C   0  0  0

+   -2.7266   -0.2739    0.0000 H   0  0  0

+   -1.5581   -2.2298    0.0000 H   0  0  0

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+    2.7033   -0.2401    0.0000 H   0  0  0

+    2.0473    2.0734    0.0000 H   0  0  0

+   -2.0736    2.0567    0.0000 H   0  0  0

+   -4.0733   -1.0633    0.0000 H   0  0  0

+   -2.8979   -3.0137    0.0000 H   0  0  0

+    2.9603   -2.9799    0.0000 H   0  0  0

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+   -4.8804   -2.8660    0.0000 H   0  0  0

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+  1  2  1  0

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+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+31688-71-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -0.2784    0.0014   -0.4326 C   0  0  0

+    0.4014   -1.2042   -0.2680 C   0  0  0

+    0.4052    1.2045   -0.2676 C   0  0  0

+   -1.7417    0.0039   -0.7928 C   0  0  0

+    1.8267   -1.2065    0.0767 C   0  0  0

+   -0.2597   -2.4412   -0.4271 C   0  0  0

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+   -0.2519    2.4438   -0.4262 C   0  0  0

+   -2.5389    0.0017    0.4207 O   0  0  0

+    2.5104   -0.0032    0.2417 C   0  0  0

+    2.4840   -2.4455    0.2364 C   0  0  0

+    0.4322   -3.5969   -0.2590 C   0  0  0

+    2.4920    2.4390    0.2372 C   0  0  0

+    0.4438    3.5971   -0.2578 C   0  0  0

+   -3.8789    0.0033    0.3435 C   0  0  0

+    3.9751   -0.0055    0.5964 C   0  0  0

+    1.7885   -3.5990    0.0689 C   0  0  0

+    1.8001    3.5948    0.0701 C   0  0  0

+   -4.7063    0.0010    1.6030 C   0  0  0

+   -4.4218    0.0066   -0.7360 O   0  0  0

+   -1.2226    0.9026    0.0000 H   0  0  0

+   -2.2617    0.9020    0.0000 H   0  0  0

+   -1.2972   -2.4664    0.0000 H   0  0  0

+   -1.2893    2.4725    0.0000 H   0  0  0

+    3.5214   -2.4739    0.0000 H   0  0  0

+   -0.0803   -4.4994    0.0000 H   0  0  0

+    3.5295    2.4641    0.0000 H   0  0  0

+   -0.0657    4.5012    0.0000 H   0  0  0

+    3.9735   -1.0433    0.0000 H   0  0  0

+    5.0129   -0.0071    0.0000 H   0  0  0

+    3.9767    1.0323    0.0000 H   0  0  0

+    2.2981   -4.5030    0.0000 H   0  0  0

+    2.3126    4.4972    0.0000 H   0  0  0

+   -4.7092    1.0388    0.0000 H   0  0  0

+   -5.7441   -0.0019    0.0000 H   0  0  0

+   -4.7034   -1.0368    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2461-15-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 35                          1 V2000

+    3.7127    0.0330   -0.1211 C   0  0  0

+    4.8789   -0.7880    0.4328 C   0  0  0

+    4.3149   -1.0336   -0.8571 O   0  0  0

+    2.4039   -0.4541    0.5040 C   0  0  0

+    1.3146    0.3127   -0.0133 O   0  0  0

+    0.1273   -0.1871    0.6051 C   0  0  0

+   -1.0832    0.5954    0.0919 C   0  0  0

+   -2.3545    0.0603    0.7540 C   0  0  0

+   -0.9150    2.0772    0.4341 C   0  0  0

+   -3.2955   -0.4904   -0.3194 C   0  0  0

+   -0.9978    2.9090   -0.8473 C   0  0  0

+   -4.5178   -1.1223    0.3494 C   0  0  0

+   -5.4588   -1.6729   -0.7240 C   0  0  0

+    3.8408    1.0238    0.0000 H   0  0  0

+    5.4372   -1.6166    0.0000 H   0  0  0

+    5.5926   -0.0888    0.0000 H   0  0  0

+    1.6777   -1.1403    0.0000 H   0  0  0

+    2.9318   -1.3023    0.0000 H   0  0  0

+   -0.5706   -0.9020    0.0000 H   0  0  0

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+   -1.1707   -0.3999    0.0000 H   0  0  0

+   -2.2732    1.0561    0.0000 H   0  0  0

+   -3.2002    0.5922    0.0000 H   0  0  0

+   -0.0716    1.5415    0.0000 H   0  0  0

+   -0.0643    2.6012    0.0000 H   0  0  0

+   -3.3245   -1.4891    0.0000 H   0  0  0

+   -2.4361   -0.9999    0.0000 H   0  0  0

+   -0.0036    3.0080    0.0000 H   0  0  0

+   -1.0968    3.9032    0.0000 H   0  0  0

+   -1.9920    2.8100    0.0000 H   0  0  0

+   -4.4888   -0.1236    0.0000 H   0  0  0

+   -5.3772   -0.6127    0.0000 H   0  0  0

+   -5.9634   -0.8106    0.0000 H   0  0  0

+   -6.3211   -2.1775    0.0000 H   0  0  0

+   -4.9542   -2.5352    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 12 32  1  0

+ 13 33  1  0

+ 13 34  1  0

+ 13 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88741-68-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+   -0.7190    0.8633   -0.0191 C   0  0  0

+   -0.9799   -0.5234   -0.0935 C   0  0  0

+    0.5974    1.3645    0.0271 C   0  0  0

+   -1.8018    1.7751    0.0041 C   0  0  0

+   -2.3009   -0.9704   -0.1375 C   0  0  0

+    0.1390   -1.4749   -0.1241 C   0  0  0

+    1.7413    0.4314   -0.0024 C   0  0  0

+    0.8003    2.6718    0.0964 N   0  0  0

+   -3.1224    1.2933   -0.0464 C   0  0  0

+   -1.5100    3.1473    0.0782 C   0  0  0

+   -3.3603   -0.0487   -0.1085 C   0  0  0

+   -2.5625   -2.2974   -0.2089 O   0  0  0

+    1.5172   -0.9573   -0.0763 C   0  0  0

+   -0.0697   -2.6732   -0.1875 O   0  0  0

+    3.0452    0.9163    0.0420 C   0  0  0

+   -0.1913    3.5431    0.1246 C   0  0  0

+   -4.6415   -0.5000   -0.1531 O   0  0  0

+   -2.8326   -2.7374    1.1236 C   0  0  0

+    2.6034   -1.8355   -0.1039 C   0  0  0

+    4.1115    0.0313    0.0132 C   0  0  0

+   -5.4868    0.6514   -0.1088 C   0  0  0

+    3.8869   -1.3408   -0.0587 C   0  0  0

+    5.3827    0.5053    0.0560 O   0  0  0

+    6.2488   -0.6305    0.0116 C   0  0  0

+   -3.9236    1.9657    0.0000 H   0  0  0

+   -2.2793    3.8559    0.0000 H   0  0  0

+    3.2205    1.9474    0.0000 H   0  0  0

+    0.0315    4.5650    0.0000 H   0  0  0

+   -3.7240   -2.1902    0.0000 H   0  0  0

+   -3.3798   -3.6288    0.0000 H   0  0  0

+   -1.9412   -3.2846    0.0000 H   0  0  0

+    2.4409   -2.8687    0.0000 H   0  0  0

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+   -6.1058    1.4945    0.0000 H   0  0  0

+   -6.3299    0.0324    0.0000 H   0  0  0

+    4.6985   -2.0006    0.0000 H   0  0  0

+    5.4171   -1.2647    0.0000 H   0  0  0

+    6.8830   -1.4622    0.0000 H   0  0  0

+    7.0805    0.0037    0.0000 H   0  0  0

+  1  2  1  0

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+ 21 35  1  0

+ 22 36  1  0

+ 24 37  1  0

+ 24 38  1  0

+ 24 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+43210-67-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -0.7233   -0.5970   -0.2238 C   0  0  0

+   -0.8199   -1.6359    0.7165 C   0  0  0

+    0.4898   -0.3712   -0.8789 C   0  0  0

+   -1.9429   -0.0016   -0.2883 N   0  0  0

+   -2.1243   -1.6094    1.1859 N   0  0  0

+    0.2836   -2.4306    0.9907 C   0  0  0

+    1.5816   -1.1719   -0.5952 C   0  0  0

+   -2.7672   -0.5962    0.5361 C   0  0  0

+    1.4764   -2.2003    0.3394 C   0  0  0

+    3.1130   -0.8903   -1.4199 S   0  0  0

+   -4.0933   -0.2460    0.7248 N   0  0  0

+    3.8116    0.3312   -0.3595 C   0  0  0

+   -4.6538    0.7091   -0.0433 C   0  0  0

+    4.9730    0.9968   -0.7337 C   0  0  0

+    3.1995    0.6355    0.8503 C   0  0  0

+   -5.9689    0.9755    0.0665 O   0  0  0

+   -3.9724    1.3297   -0.8349 O   0  0  0

+    5.5173    1.9536    0.0995 C   0  0  0

+    3.7496    1.5938    1.6788 C   0  0  0

+   -6.5728    2.0045   -0.7610 C   0  0  0

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+    0.6925    0.5171    0.0000 H   0  0  0

+   -2.5713   -2.4033    0.0000 H   0  0  0

+    0.0877   -3.3204    0.0000 H   0  0  0

+    2.1486   -2.8153    0.0000 H   0  0  0

+   -4.6441   -0.9718    0.0000 H   0  0  0

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+    3.1072    2.2399    0.0000 H   0  0  0

+   -5.7870    2.4657    0.0000 H   0  0  0

+   -7.0340    2.7903    0.0000 H   0  0  0

+   -7.3586    1.5433    0.0000 H   0  0  0

+    4.8798    3.1609    0.0000 H   0  0  0

+  1  2  2  0

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+ 18 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19686-73-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    1.7013    0.0786   -0.3410 C   0  0  0

+    0.5830    0.8572    0.3549 C   0  0  0

+    3.0466    0.7451   -0.0460 C   0  0  0

+    1.7191   -1.2654    0.1441 O   0  0  0

+   -1.1456    0.0007   -0.0240 Br  0  0  0

+    0.7526   -0.4249    0.0000 H   0  0  0

+    1.3350    1.6239    0.0000 H   0  0  0

+   -0.0476    1.7266    0.0000 H   0  0  0

+    3.5234   -0.2173    0.0000 H   0  0  0

+    4.0090    1.2219    0.0000 H   0  0  0

+    2.5698    1.7075    0.0000 H   0  0  0

+    1.7333   -2.3393    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2213-00-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 42                          1 V2000

+   -0.6841    0.5354    0.6457 C   0  0  2

+   -1.0640   -0.8813    0.2693 C   0  0  2

+    0.7779    0.8648    0.7424 C   0  0  1

+   -1.2054   -0.4134    1.7224 C   0  0  0

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+    0.0763   -1.8333    0.0852 C   0  0  0

+   -2.3098   -1.1342   -0.5400 C   0  0  0

+    1.6581   -0.2965    1.2212 C   0  0  1

+    1.3777    1.2360   -0.6293 C   0  0  0

+   -1.9906    1.7553   -1.0574 O   0  0  0

+   -1.9700    2.4714    1.0332 O   0  0  0

+    1.2992   -1.5689    0.5077 C   0  0  0

+   -0.1739   -3.1070   -0.5888 C   0  0  0

+   -3.1685   -1.8682   -0.1132 O   0  0  0

+    3.0816    0.1071    0.7630 C   0  0  0

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+   -2.8685    2.8373   -1.4659 C   0  0  0

+    0.7083   -3.9364   -0.6654 O   0  0  0

+    3.5411    0.4865   -1.6804 C   0  0  0

+    3.5317    2.4285   -0.0953 C   0  0  0

+    0.4135    1.7567    0.0000 H   0  0  0

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+   -2.7321   -0.2682    0.0000 H   0  0  0

+    0.7114   -0.4755    0.0000 H   0  0  0

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+    0.6490    1.8663    0.0000 H   0  0  0

+    1.9590   -2.2710    0.0000 H   0  0  0

+   -1.0911   -3.4020    0.0000 H   0  0  0

+    3.3163   -0.8273    0.0000 H   0  0  0

+    4.0227    0.3135    0.0000 H   0  0  0

+   -2.1203    3.4443    0.0000 H   0  0  0

+   -3.4755    3.5855    0.0000 H   0  0  0

+   -3.6167    2.2303    0.0000 H   0  0  0

+    2.8903   -0.2239    0.0000 H   0  0  0

+    4.2515   -0.1643    0.0000 H   0  0  0

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+    4.4049    2.0213    0.0000 H   0  0  0

+    3.9389    3.3017    0.0000 H   0  0  0

+    2.6585    2.8357    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+144280-50-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.7377    0.4102   -0.0026 C   0  0  0

+   -0.7377    0.4102   -0.0011 C   0  0  0

+    1.1171    1.7596   -0.0007 C   0  0  0

+    1.7047   -0.5895   -0.0002 C   0  0  0

+   -1.1171    1.7596    0.0016 C   0  0  0

+   -1.7047   -0.5895   -0.0018 C   0  0  0

+    0.0000    2.5197    0.0017 O   0  0  0

+    2.4687    2.0836   -0.0015 C   0  0  0

+    3.0410   -0.2487   -0.0018 C   0  0  0

+   -2.4687    2.0836    0.0031 C   0  0  0

+   -3.0410   -0.2487    0.0001 C   0  0  0

+    3.4191    1.0846   -0.0042 C   0  0  0

+    4.0736   -1.3092    0.0012 N   0  3  0

+   -3.4191    1.0846    0.0020 C   0  0  0

+   -4.0736   -1.3092   -0.0006 N   0  3  0

+    5.2542   -1.0097   -0.0002 O   0  0  0

+    3.7427   -2.4814    0.0050 O   0  5  0

+   -5.2542   -1.0097    0.0011 O   0  0  0

+   -3.7427   -2.4814   -0.0030 O   0  5  0

+    1.4213   -1.5895    0.0000 H   0  0  0

+   -1.4213   -1.5895    0.0000 H   0  0  0

+    2.7635    3.0803    0.0000 H   0  0  0

+   -2.7635    3.0803    0.0000 H   0  0  0

+    4.4282    1.3338    0.0000 H   0  0  0

+   -4.4282    1.3338    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  5  7  1  0

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+ 11 14  1  0

+  4 20  1  0

+  6 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86-30-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -0.0693   -0.8112   -0.0018 N   0  0  0

+   -1.2968   -0.1417    0.0019 C   0  0  0

+    1.1242   -0.0829   -0.0172 C   0  0  0

+   -0.0379   -2.1007    0.0145 N   0  0  0

+   -2.4799   -0.8555   -0.1460 C   0  0  0

+   -1.3369    1.2380    0.1591 C   0  0  0

+    1.6858    0.3076   -1.2263 C   0  0  0

+    1.7482    0.2568    1.1770 C   0  0  0

+    1.0286   -2.6828    0.1000 O   0  0  0

+   -3.6902   -0.1913   -0.1415 C   0  0  0

+   -2.5512    1.8960    0.1627 C   0  0  0

+    2.8649    1.0268   -1.2379 C   0  0  0

+    2.9267    0.9759    1.1580 C   0  0  0

+   -3.7261    1.1831    0.0100 C   0  0  0

+    3.4861    1.3582   -0.0479 C   0  0  0

+   -2.4587   -1.8885    0.0000 H   0  0  0

+   -0.4570    1.7795    0.0000 H   0  0  0

+    1.1216    1.1731    0.0000 H   0  0  0

+    2.2644   -0.6382    0.0000 H   0  0  0

+   -4.5724   -0.7291    0.0000 H   0  0  0

+   -2.5764    2.9289    0.0000 H   0  0  0

+    2.3525    1.9240    0.0000 H   0  0  0

+    3.4874    0.1081    0.0000 H   0  0  0

+   -4.6330    1.6781    0.0000 H   0  0  0

+    4.3697    1.8936    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 12 15  2  0

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+ 13 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2164-08-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+   -0.2182   -0.4608   -0.0113 N   0  0  0

+   -1.6829   -0.4704    0.0140 C   0  0  0

+    0.4457    0.7112   -0.0497 C   0  0  0

+    0.4612   -1.6225    0.0094 C   0  0  0

+   -2.1764    0.2765    1.2547 C   0  0  0

+   -2.2192    0.2180   -1.2427 C   0  0  0

+    1.8631    0.7109   -0.0738 C   0  0  0

+   -0.1676    1.7632   -0.0640 O   0  0  0

+    1.8051   -1.6369   -0.0132 N   0  0  0

+   -0.1491   -2.6734    0.0496 O   0  0  0

+   -3.7062    0.2665    1.2812 C   0  0  0

+   -3.7490    0.2080   -1.2162 C   0  0  0

+    2.5196   -0.4671   -0.0581 C   0  0  0

+    2.8453    1.8605   -0.1162 C   0  0  0

+   -4.2425    0.9550    0.0245 C   0  0  0

+    4.0147   -0.2338   -0.0888 C   0  0  0

+    4.1973    1.2471    0.3094 C   0  0  0

+   -2.1239   -1.3806    0.0000 H   0  0  0

+   -1.2415    0.6624    0.0000 H   0  0  0

+   -2.3763    1.2680    0.0000 H   0  0  0

+   -1.3056    0.6519    0.0000 H   0  0  0

+   -2.4448    1.2039    0.0000 H   0  0  0

+    2.2952   -2.5217    0.0000 H   0  0  0

+   -4.6198   -0.1674    0.0000 H   0  0  0

+   -3.4806   -0.7195    0.0000 H   0  0  0

+   -4.6840   -0.1778    0.0000 H   0  0  0

+   -3.5491   -0.7835    0.0000 H   0  0  0

+    3.3475    2.7384    0.0000 H   0  0  0

+    2.0182    2.4427    0.0000 H   0  0  0

+   -3.8380    1.8820    0.0000 H   0  0  0

+   -5.2502    0.8679    0.0000 H   0  0  0

+    4.0777   -1.2433    0.0000 H   0  0  0

+    5.0257   -0.2643    0.0000 H   0  0  0

+    5.1835    1.0227    0.0000 H   0  0  0

+    4.5201    2.2056    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  2  0

+  7 14  1  0

+ 11 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+  9 13  1  0

+ 12 15  1  0

+ 16 17  1  0

+  2 18  1  0

+  5 19  1  0

+  5 20  1  0

+  6 21  1  0

+  6 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109875-45-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+    2.3132   -0.7919    0.0148 N   0  0  0

+    0.9934   -1.1686    0.0282 C   0  0  0

+    2.8226    0.5797   -0.0587 C   0  0  2

+    3.0628   -1.9281    0.0884 C   0  0  0

+    0.9921   -2.5723    0.1073 C   0  0  0

+   -0.1650   -0.5217   -0.0144 N   0  0  0

+    4.0995    0.5835   -0.7334 O   0  0  0

+    3.1276    1.0927    1.3662 C   0  0  0

+    2.2858   -2.9708    0.1457 N   0  0  0

+   -0.2471   -3.2375    0.1374 C   0  0  0

+   -1.3097   -1.1867    0.0169 C   0  0  0

+    4.7523    1.7988   -0.3059 C   0  0  1

+    4.4263    1.9132    1.1998 C   0  0  1

+   -1.3577   -2.5127    0.0901 N   0  0  0

+   -0.3067   -4.6180    0.2144 N   0  0  0

+   -2.5814   -0.4258   -0.0323 C   0  0  0

+    6.2645    1.6577   -0.4910 C   0  0  0

+    4.1717    3.2801    1.5295 O   0  0  0

+   -3.8016   -1.0995   -0.0008 C   0  0  0

+   -2.5616    0.9659   -0.1043 C   0  0  0

+    6.5586    1.4621   -1.8756 O   0  0  0

+   -4.9818   -0.3862   -0.0469 C   0  0  0

+   -3.7485    1.6689   -0.1499 C   0  0  0

+   -4.9560    0.9949   -0.1242 C   0  0  0

+   -6.2255    1.7545   -0.1733 N   0  3  0

+   -6.2054    2.9704   -0.2413 O   0  0  0

+   -7.2902    1.1636   -0.1457 O   0  5  0

+    1.8894    1.0259    0.0000 H   0  0  0

+    4.0968   -1.9577    0.0000 H   0  0  0

+    2.9253    2.1072    0.0000 H   0  0  0

+    2.1080    1.2675    0.0000 H   0  0  0

+    4.9733    2.8094    0.0000 H   0  0  0

+    4.5429    0.8854    0.0000 H   0  0  0

+   -1.2240   -5.0961    0.0000 H   0  0  0

+    0.5660   -5.1734    0.0000 H   0  0  0

+    7.1034    2.2629    0.0000 H   0  0  0

+    5.9926    2.6558    0.0000 H   0  0  0

+    3.9823    4.2970    0.0000 H   0  0  0

+   -3.8219   -2.1337    0.0000 H   0  0  0

+   -1.6593    1.4717    0.0000 H   0  0  0

+    7.4199    0.8892    0.0000 H   0  0  0

+   -5.8875   -0.8860    0.0000 H   0  0  0

+   -3.7352    2.7032    0.0000 H   0  0  0

+  1  2  1  0

+  3  1  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  7 12  1  0

+  8 13  1  0

+ 10 14  2  0

+ 10 15  1  0

+ 11 16  1  0

+ 12 17  1  0

+ 13 18  1  0

+ 16 19  1  0

+ 16 20  2  0

+ 17 21  1  0

+ 19 22  2  0

+ 20 23  1  0

+ 22 24  1  0

+ 24 25  1  0

+ 25 26  2  0

+ 25 27  1  0

+  5  9  1  0

+ 11 14  1  0

+ 12 13  1  0

+ 23 24  2  0

+  3 28  1  0

+  4 29  1  0

+  8 30  1  0

+  8 31  1  0

+ 12 32  1  0

+ 13 33  1  0

+ 15 34  1  0

+ 15 35  1  0

+ 17 36  1  0

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+ 18 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+ 21 41  1  0

+ 22 42  1  0

+ 23 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87-29-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -2.8196   -0.0347   -0.2507 C   0  0  0

+   -3.7587   -0.1128    0.7901 C   0  0  0

+   -1.9083    1.1189   -0.3417 C   0  0  0

+   -2.7512   -1.0615   -1.1969 C   0  0  0

+   -4.6128   -1.2065    0.8644 C   0  0  0

+   -3.8334    0.8968    1.7401 N   0  0  0

+   -0.5760    0.9332   -0.2595 O   0  0  0

+   -2.3577    2.2380   -0.4908 O   0  0  0

+   -3.6025   -2.1401   -1.1028 C   0  0  0

+   -4.5363   -2.2086   -0.0805 C   0  0  0

+    0.3224    2.0703   -0.3491 C   0  0  0

+    1.7476    1.5952   -0.2295 C   0  0  0

+    2.0048    0.3046   -0.0694 C   0  0  0

+    3.4026   -0.1614    0.0480 C   0  0  0

+    3.6766   -1.5189    0.2165 C   0  0  0

+    4.4541    0.7540   -0.0151 C   0  0  0

+    4.9838   -1.9476    0.3249 C   0  0  0

+    5.7564    0.3126    0.0947 C   0  0  0

+    6.0213   -1.0345    0.2669 C   0  0  0

+   -1.7666   -1.3670    0.0000 H   0  0  0

+   -5.5997   -0.9083    0.0000 H   0  0  0

+   -2.9811    1.4767    0.0000 H   0  0  0

+   -4.7618    1.3450    0.0000 H   0  0  0

+   -3.1192   -3.0507    0.0000 H   0  0  0

+   -5.2088   -2.9900    0.0000 H   0  0  0

+    0.7591    3.0042    0.0000 H   0  0  0

+   -0.5549    2.6118    0.0000 H   0  0  0

+    2.5207    2.2772    0.0000 H   0  0  0

+    1.2317   -0.3774    0.0000 H   0  0  0

+    2.9060   -2.2037    0.0000 H   0  0  0

+    4.2546    1.7654    0.0000 H   0  0  0

+    5.1910   -2.9575    0.0000 H   0  0  0

+    6.5321    0.9917    0.0000 H   0  0  0

+    6.9974   -1.3661    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

+  3  8  2  0

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+ 11 26  1  0

+ 11 27  1  0

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+ 13 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+113163-24-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+   -0.5133   -0.1393    0.0221 C   0  0  0

+   -1.3755   -1.3615   -0.0019 C   0  0  0

+    0.8897   -0.2924   -0.0154 C   0  0  0

+   -1.0372    1.1132    0.0843 C   0  0  0

+   -2.7919   -1.1546   -0.4700 C   0  0  0

+   -2.4594   -1.2131    0.9181 O   0  0  0

+    1.7173    0.8543    0.0269 C   0  0  0

+    1.4396   -1.5090   -0.0898 N   0  0  0

+   -2.5368    1.2798    0.0935 C   0  0  0

+   -0.2210    2.2424    0.1326 C   0  0  0

+   -3.1371    0.2617   -0.8745 C   0  0  0

+    1.1348    2.1297    0.1058 C   0  0  0

+    3.1153    0.6899   -0.0109 C   0  0  0

+    2.7405   -1.6666   -0.1248 C   0  0  0

+    3.6121   -0.5802   -0.0861 C   0  0  0

+   -0.9589   -2.3196    0.0000 H   0  0  0

+   -3.5063   -1.9170    0.0000 H   0  0  0

+   -2.2769    2.2918    0.0000 H   0  0  0

+   -3.5023    1.6790    0.0000 H   0  0  0

+   -0.6575    3.1916    0.0000 H   0  0  0

+   -3.8657    1.0105    0.0000 H   0  0  0

+   -4.0513   -0.2441    0.0000 H   0  0  0

+    1.7356    2.9845    0.0000 H   0  0  0

+    3.7538    1.5169    0.0000 H   0  0  0

+    3.1349   -2.6341    0.0000 H   0  0  0

+    4.6449   -0.7380    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  4 10  1  0

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+ 14 15  1  0

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+ 11 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+81593-13-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+    0.2098    0.9332    0.5495 C   0  0  0

+    0.0758   -0.5728    0.8216 C   0  0  0

+   -0.3584    0.0196   -0.4507 N   0  0  0

+    1.5414    1.4476    0.0567 C   0  0  0

+    1.2837   -1.4461    0.5786 C   0  0  0

+   -2.0309    0.1845   -0.3616 P   0  0  0

+    2.6011    0.5691   -0.1386 C   0  0  0

+    1.6987    2.7953   -0.1978 C   0  0  0

+    2.4713   -0.8853    0.1226 C   0  0  0

+    1.1999   -2.8042    0.8120 C   0  0  0

+   -2.7329   -1.0363   -1.1419 O   0  0  0

+   -2.4901    0.1701    1.1815 O   0  0  0

+   -2.4342    1.4651   -0.9844 O   0  0  0

+    3.8251    1.0660   -0.5951 C   0  0  0

+    2.9130    3.2794   -0.6493 C   0  0  0

+    3.5771   -1.7114   -0.0961 C   0  0  0

+    2.2986   -3.6152    0.5932 C   0  0  0

+   -4.1424   -0.8094   -1.0810 C   0  0  0

+   -2.8879    1.5036    1.5065 C   0  0  0

+    3.9735    2.4132   -0.8467 C   0  0  0

+    3.4847   -3.0666    0.1393 C   0  0  0

+   -4.8728   -1.9402   -1.8082 C   0  0  0

+   -3.3944    1.5473    2.9496 C   0  0  0

+   -0.4404    1.7186    0.0000 H   0  0  0

+   -0.6428   -1.2961    0.0000 H   0  0  0

+    0.8893    3.4155    0.0000 H   0  0  0

+    0.2759   -3.2354    0.0000 H   0  0  0

+    4.6384    0.4510    0.0000 H   0  0  0

+    3.0682    4.2872    0.0000 H   0  0  0

+    4.5037   -1.2858    0.0000 H   0  0  0

+    2.1955   -4.6296    0.0000 H   0  0  0

+   -3.8434    0.1654    0.0000 H   0  0  0

+   -5.0668   -0.3792    0.0000 H   0  0  0

+   -1.8820    1.6707    0.0000 H   0  0  0

+   -2.9279    2.5225    0.0000 H   0  0  0

+    4.9173    2.7991    0.0000 H   0  0  0

+    4.3246   -3.6447    0.0000 H   0  0  0

+   -5.7293   -1.3870    0.0000 H   0  0  0

+   -5.4260   -2.7967    0.0000 H   0  0  0

+   -4.0163   -2.4934    0.0000 H   0  0  0

+   -3.3068    2.5632    0.0000 H   0  0  0

+   -4.4103    1.6349    0.0000 H   0  0  0

+   -3.4820    0.5314    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 14 20  2  0

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+ 18 22  1  0

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+  2  3  1  0

+  7  9  1  0

+ 15 20  1  0

+ 17 21  1  0

+  1 24  1  0

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+  8 26  1  0

+ 10 27  1  0

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+ 19 35  1  0

+ 20 36  1  0

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+ 22 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+ 23 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15980-15-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    1.0565   -1.1562    0.3308 C   0  0  0

+   -0.3058   -1.3825   -0.3327 C   0  0  0

+    1.6798   -0.0003   -0.2186 O   0  0  0

+   -1.4012    0.0003    0.1105 S   0  0  0

+    1.0570    1.1558    0.3308 C   0  0  0

+   -0.3053    1.3826   -0.3327 C   0  0  0

+    0.9995   -2.1904    0.0000 H   0  0  0

+    2.0534   -1.4373    0.0000 H   0  0  0

+   -1.2140   -1.8804    0.0000 H   0  0  0

+    0.0328   -2.3613    0.0000 H   0  0  0

+    2.0540    1.4365    0.0000 H   0  0  0

+    1.0003    2.1900    0.0000 H   0  0  0

+    0.0337    2.3613    0.0000 H   0  0  0

+   -1.2133    1.8809    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  3  5  1  0

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+  5  6  1  0

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+  2  9  1  0

+  2 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-59-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.4296   -1.2383   -0.0022 C   0  0  0

+   -1.1119   -2.0916   -0.0131 S   0  0  0

+    0.9973   -0.8406    1.2027 C   0  0  0

+    1.0836   -0.9663   -1.1977 C   0  0  0

+   -2.2200   -0.7216   -0.0150 C   0  0  0

+    2.2052   -0.1722    1.2073 C   0  0  0

+    2.2916   -0.2973   -1.1853 C   0  0  0

+   -3.5815   -0.9292    0.1657 C   0  0  0

+   -1.7313    0.5670   -0.1914 C   0  0  0

+    2.8506    0.1019    0.0149 C   0  0  0

+   -4.4496    0.1446    0.1646 C   0  0  0

+   -2.5995    1.6402   -0.1924 C   0  0  0

+    4.1457    0.8189    0.0241 N   0  3  0

+   -3.9616    1.4319   -0.0170 C   0  0  0

+    4.7152    1.0610   -1.0250 O   0  0  0

+    4.6418    1.1667    1.0807 O   0  5  0

+   -4.8418    2.5202   -0.0185 N   0  0  0

+    0.4498    0.0360    0.0000 H   0  0  0

+    1.5331   -1.8970    0.0000 H   0  0  0

+    1.7524    0.7569    0.0000 H   0  0  0

+    2.8432   -1.1713    0.0000 H   0  0  0

+   -3.9551   -1.8929    0.0000 H   0  0  0

+   -0.7108    0.7305    0.0000 H   0  0  0

+   -5.4701   -0.0188    0.0000 H   0  0  0

+   -2.2263    2.6040    0.0000 H   0  0  0

+   -4.4708    3.4849    0.0000 H   0  0  0

+   -5.8627    2.3591    0.0000 H   0  0  0

+  1  2  1  0

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+  4  7  1  0

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+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106636-48-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.6649    0.3837    0.0469 C   0  0  0

+   -1.4654   -0.6979   -0.0766 C   0  0  0

+    0.8184    0.3765    0.0446 C   0  0  0

+   -1.4567    1.4768    0.1674 N   0  0  0

+   -2.7857   -0.2518   -0.0239 N   0  0  0

+   -1.0208   -2.1037   -0.2390 N   0  3  0

+    1.5219    1.3824   -0.6162 C   0  0  0

+    1.5140   -0.6326    0.7078 C   0  0  0

+   -2.7069    1.0966    0.1214 C   0  0  0

+   -4.1070   -0.8726   -0.0939 C   0  0  0

+   -0.8397   -2.5602   -1.3536 O   0  0  0

+   -0.8369   -2.8016    0.7421 O   0  5  0

+    2.9017    1.3709   -0.6147 C   0  0  0

+    2.8943   -0.6340    0.7027 C   0  0  0

+   -4.3759    1.7059    0.1852 S   0  0  0

+   -5.2756    0.1188    0.0212 C   0  0  0

+    3.5870    0.3636    0.0410 C   0  0  0

+    5.0677    0.3567    0.0391 N   0  3  0

+    5.6733   -0.5290    0.6155 O   0  0  0

+    5.6800    1.2367   -0.5390 O   0  5  0

+    1.0578    2.2825    0.0000 H   0  0  0

+    1.0427   -1.5289    0.0000 H   0  0  0

+   -4.8653   -1.5438    0.0000 H   0  0  0

+   -3.5504   -1.7186    0.0000 H   0  0  0

+    3.3791    2.2640    0.0000 H   0  0  0

+    3.3632   -1.5316    0.0000 H   0  0  0

+   -6.1236    0.6723    0.0000 H   0  0  0

+   -5.8811   -0.6929    0.0000 H   0  0  0

+  1  2  2  0

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+ 10 23  1  0

+ 10 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+113058-39-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+   -0.5028    0.6814   -0.0041 C   0  0  0

+   -0.5556   -0.7343   -0.0032 C   0  0  0

+    0.8036    1.3672   -0.0030 C   0  0  0

+   -1.6713    1.4244   -0.0003 C   0  0  0

+    0.6968   -1.5143   -0.0010 C   0  0  0

+   -1.7767   -1.3872   -0.0038 C   0  0  0

+    1.9918    0.6181   -0.0009 C   0  0  0

+    0.8655    2.7617   -0.0036 C   0  0  0

+   -2.9115    0.7738    0.0046 C   0  0  0

+    1.9377   -0.8541    0.0002 C   0  0  0

+    0.6575   -2.9093    0.0005 C   0  0  0

+   -2.9647   -0.6452   -0.0057 C   0  0  0

+    3.2259    1.2804    0.0006 C   0  0  0

+    2.0882    3.3972   -0.0021 C   0  0  0

+   -4.1128    1.5079    0.0087 C   0  0  0

+    3.1167   -1.6021    0.0027 C   0  0  0

+    1.8320   -3.6293    0.0030 C   0  0  0

+   -4.2181   -1.2864   -0.0059 C   0  0  0

+    3.2635    2.6630    0.0000 C   0  0  0

+    4.3820    0.5673    0.0022 O   0  0  0

+   -5.3039    0.8517    0.0135 C   0  0  0

+    3.0567   -2.9782    0.0041 C   0  0  0

+   -5.3563   -0.5422   -0.0072 C   0  0  0

+   -1.6277    2.4704    0.0000 H   0  0  0

+   -1.8119   -2.4335    0.0000 H   0  0  0

+   -0.0171    3.3248    0.0000 H   0  0  0

+   -0.2631   -3.4079    0.0000 H   0  0  0

+    2.1296    4.4433    0.0000 H   0  0  0

+   -4.0893    2.5545    0.0000 H   0  0  0

+    4.0448   -1.1178    0.0000 H   0  0  0

+    1.7999   -4.6757    0.0000 H   0  0  0

+   -4.2737   -2.3318    0.0000 H   0  0  0

+    4.1859    3.1581    0.0000 H   0  0  0

+    5.2730    0.0177    0.0000 H   0  0  0

+   -6.1951    1.4011    0.0000 H   0  0  0

+    3.9421   -3.5368    0.0000 H   0  0  0

+   -6.2863   -1.0229    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+614-47-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    2.4079    0.2088   -0.0012 C   0  0  0

+    1.1502    0.9871   -0.0005 C   0  0  0

+    3.6393    0.8663   -0.0017 C   0  0  0

+    2.3688   -1.1870    0.0046 C   0  0  0

+   -0.1378    0.2950    0.0001 C   0  0  0

+    1.1873    2.2038   -0.0004 O   0  0  0

+    4.8087    0.1343   -0.0019 C   0  0  0

+    3.5454   -1.9067    0.0044 C   0  0  0

+   -1.2865    1.0058    0.0007 C   0  0  0

+    4.7628   -1.2485   -0.0015 C   0  0  0

+   -2.5823    0.3095    0.0013 C   0  0  0

+   -3.7740    1.0420    0.0020 C   0  0  0

+   -2.6293   -1.0889   -0.0046 C   0  0  0

+   -4.9846    0.3818    0.0020 C   0  0  0

+   -3.8476   -1.7338   -0.0045 C   0  0  0

+   -5.0226   -1.0017    0.0015 C   0  0  0

+    3.6750    1.9037    0.0000 H   0  0  0

+    1.4563   -1.6818    0.0000 H   0  0  0

+   -0.1695   -0.7425    0.0000 H   0  0  0

+    5.7250    0.6220    0.0000 H   0  0  0

+    3.5177   -2.9443    0.0000 H   0  0  0

+   -1.2548    2.0433    0.0000 H   0  0  0

+    5.6455   -1.7947    0.0000 H   0  0  0

+   -3.7471    2.0797    0.0000 H   0  0  0

+   -1.7492   -1.6392    0.0000 H   0  0  0

+   -5.8698    0.9239    0.0000 H   0  0  0

+   -3.8841   -2.7712    0.0000 H   0  0  0

+   -5.9370   -1.4930    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+636-21-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+   -2.7645    0.8546   -0.2014 C   0  0  0

+   -3.5952   -0.1149    0.3466 C   0  0  0

+   -1.5624    0.4883   -0.7737 C   0  0  0

+   -3.1778    2.3036   -0.1769 C   0  0  0

+   -3.2131   -1.4498    0.3167 C   0  0  0

+   -4.8120    0.2521    0.9258 N   0  0  0

+   -1.1850   -0.8419   -0.8018 C   0  0  0

+   -2.0093   -1.8093   -0.2573 C   0  0  0

+    7.8330    0.0933    0.1585 Cl  0  0  0

+   -0.8804    1.1573    0.0000 H   0  0  0

+   -2.2591    2.5657    0.0000 H   0  0  0

+   -3.4399    3.2223    0.0000 H   0  0  0

+   -4.0965    2.0415    0.0000 H   0  0  0

+   -3.8925   -2.1215    0.0000 H   0  0  0

+   -5.0304    1.1822    0.0000 H   0  0  0

+   -5.5083   -0.4021    0.0000 H   0  0  0

+   -0.2515   -1.0454    0.0000 H   0  0  0

+   -1.7384   -2.7255    0.0000 H   0  0  0

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+  1  2  1  0

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+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+962-32-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+   -0.8898   -2.2502   -0.3085 C   0  0  0

+   -2.3598   -1.8074   -0.2928 C   0  0  0

+    0.1748   -1.1836   -0.1899 C   0  0  0

+   -1.6814   -2.2589    0.8811 O   0  0  0

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+   -0.4857   -3.2095    0.0000 H   0  0  0

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+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71382-44-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -0.8923   -2.2749   -0.2907 C   0  0  0

+   -2.3646   -1.8398   -0.2755 C   0  0  0

+    0.1667   -1.2020   -0.1791 C   0  0  0

+   -1.6874   -2.2999    0.9442 N   0  0  0

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+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+56258-32-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 46                          1 V2000

+   -1.3186    0.2508    0.1014 C   0  0  0

+   -0.6064   -1.0430    0.3754 C   0  0  0

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+   -1.4643   -2.2248   -0.0859 C   0  0  0

+   -0.3839   -1.1638    1.7818 O   0  0  0

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+ 22 41  1  0

+ 26 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+645-12-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    1.1276    0.2159   -0.0029 C   0  0  0

+    0.0152   -0.5479   -0.0029 O   0  0  0

+    0.7403    1.5263   -0.0005 C   0  0  0

+    2.5080   -0.2737    0.0002 C   0  0  0

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+   -0.6628    1.5321    0.0011 C   0  0  0

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+    2.7290   -1.4697    0.0033 O   0  0  0

+   -2.4720   -0.2215    0.0004 N   0  3  0

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+  5  6  2  0

+  3 12  1  0

+  6 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7195-43-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    1.2034   -0.2128   -0.0627 C   0  0  0

+    0.0001    0.4870    0.0001 C   0  0  0

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+   -3.6466   -0.1579    0.1850 O   0  0  0

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+    6.0627   -0.4349   -0.3107 C   0  0  0

+   -4.9054    0.5630    0.2502 C   0  0  0

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+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+72273-04-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 83 87                          1 V2000

+    6.6763    0.6386   -0.4834 C   0  0  2

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+ 37 82  1  0

+ 37 83  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13088-34-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    1.0467    0.0399    0.0028 C   0  0  0

+    2.1901   -1.2663    0.0018 Cl  0  0  0

+    1.6062    1.6833   -0.0025 Cl  0  0  0

+   -0.2772   -0.2222    0.0020 C   0  0  0

+   -1.2728    0.7000    0.0025 O   0  0  0

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+  8  6  2  0

+  9  7  2  0

+  7  8  1  0

+  6 10  1  0

+  8 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10353-98-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    0.9594    0.0340   -0.0018 C   0  0  0

+   -0.4124    0.5393   -0.0009 C   0  0  0

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+   -1.0179   -1.7960   -0.0030 C   0  0  0

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+ 11 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77314-23-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.0859   -0.1779    0.0027 C   0  0  0

+   -1.3001   -0.4319    0.0018 C   0  0  0

+    0.5383    1.1314    0.0008 C   0  0  0

+    1.1981   -1.0127   -0.0005 N   0  0  0

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+   -0.3714    2.1935   -0.0014 C   0  0  0

+    2.3265   -0.2246    0.0023 C   0  0  0

+   -1.7127    1.9693   -0.0022 C   0  0  0

+   -3.5266    0.4177   -0.0026 N   0  0  0

+   -3.1596   -1.9155    0.0018 C   0  0  0

+    2.8257    2.2572    0.0005 C   0  0  0

+    3.5575   -0.6547    0.0007 N   0  0  0

+   -3.9998   -0.8050   -0.0018 C   0  0  0

+    3.8214   -2.0458   -0.0049 O   0  0  0

+    1.1802   -2.0562    0.0000 H   0  0  0

+   -1.1595   -2.5653    0.0000 H   0  0  0

+   -0.0150    3.1745    0.0000 H   0  0  0

+   -2.3749    2.7760    0.0000 H   0  0  0

+   -3.5648   -2.8773    0.0000 H   0  0  0

+    3.6540    1.6222    0.0000 H   0  0  0

+    3.4607    3.0855    0.0000 H   0  0  0

+    1.9974    2.8922    0.0000 H   0  0  0

+   -5.0334   -0.9498    0.0000 H   0  0  0

+    4.0159   -3.0712    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  2  0

+ 11 15  2  0

+ 14 16  1  0

+  7  9  1  0

+  8 10  2  0

+ 12 15  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+520-18-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -2.0454    0.4529    0.0095 C   0  0  0

+   -1.4706   -0.8295   -0.0269 C   0  0  0

+   -1.1532    1.6226    0.0449 C   0  0  0

+   -3.4388    0.6011    0.0175 C   0  0  0

+   -0.1278   -0.9636   -0.0293 O   0  0  0

+   -2.2945   -1.9445   -0.0605 C   0  0  0

+    0.2445    1.3782    0.0399 C   0  0  0

+   -1.5982    2.7589    0.0768 O   0  0  0

+   -4.2431   -0.5225   -0.0106 C   0  0  0

+   -3.9944    1.8388    0.0531 O   0  0  0

+    0.7002    0.0946    0.0023 C   0  0  0

+   -3.6717   -1.7900   -0.0580 C   0  0  0

+    1.1228    2.4173    0.0711 O   0  0  0

+    2.1556   -0.1422   -0.0023 C   0  0  0

+   -4.4711   -2.8867   -0.0914 O   0  0  0

+    2.7996   -0.5713    1.1616 C   0  0  0

+    2.8945    0.0561   -1.1725 C   0  0  0

+    4.1595   -0.7918    1.1525 C   0  0  0

+    4.2536   -0.1668   -1.1723 C   0  0  0

+    4.8906   -0.5883   -0.0113 C   0  0  0

+    6.2308   -0.8069   -0.0157 O   0  0  0

+   -1.8860   -2.8808    0.0000 H   0  0  0

+   -5.2597   -0.4217    0.0000 H   0  0  0

+   -4.4128    2.7708    0.0000 H   0  0  0

+    1.7823    3.1975    0.0000 H   0  0  0

+   -5.0728   -3.7122    0.0000 H   0  0  0

+    2.4261   -1.5222    0.0000 H   0  0  0

+    2.8436    1.0764    0.0000 H   0  0  0

+    4.2160   -1.8118    0.0000 H   0  0  0

+    4.6264    0.7843    0.0000 H   0  0  0

+    7.2390   -0.9714    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+ 11 14  1  0

+ 12 15  1  0

+ 14 16  2  0

+ 14 17  1  0

+ 16 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+ 20 21  1  0

+  7 11  2  0

+  9 12  1  0

+ 19 20  1  0

+  6 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 21 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+28164-57-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 45                          1 V2000

+    0.5286   -0.0417    0.4131 C   0  0  0

+   -0.9308    0.1728    0.4221 C   0  0  0

+    1.3894    0.7982   -0.4536 C   0  0  0

+    1.0722   -1.0022    1.2024 C   0  0  0

+   -1.7674   -0.6366   -0.3744 C   0  0  0

+   -1.4836    1.1716    1.2225 C   0  0  0

+    2.8511    0.5813   -0.4608 C   0  0  0

+    0.8962    1.6592   -1.1539 O   0  0  0

+    2.5210   -1.2358    1.2120 C   0  0  0

+   -3.1461   -0.4242   -0.3569 C   0  0  0

+   -1.2370   -1.6108   -1.1497 O   0  0  0

+   -2.8508    1.3799    1.2380 C   0  0  0

+   -0.5858    2.0294    2.0764 C   0  0  0

+    3.4052   -0.4213    0.3570 C   0  0  0

+    3.6804    1.3550   -1.2636 C   0  0  0

+    2.9929   -2.1009    1.9253 O   0  0  0

+   -3.6882    0.5926    0.4530 C   0  0  0

+   -4.0474   -1.2528   -1.1785 C   0  0  0

+    4.7858   -0.6308    0.3536 C   0  0  0

+    5.0510    1.1373   -1.2570 C   0  0  0

+   -5.1508    0.8066    0.4613 C   0  0  0

+   -5.5015   -1.0094   -1.1439 C   0  0  0

+   -3.5932   -2.1337   -1.8825 O   0  0  0

+    5.6007    0.1559   -0.4600 C   0  0  0

+    5.3310   -1.5932    1.1373 O   0  0  0

+    5.9456    1.9791   -2.1300 C   0  0  0

+   -6.0192   -0.0424   -0.3739 C   0  0  0

+   -5.6356    1.6791    1.1545 O   0  0  0

+    0.5736   -1.7189    0.0000 H   0  0  0

+   -0.8195   -2.3776    0.0000 H   0  0  0

+   -3.1102    2.2135    0.0000 H   0  0  0

+    0.0173    1.3982    0.0000 H   0  0  0

+    0.0454    2.6325    0.0000 H   0  0  0

+   -1.1889    2.6606    0.0000 H   0  0  0

+    3.4252    2.1899    0.0000 H   0  0  0

+   -6.0106   -1.7187    0.0000 H   0  0  0

+    6.4644    0.0287    0.0000 H   0  0  0

+    5.7613   -2.3528    0.0000 H   0  0  0

+    6.5439    1.3433    0.0000 H   0  0  0

+    6.5814    2.5774    0.0000 H   0  0  0

+    5.3473    2.6149    0.0000 H   0  0  0

+   -6.8821    0.0903    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+ 10 18  1  0

+ 14 19  1  0

+ 15 20  2  0

+ 17 21  1  0

+ 18 22  1  0

+ 18 23  2  0

+ 19 24  2  0

+ 19 25  1  0

+ 20 26  1  0

+ 21 27  1  0

+ 21 28  2  0

+  9 14  1  0

+ 12 17  1  0

+ 20 24  1  0

+ 22 27  2  0

+  4 29  1  0

+ 11 30  1  0

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+ 13 32  1  0

+ 13 33  1  0

+ 13 34  1  0

+ 15 35  1  0

+ 22 36  1  0

+ 24 37  1  0

+ 25 38  1  0

+ 26 39  1  0

+ 26 40  1  0

+ 26 41  1  0

+ 27 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3296-90-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.0000    0.0000    0.1671 C   0  0  0

+    0.0000   -1.2492   -0.7162 C   0  0  0

+    0.0000    1.2492   -0.7162 C   0  0  0

+   -1.2493    0.0000    1.0505 C   0  0  0

+    1.2492    0.0000    1.0505 C   0  0  0

+    0.0000   -2.4160    0.1089 O   0  0  0

+    0.0000    2.4160    0.1089 O   0  0  0

+   -2.8544    0.0000   -0.0847 Br  0  0  0

+    2.8544    0.0000   -0.0846 Br  0  0  0

+   -0.8114   -0.7807    0.0000 H   0  0  0

+   -0.8114   -1.7176    0.0000 H   0  0  0

+   -0.8114    1.7176    0.0000 H   0  0  0

+   -0.8114    0.7807    0.0000 H   0  0  0

+   -0.7808    0.8114    0.0000 H   0  0  0

+   -1.7177    0.8114    0.0000 H   0  0  0

+    1.7176    0.8114    0.0000 H   0  0  0

+    0.7807    0.8114    0.0000 H   0  0  0

+    0.0000   -3.3529    0.0000 H   0  0  0

+    0.0000    3.3529    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

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+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+116208-67-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -1.5825    0.1905    0.0051 C   0  0  0

+   -0.8707   -1.0136    0.0075 C   0  0  0

+   -0.7342    1.3030    0.0050 C   0  0  0

+   -2.9778    0.2732   -0.0024 C   0  0  0

+    0.5609   -0.6503    0.0070 C   0  0  0

+   -1.6142   -2.1821    0.0087 C   0  0  0

+    0.6448    0.7741    0.0056 C   0  0  0

+   -1.3359    2.5498    0.0032 C   0  0  0

+   -3.6980   -0.9366   -0.0071 C   0  0  0

+   -3.5497    1.5557   -0.0042 C   0  0  0

+    1.7120   -1.4117    0.0072 C   0  0  0

+   -3.0058   -2.1194    0.0062 C   0  0  0

+    1.8772    1.3954    0.0056 C   0  0  0

+   -2.7263    2.6484    0.0002 C   0  0  0

+   -5.0490   -0.9315   -0.0143 F   0  0  0

+    2.9683   -0.7881    0.0014 C   0  0  0

+    3.0518    0.6287    0.0018 C   0  0  0

+    4.1527   -1.5469   -0.0035 C   0  0  0

+    4.3168    1.2436   -0.0043 C   0  0  0

+    5.3584   -0.9158   -0.0109 C   0  0  0

+    5.4402    0.4757   -0.0094 C   0  0  0

+   -1.1305   -3.1122    0.0000 H   0  0  0

+   -0.7475    3.4174    0.0000 H   0  0  0

+   -4.5913    1.6741    0.0000 H   0  0  0

+    1.6472   -2.4580    0.0000 H   0  0  0

+   -3.5476   -3.0168    0.0000 H   0  0  0

+    1.9355    2.4421    0.0000 H   0  0  0

+   -3.1606    3.6025    0.0000 H   0  0  0

+    4.1068   -2.5942    0.0000 H   0  0  0

+    4.3939    2.2891    0.0000 H   0  0  0

+    6.2389   -1.4847    0.0000 H   0  0  0

+    6.3813    0.9376    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

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+  7 13  1  0

+  8 14  1  0

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+ 13 17  2  0

+ 16 18  1  0

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+  5  7  2  0

+  9 12  2  0

+ 10 14  2  0

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+ 10 24  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4823-47-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    2.7285   -0.0530   -0.0010 C   0  0  0

+    1.5621    0.6227    0.0006 O   0  0  0

+    4.0022    0.6799    0.0003 C   0  0  0

+    2.7267   -1.2683    0.0014 O   0  0  0

+    0.3036   -0.1015   -0.0007 C   0  0  0

+    5.1538    0.0128   -0.0013 C   0  0  0

+   -0.8579    0.8945    0.0016 C   0  0  0

+   -2.5619   -0.0861   -0.0002 Br  0  0  0

+    4.0038    1.7689    0.0000 H   0  0  0

+   -0.4942   -0.8428    0.0000 H   0  0  0

+    0.9499   -0.9779    0.0000 H   0  0  0

+    5.1522   -1.0762    0.0000 H   0  0  0

+    6.0977    0.5559    0.0000 H   0  0  0

+   -0.0601    1.6358    0.0000 H   0  0  0

+   -1.5043    1.7709    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  7  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102791-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 30                          1 V2000

+   -0.0583   -0.2687   -0.0700 C   0  0  0

+   -1.2587    0.5581   -0.0588 C   0  0  0

+    1.2014    0.3643   -0.0254 C   0  0  0

+   -0.1791   -1.6647   -0.1403 C   0  0  0

+   -2.5180   -0.0788   -0.0120 C   0  0  0

+   -1.1456    1.9591   -0.0878 C   0  0  0

+    2.3453   -0.4408    0.0246 C   0  0  0

+    1.2618    1.7775   -0.0392 C   0  0  0

+   -1.4075   -2.2222   -0.2915 O   0  0  0

+    0.9714   -2.4273   -0.0787 C   0  0  0

+   -2.5201   -1.5488    0.0993 C   0  0  0

+   -3.6622    0.6997   -0.0562 C   0  0  0

+    0.1445    2.5400   -0.0757 C   0  0  0

+   -2.3240    2.7156   -0.1255 C   0  0  0

+    2.2136   -1.8122    0.0080 C   0  0  0

+    3.6885    0.1774    0.0942 N   0  3  0

+   -3.4906   -2.1416    0.5294 O   0  0  0

+   -3.5498    2.0832   -0.1167 C   0  0  0

+    4.5864   -0.2349   -0.6181 O   0  0  0

+    3.8959    1.0985    0.8638 O   0  5  0

+    2.1925    2.2440    0.0000 H   0  0  0

+    0.9061   -3.4663    0.0000 H   0  0  0

+   -4.6013    0.2505    0.0000 H   0  0  0

+    0.2359    3.5770    0.0000 H   0  0  0

+   -2.2749    3.7555    0.0000 H   0  0  0

+    3.0708   -2.4029    0.0000 H   0  0  0

+   -4.4161    2.6605    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

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+  4  9  1  0

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+  5 11  1  0

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+  6 13  1  0

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+ 11 17  2  0

+ 12 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  8 13  2  0

+  9 11  1  0

+ 10 15  2  0

+ 14 18  2  0

+  8 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 18 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+506-87-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 11                          1 V2000

+   -4.4880    0.0459    0.0157 C   0  0  0

+   -5.2668   -0.9407    0.4953 O   0  0  0

+   -3.3845   -0.2527   -0.6936 O   0  0  0

+   -4.7838    1.2060    0.2188 O   0  0  0

+    5.2715   -0.1021   -0.2391 N   0  0  0

+   13.9192    0.0485    0.2022 N   0  0  0

+   -5.8231   -1.6455    0.0000 H   0  0  0

+   -2.5178   -0.4872    0.0000 H   0  0  0

+    4.8225    0.6755    0.0000 H   0  0  0

+    4.8225   -0.8797    0.0000 H   0  0  0

+    6.1694   -0.1021    0.0000 H   0  0  0

+   13.4702    0.8261    0.0000 H   0  0  0

+   13.4702   -0.7291    0.0000 H   0  0  0

+   14.8171    0.0485    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89-25-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    0.5236   -0.0094   -0.0010 N   0  0  0

+   -0.8690    0.1315    0.0202 C   0  0  0

+    1.4232    1.0338    0.1961 N   0  0  0

+    1.1696   -1.1758   -0.2094 C   0  0  0

+   -1.4648    1.2430   -0.5612 C   0  0  0

+   -1.6582   -0.8430    0.6176 C   0  0  0

+    2.6424    0.6639    0.1318 C   0  0  0

+    2.6438   -0.8256   -0.1417 C   0  0  0

+    0.6782   -2.2669   -0.4074 O   0  0  0

+   -2.8392    1.3788   -0.5390 C   0  0  0

+   -3.0316   -0.7013    0.6364 C   0  0  0

+    3.8543    1.5439    0.2994 C   0  0  0

+   -3.6216    0.4096    0.0611 C   0  0  0

+   -0.9004    2.0885    0.0000 H   0  0  0

+   -1.2683   -1.7818    0.0000 H   0  0  0

+    2.8015   -1.8299    0.0000 H   0  0  0

+    3.6573   -0.7460    0.0000 H   0  0  0

+   -3.2319    2.3165    0.0000 H   0  0  0

+   -3.5995   -1.5445    0.0000 H   0  0  0

+    4.4516    0.7213    0.0000 H   0  0  0

+    4.6769    2.1412    0.0000 H   0  0  0

+    3.2570    2.3665    0.0000 H   0  0  0

+   -4.6335    0.5065    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+ 10 13  2  0

+  7  8  1  0

+ 11 13  1  0

+  5 14  1  0

+  6 15  1  0

+  8 16  1  0

+  8 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19727-83-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -1.2427    0.5674    0.0029 C   0  0  0

+   -1.6282   -0.7639    0.0016 C   0  0  0

+    0.1190    0.8786    0.0023 C   0  0  0

+   -2.3455    1.4229   -0.0008 N   0  0  0

+   -0.6794   -1.7683   -0.0001 C   0  0  0

+   -3.1391   -0.8269    0.0019 C   0  0  0

+    1.0617   -0.1268    0.0003 C   0  0  0

+   -3.5867    0.6440   -0.0051 C   0  0  0

+    0.6663   -1.4521   -0.0004 C   0  0  0

+    2.5022    0.2129   -0.0004 N   0  3  0

+    3.3371   -0.6739   -0.0022 O   0  0  0

+    2.8528    1.3794    0.0007 O   0  5  0

+    0.4227    1.8728    0.0000 H   0  0  0

+   -2.2939    2.4611    0.0000 H   0  0  0

+   -0.9782   -2.7639    0.0000 H   0  0  0

+   -4.1556   -1.0444    0.0000 H   0  0  0

+   -3.0082   -1.8581    0.0000 H   0  0  0

+   -4.0594    1.5698    0.0000 H   0  0  0

+   -4.5506    0.2548    0.0000 H   0  0  0

+    1.3793   -2.2085    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  8  1  0

+  7  9  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92279-99-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 48                          1 V2000

+    2.0543    0.7070   -0.5688 C   0  0  0

+    1.3059   -0.4654   -0.7991 C   0  0  0

+    3.2860    0.6352    0.1298 C   0  0  0

+    1.5899    1.9519   -1.0332 C   0  0  0

+    1.8267   -1.6792   -0.3149 C   0  0  0

+    0.1046   -0.4237   -1.4753 N   0  0  0

+    3.7613   -0.5257    0.5797 N   0  0  0

+    4.0171    1.8279    0.3473 C   0  0  0

+    2.3209    3.0756   -0.8047 C   0  0  0

+    3.1064   -1.6685    0.3973 C   0  0  0

+    1.1539   -2.8989   -0.4960 C   0  0  0

+   -0.9427   -0.2291   -0.4638 C   0  0  0

+    3.5305    3.0146   -0.1135 C   0  0  0

+    5.2006    1.7896    1.0141 O   0  0  0

+    3.6179   -2.8908    0.8776 C   0  0  0

+    1.7024   -4.0443   -0.0078 C   0  0  0

+   -2.3095   -0.1733   -1.1490 C   0  0  0

+    5.6865    3.1323    1.0707 C   0  0  0

+    2.9191   -4.0381    0.6710 C   0  0  0

+   -3.4003    0.0294   -0.0955 C   0  0  0

+   -4.7126    0.0830   -0.7534 N   0  0  0

+   -5.7094    0.2779    0.3080 C   0  0  0

+   -7.1071    0.3431   -0.3108 C   0  0  0

+   -8.3305    0.5823    0.9919 Cl  0  0  0

+    0.6223    2.0586    0.0000 H   0  0  0

+   -0.0015   -1.3914    0.0000 H   0  0  0

+    1.8784    3.9427    0.0000 H   0  0  0

+    0.1808   -2.8709    0.0000 H   0  0  0

+   -0.3461    0.5401    0.0000 H   0  0  0

+   -1.3531    0.6537    0.0000 H   0  0  0

+    4.0930    3.8091    0.0000 H   0  0  0

+    4.5886   -2.9641    0.0000 H   0  0  0

+    1.1857   -4.8693    0.0000 H   0  0  0

+   -2.9061   -0.9425    0.0000 H   0  0  0

+   -1.8991   -1.0561    0.0000 H   0  0  0

+    6.6019    2.8010    0.0000 H   0  0  0

+    6.0178    4.0477    0.0000 H   0  0  0

+    4.7711    3.4636    0.0000 H   0  0  0

+    3.3981   -4.8856    0.0000 H   0  0  0

+   -2.8037    0.7986    0.0000 H   0  0  0

+   -3.8107    0.9122    0.0000 H   0  0  0

+   -4.8262   -0.8838    0.0000 H   0  0  0

+   -5.1065    1.0422    0.0000 H   0  0  0

+   -6.1136    1.1635    0.0000 H   0  0  0

+   -7.7100   -0.4212    0.0000 H   0  0  0

+   -6.7029   -0.5425    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  8 13  2  0

+  8 14  1  0

+ 10 15  1  0

+ 11 16  2  0

+ 12 17  1  0

+ 14 18  1  0

+ 15 19  2  0

+ 17 20  1  0

+ 20 21  1  0

+ 21 22  1  0

+ 22 23  1  0

+ 23 24  1  0

+  7 10  2  0

+  9 13  1  0

+ 16 19  1  0

+  4 25  1  0

+  6 26  1  0

+  9 27  1  0

+ 11 28  1  0

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+ 20 41  1  0

+ 21 42  1  0

+ 22 43  1  0

+ 22 44  1  0

+ 23 45  1  0

+ 23 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-16-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.0996    0.1984    0.0035 C   0  0  0

+    0.8434   -0.8108    0.0026 C   0  0  0

+    0.3016    1.5216    0.0021 C   0  0  0

+   -1.5674   -0.1430   -0.0002 C   0  0  0

+    2.1960   -0.4953    0.0001 C   0  0  0

+    1.6477    1.8393   -0.0003 C   0  0  0

+   -2.3204    1.0361    0.0016 F   0  0  0

+   -1.8701   -0.8879   -1.1450 F   0  0  0

+   -1.8744   -0.8941    1.1395 F   0  0  0

+    2.5957    0.8353   -0.0013 C   0  0  0

+    3.1522   -1.5134   -0.0004 N   0  0  0

+    0.5417   -1.8033    0.0000 H   0  0  0

+   -0.4086    2.2777    0.0000 H   0  0  0

+    1.9455    2.8330    0.0000 H   0  0  0

+    3.6051    1.0743    0.0000 H   0  0  0

+    2.8525   -2.5065    0.0000 H   0  0  0

+    4.1621   -1.2765    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 10  2  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+34433-31-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 40                          1 V2000

+   -6.2777    0.6658   -0.4849 N   0  3  0

+   -7.3567    1.4875   -0.4202 C   0  0  0

+   -5.1200    0.9261    0.3743 C   0  0  0

+   -6.2580   -0.3838   -1.3195 C   0  0  0

+   -8.4608    1.2517   -1.2295 C   0  0  0

+   -7.3562    2.6299    0.5083 C   0  0  0

+   -4.1159   -0.0616    0.1328 O   0  0  0

+   -7.3227   -0.6554   -2.1277 C   0  0  0

+   -8.4430    0.1696   -2.0988 C   0  0  0

+   -8.3844    3.4138    0.5706 N   0  0  0

+   -3.0189    0.2450    0.9957 C   0  0  0

+   -8.3840    4.5126    1.4637 O   0  0  0

+   -1.9504   -0.7369    0.7949 N   0  3  0

+   -0.7662   -0.3191    0.3937 C   0  0  0

+   -2.2014   -2.0100    1.0261 C   0  0  0

+    0.2697   -1.2103    0.1924 C   0  0  0

+   -1.2229   -2.9694    0.8500 C   0  0  0

+    0.0467   -2.5718    0.4205 C   0  0  0

+    1.1273   -3.5648    0.2174 C   0  0  0

+    0.8918   -4.8725    0.4428 N   0  0  0

+    2.2258   -3.2001   -0.1524 O   0  0  0

+   10.8050   -0.1227   -0.0660 Cl  0  0  0

+   19.0452    2.5257   -0.3575 Cl  0  0  0

+   -4.3198    1.4769    0.0000 H   0  0  0

+   -5.5090    1.8163    0.0000 H   0  0  0

+   -5.4853   -0.9726    0.0000 H   0  0  0

+   -9.2211    1.8565    0.0000 H   0  0  0

+   -6.4855    3.0607    0.0000 H   0  0  0

+   -7.5085   -1.6089    0.0000 H   0  0  0

+   -9.3064   -0.2758    0.0000 H   0  0  0

+   -2.2412    0.8272    0.0000 H   0  0  0

+   -3.4481    1.1165    0.0000 H   0  0  0

+   -8.3836    5.4841    0.0000 H   0  0  0

+   -0.5869    0.6357    0.0000 H   0  0  0

+   -3.1294   -2.2974    0.0000 H   0  0  0

+    1.1826   -0.8781    0.0000 H   0  0  0

+   -1.4501   -3.9139    0.0000 H   0  0  0

+   -0.0223   -5.2014    0.0000 H   0  0  0

+    1.6337   -5.4996    0.0000 H   0  0  0

+   11.7765   -0.1227    0.0000 H   0  0  0

+   20.0167    2.5257    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 13 14  1  0

+ 13 15  2  0

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+ 15 17  1  0

+ 16 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+ 19 21  2  0

+  8  9  2  0

+ 17 18  2  0

+  3 24  1  0

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+  4 26  1  0

+  5 27  1  0

+  6 28  1  0

+  8 29  1  0

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+ 11 31  1  0

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+ 12 33  1  0

+ 14 34  1  0

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+ 16 36  1  0

+ 17 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107-11-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.6985    0.0612   -0.4585 C   0  0  0

+   -0.5369   -0.6142    0.0788 C   0  0  0

+    1.7696    0.1585    0.2894 C   0  0  0

+   -1.6554    0.3382    0.0774 N   0  0  0

+    0.3910    1.0714    0.0000 H   0  0  0

+   -1.3140   -1.3291    0.0000 H   0  0  0

+    0.0784   -1.4724    0.0000 H   0  0  0

+    2.3782   -0.7045    0.0000 H   0  0  0

+    2.2127    1.1170    0.0000 H   0  0  0

+   -1.4645    1.3768    0.0000 H   0  0  0

+   -2.6503   -0.0158    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5709-67-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -1.0148    0.7188   -0.0024 C   0  0  0

+   -0.9870   -0.6860   -0.0009 C   0  0  0

+    0.3043    1.1260   -0.0018 N   0  0  0

+   -2.2325    1.3855    0.0009 C   0  0  0

+    0.3196   -1.0557    0.0005 N   0  0  0

+   -2.1898   -1.3974   -0.0011 C   0  0  0

+    1.0741    0.0043    0.0000 C   0  0  0

+   -3.4065    0.6631    0.0057 C   0  0  0

+   -3.3785   -0.7244   -0.0028 C   0  0  0

+    2.5541   -0.0084    0.0004 N   0  3  0

+    3.1540   -1.0684    0.0021 O   0  0  0

+    3.1721    1.0412   -0.0009 O   0  5  0

+    0.6442    2.1024    0.0000 H   0  0  0

+   -2.2587    2.4190    0.0000 H   0  0  0

+   -2.1800   -2.4312    0.0000 H   0  0  0

+   -4.3140    1.1583    0.0000 H   0  0  0

+   -4.2663   -1.2541    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

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+ 10 11  2  0

+ 10 12  1  0

+  5  7  2  0

+  8  9  1  0

+  3 13  1  0

+  4 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1169-60-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    0.3941    1.0256    0.0568 C   0  0  0

+   -0.5882    0.0138    0.0753 C   0  0  0

+    1.8060    0.6354    0.0018 C   0  0  0

+    0.0134    2.3743    0.0850 C   0  0  0

+   -1.9555    0.3791    0.1297 C   0  0  0

+   -0.2029   -1.3418    0.0393 C   0  0  0

+    2.1285   -0.7398   -0.0329 C   0  0  0

+    2.8253    1.5894   -0.0162 C   0  0  0

+   -1.3345    2.7135    0.1319 C   0  0  0

+    0.7529    3.5190    0.0751 O   0  0  0

+   -2.3076    1.7256    0.1623 C   0  0  0

+   -2.9973   -0.6581    0.1521 C   0  0  0

+    1.0976   -1.7041   -0.0128 C   0  0  0

+   -1.2464   -2.3917    0.0595 N   0  3  0

+    3.4811   -1.1250   -0.0869 C   0  0  0

+    4.1309    1.1915   -0.0680 C   0  0  0

+   -1.4396    4.0762    0.1507 O   0  0  0

+   -0.1624    4.5656   -0.2981 C   0  0  0

+   -3.9269   -0.7010   -0.8235 O   0  0  0

+   -3.0205   -1.4770    1.0502 O   0  0  0

+   -1.3795   -3.0992    1.0419 O   0  0  0

+   -1.9719   -2.5479   -0.9064 O   0  5  0

+    4.4633   -0.1566   -0.1038 C   0  0  0

+    3.8168   -2.4404   -0.1217 O   0  0  0

+   -5.0310   -1.6397   -0.7334 C   0  0  0

+    5.2436   -2.5013   -0.1726 C   0  0  0

+    2.5893    2.6051    0.0000 H   0  0  0

+   -3.3151    1.9947    0.0000 H   0  0  0

+    1.3456   -2.7170    0.0000 H   0  0  0

+    4.8879    1.9087    0.0000 H   0  0  0

+    0.6976    5.1553    0.0000 H   0  0  0

+   -0.6471    5.4889    0.0000 H   0  0  0

+    5.4668   -0.4401    0.0000 H   0  0  0

+   -5.7064   -0.8452    0.0000 H   0  0  0

+   -5.8255   -2.3151    0.0000 H   0  0  0

+   -4.3556   -2.4342    0.0000 H   0  0  0

+    5.1991   -3.5431    0.0000 H   0  0  0

+    6.2854   -2.5458    0.0000 H   0  0  0

+    5.2881   -1.4595    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 19 25  1  0

+ 24 26  1  0

+  7 13  1  0

+  9 11  1  0

+ 16 23  1  0

+ 17 18  1  0

+  8 27  1  0

+ 11 28  1  0

+ 13 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 23 33  1  0

+ 25 34  1  0

+ 25 35  1  0

+ 25 36  1  0

+ 26 37  1  0

+ 26 38  1  0

+ 26 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17526-17-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+    0.2074    0.2822    0.2399 C   0  0  0

+    0.5066   -1.0852    0.0800 C   0  0  0

+    1.2841    1.2838    0.1903 C   0  0  0

+   -1.1179    0.6818    0.4519 C   0  0  0

+    1.9039   -1.5156   -0.1381 C   0  0  0

+   -0.5147   -2.0248    0.1285 C   0  0  0

+    2.6823    0.8554   -0.0277 C   0  0  0

+    1.0240    2.4635    0.3281 O   0  0  0

+   -2.1271   -0.2714    0.5030 C   0  0  0

+   -1.4152    1.9954    0.6073 O   0  0  0

+    2.9842   -0.5085   -0.1877 C   0  0  0

+    2.1635   -2.6946   -0.2758 O   0  0  0

+   -1.8299   -1.6142    0.3347 C   0  0  0

+    3.7055    1.7975   -0.0753 C   0  0  0

+   -3.5534    0.1582    0.7311 C   0  0  0

+    4.3034   -0.9034   -0.3931 C   0  0  0

+   -2.8248   -2.5360    0.3809 O   0  0  0

+    5.0115    1.3879   -0.2793 C   0  0  0

+   -4.1818    0.4107   -0.5272 O   0  0  0

+    5.3083    0.0465   -0.4385 C   0  0  0

+   -5.5241    0.8118   -0.2454 C   0  0  0

+   -6.2567    1.0989   -1.5576 C   0  0  0

+   -0.2877   -3.0373    0.0000 H   0  0  0

+   -1.6442    3.0074    0.0000 H   0  0  0

+    3.4789    2.8101    0.0000 H   0  0  0

+   -4.3504   -0.5063    0.0000 H   0  0  0

+   -3.3460   -0.8585    0.0000 H   0  0  0

+    4.5432   -1.9129    0.0000 H   0  0  0

+   -3.5859   -3.2412    0.0000 H   0  0  0

+    5.7761    2.0893    0.0000 H   0  0  0

+    6.3002   -0.2580    0.0000 H   0  0  0

+   -6.3168    0.1422    0.0000 H   0  0  0

+   -5.3123   -0.2040    0.0000 H   0  0  0

+   -5.8781    2.0650    0.0000 H   0  0  0

+   -7.2228    1.4775    0.0000 H   0  0  0

+   -6.6353    0.1328    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  4 10  1  0

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+ 20 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13177-26-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -0.6109    0.3712    0.0018 C   0  0  0

+   -0.1515   -0.8375    0.0010 C   0  0  0

+    0.4769    1.3484    0.0013 C   0  0  0

+   -2.0164    0.7585   -0.0026 C   0  0  0

+    1.3174   -0.7527    0.0001 C   0  0  0

+   -1.1569   -1.9173    0.0012 C   0  0  0

+    1.6930    0.5211    0.0005 C   0  0  0

+    0.1426    2.6147    0.0014 C   0  0  0

+   -2.9109   -0.2005   -0.0075 C   0  0  0

+   -2.2921    2.2053   -0.0016 C   0  0  0

+    2.3485   -1.8072   -0.0016 C   0  0  0

+   -2.4400   -1.6031    0.0023 C   0  0  0

+    3.1228    0.8670    0.0006 C   0  0  0

+   -1.2670    3.0385    0.0020 C   0  0  0

+    3.6244   -1.4935   -0.0022 C   0  0  0

+   -3.3572   -2.6005    0.0028 N   0  0  0

+    4.0363   -0.0793   -0.0001 C   0  0  0

+   -0.8433   -2.9665    0.0000 H   0  0  0

+    0.9300    3.3758    0.0000 H   0  0  0

+   -3.9811    0.0314    0.0000 H   0  0  0

+   -3.3208    2.5808    0.0000 H   0  0  0

+    2.0482   -2.8603    0.0000 H   0  0  0

+    3.4284    1.9185    0.0000 H   0  0  0

+   -1.4794    4.1128    0.0000 H   0  0  0

+    4.3822   -2.2840    0.0000 H   0  0  0

+   -4.4259   -2.3616    0.0000 H   0  0  0

+   -3.0298   -3.6455    0.0000 H   0  0  0

+    5.0994    0.1833    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5598-13-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -2.2458    0.1844   -0.0095 P   0  0  0

+   -1.3965   -1.1827   -0.0520 O   0  0  0

+   -2.0196    0.9995   -1.3794 O   0  0  0

+   -3.8096   -0.1603    0.1579 O   0  0  0

+   -1.6808    1.2223    1.4314 S   0  0  0

+   -0.0858   -0.8310   -0.0300 C   0  0  0

+   -2.2534    0.0818   -2.4495 C   0  0  0

+   -4.4789    1.0746    0.4207 C   0  0  0

+    0.8892   -1.8166    0.0606 C   0  0  0

+    0.2506    0.4461   -0.1006 N   0  0  0

+    2.2238   -1.4453    0.0817 C   0  0  0

+    0.4411   -3.4916    0.1468 Cl  0  0  0

+    1.5132    0.8321   -0.0829 C   0  0  0

+    2.5362   -0.0946    0.0110 C   0  0  0

+    1.8942    2.5231   -0.1791 Cl  0  0  0

+    4.1923    0.4256    0.0343 Cl  0  0  0

+   -3.2606    0.3384    0.0000 H   0  0  0

+   -2.5100   -0.9254    0.0000 H   0  0  0

+   -1.2462   -0.1748    0.0000 H   0  0  0

+   -3.5651    1.5699    0.0000 H   0  0  0

+   -4.9742    1.9884    0.0000 H   0  0  0

+   -5.3927    0.5793    0.0000 H   0  0  0

+    2.9748   -2.1639    0.0000 H   0  0  0

+  1  2  1  0

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+  1  5  2  0

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+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17070-45-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 48                          1 V2000

+    1.1879   -0.3078    0.7250 C   0  0  0

+    1.6680   -1.5444    0.2468 C   0  0  0

+    1.9581    0.8390    0.4618 C   0  0  0

+    0.0004   -0.2250    1.4222 N   0  0  0

+    2.8895   -1.6003   -0.4725 C   0  0  0

+    0.9425   -2.7268    0.4788 C   0  0  0

+    3.2085    0.6977   -0.2879 C   0  0  0

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+   -1.0568    0.0073    0.4291 C   0  0  0

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+    3.3486   -2.8501   -0.9401 C   0  0  0

+    1.4194   -3.9161    0.0105 C   0  0  0

+    3.9711    1.8542   -0.5451 C   0  0  0

+    2.3414    3.1912    0.6166 C   0  0  0

+   -2.4088    0.1099    1.1381 C   0  0  0

+    2.6240   -3.9731   -0.6991 C   0  0  0

+    0.7170   -5.0581    0.2361 O   0  0  0

+    3.5330    3.0613   -0.0961 C   0  0  0

+   -3.5100    0.3517    0.1038 C   0  0  0

+    1.4562   -6.1232   -0.3649 C   0  0  0

+    4.4827    4.4781   -0.4194 Cl  0  0  0

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+   -8.4359    1.0776   -0.8974 Cl  0  0  0

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+    4.9407    1.7398    0.0000 H   0  0  0

+    1.9456    4.0837    0.0000 H   0  0  0

+   -3.0325   -0.6412    0.0000 H   0  0  0

+   -2.0277   -0.7889    0.0000 H   0  0  0

+    3.0707   -4.8412    0.0000 H   0  0  0

+   -2.8863    1.1028    0.0000 H   0  0  0

+   -3.8911    1.2505    0.0000 H   0  0  0

+    0.6541   -6.6798    0.0000 H   0  0  0

+    2.0128   -6.9253    0.0000 H   0  0  0

+    2.2583   -5.5666    0.0000 H   0  0  0

+   -4.9544   -0.5151    0.0000 H   0  0  0

+   -5.1859    1.4272    0.0000 H   0  0  0

+   -6.1905    1.5825    0.0000 H   0  0  0

+   -7.8290    0.0481    0.0000 H   0  0  0

+   -6.8244   -0.1072    0.0000 H   0  0  0

+  1  2  1  0

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+ 22 42  1  0

+ 23 43  1  0

+ 23 44  1  0

+ 24 45  1  0

+ 24 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1222-05-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 47                          1 V2000

+   -0.7930    0.7836   -0.0161 C   0  0  0

+   -0.6604   -0.5865   -0.1413 C   0  0  0

+    0.3375    1.5805    0.0453 C   0  0  0

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+   -2.6951    1.4392    1.4641 C   0  0  0

+   -2.5245    2.3729   -0.8615 C   0  0  0

+    1.7303   -0.3568   -0.1448 C   0  0  0

+   -2.0782   -2.2982   -1.2814 C   0  0  0

+   -2.3710   -1.8478    1.1712 C   0  0  0

+    2.8173    1.8935    0.0485 C   0  0  0

+   -4.3085   -0.2771    0.2501 C   0  0  0

+    3.0910   -0.9970   -0.2172 C   0  0  0

+    4.0369    1.0871   -0.4065 C   0  0  0

+    4.0833   -0.1347    0.3316 O   0  0  0

+    3.0760   -2.3158    0.5583 C   0  0  0

+    0.2397    2.6110    0.0000 H   0  0  0

+    0.6998   -2.1838    0.0000 H   0  0  0

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+   -3.2617    0.5729    0.0000 H   0  0  0

+   -1.5130    2.5926    0.0000 H   0  0  0

+   -2.7442    3.3844    0.0000 H   0  0  0

+   -3.5360    2.1532    0.0000 H   0  0  0

+   -3.1122   -2.2511    0.0000 H   0  0  0

+   -2.1253   -3.3322    0.0000 H   0  0  0

+   -1.0442   -2.3453    0.0000 H   0  0  0

+   -3.2768   -1.3468    0.0000 H   0  0  0

+   -2.8720   -2.7536    0.0000 H   0  0  0

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+    2.1152    2.6541    0.0000 H   0  0  0

+   -4.4629    0.7464    0.0000 H   0  0  0

+   -5.3320   -0.4315    0.0000 H   0  0  0

+   -4.1541   -1.3006    0.0000 H   0  0  0

+    4.0304   -1.4317    0.0000 H   0  0  0

+    5.0572    0.9126    0.0000 H   0  0  0

+    4.4178    2.0496    0.0000 H   0  0  0

+    2.0410   -2.3040    0.0000 H   0  0  0

+    3.0642   -3.3508    0.0000 H   0  0  0

+    4.1110   -2.3276    0.0000 H   0  0  0

+  1  2  2  0

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+ 16 40  1  0

+ 17 41  1  0

+ 17 42  1  0

+ 19 43  1  0

+ 19 44  1  0

+ 19 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88-45-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    1.6132   -0.2988   -0.0006 S   0  0  0

+   -0.1123    0.0578    0.0013 C   0  0  0

+    1.7649   -1.8131    0.0184 O   0  0  0

+    2.0928    0.1213   -1.2705 O   0  0  0

+    2.1024    0.1540    1.2543 O   0  0  0

+   -0.5488    1.3758   -0.0011 C   0  0  0

+   -1.0307   -0.9738   -0.0006 C   0  0  0

+   -1.9088    1.6569    0.0005 C   0  0  0

+    0.3821    2.4215   -0.0045 N   0  0  0

+   -2.3904   -0.6927    0.0010 C   0  0  0

+   -2.8269    0.6257    0.0044 C   0  0  0

+   -3.3213   -1.7384   -0.0013 N   0  0  0

+    1.8687   -2.8494    0.0000 H   0  0  0

+   -0.7033   -1.9625    0.0000 H   0  0  0

+   -2.2362    2.6456    0.0000 H   0  0  0

+    1.4020    2.2107    0.0000 H   0  0  0

+    0.0547    3.4101    0.0000 H   0  0  0

+   -3.8468    0.8365    0.0000 H   0  0  0

+   -4.3412   -1.5276    0.0000 H   0  0  0

+   -2.9939   -2.7270    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  8 15  1  0

+  9 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51-18-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 30                          1 V2000

+   -1.4203    0.6074   -0.1405 C   0  0  0

+   -2.7303    1.0357   -0.2121 N   0  0  0

+   -0.4468    1.4821    0.0940 N   0  0  0

+   -1.1324   -0.6803   -0.3005 N   0  0  0

+   -3.5495   -0.1542   -0.4784 C   0  0  0

+   -3.4338    0.4349    0.9289 C   0  0  0

+    0.8149    1.0695    0.1629 C   0  0  0

+    0.1296   -1.0930   -0.2315 C   0  0  0

+    1.8254    1.9775    0.4063 N   0  0  0

+    1.1034   -0.2176   -0.0031 N   0  0  0

+    0.4284   -2.4301   -0.3972 N   0  0  0

+    3.0819    1.2165    0.4217 C   0  0  0

+    2.6535    2.0225   -0.8062 C   0  0  0

+    1.8861   -2.5563   -0.2660 C   0  0  0

+    0.9486   -2.9091    0.8905 C   0  0  0

+   -4.5205   -0.3443    0.0000 H   0  0  0

+   -3.0068   -0.9815    0.0000 H   0  0  0

+   -3.8251    1.3437    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66552-77-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -0.6583    0.7334   -0.0036 C   0  0  0

+   -0.6584   -0.7333   -0.0021 C   0  0  0

+    0.5458    1.4346   -0.0031 C   0  0  0

+   -1.8965    1.4115    0.0003 C   0  0  0

+    0.5458   -1.4345   -0.0001 C   0  0  0

+   -1.8965   -1.4115   -0.0022 C   0  0  0

+    1.7503    0.7333   -0.0012 C   0  0  0

+    0.5458    2.9416   -0.0052 C   0  0  0

+   -3.0510    0.6977    0.0054 C   0  0  0

+    1.7503   -0.7332    0.0003 C   0  0  0

+    0.5458   -2.9415    0.0019 C   0  0  0

+   -3.0510   -0.6977   -0.0036 C   0  0  0

+    2.9884    1.4114    0.0004 C   0  0  0

+   -4.3673    1.4314    0.0095 C   0  0  0

+    2.9882   -1.4114    0.0019 C   0  0  0

+   -4.3673   -1.4315   -0.0037 C   0  0  0

+    4.1430    0.6976    0.0033 C   0  0  0

+    4.1429   -0.6978    0.0018 C   0  0  0

+   -1.9242    2.4637    0.0000 H   0  0  0

+   -1.9242   -2.4637    0.0000 H   0  0  0

+    1.5984    2.9416    0.0000 H   0  0  0

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+    0.5458   -3.9941    0.0000 H   0  0  0

+    1.5984   -2.9415    0.0000 H   0  0  0

+    3.0161    2.4636    0.0000 H   0  0  0

+   -3.8548    2.3508    0.0000 H   0  0  0

+   -5.2867    1.9439    0.0000 H   0  0  0

+   -4.8798    0.5120    0.0000 H   0  0  0

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+   -5.2867   -1.9440    0.0000 H   0  0  0

+   -3.8548   -2.3509    0.0000 H   0  0  0

+    5.0624    1.2101    0.0000 H   0  0  0

+    5.0622   -1.2104    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90-00-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.4188   -0.4013    0.2668 C   0  0  0

+    0.0642    0.8827    0.0614 C   0  0  0

+    0.4445   -1.4789    0.2182 C   0  0  0

+   -1.8829   -0.6201    0.5489 C   0  0  0

+    1.4138    1.0814   -0.1925 C   0  0  0

+   -0.7831    1.9442    0.1082 O   0  0  0

+    1.7887   -1.2783   -0.0349 C   0  0  0

+   -2.6390   -0.7766   -0.7720 C   0  0  0

+    2.2727    0.0008   -0.2401 C   0  0  0

+    0.0701   -2.4338    0.0000 H   0  0  0

+   -1.5248    0.3411    0.0000 H   0  0  0

+   -2.5508    0.1583    0.0000 H   0  0  0

+    1.7909    2.0353    0.0000 H   0  0  0

+   -1.4230    2.7458    0.0000 H   0  0  0

+    2.4325   -2.0768    0.0000 H   0  0  0

+   -2.8469    0.2278    0.0000 H   0  0  0

+   -3.6434   -0.9845    0.0000 H   0  0  0

+   -2.4311   -1.7810    0.0000 H   0  0  0

+    3.2861    0.1591    0.0000 H   0  0  0

+  1  2  2  0

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+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-68-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    0.5667   -0.5438    0.0000 C   0  0  0

+   -0.6456    0.3515    0.0000 C   0  0  0

+    1.8338    0.3136    0.0000 C   0  0  0

+   -1.8760   -0.1849    0.0000 O   0  0  0

+   -0.5099    1.5521    0.0000 O   0  0  0

+    3.0646   -0.5953    0.0000 C   0  0  0

+   -3.0440    0.6777    0.0000 C   0  0  0

+    4.3318    0.2621    0.0000 C   0  0  0

+   -4.2922   -0.1668    0.0000 C   0  0  0

+    5.5625   -0.6469    0.0000 C   0  0  0

+   -4.1989   -1.4735    0.0000 C   0  0  0

+   -0.2032   -1.3713    0.0000 H   0  0  0

+    1.3019   -1.4023    0.0000 H   0  0  0

+    2.6037    1.1411    0.0000 H   0  0  0

+    1.0986    1.1721    0.0000 H   0  0  0

+    2.2947   -1.4228    0.0000 H   0  0  0

+    3.7998   -1.4538    0.0000 H   0  0  0

+   -2.2740    1.5052    0.0000 H   0  0  0

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+   -5.3088    0.3272    0.0000 H   0  0  0

+    4.8910   -1.5561    0.0000 H   0  0  0

+    6.4717   -1.3184    0.0000 H   0  0  0

+    6.2340    0.2623    0.0000 H   0  0  0

+   -5.1350   -2.1069    0.0000 H   0  0  0

+   -3.1823   -1.9675    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24400-01-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 49                          1 V2000

+    1.2824    0.7564   -0.1141 C   0  0  0

+    0.5401   -0.3825   -0.4841 C   0  0  0

+    2.6075    0.5982    0.3709 C   0  0  0

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+    1.1597   -1.6412   -0.3521 C   0  0  0

+   -0.7489   -0.2693   -0.9586 N   0  0  0

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+    1.4720    3.1270    0.1403 C   0  0  0

+   -0.6466    2.2239   -0.7330 N   0  3  0

+    2.4889   -1.7160    0.1411 C   0  0  0

+    0.4808   -2.8211   -0.7011 C   0  0  0

+   -1.6410   -0.4614    0.1926 C   0  0  0

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+    4.7480    1.6098    1.2564 C   0  0  0

+   -0.8915    2.0271   -1.9098 O   0  0  0

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+   -7.2256   -1.1627    0.0000 H   0  0  0

+   -6.0249   -1.9122    0.0000 H   0  0  0

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+   -5.9533    1.5687    0.0000 H   0  0  0

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+  1  2  2  0

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+ 25 45  1  0

+ 25 46  1  0

+ 25 47  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5679-89-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -1.8974   -1.2267    0.1318 C   0  0  0

+   -2.3885    0.0445   -0.1427 C   0  0  0

+   -0.5236   -1.4646    0.1121 N   0  0  0

+   -2.7794   -2.2590    0.4317 C   0  0  0

+   -3.7496    0.2763   -0.1217 C   0  0  0

+    0.3015   -0.4990    0.3376 N   0  3  0

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+   -0.1034    0.5527    0.7997 O   0  5  0

+   -6.1086   -0.4971    0.1931 C   0  0  0

+   -4.1686    2.0943   -1.5348 O   0  0  0

+   -4.8095    2.2782    0.4667 O   0  5  0

+    2.5150    0.3931    0.3050 C   0  0  0

+    2.0860   -1.8660   -0.4655 C   0  0  0

+    3.8523    0.2251    0.0199 C   0  0  0

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+    5.0596    1.6604    1.4198 O   0  0  0

+    5.3356    1.9039   -0.6575 O   0  5  0

+   -1.7463    0.8299    0.0000 H   0  0  0

+   -2.4371   -3.2140    0.0000 H   0  0  0

+   -4.7841   -2.8007    0.0000 H   0  0  0

+   -5.9354    0.5025    0.0000 H   0  0  0

+   -7.1082   -0.3239    0.0000 H   0  0  0

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+    5.6537   -2.1536    0.0000 H   0  0  0

+    6.7804   -1.2653    0.0000 H   0  0  0

+    5.8921   -0.1386    0.0000 H   0  0  0

+  1  2  2  0

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+  7  8  1  0

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+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2517-98-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 45                          1 V2000

+    1.3108   -0.3097    0.0620 C   0  0  0

+    0.1551    0.5360    0.3658 C   0  0  0

+    2.6369    0.3178   -0.0337 C   0  0  0

+    1.1539   -1.6728   -0.1249 C   0  0  0

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+    5.0006    0.1722   -0.4033 C   0  0  0

+   -0.3156   -3.6259   -0.2061 C   0  0  0

+   -2.5501   -2.0004    0.3632 C   0  0  0

+   -2.8831    1.3366   -0.4600 O   0  0  0

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+   -2.6728   -3.3396    0.1692 C   0  0  0

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+   -4.4484    2.4473    0.6353 O   0  0  0

+   -0.4764    2.5946    0.0000 H   0  0  0

+    3.7061   -1.4782    0.0000 H   0  0  0

+    1.7398   -3.3778    0.0000 H   0  0  0

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+   -3.4008   -1.4061    0.0000 H   0  0  0

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+  1  2  1  0

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+ 19 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1875-48-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -1.2784   -2.2516    0.0020 O   0  0  0

+   -0.8664   -1.1092    0.0029 C   0  0  0

+    0.5553   -0.7047    0.0013 C   0  0  0

+   -1.6276    0.0000   -0.0003 N   0  0  0

+    0.5553    0.7048    0.0032 C   0  0  0

+    1.7575   -1.3938   -0.0019 C   0  0  0

+   -2.9936   -0.0001   -0.0055 N   0  0  0

+   -0.8665    1.1092    0.0019 C   0  0  0

+    1.7575    1.3938    0.0017 C   0  0  0

+    2.9523   -0.6912   -0.0031 C   0  0  0

+   -1.2785    2.2516   -0.0001 O   0  0  0

+    2.9523    0.6911   -0.0017 C   0  0  0

+    1.7633   -2.4330    0.0000 H   0  0  0

+   -3.5133    0.8999    0.0000 H   0  0  0

+   -3.5131   -0.9001    0.0000 H   0  0  0

+    1.7633    2.4330    0.0000 H   0  0  0

+    3.8544   -1.2072    0.0000 H   0  0  0

+    3.8544    1.2071    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  4  1  0

+  9  5  1  0

+ 10  6  2  0

+ 11  8  2  0

+ 12  9  2  0

+  5  8  1  0

+ 10 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3351-31-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.1857    0.4279    0.0021 C   0  0  0

+   -0.7361   -0.6361    0.0010 C   0  0  0

+    1.6158    0.1135    0.0014 C   0  0  0

+   -0.2682    1.7581   -0.0019 C   0  0  0

+   -2.1657   -0.3216    0.0011 C   0  0  0

+   -0.2817   -1.9666   -0.0007 C   0  0  0

+    2.0151   -1.2435   -0.0002 C   0  0  0

+    2.5846    1.1204    0.0018 C   0  0  0

+   -1.5885    2.0540   -0.0073 C   0  0  0

+   -2.5649    1.0355    0.0025 C   0  0  0

+   -3.1352   -1.3285   -0.0007 C   0  0  0

+    1.0383   -2.2623   -0.0016 C   0  0  0

+    3.3835   -1.5533   -0.0010 C   0  0  0

+    3.9078    0.7850    0.0006 C   0  0  0

+   -3.9338    1.3455    0.0025 C   0  0  0

+   -4.4580   -0.9929   -0.0010 C   0  0  0

+    4.3043   -0.5479   -0.0002 C   0  0  0

+    4.9514    1.8722    0.0005 C   0  0  0

+   -4.8544    0.3405    0.0011 C   0  0  0

+    0.4346    2.5415    0.0000 H   0  0  0

+   -0.9844   -2.7501    0.0000 H   0  0  0

+    2.2955    2.1324    0.0000 H   0  0  0

+   -1.8925    3.0616    0.0000 H   0  0  0

+   -2.8464   -2.3406    0.0000 H   0  0  0

+    1.3423   -3.2699    0.0000 H   0  0  0

+    3.6979   -2.5577    0.0000 H   0  0  0

+   -4.2481    2.3499    0.0000 H   0  0  0

+   -5.1870   -1.7520    0.0000 H   0  0  0

+    5.3300   -0.7839    0.0000 H   0  0  0

+    5.7107    1.1434    0.0000 H   0  0  0

+    5.6802    2.6315    0.0000 H   0  0  0

+    4.1921    2.6010    0.0000 H   0  0  0

+   -5.8800    0.5767    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

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+ 13 17  1  0

+ 14 18  1  0

+ 15 19  2  0

+  7 12  1  0

+  9 10  2  0

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+ 16 19  1  0

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+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1122-62-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.1852   -0.0079    0.0033 C   0  0  0

+    0.5070   -1.2196    0.0029 C   0  0  0

+    0.4742    1.1459    0.0009 N   0  0  0

+   -1.6607   -0.0077    0.0001 C   0  0  0

+    1.8925   -1.2028    0.0001 C   0  0  0

+    1.7880    1.1889   -0.0018 C   0  0  0

+   -2.4141    1.2975    0.0004 C   0  0  0

+   -2.2669   -1.0574   -0.0029 O   0  0  0

+    2.5392    0.0235   -0.0022 C   0  0  0

+   -0.0095   -2.1220    0.0000 H   0  0  0

+    2.4349   -2.0899    0.0000 H   0  0  0

+    2.2707    2.1099    0.0000 H   0  0  0

+   -1.5136    1.8173    0.0000 H   0  0  0

+   -2.9339    2.1980    0.0000 H   0  0  0

+   -3.3146    0.7777    0.0000 H   0  0  0

+    3.5780    0.0689    0.0000 H   0  0  0

+  1  2  1  0

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+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+117760-92-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+   -0.3978    0.9327    0.1052 C   0  0  0

+   -1.1053   -0.2904    0.0398 C   0  0  0

+    0.9988    0.9097    0.1624 C   0  0  0

+   -1.1077    2.1569    0.1178 C   0  0  0

+   -2.5694   -0.2529   -0.0177 C   0  0  0

+   -0.4098   -1.5028    0.0314 C   0  0  0

+    1.6672   -0.3074    0.1535 C   0  0  0

+    1.7880    2.1895    0.2342 C   0  0  2

+   -2.4545    2.1899    0.0697 C   0  0  0

+   -3.2187    1.0021   -0.0068 C   0  0  0

+   -3.3268   -1.4245   -0.0821 C   0  0  0

+    0.9520   -1.5105    0.0872 C   0  0  0

+    3.1447   -0.3143    0.2142 C   0  0  0

+    3.1006    2.0331   -0.5314 C   0  0  1

+    2.0678    2.5007    1.6005 O   0  0  0

+   -4.6190    1.0470   -0.0614 C   0  0  0

+   -4.6893   -1.3471   -0.1339 C   0  0  0

+    1.6805   -2.7990    0.0777 N   0  3  0

+    3.8172    0.7829   -0.1025 C   0  0  0

+    2.8299    1.9698   -1.9331 O   0  0  0

+   -5.3317   -0.1144   -0.1239 C   0  0  0

+    1.3958   -3.6535   -0.7421 O   0  0  0

+    2.5647   -3.0046    0.8898 O   0  5  0

+   -0.5740    3.0576    0.0000 H   0  0  0

+   -0.9371   -2.4073    0.0000 H   0  0  0

+    0.9498    2.8168    0.0000 H   0  0  0

+   -2.9447    3.1150    0.0000 H   0  0  0

+   -2.8526   -2.3579    0.0000 H   0  0  0

+    3.6541   -1.2290    0.0000 H   0  0  0

+    3.6783    2.9063    0.0000 H   0  0  0

+    2.7678    3.2792    0.0000 H   0  0  0

+   -5.1156    1.9687    0.0000 H   0  0  0

+   -5.2574   -2.2265    0.0000 H   0  0  0

+    4.8640    0.7675    0.0000 H   0  0  0

+    1.8104    1.7314    0.0000 H   0  0  0

+   -6.3780   -0.0778    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6795-16-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -0.1858   -0.3144   -0.1035 C   0  0  0

+   -1.5565   -0.3195    0.1358 C   0  0  0

+    0.4720    0.9260   -0.1370 C   0  0  0

+    0.4307   -1.4820   -0.3170 O   0  0  0

+   -2.2685    0.8578    0.2990 C   0  0  0

+   -2.5359   -1.4665    0.2819 C   0  0  1

+   -0.2403    2.1212    0.0090 C   0  0  0

+    1.9385    0.9297   -0.3063 C   0  0  0

+    1.7472   -1.5239   -0.0867 C   0  0  0

+   -3.5903    0.6096    0.5048 O   0  0  0

+   -1.6025    2.0849    0.2312 C   0  0  0

+   -3.7698   -0.7555    0.9126 C   0  0  1

+   -3.0237   -1.8806   -1.1222 C   0  0  0

+    0.4053    3.3120   -0.0679 O   0  0  0

+    2.5706   -0.3892   -0.0837 C   0  0  0

+    2.5705    1.9278   -0.6028 O   0  0  0

+    2.3398   -2.7642    0.1636 C   0  0  0

+   -4.9012   -1.2948    0.1964 O   0  0  0

+   -4.4812   -1.3735   -1.1824 C   0  0  0

+   -0.5808    4.3293    0.1187 C   0  0  0

+    3.9482   -0.4963    0.1271 C   0  0  0

+    3.6953   -2.8634    0.3861 C   0  0  0

+    4.5064   -1.7420    0.3652 C   0  0  0

+    4.7324    0.6106    0.0992 O   0  0  0

+   -1.8076   -2.1969    0.0000 H   0  0  0

+   -2.1417    2.9642    0.0000 H   0  0  0

+   -3.8100   -1.7861    0.0000 H   0  0  0

+   -3.5292   -2.7797    0.0000 H   0  0  0

+   -2.2279   -2.5368    0.0000 H   0  0  0

+    1.7582   -3.6160    0.0000 H   0  0  0

+   -3.7352   -0.6613    0.0000 H   0  0  0

+   -4.7747   -0.3847    0.0000 H   0  0  0

+    0.1598    5.0472    0.0000 H   0  0  0

+   -1.2987    5.0699    0.0000 H   0  0  0

+   -1.3214    3.6114    0.0000 H   0  0  0

+    4.1307   -3.7984    0.0000 H   0  0  0

+    5.5324   -1.8475    0.0000 H   0  0  0

+    5.3287    1.4522    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  1  0

+  5 10  1  0

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+  7 11  2  0

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+ 20 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+85721-33-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 45                          1 V2000

+    0.4762    0.5251   -0.0861 C   0  0  0

+    1.5478    1.3908   -0.1485 N   0  0  0

+    0.6892   -0.8626    0.0034 C   0  0  0

+   -0.8258    1.0118   -0.1050 C   0  0  0

+    1.2836    2.8289   -0.2405 C   0  0  0

+    2.8201    0.9723   -0.1281 C   0  0  0

+    2.0735   -1.3633    0.0286 C   0  0  0

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+    2.6064    3.5813   -0.3991 C   0  0  0

+    3.1526   -0.3641   -0.0426 C   0  0  0

+    2.3162   -2.5554    0.1055 O   0  0  0

+   -1.6699   -1.2477    0.0421 C   0  0  0

+   -3.1956    0.6193   -0.0603 N   0  0  0

+    4.5609   -0.7833   -0.0224 C   0  0  0

+   -2.7199   -2.0955    0.1032 F   0  0  0

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+   -5.3245    0.5260    1.1489 C   0  0  0

+   -5.3482    0.3736   -1.2045 C   0  0  0

+   -6.0007   -0.1173    0.0156 N   0  0  0

+   -0.9973    2.0307    0.0000 H   0  0  0

+    0.2877    3.1039    0.0000 H   0  0  0

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+   -3.0355   -0.6309    0.0000 H   0  0  0

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+  1  2  1  0

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+ 22 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+34256-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+    0.8937    0.7023   -0.0334 C   0  0  0

+   -0.0165   -0.3229    0.2469 N   0  0  0

+    0.9351    1.8346    0.7693 C   0  0  0

+    1.7615    0.5870   -1.1117 C   0  0  0

+   -1.2461   -0.3017   -0.3045 C   0  0  0

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+   -0.0008    1.9613    1.9437 C   0  0  0

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+   -2.4675   -0.2849    0.5782 C   0  0  0

+   -1.3697   -0.2962   -1.5110 O   0  0  0

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+    2.6933    2.7296   -0.5876 C   0  0  0

+   -1.2953    2.6410    1.4931 C   0  0  0

+   -3.9500   -0.2583   -0.4477 Cl  0  0  0

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+    2.5306   -4.2802    0.3875 C   0  0  0

+   -0.5320   -1.2863    0.0000 H   0  0  0

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+  5 12  2  0

+  6 13  1  0

+  7 14  2  0

+  8 15  1  0

+ 11 16  1  0

+ 13 17  1  0

+ 17 18  1  0

+  9 14  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2210-79-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.7423    0.1511    0.0676 C   0  0  0

+   -1.9103    0.8943   -0.0180 C   0  0  0

+    0.4590    0.7796    0.1622 O   0  0  0

+   -0.8028   -1.2351    0.0624 C   0  0  0

+   -3.1303    0.2530   -0.1142 C   0  0  0

+   -1.8487    2.4000   -0.0068 C   0  0  0

+    1.4553   -0.2423    0.2335 C   0  0  0

+   -2.0254   -1.8714   -0.0281 C   0  0  0

+   -3.1875   -1.1282   -0.1250 C   0  0  0

+    2.8391    0.4012    0.3421 C   0  0  0

+    3.9058   -0.6929    0.4184 C   0  0  0

+    3.6299    0.0237   -0.7867 O   0  0  0

+    0.0716   -1.7922    0.0000 H   0  0  0

+   -4.0065    0.8073    0.0000 H   0  0  0

+   -0.8128    2.3576    0.0000 H   0  0  0

+   -1.8063    3.4359    0.0000 H   0  0  0

+   -2.8846    2.4424    0.0000 H   0  0  0

+    0.6364   -0.8782    0.0000 H   0  0  0

+    1.9952   -1.1274    0.0000 H   0  0  0

+   -2.0716   -2.9072    0.0000 H   0  0  0

+   -4.1070   -1.6072    0.0000 H   0  0  0

+    2.8443    1.4380    0.0000 H   0  0  0

+    3.4930   -1.6439    0.0000 H   0  0  0

+    4.9424   -0.7147    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+ 10 11  1  0

+ 10 12  1  0

+  8  9  1  0

+ 11 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60-35-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+   -0.0164    0.0133   -0.0015 C   0  0  0

+   -1.4679    0.4184    0.0004 C   0  0  0

+    0.9465    0.9563    0.0004 N   0  0  0

+    0.2853   -1.1614    0.0004 O   0  0  0

+   -1.1962    1.3920    0.0000 H   0  0  0

+   -2.4415    0.6901    0.0000 H   0  0  0

+   -1.7396   -0.5552    0.0000 H   0  0  0

+    1.9201    0.6845    0.0000 H   0  0  0

+    0.6951    1.9353    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-88-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.1907   -0.5082    0.0040 C   0  0  0

+    0.7305   -1.5456    0.0029 C   0  0  0

+    0.2490    0.8073    0.0030 C   0  0  0

+   -1.5223   -0.7806    0.0005 O   0  0  0

+    2.0833   -1.2668    0.0008 C   0  0  0

+    1.6030    1.0822    0.0009 C   0  0  0

+   -2.2012    0.4768    0.0027 C   0  0  0

+    2.5200    0.0464   -0.0002 C   0  0  0

+   -3.6901    0.2439   -0.0011 C   0  0  0

+    4.2208    0.3943   -0.0023 Cl  0  0  0

+   -4.5328    1.2886    0.0002 O   0  0  0

+   -4.1252   -0.8833   -0.0053 O   0  0  0

+    0.4034   -2.5304    0.0000 H   0  0  0

+   -0.4386    1.5846    0.0000 H   0  0  0

+    2.7726   -2.0425    0.0000 H   0  0  0

+    1.9323    2.0663    0.0000 H   0  0  0

+   -1.2382    0.8634    0.0000 H   0  0  0

+   -2.4765    1.4774    0.0000 H   0  0  0

+   -5.1843    2.0963    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  9 12  2  0

+  6  8  2  0

+  2 13  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+611-06-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.7876    0.6343    0.0032 C   0  0  0

+   -0.2872   -0.6554    0.0014 C   0  0  0

+    0.0782    1.7120    0.0034 C   0  0  0

+   -2.2504    0.8604   -0.0012 N   0  3  0

+    1.0802   -0.8665   -0.0003 C   0  0  0

+   -1.3746   -2.0086    0.0018 Cl  0  0  0

+    1.4441    1.5017    0.0017 C   0  0  0

+   -2.6911    1.9958    0.0004 O   0  0  0

+   -3.0133   -0.0890   -0.0064 O   0  5  0

+    1.9459    0.2121   -0.0002 C   0  0  0

+    3.6617   -0.0519   -0.0017 Cl  0  0  0

+   -0.2976    2.6791    0.0000 H   0  0  0

+    1.4560   -1.8336    0.0000 H   0  0  0

+    2.0935    2.3109    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+ 10 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90-19-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+   -1.5151    0.6270    0.1066 C   0  0  0

+   -2.0549   -0.6616   -0.0494 C   0  0  0

+   -0.1779    0.7895    0.1891 O   0  0  0

+   -2.3675    1.7183    0.1798 C   0  0  0

+   -1.1329   -1.8065   -0.1186 C   0  0  0

+   -3.4421   -0.8393   -0.1355 C   0  0  0

+    0.6770   -0.2458    0.1276 C   0  0  0

+   -3.7388    1.5344    0.0993 C   0  0  0

+    0.2561   -1.5331   -0.0223 C   0  0  0

+   -1.5470   -2.9469   -0.2532 O   0  0  0

+   -4.2750    0.2615   -0.0658 C   0  0  0

+   -3.9640   -2.0829   -0.2866 O   0  0  0

+    2.1237    0.0213    0.2261 C   0  0  0

+   -4.5663    2.6081    0.1718 O   0  0  0

+    1.1607   -2.5482   -0.0797 O   0  0  0

+    2.8158    0.5445   -0.8699 C   0  0  0

+    2.8054   -0.2427    1.4174 C   0  0  0

+   -5.9008    2.1093    0.0607 C   0  0  0

+    4.1715    0.7933   -0.7719 C   0  0  0

+    4.1577    0.0082    1.5076 C   0  0  0

+    4.8456    0.5227    0.4175 C   0  0  0

+    4.8480    1.3019   -1.8364 O   0  0  0

+    6.1788    0.7681    0.5118 O   0  0  0

+   -1.9824    2.6626    0.0000 H   0  0  0

+   -5.2869    0.1348    0.0000 H   0  0  0

+   -4.3586   -3.0232    0.0000 H   0  0  0

+    1.8391   -3.3095    0.0000 H   0  0  0

+    2.4052    1.4779    0.0000 H   0  0  0

+    2.7107   -1.2581    0.0000 H   0  0  0

+   -6.2578    3.0645    0.0000 H   0  0  0

+   -6.8560    1.7523    0.0000 H   0  0  0

+   -5.5438    1.1541    0.0000 H   0  0  0

+    4.5668   -0.9259    0.0000 H   0  0  0

+    5.6631    1.9147    0.0000 H   0  0  0

+    7.1817    0.9527    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  7 13  1  0

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+  9 15  1  0

+ 13 16  2  0

+ 13 17  1  0

+ 14 18  1  0

+ 16 19  1  0

+ 17 20  2  0

+ 19 21  2  0

+ 19 22  1  0

+ 21 23  1  0

+  7  9  2  0

+  8 11  1  0

+ 20 21  1  0

+  4 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 20 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-76-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.0468    0.5994    0.0028 C   0  0  0

+   -0.3875   -0.7428    0.0004 C   0  0  0

+    1.2834    0.9756    0.0026 C   0  0  0

+   -1.2908    1.8102   -0.0013 Cl  0  0  0

+    0.6019   -1.7102   -0.0017 C   0  0  0

+   -2.0588   -1.2126    0.0005 Cl  0  0  0

+    2.2775    0.0061    0.0001 C   0  0  0

+    1.9322   -1.3395   -0.0018 C   0  0  0

+    3.6230    0.3834   -0.0001 N   0  0  0

+    1.5397    1.9850    0.0000 H   0  0  0

+    0.3430   -2.7190    0.0000 H   0  0  0

+    2.6761   -2.0683    0.0000 H   0  0  0

+    4.3679   -0.3444    0.0000 H   0  0  0

+    3.8809    1.3924    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  5 11  1  0

+  8 12  1  0

+  9 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+626-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -0.3784   -0.0261    0.0030 C   0  0  0

+    0.2915   -1.2410    0.0015 C   0  0  0

+    0.3546    1.1473    0.0020 C   0  0  0

+   -2.1137    0.0212   -0.0011 Cl  0  0  0

+    1.6780   -1.2298   -0.0009 C   0  0  0

+    1.6728    1.1186   -0.0004 N   0  0  0

+    2.3419   -0.0179   -0.0018 C   0  0  0

+   -0.2325   -2.1366    0.0000 H   0  0  0

+   -0.1386    2.0602    0.0000 H   0  0  0

+    2.2105   -2.1204    0.0000 H   0  0  0

+    3.3794   -0.0019    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  6  7  1  0

+  2  8  1  0

+  3  9  1  0

+  5 10  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129-20-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    0.0485    0.6845   -0.2977 N   0  0  0

+   -0.4473   -0.6155   -0.3407 N   0  0  0

+    1.3917    1.0069   -0.0631 C   0  0  0

+   -0.9204    1.5939   -0.5149 C   0  0  0

+    0.3342   -1.7610   -0.1535 C   0  0  0

+   -1.7715   -0.6352   -0.5837 C   0  0  0

+    2.1734    1.5169   -1.0913 C   0  0  0

+    1.9401    0.8219    1.1988 C   0  0  0

+   -2.1997    0.8108   -0.7252 C   0  0  0

+   -0.7940    2.8000   -0.5371 O   0  0  0

+    0.1916   -2.5196    1.0007 C   0  0  0

+    1.2501   -2.1449   -1.1245 C   0  0  0

+   -2.4790   -1.6157   -0.6782 O   0  0  0

+    3.4968    1.8348   -0.8594 C   0  0  0

+    3.2640    1.1403    1.4294 C   0  0  0

+   -3.1959    1.1540    0.3842 C   0  0  0

+    0.9642   -3.6502    1.1822 C   0  0  0

+    2.0195   -3.2761   -0.9370 C   0  0  0

+    4.0457    1.6448    0.4006 C   0  0  0

+   -4.5917    0.6726   -0.0169 C   0  0  0

+    1.8788   -4.0267    0.2161 C   0  0  0

+    5.3491    1.9580    0.6284 O   0  0  0

+   -5.5879    1.0158    1.0925 C   0  0  0

+   -6.9837    0.5344    0.6915 C   0  0  0

+    1.7796    2.4306    0.0000 H   0  0  0

+    1.8957   -0.1720    0.0000 H   0  0  0

+   -2.3077    1.7999    0.0000 H   0  0  0

+   -0.7821   -2.7239    0.0000 H   0  0  0

+    1.8797   -1.3745    0.0000 H   0  0  0

+    3.5453    2.8286    0.0000 H   0  0  0

+    3.6556    0.2257    0.0000 H   0  0  0

+   -2.6065    1.9555    0.0000 H   0  0  0

+   -3.7856    1.9553    0.0000 H   0  0  0

+    0.3379   -4.4233    0.0000 H   0  0  0

+    2.9934   -3.0726    0.0000 H   0  0  0

+   -5.1811   -0.1289    0.0000 H   0  0  0

+   -4.0020   -0.1287    0.0000 H   0  0  0

+    2.3536   -4.9010    0.0000 H   0  0  0

+    6.3165    2.1905    0.0000 H   0  0  0

+   -4.9985    1.8173    0.0000 H   0  0  0

+   -6.1776    1.8171    0.0000 H   0  0  0

+   -7.3081    1.4750    0.0000 H   0  0  0

+   -7.9243    0.2100    0.0000 H   0  0  0

+   -6.6593   -0.4062    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  7 14  2  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 12 18  2  0

+ 14 19  1  0

+ 16 20  1  0

+ 17 21  2  0

+ 19 22  1  0

+ 20 23  1  0

+ 23 24  1  0

+  6  9  1  0

+ 15 19  2  0

+ 18 21  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 20 36  1  0

+ 20 37  1  0

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+ 22 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+461-72-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    1.1523   -0.1070   -0.0017 C   0  0  0

+    0.0450   -0.8751   -0.0014 N   0  0  0

+    0.6572    1.3257   -0.0005 C   0  0  0

+    2.3047   -0.4835    0.0016 O   0  0  0

+   -1.0693   -0.1345   -0.0001 C   0  0  0

+   -0.8092    1.1853    0.0005 N   0  0  0

+   -2.1912   -0.6020    0.0008 O   0  0  0

+    0.0550   -1.8839    0.0000 H   0  0  0

+    1.6338    1.5789    0.0000 H   0  0  0

+    0.4820    2.3193    0.0000 H   0  0  0

+   -1.4864    1.9332    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  2  0

+  5  6  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+53693-66-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 62                          1 V2000

+   -1.3876   -0.0016   -0.0019 C   0  0  0

+   -2.8702   -0.0015   -0.0019 C   0  0  0

+   -0.6902   -0.0118   -1.2096 C   0  0  0

+   -0.6901    0.0144    1.2062 C   0  0  0

+   -3.5685   -0.7649    0.9328 C   0  0  0

+   -3.5685    0.7667   -0.9333 C   0  0  0

+    0.6873   -0.0114   -1.2095 C   0  0  0

+    0.6870    0.0148    1.2062 C   0  0  0

+   -4.9471   -0.7629    0.9311 C   0  0  0

+   -4.9467    0.7656   -0.9311 C   0  0  0

+    1.3846   -0.0007   -0.0018 C   0  0  0

+   -5.6410   -0.0006   -0.0014 C   0  0  0

+    2.8672   -0.0002   -0.0017 C   0  0  0

+   -7.0367   -0.0002   -0.0012 N   0  0  0

+    3.5653    0.7795    0.9202 C   0  0  0

+    3.5657   -0.7837   -0.9195 C   0  0  0

+   -7.7696   -0.7672   -1.0115 C   0  0  0

+   -7.7687    0.7673    1.0094 C   0  0  0

+    4.9435    0.7780    0.9187 C   0  0  0

+    4.9443   -0.7820   -0.9172 C   0  0  0

+   -7.7868   -2.2452   -0.6163 C   0  0  0

+   -7.7615    2.2492    0.6285 C   0  0  0

+    5.6380    0.0000   -0.0009 C   0  0  0

+    7.0337    0.0001   -0.0006 N   0  0  0

+    7.7664    0.7515   -1.0227 C   0  0  0

+    7.7659   -0.7512    1.0220 C   0  0  0

+    7.7992    2.2328   -0.6411 C   0  0  0

+    7.7856   -2.2348    0.6485 C   0  0  0

+   -0.6959   -0.8073    0.0000 H   0  0  0

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+   -3.2483   -1.4932    0.0000 H   0  0  0

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+   -8.5823   -2.2359    0.0000 H   0  0  0

+   -7.7961   -3.0407    0.0000 H   0  0  0

+   -6.9913   -2.2545    0.0000 H   0  0  0

+   -6.9660    2.2453    0.0000 H   0  0  0

+   -7.7576    3.0447    0.0000 H   0  0  0

+   -8.5570    2.2531    0.0000 H   0  0  0

+    8.1649    0.0629    0.0000 H   0  0  0

+    8.5370    0.9493    0.0000 H   0  0  0

+    8.5353   -0.9536    0.0000 H   0  0  0

+    8.1665   -0.0639    0.0000 H   0  0  0

+    8.5946    2.2152    0.0000 H   0  0  0

+    7.8168    3.0282    0.0000 H   0  0  0

+    7.0038    2.2504    0.0000 H   0  0  0

+    6.9901   -2.2454    0.0000 H   0  0  0

+    7.7962   -3.0303    0.0000 H   0  0  0

+    8.5811   -2.2242    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 22  1  0

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+ 23 24  1  0

+ 24 25  1  0

+ 24 26  1  0

+ 25 27  1  0

+ 26 28  1  0

+  8 11  1  0

+ 10 12  1  0

+ 20 23  2  0

+  3 29  1  0

+  4 30  1  0

+  5 31  1  0

+  6 32  1  0

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+ 27 55  1  0

+ 27 56  1  0

+ 27 57  1  0

+ 28 58  1  0

+ 28 59  1  0

+ 28 60  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+581-28-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.8791    0.5972   -0.0048 C   0  0  0

+   -0.7264   -0.8614   -0.0024 C   0  0  0

+    0.2575    1.4108   -0.0045 C   0  0  0

+   -2.1737    1.1511   -0.0015 C   0  0  0

+    0.4803   -1.4172    0.0001 N   0  0  0

+   -1.8905   -1.6605   -0.0022 C   0  0  0

+    1.5065    0.7857   -0.0019 C   0  0  0

+   -3.2583    0.3224    0.0039 C   0  0  0

+    1.5842   -0.6786    0.0004 C   0  0  0

+   -3.1121   -1.0710   -0.0043 C   0  0  0

+    2.7007    1.5349   -0.0010 C   0  0  0

+   -4.5406    0.8750    0.0076 N   0  0  0

+    2.8601   -1.2827    0.0034 C   0  0  0

+    3.8954    0.8887    0.0020 C   0  0  0

+    3.9722   -0.5041    0.0041 C   0  0  0

+    0.1752    2.4551    0.0000 H   0  0  0

+   -2.3033    2.1906    0.0000 H   0  0  0

+   -1.8110   -2.7050    0.0000 H   0  0  0

+   -3.9690   -1.6735    0.0000 H   0  0  0

+    2.6669    2.5819    0.0000 H   0  0  0

+   -4.6626    1.9154    0.0000 H   0  0  0

+   -5.3806    0.2492    0.0000 H   0  0  0

+    2.9483   -2.3265    0.0000 H   0  0  0

+    4.7801    1.4496    0.0000 H   0  0  0

+    4.9143   -0.9620    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

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+  7  9  1  0

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+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89-61-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.4116    0.4126    0.0031 C   0  0  0

+   -0.7704   -0.9233    0.0011 C   0  0  0

+    0.9237    0.7696    0.0026 C   0  0  0

+   -1.4576    1.4599   -0.0004 N   0  3  0

+    0.2075   -1.9024   -0.0015 C   0  0  0

+   -2.4475   -1.3717    0.0011 Cl  0  0  0

+    1.9013   -0.2091    0.0001 C   0  0  0

+   -1.1417    2.6362    0.0014 O   0  0  0

+   -2.6343    1.1453   -0.0050 O   0  5  0

+    1.5424   -1.5455   -0.0019 C   0  0  0

+    3.5784    0.2392   -0.0005 Cl  0  0  0

+    1.1928    1.7716    0.0000 H   0  0  0

+   -0.0616   -2.9044    0.0000 H   0  0  0

+    2.2756   -2.2795    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16169-17-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.4425   -0.6160   -0.0572 C   0  0  0

+   -1.0173   -0.3553   -0.0401 C   0  0  0

+    1.3481    0.4465    0.0485 C   0  0  0

+    0.9191   -1.9192   -0.1726 C   0  0  0

+   -1.7896   -0.7715    1.0427 C   0  0  0

+   -1.6213    0.3121   -1.1046 C   0  0  0

+    2.7119    0.1922    0.0315 C   0  0  0

+    0.8812    1.7551    0.1699 N   0  0  0

+    2.2789   -2.1570   -0.1880 C   0  0  0

+   -3.1477   -0.5257    1.0534 C   0  0  0

+   -2.9799    0.5523   -1.0831 C   0  0  0

+    3.1723   -1.1049   -0.0893 C   0  0  0

+    1.7997    2.8275    0.2766 O   0  0  0

+   -3.7425    0.1322   -0.0079 C   0  0  0

+    0.2549   -2.7132    0.0000 H   0  0  0

+   -1.6271   -1.7939    0.0000 H   0  0  0

+   -1.1204    1.2180    0.0000 H   0  0  0

+    3.3843    0.9792    0.0000 H   0  0  0

+   -0.1367    1.9432    0.0000 H   0  0  0

+    2.6308   -3.1305    0.0000 H   0  0  0

+   -3.6507   -1.4305    0.0000 H   0  0  0

+   -3.1492    1.5735    0.0000 H   0  0  0

+    4.1905   -1.2917    0.0000 H   0  0  0

+    2.4731    3.6137    0.0000 H   0  0  0

+   -4.7634    0.3034    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94-96-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    0.9718    0.0569   -0.2338 C   0  0  0

+   -0.3913    0.5905    0.2113 C   0  0  0

+    2.0629    1.0558    0.1570 C   0  0  0

+    1.2414   -1.2857    0.4484 C   0  0  0

+   -1.5006   -0.1947   -0.4914 C   0  0  0

+   -0.5232    0.4388    1.6261 O   0  0  0

+    2.2939    2.0355   -0.9952 C   0  0  0

+    2.1435   -2.0535   -0.3509 O   0  0  0

+   -2.8637    0.3389   -0.0462 C   0  0  0

+   -3.9730   -0.4463   -0.7490 C   0  0  0

+    0.1908   -0.5981    0.0000 H   0  0  0

+   -0.5148    1.6023    0.0000 H   0  0  0

+    2.4758    0.1238    0.0000 H   0  0  0

+    3.0778    1.1502    0.0000 H   0  0  0

+    0.2275   -1.1810    0.0000 H   0  0  0

+    0.8407   -2.2229    0.0000 H   0  0  0

+   -2.0481   -1.0545    0.0000 H   0  0  0

+   -0.7624   -0.8976    0.0000 H   0  0  0

+   -1.1920   -0.3304    0.0000 H   0  0  0

+    3.2860    1.8016    0.0000 H   0  0  0

+    2.5278    3.0276    0.0000 H   0  0  0

+    1.3018    2.2694    0.0000 H   0  0  0

+    2.9197   -2.7142    0.0000 H   0  0  0

+   -2.3162    1.1987    0.0000 H   0  0  0

+   -3.6019    1.0418    0.0000 H   0  0  0

+   -4.5619    0.3857    0.0000 H   0  0  0

+   -4.8050   -1.0352    0.0000 H   0  0  0

+   -3.3841   -1.2783    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+63655-40-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+    0.7561    0.8596    0.0028 C   0  0  0

+    0.4640   -0.5161   -0.0003 C   0  0  0

+    2.1354    0.9594    0.0029 N   0  0  0

+   -0.2735    1.7920   -0.0001 C   0  0  0

+   -0.8647   -0.9367   -0.0008 C   0  0  0

+    1.6523   -1.1771   -0.0019 N   0  0  0

+    2.6351   -0.3118    0.0000 C   0  0  0

+   -1.5748    1.3778   -0.0060 C   0  0  0

+   -1.8845    0.0116    0.0018 C   0  0  0

+    3.9753   -0.6357   -0.0007 N   0  0  0

+   -3.2528   -0.4108    0.0013 C   0  0  0

+   -4.3382   -0.7458    0.0009 N   0  0  0

+    2.6881    1.8370    0.0000 H   0  0  0

+   -0.0534    2.8055    0.0000 H   0  0  0

+   -1.0923   -1.9486    0.0000 H   0  0  0

+   -2.3388    2.0793    0.0000 H   0  0  0

+    4.2684   -1.6306    0.0000 H   0  0  0

+    4.6904    0.1156    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

+  4  8  2  0

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+  6  7  2  0

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+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  8 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101021-43-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+    0.3674   -0.9059    0.0021 C   0  0  0

+   -1.0749   -0.6591    0.0015 C   0  0  0

+    1.5453   -0.0460    0.0012 C   0  0  0

+    0.5368   -2.2934   -0.0029 C   0  0  0

+   -1.8991    0.5440    0.0003 C   0  0  0

+   -1.6967   -1.9108    0.0028 C   0  0  0

+    2.8272   -0.6477    0.0023 C   0  0  0

+    1.4378    1.3494   -0.0011 C   0  0  0

+   -0.7130   -2.8790   -0.0065 N   0  0  0

+    1.8294   -2.8371   -0.0031 C   0  0  0

+   -3.3082    0.4037    0.0005 C   0  0  0

+   -1.3323    1.8235    0.0000 C   0  0  0

+   -3.0965   -1.9930    0.0030 C   0  0  0

+    2.9336   -2.0520    0.0037 C   0  0  0

+    3.9687    0.1697    0.0016 C   0  0  0

+    2.5670    2.1137   -0.0022 C   0  0  0

+   -3.8763   -0.8849    0.0014 C   0  0  0

+   -4.1118    1.5549   -0.0007 C   0  0  0

+   -2.1422    2.9206   -0.0001 C   0  0  0

+    3.8283    1.5247   -0.0003 C   0  0  0

+   -3.5276    2.7856   -0.0019 C   0  0  0

+    5.0561    2.3986   -0.0006 C   0  0  0

+    0.4924    1.8054    0.0000 H   0  0  0

+   -0.8902   -3.9135    0.0000 H   0  0  0

+    1.9446   -3.8804    0.0000 H   0  0  0

+   -0.2890    1.9382    0.0000 H   0  0  0

+   -3.5525   -2.9384    0.0000 H   0  0  0

+    3.8839   -2.4977    0.0000 H   0  0  0

+    4.9258   -0.2612    0.0000 H   0  0  0

+    2.4841    3.1600    0.0000 H   0  0  0

+   -4.9208   -0.9886    0.0000 H   0  0  0

+   -5.1578    1.4678    0.0000 H   0  0  0

+   -1.7153    3.8795    0.0000 H   0  0  0

+   -4.1309    3.6445    0.0000 H   0  0  0

+    5.6647    1.5435    0.0000 H   0  0  0

+    5.9112    3.0072    0.0000 H   0  0  0

+    4.4475    3.2537    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  1  0

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+  6  9  1  0

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+ 18 32  1  0

+ 19 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+56980-94-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 44                          1 V2000

+   -1.7600    0.1475   -0.0505 C   0  0  0

+   -3.0460   -0.4155   -0.0670 C   0  0  0

+   -1.6110    1.5242    0.0235 C   0  0  0

+   -0.6659   -0.6535   -0.1010 O   0  0  0

+   -4.1680    0.4200   -0.0086 C   0  0  0

+   -3.2133   -1.8717   -0.1456 C   0  0  0

+   -2.7222    2.3404    0.0808 C   0  0  0

+    0.4762    0.2047   -0.0683 C   0  0  0

+   -4.0011    1.7909    0.0649 C   0  0  0

+   -4.5957   -2.4714   -0.1631 C   0  0  0

+   -2.2388   -2.5923   -0.1965 O   0  0  0

+    1.7507   -0.6401   -0.1227 C   0  0  0

+   -5.1211    2.6281    0.1234 N   0  0  0

+    2.9735    0.2789   -0.0876 C   0  0  0

+    1.7856   -1.5225    1.0008 O   0  0  0

+    4.1972   -0.5322   -0.1399 N   0  0  0

+    5.3272    0.4056   -0.1030 C   0  0  0

+    5.2472    1.3482   -1.3055 C   0  0  0

+    5.2702    1.2222    1.1897 C   0  0  0

+    6.6411   -0.3766   -0.1546 C   0  0  0

+   -0.6510    1.9469    0.0000 H   0  0  0

+   -5.1322    0.0069    0.0000 H   0  0  0

+   -2.6030    3.3826    0.0000 H   0  0  0

+    1.1512    1.0076    0.0000 H   0  0  0

+   -0.2450    0.9664    0.0000 H   0  0  0

+   -5.0132   -1.5091    0.0000 H   0  0  0

+   -5.5580   -2.8889    0.0000 H   0  0  0

+   -4.1782   -3.4337    0.0000 H   0  0  0

+    0.8365   -1.1545    0.0000 H   0  0  0

+   -4.9973    3.6697    0.0000 H   0  0  0

+   -6.0851    2.2145    0.0000 H   0  0  0

+    3.6485    1.0819    0.0000 H   0  0  0

+    2.2523    1.0406    0.0000 H   0  0  0

+    1.8271   -2.5706    0.0000 H   0  0  0

+    4.2535   -1.5796    0.0000 H   0  0  0

+    6.2924    1.4369    0.0000 H   0  0  0

+    5.1585    2.3934    0.0000 H   0  0  0

+    4.2020    1.2595    0.0000 H   0  0  0

+    6.3166    1.2952    0.0000 H   0  0  0

+    5.1972    2.2686    0.0000 H   0  0  0

+    4.2238    1.1492    0.0000 H   0  0  0

+    6.1045   -1.2779    0.0000 H   0  0  0

+    7.5424   -0.9132    0.0000 H   0  0  0

+    7.1777    0.5247    0.0000 H   0  0  0

+  1  2  2  0

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+  7  9  1  0

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+ 19 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 20 42  1  0

+ 20 43  1  0

+ 20 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+931-97-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.5614    0.5173    0.0000 C   0  0  0

+    0.3041    0.6936    1.2493 C   0  0  0

+    0.3041    0.6937   -1.2492 C   0  0  0

+   -1.1542   -0.8301    0.0000 C   0  0  0

+   -1.6028    1.4958    0.0001 O   0  0  0

+    1.4191   -0.3542    1.2492 C   0  0  0

+    1.4191   -0.3541   -1.2492 C   0  0  0

+   -1.6117   -1.8699   -0.0001 N   0  0  0

+    2.2846   -0.1777    0.0000 C   0  0  0

+    1.0018    1.1826    0.0000 H   0  0  0

+   -0.0325    1.4763    0.0000 H   0  0  0

+    1.0018    1.1827    0.0000 H   0  0  0

+   -0.0325    1.4764    0.0000 H   0  0  0

+   -2.2237    2.0792    0.0000 H   0  0  0

+    0.7214   -0.8432    0.0000 H   0  0  0

+    1.7558   -1.1368    0.0000 H   0  0  0

+    0.7214   -0.8431    0.0000 H   0  0  0

+    1.7557   -1.1368    0.0000 H   0  0  0

+    2.8494   -0.8156    0.0000 H   0  0  0

+    2.5546    0.6304    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59229-75-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.8944    0.0001    0.0037 C   0  0  0

+   -0.2050   -1.1974    0.0029 C   0  0  0

+   -0.2053    1.1973    0.0024 C   0  0  0

+   -2.3744    0.0000   -0.0003 N   0  3  0

+    1.1845   -1.2010    0.0009 C   0  0  0

+    1.1847    1.2008    0.0004 C   0  0  0

+   -2.9834    1.0549    0.0003 O   0  0  0

+   -2.9834   -1.0548   -0.0043 O   0  5  0

+    1.8800    0.0001   -0.0004 C   0  0  0

+    1.8805   -2.4119    0.0006 N   0  0  0

+    1.8807    2.4118   -0.0013 N   0  0  0

+    3.3870    0.0001   -0.0032 C   0  0  0

+   -0.7275   -2.0984    0.0000 H   0  0  0

+   -0.7278    2.0983    0.0000 H   0  0  0

+    1.3580   -3.3129    0.0000 H   0  0  0

+    2.9220   -2.4139    0.0000 H   0  0  0

+    2.9222    2.4138    0.0000 H   0  0  0

+    1.3582    3.3128    0.0000 H   0  0  0

+    3.3870   -1.0414    0.0000 H   0  0  0

+    4.4285    0.0001    0.0000 H   0  0  0

+    3.3870    1.0416    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91575-29-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+    3.2970    0.1152    0.3503 C   0  0  0

+    2.8457   -0.8950   -0.4911 C   0  0  0

+    2.6810    1.3589    0.3289 C   0  0  0

+    4.3666   -0.1230    1.2213 N   0  0  0

+    1.7858   -0.6579   -1.3455 C   0  0  0

+    3.6120   -2.4525   -0.4681 Cl  0  0  0

+    1.6218    1.5892   -0.5278 C   0  0  0

+    5.4266    0.7094    1.2302 C   0  0  0

+    1.1748    0.5827   -1.3636 C   0  0  0

+    6.5162    0.5310    2.2558 C   0  0  0

+    5.5036    1.6020    0.4126 O   0  0  0

+    0.0195    0.8382   -2.2969 C   0  0  0

+   -1.2727    0.4913   -1.6034 C   0  0  0

+   -1.9463    1.4562   -0.8767 C   0  0  0

+   -1.7850   -0.7892   -1.6997 C   0  0  0

+   -3.1316    1.1412   -0.2401 C   0  0  0

+   -2.9696   -1.1109   -1.0657 C   0  0  0

+   -3.6462   -0.1469   -0.3310 C   0  0  0

+   -3.9767    2.3524    0.6724 Cl  0  0  0

+   -4.8463   -0.4698    0.3129 N   0  0  0

+   -4.9035   -1.5348    1.1370 C   0  0  0

+   -6.2224   -1.9581    1.7307 C   0  0  0

+   -3.8936   -2.1524    1.4008 O   0  0  0

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+   -0.5100    1.5707    0.0000 H   0  0  0

+   -1.6357    2.3050    0.0000 H   0  0  0

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+   -6.4986   -1.0975    0.0000 H   0  0  0

+   -7.0830   -2.2343    0.0000 H   0  0  0

+   -5.9462   -2.8187    0.0000 H   0  0  0

+  1  2  1  0

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+  7  9  2  0

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+ 17 35  1  0

+ 20 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134-81-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.8395    0.1944   -0.1719 C   0  0  0

+    0.5477    0.5062   -0.8104 C   0  0  0

+    2.8692    1.1411   -0.1697 C   0  0  0

+    2.0398   -1.0477    0.4401 C   0  0  0

+   -0.5477   -0.5061   -0.8104 C   0  0  0

+    0.3756    1.5866   -1.3360 O   0  0  0

+    4.0745    0.8420    0.4294 C   0  0  0

+    3.2504   -1.3317    1.0348 C   0  0  0

+   -1.8396   -0.1943   -0.1721 C   0  0  0

+   -0.3755   -1.5865   -1.3360 O   0  0  0

+    4.2669   -0.3913    1.0277 C   0  0  0

+   -2.8693   -1.1410   -0.1701 C   0  0  0

+   -2.0400    1.0478    0.4398 C   0  0  0

+   -4.0744   -0.8421    0.4294 C   0  0  0

+   -3.2504    1.3316    1.0349 C   0  0  0

+   -4.2667    0.3911    1.0281 C   0  0  0

+    2.6357    2.0554    0.0000 H   0  0  0

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+    3.4912   -2.2441    0.0000 H   0  0  0

+    5.1581   -0.7013    0.0000 H   0  0  0

+   -2.6357   -2.0552    0.0000 H   0  0  0

+   -1.3497    1.6912    0.0000 H   0  0  0

+   -4.7705   -1.4792    0.0000 H   0  0  0

+   -3.4913    2.2439    0.0000 H   0  0  0

+   -5.1579    0.7011    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+930-22-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -0.1880    0.0306   -0.5530 C   0  0  0

+   -1.2034   -0.8702    0.1530 C   0  0  0

+   -1.3585    0.5486    0.0822 O   0  0  0

+    1.0050    0.2415    0.3433 C   0  0  0

+    2.1962   -0.1327   -0.0529 C   0  0  0

+    0.2298   -0.8337    0.0000 H   0  0  0

+   -2.1163   -1.1671    0.0000 H   0  0  0

+   -0.7263   -1.7033    0.0000 H   0  0  0

+    1.0671    1.1995    0.0000 H   0  0  0

+    2.4050   -1.0697    0.0000 H   0  0  0

+    2.9033    0.5166    0.0000 H   0  0  0

+  1  2  1  0

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+  4  5  2  0

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+  2  7  1  0

+  2  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+224-53-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -1.1581    0.2652   -0.0024 C   0  0  0

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+ 21 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17831-71-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 42                          1 V2000

+    6.0746   -0.8208   -0.1898 C   0  0  0

+    5.1086   -0.2345    0.5452 O   0  0  0

+    7.0047    0.0043   -0.9731 C   0  0  0

+    6.1795   -2.0315   -0.2006 O   0  0  0

+    4.1896   -1.0498    1.3192 C   0  0  0

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+    3.2003   -0.1440    2.0553 C   0  0  0

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+   -2.4661    0.6424   -1.0986 O   0  0  0

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+ 21 42  1  0

+ 21 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+304-28-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 39                          1 V2000

+    0.7429   -0.4953   -0.2285 C   0  0  0

+   -0.7183   -0.7031   -0.0773 C   0  0  0

+    1.0550    0.8311    0.0598 C   0  0  0

+    1.7634   -1.3800   -0.5863 C   0  0  0

+   -1.3197    0.4934    0.3056 C   0  0  0

+   -1.5060   -1.8437   -0.2526 C   0  0  0

+   -0.2323    1.5342    0.4147 C   0  0  0

+    2.3587    1.2704   -0.0116 C   0  0  0

+    3.0661   -0.9376   -0.6581 C   0  0  0

+   -2.6807    0.5538    0.5100 C   0  0  0

+   -2.8668   -1.7804   -0.0471 C   0  0  0

+    3.3703    0.3883   -0.3729 C   0  0  0

+   -3.4608   -0.5830    0.3342 C   0  0  0

+    4.6941    0.8336   -0.4456 N   0  0  0

+   -4.8426   -0.5225    0.5419 N   0  0  0

+    5.6672    0.1633    0.2026 C   0  0  0

+   -5.5741    0.4330   -0.0650 C   0  0  0

+    7.1082    0.5657    0.0222 C   0  0  0

+    5.3831   -0.7639    0.9311 O   0  0  0

+   -7.0390    0.5791    0.2573 C   0  0  0

+   -5.0534    1.1753   -0.8706 O   0  0  0

+    1.5670   -2.3829    0.0000 H   0  0  0

+   -1.0523   -2.7595    0.0000 H   0  0  0

+    0.3467    2.3763    0.0000 H   0  0  0

+   -1.0108    2.1963    0.0000 H   0  0  0

+    2.5578    2.2728    0.0000 H   0  0  0

+    3.8246   -1.6225    0.0000 H   0  0  0

+   -3.1367    1.4684    0.0000 H   0  0  0

+   -3.4255   -2.6361    0.0000 H   0  0  0

+    4.8361    1.8457    0.0000 H   0  0  0

+   -5.3150   -1.4287    0.0000 H   0  0  0

+    7.3831   -0.4186    0.0000 H   0  0  0

+    8.0925    0.8406    0.0000 H   0  0  0

+    6.8333    1.5500    0.0000 H   0  0  0

+   -6.9376    1.5960    0.0000 H   0  0  0

+   -8.0559    0.6805    0.0000 H   0  0  0

+   -7.1404   -0.4378    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+ 10 13  2  0

+ 12 14  1  0

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+ 16 18  1  0

+ 16 19  2  0

+ 17 20  1  0

+ 17 21  2  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  1  0

+  4 22  1  0

+  6 23  1  0

+  7 24  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-84-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.5297    0.0000   -0.3199 C   0  0  0

+   -0.7718    0.0000    0.4398 C   0  0  0

+    1.3337    1.2492    0.0460 C   0  0  0

+    1.3337   -1.2492    0.0461 C   0  0  0

+   -1.8205    0.0000   -0.1591 O   0  0  0

+    0.0291    0.9175    0.0000 H   0  0  0

+   -0.7718    1.0452    0.0000 H   0  0  0

+    2.2126    0.6836    0.0000 H   0  0  0

+    1.8993    2.1281    0.0000 H   0  0  0

+    0.4548    1.8148    0.0000 H   0  0  0

+    0.4548   -1.8148    0.0000 H   0  0  0

+    1.8993   -2.1281    0.0000 H   0  0  0

+    2.2126   -0.6836    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  1  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+132742-03-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.5872   -0.6411    0.0344 C   0  0  0

+   -0.8087   -0.8071   -0.0092 C   0  0  0

+    1.1383    0.6559    0.1052 C   0  0  0

+    1.4337   -1.7748    0.0014 C   0  0  0

+   -1.6513    0.3273    0.0206 C   0  0  0

+   -1.3633   -2.1047   -0.0836 C   0  0  0

+    2.6062    0.8023    0.1458 C   0  0  0

+    0.2959    1.7630    0.1341 C   0  0  0

+    2.8873   -1.5889    0.0578 C   0  0  0

+    0.8708   -3.0488   -0.0805 C   0  0  0

+   -3.0982    0.1267   -0.0249 C   0  0  0

+   -1.0875    1.6042    0.0918 C   0  0  0

+   -0.5089   -3.2153   -0.1144 C   0  0  0

+   -2.7692   -2.2578   -0.1251 C   0  0  0

+    3.4256   -0.3455    0.1406 C   0  0  0

+    3.1960    2.0816    0.2076 C   0  0  0

+   -3.6033   -1.1571   -0.0959 C   0  0  0

+   -4.0166    1.2916    0.0053 N   0  3  0

+    4.9228   -0.1873    0.2377 C   0  0  0

+    4.5050    2.2468   -0.0636 C   0  0  0

+   -5.0279    1.2523    0.6829 O   0  0  0

+   -3.7172    2.4491   -0.7535 O   0  5  0

+    5.3575    1.0828   -0.4917 C   0  0  0

+    0.7094    2.7328    0.0000 H   0  0  0

+    3.5209   -2.4316    0.0000 H   0  0  0

+    1.4982   -3.8961    0.0000 H   0  0  0

+   -1.7126    2.4532    0.0000 H   0  0  0

+   -0.9170   -4.1874    0.0000 H   0  0  0

+   -3.1865   -3.2260    0.0000 H   0  0  0

+    2.5730    2.9322    0.0000 H   0  0  0

+   -4.6477   -1.3009    0.0000 H   0  0  0

+    4.8809   -1.2408    0.0000 H   0  0  0

+    5.9592   -0.3810    0.0000 H   0  0  0

+    4.9219    3.2152    0.0000 H   0  0  0

+    6.2657    0.5473    0.0000 H   0  0  0

+    6.0650    1.8644    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

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+  6 14  2  0

+  7 15  2  0

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+ 11 17  2  0

+ 11 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 18 21  2  0

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+  8 12  2  0

+  9 15  1  0

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+ 17 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 23 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86-00-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.5246   -0.7672   -0.0104 C   0  0  0

+   -0.9460   -0.5691   -0.0147 C   0  0  0

+    1.3783    0.3336    0.0119 C   0  0  0

+    1.0569   -2.0551   -0.0229 C   0  0  0

+   -1.6265   -0.4102   -1.2200 C   0  0  0

+   -1.6522   -0.5472    1.1864 C   0  0  0

+    2.7455    0.1435    0.0158 C   0  0  0

+    0.8201    1.7044    0.0310 N   0  3  0

+    2.4252   -2.2335   -0.0189 C   0  0  0

+   -2.9946   -0.2267   -1.2181 C   0  0  0

+   -3.0198   -0.3632    1.1766 C   0  0  0

+    3.2683   -1.1367   -0.0025 C   0  0  0

+    1.5616    2.6653   -0.0708 O   0  0  0

+   -0.3806    1.8715    0.1486 O   0  5  0

+   -3.6898   -0.2006   -0.0228 C   0  0  0

+    0.4270   -2.8765    0.0000 H   0  0  0

+   -1.4398    0.6079    0.0000 H   0  0  0

+   -1.7374   -1.5788    0.0000 H   0  0  0

+    3.3806    0.9608    0.0000 H   0  0  0

+    2.8215   -3.1897    0.0000 H   0  0  0

+   -2.9063    0.8046    0.0000 H   0  0  0

+   -3.2111   -1.3805    0.0000 H   0  0  0

+    4.2941   -1.2748    0.0000 H   0  0  0

+   -4.7151   -0.0584    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  7 12  2  0

+  8 13  2  0

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+  9 12  1  0

+ 11 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93106-60-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 51                          1 V2000

+    1.0261    0.5217   -0.0698 C   0  0  0

+    2.0937    1.3900   -0.1602 N   0  0  0

+    1.2449   -0.8649    0.0218 C   0  0  0

+   -0.2772    1.0049   -0.0622 C   0  0  0

+    1.8236    2.8268   -0.2535 C   0  0  0

+    3.3673    0.9750   -0.1660 C   0  0  0

+    2.6309   -1.3618    0.0188 C   0  0  0

+    0.1637   -1.7451    0.1138 C   0  0  0

+   -1.3393    0.1202    0.0291 C   0  0  0

+    2.4726    3.5457    0.9309 C   0  0  0

+    3.1404    3.5819   -0.4452 C   0  0  0

+    3.7054   -0.3601   -0.0813 C   0  0  0

+    2.8785   -2.5528    0.0962 O   0  0  0

+   -1.1116   -1.2561    0.1149 C   0  0  0

+   -2.6444    0.6062    0.0371 N   0  0  0

+    5.1149   -0.7755   -0.0903 C   0  0  0

+   -2.1577   -2.1064    0.2034 F   0  0  0

+   -3.2683    0.1197    1.2738 C   0  0  0

+   -3.3437   -0.0445   -1.0777 C   0  0  0

+    5.4329   -2.0829   -0.0070 O   0  0  0

+    5.9942    0.0599   -0.1728 O   0  0  0

+   -4.7457    0.5133    1.2937 C   0  0  0

+   -4.8212    0.3491   -1.0577 C   0  0  0

+   -5.4450   -0.1374    0.1789 N   0  0  0

+   -6.8217    0.3752    0.1873 C   0  0  0

+   -7.6114   -0.2654   -0.9558 C   0  0  0

+   -0.4517    2.0230    0.0000 H   0  0  0

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+   -4.3475    1.2670    0.0000 H   0  0  0

+   -5.6163    1.0085    0.0000 H   0  0  0

+   -6.2959    1.2643    0.0000 H   0  0  0

+   -7.6039    1.0498    0.0000 H   0  0  0

+   -8.2621    0.5368    0.0000 H   0  0  0

+   -8.4136   -0.9161    0.0000 H   0  0  0

+   -6.9607   -1.0676    0.0000 H   0  0  0

+  1  2  1  0

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+  9 14  1  0

+ 10 11  1  0

+ 23 24  1  0

+  4 27  1  0

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+  8 30  1  0

+ 10 31  1  0

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+ 11 33  1  0

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+ 18 35  1  0

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+ 22 40  1  0

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+ 23 43  1  0

+ 25 44  1  0

+ 25 45  1  0

+ 26 46  1  0

+ 26 47  1  0

+ 26 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+934-73-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.8554    0.1422    0.1550 C   0  0  0

+   -2.6125    0.2315    0.2521 S   0  0  0

+   -0.0900    1.2578    0.4396 C   0  0  0

+   -0.2427   -1.0448   -0.2001 C   0  0  0

+   -2.9968    0.7338   -1.4480 C   0  0  0

+   -2.9207   -1.1454    0.4204 O   0  0  0

+    1.2881    1.1882    0.3640 C   0  0  0

+    1.1358   -1.1157   -0.2761 C   0  0  0

+    1.9019    0.0017    0.0034 C   0  0  0

+    3.6331   -0.0865   -0.0917 Cl  0  0  0

+   -0.5448    2.1769    0.0000 H   0  0  0

+   -0.7985   -1.9066    0.0000 H   0  0  0

+   -2.1823    1.3569    0.0000 H   0  0  0

+   -3.6199    1.5483    0.0000 H   0  0  0

+   -3.8113    0.1107    0.0000 H   0  0  0

+    1.8432    2.0505    0.0000 H   0  0  0

+    1.5903   -2.0350    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  3  7  2  0

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+  8  9  2  0

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+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  7 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+52278-77-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    0.7558   -0.6678    0.4746 C   0  0  2

+   -0.6610   -0.3588    0.2665 N   0  0  0

+    1.5076    0.5616    0.5711 O   0  0  0

+    1.3176   -1.3766   -0.7778 C   0  0  0

+   -1.5883   -1.3175    0.4437 C   0  0  0

+   -1.0345    0.9027   -0.1012 C   0  0  0

+    2.8670    0.2033    0.2404 C   0  0  1

+    2.7384   -0.7903   -0.9354 C   0  0  1

+   -2.8832   -1.0658    0.2618 N   0  0  0

+   -1.2364   -2.4375    0.7767 O   0  0  0

+   -2.3501    1.1747   -0.2904 C   0  0  0

+    3.6238    1.4489   -0.2250 C   0  0  0

+    3.7035   -1.8335   -0.7852 O   0  0  0

+   -3.2955    0.1414   -0.1004 C   0  0  0

+   -2.7531    2.4226   -0.6570 O   0  0  0

+    3.6649    2.4054    0.8359 O   0  0  0

+   -4.6372    0.3881   -0.2851 N   0  0  0

+    0.2245   -1.5197    0.0000 H   0  0  0

+    0.4763   -1.9245    0.0000 H   0  0  0

+    1.7850   -2.2651    0.0000 H   0  0  0

+   -0.3550    1.6418    0.0000 H   0  0  0

+    3.8144   -0.1290    0.0000 H   0  0  0

+    3.6948   -0.4851    0.0000 H   0  0  0

+    4.2464    0.6613    0.0000 H   0  0  0

+    4.5790    1.7580    0.0000 H   0  0  0

+    4.3853   -2.5705    0.0000 H   0  0  0

+   -3.0616    3.3780    0.0000 H   0  0  0

+    3.7080    3.4084    0.0000 H   0  0  0

+   -4.9737    1.3340    0.0000 H   0  0  0

+   -5.2881   -0.3762    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

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+  7 12  1  0

+  8 13  1  0

+  9 14  2  0

+ 11 15  1  0

+ 12 16  1  0

+ 14 17  1  0

+  7  8  1  0

+ 11 14  1  0

+  1 18  1  0

+  4 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+76-03-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.1386   -0.0254    0.0000 C   0  0  0

+   -1.3167    0.3658    0.0000 C   0  0  0

+    0.4984   -1.0022    1.4722 Cl  0  0  0

+    0.4984   -1.0022   -1.4721 Cl  0  0  0

+    1.1603    1.4602    0.0000 Cl  0  0  0

+   -2.2666   -0.5826    0.0000 O   0  0  0

+   -1.6285    1.5331    0.0000 O   0  0  0

+   -2.9434   -1.2584    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  6  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+612-22-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.3759   -1.9802    0.4167 C   0  0  0

+    0.9409   -2.4217   -0.9349 C   0  0  0

+   -0.5509   -0.8091    0.2154 C   0  0  0

+   -0.0332    0.4624    0.0558 C   0  0  0

+   -1.9188   -1.0075    0.1846 C   0  0  0

+    1.4315    0.6739    0.0827 N   0  3  0

+   -0.8835    1.5368   -0.1293 C   0  0  0

+   -2.7689    0.0666    0.0000 C   0  0  0

+    2.0682    0.3993    1.0840 O   0  0  0

+    2.0001    1.1225   -0.8966 O   0  5  0

+   -2.2512    1.3393   -0.1543 C   0  0  0

+   -0.6277   -2.2101    0.0000 H   0  0  0

+    0.1522   -2.9852    0.0000 H   0  0  0

+    0.3069   -3.2330    0.0000 H   0  0  0

+    1.7522   -3.0557    0.0000 H   0  0  0

+    1.5749   -1.6104    0.0000 H   0  0  0

+   -2.2994   -1.9642    0.0000 H   0  0  0

+   -0.5026    2.4934    0.0000 H   0  0  0

+   -3.7882   -0.0787    0.0000 H   0  0  0

+   -2.8857    2.1502    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  4  1  0

+  8  5  2  0

+  9  6  2  0

+ 10  6  1  0

+ 11  7  2  0

+  8 11  1  0

+  1 12  1  0

+  1 13  1  0

+  2 14  1  0

+  2 15  1  0

+  2 16  1  0

+  5 17  1  0

+  7 18  1  0

+  8 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+834-28-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    2.5979    0.1636   -0.4971 C   0  0  0

+    1.1884    0.1720   -1.0302 C   0  0  0

+    3.3907   -0.9573   -0.6572 C   0  0  0

+    3.1001    1.2791    0.1470 C   0  0  0

+    0.2325   -0.3435    0.0475 C   0  0  0

+    4.6838   -0.9650   -0.1682 C   0  0  0

+    4.3928    1.2714    0.6359 C   0  0  0

+   -1.1377   -0.3354   -0.4707 N   0  0  0

+    5.1838    0.1481    0.4808 C   0  0  0

+   -2.1758   -0.7593    0.3245 C   0  0  0

+   -3.4660   -0.7517   -0.1634 N   0  0  0

+   -1.9411   -1.1683    1.5387 N   0  0  0

+   -4.2171    0.4040   -0.1090 C   0  0  0

+   -5.4676    0.4385   -0.6787 N   0  0  0

+   -3.7413    1.4627    0.4822 N   0  0  0

+    1.5317    1.0767    0.0000 H   0  0  0

+    0.4606    0.8097    0.0000 H   0  0  0

+    2.9434   -1.8154    0.0000 H   0  0  0

+    2.5772    2.0933    0.0000 H   0  0  0

+   -0.1108   -1.2482    0.0000 H   0  0  0

+    0.9603   -0.9812    0.0000 H   0  0  0

+    5.2071   -1.7790    0.0000 H   0  0  0

+    4.8410    2.1290    0.0000 H   0  0  0

+   -1.3213    0.6147    0.0000 H   0  0  0

+    6.1470    0.2405    0.0000 H   0  0  0

+   -3.9301   -1.6008    0.0000 H   0  0  0

+   -1.4595   -2.0076    0.0000 H   0  0  0

+   -5.9281    1.2895    0.0000 H   0  0  0

+   -5.9744   -0.3859    0.0000 H   0  0  0

+   -3.3446    2.3453    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+ 10 11  1  0

+ 10 12  2  0

+ 11 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+  7  9  1  0

+  2 16  1  0

+  2 17  1  0

+  3 18  1  0

+  4 19  1  0

+  5 20  1  0

+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+28622-66-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.0521   -0.3682   -0.0647 C   0  0  0

+   -1.3620   -0.3803   -0.0427 C   0  0  0

+    0.7300    0.8326    0.0827 C   0  0  0

+    0.8200   -1.6149   -0.2361 C   0  0  0

+   -2.0584    0.8408    0.1338 C   0  0  0

+   -2.0864   -1.5709   -0.1917 C   0  0  0

+    0.0287    2.0202    0.2555 C   0  0  0

+    2.2366    0.8361    0.0523 C   0  0  0

+    2.0991   -1.6501    0.1180 C   0  0  0

+   -1.3333    2.0361    0.2817 C   0  0  0

+   -3.4637    0.8341    0.1573 C   0  0  0

+   -3.4481   -1.5407   -0.1646 C   0  0  0

+    2.7714   -0.4402    0.6987 C   0  0  0

+    2.6856    0.9081   -1.3024 O   0  0  0

+   -4.1346   -0.3411    0.0096 C   0  0  0

+    4.1815   -0.5280    0.4843 O   0  0  0

+    0.3014   -2.5141    0.0000 H   0  0  0

+   -1.5878   -2.4813    0.0000 H   0  0  0

+    0.5485    2.9186    0.0000 H   0  0  0

+    2.1530    1.8707    0.0000 H   0  0  0

+    2.6131   -2.5519    0.0000 H   0  0  0

+   -1.8372    2.9436    0.0000 H   0  0  0

+   -3.9870    1.7305    0.0000 H   0  0  0

+   -3.9787   -2.4328    0.0000 H   0  0  0

+    1.7350   -0.3829    0.0000 H   0  0  0

+    3.7105    1.0724    0.0000 H   0  0  0

+   -5.1726   -0.3416    0.0000 H   0  0  0

+    5.2175   -0.5925    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  1  0

+  8 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+  7 10  2  0

+  9 13  1  0

+ 12 15  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+493-52-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -2.2900   -0.6177   -0.0018 C   0  0  0

+   -3.3099    0.3566   -0.0011 C   0  0  0

+   -0.9786   -0.2397   -0.0008 N   0  0  0

+   -2.6314   -1.9707    0.0022 C   0  0  0

+   -4.6448   -0.0460   -0.0017 C   0  0  0

+   -2.9668    1.7910    0.0007 C   0  0  0

+   -0.0494   -1.1346   -0.0015 N   0  0  0

+   -3.9592   -2.3469    0.0069 C   0  0  0

+   -4.9606   -1.3899   -0.0030 C   0  0  0

+   -3.9450    2.7178    0.0014 O   0  0  0

+   -1.8022    2.1371    0.0016 O   0  0  0

+    1.2598   -0.7573   -0.0005 C   0  0  0

+    2.2699   -1.7270   -0.0012 C   0  0  0

+    1.5989    0.6012   -0.0045 C   0  0  0

+    3.5818   -1.3474   -0.0006 C   0  0  0

+    2.9236    0.9751   -0.0039 C   0  0  0

+    3.9207    0.0032    0.0007 C   0  0  0

+    5.2595    0.3826    0.0017 N   0  0  0

+    5.6183    1.8030    0.0030 C   0  0  0

+    6.3102   -0.6383    0.0014 C   0  0  0

+   -1.8828   -2.6979    0.0000 H   0  0  0

+   -5.4053    0.6687    0.0000 H   0  0  0

+   -4.2106   -3.3598    0.0000 H   0  0  0

+   -5.9611   -1.6870    0.0000 H   0  0  0

+   -4.7026    3.4356    0.0000 H   0  0  0

+    2.0201   -2.7403    0.0000 H   0  0  0

+    0.8498    1.3278    0.0000 H   0  0  0

+    4.3329   -2.0720    0.0000 H   0  0  0

+    3.1805    1.9866    0.0000 H   0  0  0

+    6.6302    1.5474    0.0000 H   0  0  0

+    5.8739    2.8149    0.0000 H   0  0  0

+    4.6064    2.0586    0.0000 H   0  0  0

+    5.5829   -1.3868    0.0000 H   0  0  0

+    7.0587   -1.3656    0.0000 H   0  0  0

+    7.0375    0.1102    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  6 11  2  0

+  7 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 18 20  1  0

+  8  9  2  0

+ 16 17  2  0

+  4 21  1  0

+  5 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+147-47-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.6968    0.5784    0.0432 C   0  0  0

+   -0.4809   -0.7897    0.2746 C   0  0  0

+    0.4587    1.4961    0.0880 C   0  0  0

+   -1.9829    1.0405   -0.2158 C   0  0  0

+    0.8233   -1.2177    0.5295 N   0  0  0

+   -1.5442   -1.6726    0.2442 C   0  0  0

+    1.6902    1.0046    0.0358 C   0  0  0

+    0.2408    2.9837    0.1921 C   0  0  0

+   -3.0364    0.1473   -0.2403 C   0  0  0

+    1.9326   -0.4764   -0.0844 C   0  0  0

+   -2.8185   -1.2016   -0.0174 C   0  0  0

+    3.2389   -0.8366    0.6260 C   0  0  0

+    2.0382   -0.8532   -1.5636 C   0  0  0

+   -2.1659    2.0513    0.0000 H   0  0  0

+    0.9626   -2.2354    0.0000 H   0  0  0

+   -1.3710   -2.6851    0.0000 H   0  0  0

+    2.4911    1.6478    0.0000 H   0  0  0

+    1.2572    3.1326    0.0000 H   0  0  0

+    0.0919    4.0001    0.0000 H   0  0  0

+   -0.7756    2.8348    0.0000 H   0  0  0

+   -4.0000    0.5031    0.0000 H   0  0  0

+   -3.6117   -1.8542    0.0000 H   0  0  0

+    2.9658   -1.8269    0.0000 H   0  0  0

+    4.2292   -1.1097    0.0000 H   0  0  0

+    3.5120    0.1537    0.0000 H   0  0  0

+    1.0491   -1.1304    0.0000 H   0  0  0

+    2.3154   -1.8423    0.0000 H   0  0  0

+    3.0273   -0.5760    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+ 10 12  1  0

+ 10 13  1  0

+  7 10  1  0

+  9 11  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

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+  8 20  1  0

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+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120812-52-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 44                          1 V2000

+    0.7027   -1.4164   -0.0003 C   0  0  0

+   -0.7025   -1.4164   -0.0033 C   0  0  0

+    1.3957   -0.1891    0.0035 C   0  0  0

+    1.4033   -2.6434    0.0050 C   0  0  0

+   -1.3953   -0.1893   -0.0051 C   0  0  0

+   -1.4035   -2.6435   -0.0051 C   0  0  0

+    0.6738    1.0399    0.0047 C   0  0  0

+    2.7933   -0.2053    0.0063 C   0  0  0

+    2.8003   -2.6180    0.0079 C   0  0  0

+    0.6762   -3.8586    0.0076 C   0  0  0

+   -0.6737    1.0397   -0.0061 C   0  0  0

+   -2.7934   -0.2053   -0.0067 C   0  0  0

+   -2.8002   -2.6180   -0.0071 C   0  0  0

+   -0.6764   -3.8587   -0.0054 C   0  0  0

+    1.4883    2.3084    0.0253 C   0  0  0

+    3.4706   -1.4099    0.0058 C   0  0  0

+    3.5483    1.0684    0.0093 N   0  3  0

+   -1.4887    2.3080   -0.0264 C   0  0  0

+   -3.4705   -1.4095   -0.0082 C   0  0  0

+   -3.5482    1.0684   -0.0074 N   0  3  0

+    0.6464    3.5038   -0.4126 C   0  0  0

+    3.8552    1.5970   -1.0442 O   0  0  0

+    3.8626    1.5876    1.0654 O   0  5  0

+   -0.6470    3.5038    0.4106 C   0  0  0

+   -3.8531    1.5963    1.0471 O   0  0  0

+   -3.8643    1.5884   -1.0625 O   0  5  0

+    3.3419   -3.5190    0.0000 H   0  0  0

+    1.1948   -4.7731    0.0000 H   0  0  0

+   -3.3419   -3.5190    0.0000 H   0  0  0

+   -1.1949   -4.7732    0.0000 H   0  0  0

+    2.2926    1.6315    0.0000 H   0  0  0

+    2.2629    3.0191    0.0000 H   0  0  0

+    4.5219   -1.4069    0.0000 H   0  0  0

+   -2.2635    3.0185    0.0000 H   0  0  0

+   -2.2928    1.6308    0.0000 H   0  0  0

+   -4.5218   -1.4064    0.0000 H   0  0  0

+    1.6109    3.9219    0.0000 H   0  0  0

+    0.4329    4.5332    0.0000 H   0  0  0

+   -0.4336    4.5332    0.0000 H   0  0  0

+   -1.6116    3.9218    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  6 14  1  0

+  7 15  1  0

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+  8 17  1  0

+ 11 18  1  0

+ 12 19  2  0

+ 12 20  1  0

+ 15 21  1  0

+ 17 22  2  0

+ 17 23  1  0

+ 18 24  1  0

+ 20 25  2  0

+ 20 26  1  0

+  7 11  2  0

+  9 16  2  0

+ 10 14  2  0

+ 13 19  1  0

+ 21 24  1  0

+  9 27  1  0

+ 10 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2540-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    2.2877   -0.0413    0.0853 P   0  0  0

+    0.5440    0.9175   -0.6458 S   0  0  0

+    3.5774    0.5204   -0.6978 O   0  0  0

+    2.4439    0.2567    1.6598 O   0  0  0

+    2.1469   -1.8793   -0.1880 S   0  0  0

+   -0.7280   -0.1896    0.0226 C   0  0  0

+    4.6745   -0.3255   -0.3470 C   0  0  0

+    2.3342    1.6719    1.8251 C   0  0  0

+   -2.0912    0.3093   -0.3822 C   0  0  0

+   -3.1956   -0.3598    0.0038 N   0  0  0

+   -2.1944    1.3128   -1.0553 O   0  0  0

+   -4.5209    0.1251   -0.3897 C   0  0  0

+   -5.5776   -0.7946    0.1656 C   0  0  0

+   -6.4134   -0.3656    0.9243 O   0  0  0

+   -1.2511   -1.1058    0.0000 H   0  0  0

+    0.0879   -0.8585    0.0000 H   0  0  0

+    4.0303   -1.1610    0.0000 H   0  0  0

+    5.5100   -0.9697    0.0000 H   0  0  0

+    5.3187    0.5100    0.0000 H   0  0  0

+    3.3861    1.7534    0.0000 H   0  0  0

+    2.2527    2.7238    0.0000 H   0  0  0

+    1.2823    1.5904    0.0000 H   0  0  0

+   -3.0934   -1.4099    0.0000 H   0  0  0

+   -3.9979    1.0414    0.0000 H   0  0  0

+   -5.3368    0.7939    0.0000 H   0  0  0

+   -5.4503   -1.8419    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  9 10  1  0

+  9 11  2  0

+ 10 12  1  0

+ 12 13  1  0

+ 13 14  2  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81-64-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.9284    0.7055    0.0481 C   0  0  0

+   -0.9286   -0.7055    0.0473 C   0  0  0

+    0.3445    1.4356    0.1917 C   0  0  0

+   -2.1323    1.3968   -0.0928 C   0  0  0

+    0.3442   -1.4360    0.1900 C   0  0  0

+   -2.1331   -1.3963   -0.0897 C   0  0  0

+    1.6193    0.7033    0.0266 C   0  0  0

+    0.3464    2.6253    0.4425 O   0  0  0

+   -3.3260    0.6885   -0.2334 C   0  0  0

+   -2.1420    2.7528   -0.0926 O   0  0  0

+    1.6192   -0.7036    0.0263 C   0  0  0

+    0.3460   -2.6260    0.4389 O   0  0  0

+   -3.3271   -0.6876   -0.2251 C   0  0  0

+   -2.1431   -2.7523   -0.0907 O   0  0  0

+    2.8173    1.3932   -0.1277 C   0  0  0

+    2.8171   -1.3934   -0.1290 C   0  0  0

+    4.0002    0.6915   -0.2808 C   0  0  0

+    4.0000   -0.6917   -0.2817 C   0  0  0

+   -4.2289    1.2031    0.0000 H   0  0  0

+   -2.1494    3.7920    0.0000 H   0  0  0

+   -4.2304   -1.2014    0.0000 H   0  0  0

+   -2.1508   -3.7915    0.0000 H   0  0  0

+    2.8240    2.4324    0.0000 H   0  0  0

+    2.8238   -2.4326    0.0000 H   0  0  0

+    4.9033    1.2057    0.0000 H   0  0  0

+    4.9030   -1.2060    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 11 16  1  0

+ 15 17  2  0

+ 16 18  2  0

+  7 11  2  0

+  9 13  2  0

+ 17 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94-11-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -0.7311    0.1427    0.0243 C   0  0  0

+   -1.8114    1.0151    0.0226 C   0  0  0

+    0.5375    0.6304    0.0529 O   0  0  0

+   -0.9482   -1.2265    0.0026 C   0  0  0

+   -3.1002    0.5168   -0.0060 C   0  0  0

+   -1.5434    2.7299    0.0569 Cl  0  0  0

+    1.4141   -0.4982    0.0469 C   0  0  0

+   -2.2386   -1.7206   -0.0207 C   0  0  0

+   -3.3138   -0.8502   -0.0330 C   0  0  0

+    2.8441   -0.0237    0.0778 C   0  0  0

+   -4.9335   -1.4739   -0.0683 Cl  0  0  0

+    3.8473   -0.9156    0.0779 O   0  0  0

+    3.0876    1.1595    0.1024 O   0  0  0

+    5.2251   -0.4584    0.1077 C   0  0  0

+    6.0913   -1.4961    0.8246 C   0  0  0

+    5.7318   -0.2726   -1.3239 C   0  0  0

+   -0.1422   -1.8799    0.0000 H   0  0  0

+   -3.9080    1.1680    0.0000 H   0  0  0

+    0.5279   -1.0379    0.0000 H   0  0  0

+    1.8501   -1.4397    0.0000 H   0  0  0

+   -2.4013   -2.7454    0.0000 H   0  0  0

+    4.8831    0.5212    0.0000 H   0  0  0

+    5.2947   -2.1610    0.0000 H   0  0  0

+    6.7562   -2.2927    0.0000 H   0  0  0

+    6.8879   -0.8312    0.0000 H   0  0  0

+    6.0890   -1.2468    0.0000 H   0  0  0

+    6.7060    0.0846    0.0000 H   0  0  0

+    5.3746    0.7016    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 10 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+  8  9  2  0

+  4 17  1  0

+  5 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-46-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    1.0282   -0.5992   -0.1104 C   0  0  0

+   -0.1160    0.3126    0.3374 C   0  0  0

+    2.3630    0.0015    0.3350 C   0  0  0

+   -1.3828   -0.2574   -0.0853 O   0  0  0

+    3.5072   -0.9103   -0.1128 C   0  0  0

+    2.5360    1.3844   -0.2964 C   0  0  0

+   -2.4254    0.3166    0.1734 N   0  0  0

+   -3.4881   -0.1616   -0.1812 O   0  0  0

+    0.2560   -1.3037    0.0000 H   0  0  0

+    1.6021   -1.4728    0.0000 H   0  0  0

+    0.6562    1.0171    0.0000 H   0  0  0

+   -0.6899    1.1862    0.0000 H   0  0  0

+    3.3311    0.3958    0.0000 H   0  0  0

+    2.8558   -1.7277    0.0000 H   0  0  0

+    4.3246   -1.5617    0.0000 H   0  0  0

+    4.1586   -0.0929    0.0000 H   0  0  0

+    3.5732    1.2546    0.0000 H   0  0  0

+    2.6658    2.4216    0.0000 H   0  0  0

+    1.4988    1.5142    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

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+  3 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  6 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93957-55-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 58                          1 V2000

+   -2.9037   -0.0964    0.1675 C   0  0  0

+   -3.6757   -1.2231    0.7098 C   0  0  0

+   -1.7461   -0.6333   -0.3623 C   0  0  0

+   -3.2925    1.3311    0.1805 C   0  0  0

+   -2.9149   -2.3797    0.4640 C   0  0  0

+   -4.9074   -1.3228    1.3593 C   0  0  0

+   -1.7587   -1.9972   -0.1821 N   0  0  0

+   -0.6738    0.1298   -1.0143 C   0  0  0

+   -3.0396    2.1154    1.3066 C   0  0  0

+   -3.9083    1.8995   -0.9358 C   0  0  0

+   -3.4052   -3.6159    0.8754 C   0  0  0

+   -5.3697   -2.5466    1.7544 C   0  0  0

+   -0.6977   -2.9104   -0.6140 C   0  0  0

+    0.0685    0.9757   -0.3030 C   0  0  0

+   -3.4042    3.4459    1.3134 C   0  0  0

+   -4.2687    3.2306   -0.9184 C   0  0  0

+   -4.6231   -3.6920    1.5150 C   0  0  0

+   -0.1518   -3.6676    0.5982 C   0  0  0

+   -1.2644   -3.9084   -1.6259 C   0  0  0

+    1.1686    1.7587   -0.9720 C   0  0  2

+   -4.0204    4.0036    0.2049 C   0  0  0

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+    0.9122    3.1573   -0.8298 O   0  0  0

+   -4.3758    5.3070    0.2169 F   0  0  0

+    2.9815    0.0472   -0.8088 C   0  0  2

+    4.2055   -0.3896   -0.0012 C   0  0  0

+    3.3291    0.1316   -2.1923 O   0  0  0

+    4.6713   -1.7385   -0.4853 C   0  0  0

+    5.6436   -2.2716    0.0316 O   0  0  0

+    4.0772   -2.3006   -1.3953 O   0  0  0

+   15.1689    1.7834    1.8919 Na  0  3  0

+   -5.4992   -0.5365    0.0000 H   0  0  0

+   -0.0142   -0.6006    0.0000 H   0  0  0

+   -2.0557    2.0935    0.0000 H   0  0  0

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+   -5.2526    3.2534    0.0000 H   0  0  0

+   -5.0647   -4.5715    0.0000 H   0  0  0

+   -0.9501   -4.2431    0.0000 H   0  0  0

+    0.4237   -4.4659    0.0000 H   0  0  0

+    0.6465   -3.0921    0.0000 H   0  0  0

+   -2.1202   -3.4225    0.0000 H   0  0  0

+   -1.7503   -4.7642    0.0000 H   0  0  0

+   -0.4086   -4.3943    0.0000 H   0  0  0

+    1.3490    0.7913    0.0000 H   0  0  0

+    3.4833    1.5525    0.0000 H   0  0  0

+    2.5634    2.3994    0.0000 H   0  0  0

+    0.7347    4.1253    0.0000 H   0  0  0

+    2.2820   -0.6451    0.0000 H   0  0  0

+    5.1839   -0.2841    0.0000 H   0  0  0

+    4.3210    0.5877    0.0000 H   0  0  0

+    4.2854    0.3638    0.0000 H   0  0  0

+    3.3623   -2.9770    0.0000 H   0  0  0

+  1  2  1  0

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+ 21 24  1  0

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+ 26 28  1  0

+ 28 29  2  0

+ 28 30  1  0

+  5  7  1  0

+ 12 17  1  0

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+ 25 53  1  0

+ 26 54  1  0

+ 26 55  1  0

+ 27 56  1  0

+ 30 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+637-92-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.4286   -0.6388    0.0000 O   0  0  0

+   -0.8526   -0.0058    0.0000 C   0  0  0

+    1.4048    0.4048    0.0000 C   0  0  0

+   -0.9904    0.8667   -1.2493 C   0  0  0

+   -1.9488   -1.0732    0.0000 C   0  0  0

+   -0.9904    0.8667    1.2492 C   0  0  0

+    2.8066   -0.2082    0.0000 C   0  0  0

+    1.9425    1.3320    0.0000 H   0  0  0

+    0.5444    1.0438    0.0000 H   0  0  0

+    0.0682    1.0339    0.0000 H   0  0  0

+   -1.1576    1.9253    0.0000 H   0  0  0

+   -2.0490    0.6995    0.0000 H   0  0  0

+   -2.6965   -0.3053    0.0000 H   0  0  0

+   -2.7167   -1.8209    0.0000 H   0  0  0

+   -1.2011   -1.8411    0.0000 H   0  0  0

+    0.0682    1.0339    0.0000 H   0  0  0

+   -1.1576    1.9253    0.0000 H   0  0  0

+   -2.0490    0.6995    0.0000 H   0  0  0

+    2.3772   -1.1902    0.0000 H   0  0  0

+    3.7886   -0.6376    0.0000 H   0  0  0

+    3.2360    0.7738    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  7 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1120-36-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 41                          1 V2000

+    0.5931   -0.3808   -0.1038 C   0  0  0

+   -0.6499    0.5077   -0.0234 C   0  0  0

+    1.8479    0.4846    0.0287 C   0  0  0

+   -1.9047   -0.3577   -0.1560 C   0  0  0

+    3.0909   -0.4039   -0.0517 C   0  0  0

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+   -7.7644   -0.3244    0.7091 C   0  0  0

+   -0.1744   -1.2280    0.0000 H   0  0  0

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+   -2.3802    1.3780    0.0000 H   0  0  0

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+   -5.1700   -1.1819    0.0000 H   0  0  0

+   -3.6493   -1.1946    0.0000 H   0  0  0

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+    6.3418   -1.2870    0.0000 H   0  0  0

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+    6.0904    1.2985    0.0000 H   0  0  0

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+    9.0166   -1.1147    0.0000 H   0  0  0

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+   -8.3648    0.6485    0.0000 H   0  0  0

+   -8.3067   -1.3308    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

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+  1 15  1  0

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+ 13 38  1  0

+ 13 39  1  0

+ 13 40  1  0

+ 14 41  1  0

+ 14 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+476-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.8647    0.7327   -0.0025 C   0  0  0

+   -0.8647   -0.7327   -0.0016 C   0  0  0

+    0.3431    1.4364   -0.0023 C   0  0  0

+   -2.1046    1.4127    0.0023 C   0  0  0

+    0.3431   -1.4363    0.0000 C   0  0  0

+   -2.1045   -1.4127   -0.0019 C   0  0  0

+    1.5519    0.7332   -0.0012 C   0  0  0

+    0.3426    2.7950   -0.0036 O   0  0  0

+   -3.2645    0.6967    0.0076 C   0  0  0

+   -2.1395    2.7715    0.0021 O   0  0  0

+    1.5519   -0.7330    0.0007 C   0  0  0

+    0.3427   -2.7949    0.0012 O   0  0  0

+   -3.2645   -0.6969   -0.0030 C   0  0  0

+   -2.1393   -2.7715   -0.0016 O   0  0  0

+    2.7886    1.4111   -0.0005 C   0  0  0

+    2.7885   -1.4111    0.0018 C   0  0  0

+    3.9439    0.6976    0.0010 C   0  0  0

+    3.9439   -0.6976    0.0021 C   0  0  0

+    0.3422    3.8424    0.0000 H   0  0  0

+   -4.1792    1.2070    0.0000 H   0  0  0

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+    4.8586    1.2078    0.0000 H   0  0  0

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+  1  2  1  0

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+  5 11  2  0

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+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 11 16  1  0

+ 15 17  2  0

+ 16 18  2  0

+  7 11  1  0

+  9 13  2  0

+ 17 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+491-92-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 53                          1 V2000

+    1.2287    0.2930   -0.1859 C   0  0  0

+    2.5033    0.6995    0.2695 C   0  0  0

+    0.9921   -1.0359   -0.4537 C   0  0  0

+    0.2139    1.2332   -0.3574 N   0  0  0

+    3.5184   -0.2731    0.4425 C   0  0  0

+    2.7592    1.9826    0.5370 N   0  0  0

+    1.9976   -1.9901   -0.2809 C   0  0  0

+   -0.4765    1.3390   -1.6452 C   0  0  0

+    3.2477   -1.6218    0.1618 C   0  0  0

+    4.7863    0.1378    0.8964 C   0  0  0

+    3.9382    2.3694    0.9602 C   0  0  0

+    1.7385   -3.2962   -0.5523 O   0  0  0

+   -1.9462    1.6923   -1.4084 C   0  0  0

+    0.1815    2.4332   -2.4882 C   0  0  0

+    4.9808    1.4657    1.1509 C   0  0  0

+    2.9412   -4.0201   -0.2847 C   0  0  0

+   -2.6043    0.5982   -0.5653 C   0  0  0

+   -4.0740    0.9514   -0.3284 C   0  0  0

+   -4.7057   -0.0991    0.4810 N   0  0  0

+   -5.3488    0.5734    1.6178 C   0  0  0

+   -5.7841   -0.6707   -0.3364 C   0  0  0

+   -4.8084   -0.0074    2.9261 C   0  0  0

+   -5.5686   -2.1783   -0.4830 C   0  0  0

+    0.0407   -1.3487    0.0000 H   0  0  0

+    0.6492    2.1351    0.0000 H   0  0  0

+   -0.6696    0.3563    0.0000 H   0  0  0

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+   -1.6143    2.6372    0.0000 H   0  0  0

+   -2.8525    2.1186    0.0000 H   0  0  0

+    1.0398    1.9171    0.0000 H   0  0  0

+    0.6976    3.2915    0.0000 H   0  0  0

+   -0.6768    2.9493    0.0000 H   0  0  0

+    5.9196    1.8144    0.0000 H   0  0  0

+    2.4247   -4.8782    0.0000 H   0  0  0

+    3.7993   -4.5366    0.0000 H   0  0  0

+    3.4577   -3.1620    0.0000 H   0  0  0

+   -2.9362   -0.3467    0.0000 H   0  0  0

+   -1.6980    0.1720    0.0000 H   0  0  0

+   -3.7422    1.8963    0.0000 H   0  0  0

+   -4.9803    1.3776    0.0000 H   0  0  0

+   -5.0637    1.5335    0.0000 H   0  0  0

+   -6.3239    0.3447    0.0000 H   0  0  0

+   -6.1484    0.2622    0.0000 H   0  0  0

+   -6.7527   -0.9254    0.0000 H   0  0  0

+   -5.5416   -0.6896    0.0000 H   0  0  0

+   -4.1262   -0.7406    0.0000 H   0  0  0

+   -4.0752    0.6748    0.0000 H   0  0  0

+   -6.5600   -2.3200    0.0000 H   0  0  0

+   -5.4269   -3.1697    0.0000 H   0  0  0

+   -4.5772   -2.0366    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  5  9  1  0

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+ 21 23  1  0

+  7  9  2  0

+ 11 15  2  0

+  3 24  1  0

+  4 25  1  0

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+  9 27  1  0

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+ 22 47  1  0

+ 22 48  1  0

+ 22 49  1  0

+ 23 50  1  0

+ 23 51  1  0

+ 23 52  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+124-18-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    0.6341   -0.4280    0.0000 C   0  0  0

+   -0.6341    0.4280    0.0000 C   0  0  0

+    1.8638    0.4823    0.0000 C   0  0  0

+   -1.8638   -0.4823    0.0000 C   0  0  0

+    3.1319   -0.3737    0.0000 C   0  0  0

+   -3.1319    0.3737    0.0000 C   0  0  0

+    4.3617    0.5366    0.0000 C   0  0  0

+   -4.3617   -0.5366    0.0000 C   0  0  0

+    5.6298   -0.3194    0.0000 C   0  0  0

+   -5.6298    0.3194    0.0000 C   0  0  0

+   -0.1113   -1.3004    0.0000 H   0  0  0

+    1.4167   -1.2672    0.0000 H   0  0  0

+    0.1113    1.3004    0.0000 H   0  0  0

+   -1.4167    1.2672    0.0000 H   0  0  0

+    2.6092    1.3547    0.0000 H   0  0  0

+    1.0812    1.3215    0.0000 H   0  0  0

+   -2.6092   -1.3547    0.0000 H   0  0  0

+   -1.0812   -1.3215    0.0000 H   0  0  0

+    2.3865   -1.2461    0.0000 H   0  0  0

+    3.9145   -1.2129    0.0000 H   0  0  0

+   -2.3865    1.2461    0.0000 H   0  0  0

+   -3.9145    1.2129    0.0000 H   0  0  0

+    5.1071    1.4090    0.0000 H   0  0  0

+    3.5791    1.3758    0.0000 H   0  0  0

+   -5.1071   -1.4090    0.0000 H   0  0  0

+   -3.5791   -1.3758    0.0000 H   0  0  0

+    4.9878   -1.2705    0.0000 H   0  0  0

+    6.5809   -0.9614    0.0000 H   0  0  0

+    6.2718    0.6317    0.0000 H   0  0  0

+   -4.9878    1.2705    0.0000 H   0  0  0

+   -6.5809    0.9614    0.0000 H   0  0  0

+   -6.2718   -0.6317    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+  1 11  1  0

+  1 12  1  0

+  2 13  1  0

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+  3 15  1  0

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+  4 17  1  0

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+  5 19  1  0

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+  7 23  1  0

+  7 24  1  0

+  8 25  1  0

+  8 26  1  0

+  9 27  1  0

+  9 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 10 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1825-21-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.0019   -1.4850    0.1394 C   0  0  0

+   -1.2024   -0.7894    0.1020 C   0  0  0

+    1.2002   -0.7933    0.1015 C   0  0  0

+   -0.0040   -2.8424    0.2186 O   0  0  0

+   -1.1985    0.5920    0.0271 C   0  0  0

+   -2.7080   -1.6524    0.1486 Cl  0  0  0

+    1.2004    0.5886    0.0266 C   0  0  0

+    2.7032   -1.6607    0.1487 Cl  0  0  0

+   -0.0083   -3.3344   -1.1230 C   0  0  0

+    0.0022    1.2807   -0.0106 C   0  0  0

+   -2.6997    1.4625   -0.0203 Cl  0  0  0

+    2.7043    1.4545   -0.0208 Cl  0  0  0

+    0.0048    3.0141   -0.1052 Cl  0  0  0

+   -1.0484   -3.3253    0.0000 H   0  0  0

+   -0.0174   -4.3745    0.0000 H   0  0  0

+    1.0318   -3.3435    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  7 12  1  0

+ 10 13  1  0

+  7 10  2  0

+  9 14  1  0

+  9 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33100-27-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 35                          1 V2000

+    3.0739   -0.2669   -0.4263 C   0  0  0

+    1.8483   -0.9344    0.2007 C   0  0  0

+    3.1100    1.1115   -0.0513 O   0  0  0

+    1.7779   -2.2966   -0.2254 O   0  0  0

+    1.8446    1.4118    0.5408 C   0  0  0

+    0.7045   -2.9010    0.4988 C   0  0  0

+    1.0967    2.4176   -0.3367 C   0  0  0

+   -0.5527   -2.9187   -0.3731 C   0  0  0

+   -0.0304    2.9278    0.3783 O   0  0  0

+   -1.6586   -2.4100    0.3754 O   0  0  0

+   -1.1787    2.6939   -0.4395 C   0  0  0

+   -2.3303   -1.4710   -0.4667 C   0  0  0

+   -2.2365    1.9410    0.3700 C   0  0  0

+   -2.8042   -0.2821    0.3716 C   0  0  0

+   -2.7978    0.8998   -0.4317 O   0  0  0

+    3.3729   -1.1581    0.0000 H   0  0  0

+    4.0036   -0.1276    0.0000 H   0  0  0

+    1.5568   -0.0407    0.0000 H   0  0  0

+    0.9164   -1.0580    0.0000 H   0  0  0

+    0.9611    1.0907    0.0000 H   0  0  0

+    1.8989    0.4733    0.0000 H   0  0  0

+    0.3881   -3.7862    0.0000 H   0  0  0

+    1.4231   -3.5070    0.0000 H   0  0  0

+    1.9989    2.6815    0.0000 H   0  0  0

+    1.1627    3.3553    0.0000 H   0  0  0

+   -1.2312   -3.5694    0.0000 H   0  0  0

+   -0.1959   -3.7884    0.0000 H   0  0  0

+   -1.0072    3.6182    0.0000 H   0  0  0

+   -1.9712    3.1995    0.0000 H   0  0  0

+   -3.2684   -1.4111    0.0000 H   0  0  0

+   -2.7866   -2.2929    0.0000 H   0  0  0

+   -2.4669    2.8524    0.0000 H   0  0  0

+   -3.1694    2.0567    0.0000 H   0  0  0

+   -3.6698    0.0846    0.0000 H   0  0  0

+   -3.4760   -0.9396    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

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+  5  7  1  0

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+ 11 28  1  0

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+ 12 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 14 34  1  0

+ 14 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+140-56-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    1.8343   -1.7078    0.2783 S   0  0  0

+    0.4364   -0.8260    0.3802 N   0  0  0

+    2.7402   -1.1021    1.1904 O   0  0  0

+    1.4335   -3.0709    0.3003 O   0  0  0

+    2.4215   -1.4717   -1.1059 O   0  0  0

+   -0.5424   -1.1329   -0.3165 N   0  0  0

+   -1.6969   -0.4047   -0.2325 C   0  0  0

+   -2.8014   -0.7495   -1.0173 C   0  0  0

+   -1.7772    0.6823    0.6425 C   0  0  0

+   -3.9620   -0.0147   -0.9299 C   0  0  0

+   -2.9411    1.4130    0.7251 C   0  0  0

+   -4.0369    1.0705   -0.0614 C   0  0  0

+   -5.2122    1.8115    0.0246 N   0  0  0

+   -5.2928    2.9539    0.9381 C   0  0  0

+   -6.3686    1.4488   -0.7986 C   0  0  0

+   11.1783    3.0568   -0.3263 Na  0  3  0

+   -2.9147   -1.6099    0.0000 H   0  0  0

+   -1.0338    1.1299    0.0000 H   0  0  0

+   -4.7074   -0.4591    0.0000 H   0  0  0

+   -2.8296    2.2736    0.0000 H   0  0  0

+   -4.4272    3.0150    0.0000 H   0  0  0

+   -5.3539    3.8195    0.0000 H   0  0  0

+   -6.1584    2.8928    0.0000 H   0  0  0

+   -6.6283    2.2768    0.0000 H   0  0  0

+   -7.1966    1.1891    0.0000 H   0  0  0

+   -6.1089    0.6208    0.0000 H   0  0  0

+    3.2267   -1.1480    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  2  0

+  1  5  1  0

+  2  6  2  0

+  6  7  1  0

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+  7  9  2  0

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+ 10 12  1  0

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+ 11 12  2  0

+  8 17  1  0

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+ 11 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+  5 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5408-55-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.9147    0.0602   -0.0032 C   0  0  0

+   -0.5160   -0.3004   -0.0025 C   0  0  0

+    0.9527    1.4618   -0.0008 C   0  0  0

+    2.0963   -0.6727   -0.0006 C   0  0  0

+   -1.2137    0.9153    0.0003 C   0  0  0

+   -1.2091   -1.5062   -0.0044 C   0  0  0

+   -0.3164    1.9255    0.0012 O   0  0  0

+    2.1838    2.1061   -0.0004 C   0  0  0

+    3.3091   -0.0155   -0.0017 C   0  0  0

+   -2.6036    0.8989    0.0015 C   0  0  0

+   -2.5881   -1.5026   -0.0035 C   0  0  0

+    3.3499    1.3694   -0.0024 C   0  0  0

+    4.5696   -0.7915    0.0015 N   0  3  0

+   -3.2808   -0.3022    0.0000 C   0  0  0

+    5.6412   -0.2125    0.0005 O   0  0  0

+    4.5353   -2.0090    0.0052 O   0  5  0

+   -4.7610   -0.3096    0.0014 N   0  3  0

+   -5.3647   -1.3675    0.0001 O   0  0  0

+   -5.3752    0.7421    0.0038 O   0  5  0

+    2.0659   -1.7114    0.0000 H   0  0  0

+   -0.6899   -2.4063    0.0000 H   0  0  0

+    2.2260    3.1444    0.0000 H   0  0  0

+   -3.1330    1.7930    0.0000 H   0  0  0

+   -3.1089   -2.4018    0.0000 H   0  0  0

+    4.2673    1.8575    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  5  7  1  0

+  9 12  2  0

+ 11 14  1  0

+  4 20  1  0

+  6 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85068-73-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -1.5048    0.4705   -0.1037 N   0  0  0

+   -0.6138    1.2293   -0.9851 C   0  0  0

+   -1.4325   -0.9282   -0.0705 N   0  3  0

+   -2.4671    1.1747    0.7473 C   0  0  0

+    0.7961    1.2482   -0.3912 C   0  0  0

+   -2.1732   -1.5591    0.6622 O   0  0  0

+   -0.6290   -1.5135   -0.7743 O   0  5  0

+   -3.8805    0.9653    0.2002 C   0  0  0

+    1.3288   -0.0778   -0.3864 O   0  0  0

+    2.6276    0.0049    0.1715 N   0  3  0

+    3.3048   -1.0006    0.2896 O   0  0  0

+    3.0676    1.0815    0.5332 O   0  5  0

+   -0.3630    2.1032    0.0000 H   0  0  0

+   -1.3781    1.7218    0.0000 H   0  0  0

+   -1.7573    1.7429    0.0000 H   0  0  0

+   -2.8304    2.0082    0.0000 H   0  0  0

+    1.6750    1.4812    0.0000 H   0  0  0

+    0.6726    2.1490    0.0000 H   0  0  0

+   -4.0137    1.8647    0.0000 H   0  0  0

+   -4.7799    0.8321    0.0000 H   0  0  0

+   -3.7473    0.0659    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

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+  2 13  1  0

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+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+643-22-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+174175                          1 V2000

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1640-39-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+475-80-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

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+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 23 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+334-48-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    0.5476   -0.6280    0.0000 C   0  0  0

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+   -5.6432    0.5840    0.0000 C   0  0  0

+   -6.9373   -0.2322    0.0000 C   0  0  0

+   -0.2607   -1.4425    0.0000 H   0  0  0

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+   -7.9079   -0.8443    0.0000 H   0  0  0

+   -6.3252   -1.2028    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 30  1  0

+ 12 31  1  0

+ 12 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-38-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.7054   -0.6138   -0.0774 C   0  0  0

+   -0.5346    0.0521    0.4613 C   0  0  0

+    1.8609    0.3891   -0.0840 C   0  0  0

+   -1.5250    0.1296   -0.2252 O   0  0  0

+    0.0973   -1.4767    0.0000 H   0  0  0

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+   -0.2373    1.0650    0.0000 H   0  0  0

+    2.5528   -0.4081    0.0000 H   0  0  0

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+  1  2  1  0

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+  1  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+125579-40-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 88 89                          1 V2000

+   -4.5046    0.0931   -0.9911 C   0  0  0

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+   -2.2089    2.1350   -3.3308 C   0  0  0

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+ 42 87  1  0

+ 42 88  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19780-11-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 45                          1 V2000

+    3.6653    0.0388    0.5101 C   0  0  0

+    3.8663   -1.1727   -0.4232 C   0  0  0

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+    5.9048   -0.5861    0.5290 O   0  0  0

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+  1  2  1  0

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+ 19 43  1  0

+ 19 44  1  0

+ 19 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1629-58-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.0160    0.0479   -0.0009 C   0  0  0

+   -1.2446    0.8737    0.0011 C   0  0  0

+    1.3218    0.7066    0.0008 C   0  0  0

+   -0.0524   -1.1635    0.0010 O   0  0  0

+   -2.4617   -0.0535   -0.0013 C   0  0  0

+    2.4382   -0.0247   -0.0011 C   0  0  0

+   -0.5437    1.7174    0.0000 H   0  0  0

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+  1  2  1  0

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+  5 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2206-89-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    1.7984   -0.0541   -0.0011 C   0  0  0

+    0.6131    0.5879    0.0006 O   0  0  0

+    3.0505    0.7149    0.0004 C   0  0  0

+    1.8314   -1.2690    0.0013 O   0  0  0

+   -0.6242   -0.1720   -0.0009 C   0  0  0

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+   -1.8137    0.7903    0.0014 C   0  0  0

+   -3.3500   -0.1533   -0.0004 Cl  0  0  0

+    3.0209    1.8035    0.0000 H   0  0  0

+   -1.4004   -0.9358    0.0000 H   0  0  0

+    0.0470   -1.0296    0.0000 H   0  0  0

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+  1  2  1  0

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+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+127072-60-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+   -0.8440   -0.1839   -0.4263 C   0  0  0

+   -2.0901   -0.0587    0.2380 C   0  0  0

+    0.3139    0.0013    0.2607 C   0  0  0

+   -3.2288   -0.2409   -0.4377 C   0  0  0

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+   -5.3730    1.0037   -0.3901 C   0  0  0

+   -5.2671   -1.3426    0.1790 O   0  0  0

+    3.9446   -0.0605   -0.3648 C   0  0  0

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+    5.1178    0.1272    0.3312 C   0  0  0

+    6.3484    0.0035   -0.3248 C   0  0  0

+    7.3843    0.1693    0.2898 O   0  0  0

+   -0.8169   -1.1122    0.0000 H   0  0  0

+   -2.1173    0.8696    0.0000 H   0  0  0

+    0.2867    0.9296    0.0000 H   0  0  0

+   -3.2016   -1.1692    0.0000 H   0  0  0

+    1.5768   -1.0511    0.0000 H   0  0  0

+   -4.0938    0.6992    0.0000 H   0  0  0

+    2.6853    0.9916    0.0000 H   0  0  0

+   -4.5141    1.3569    0.0000 H   0  0  0

+   -5.5072    1.9227    0.0000 H   0  0  0

+   -5.7318   -2.1467    0.0000 H   0  0  0

+    3.9718   -0.9888    0.0000 H   0  0  0

+   -6.6250    2.0630    0.0000 H   0  0  0

+   -7.6420    1.2318    0.0000 H   0  0  0

+   -6.8108    0.2148    0.0000 H   0  0  0

+    5.0907    1.0555    0.0000 H   0  0  0

+    6.3756   -0.9248    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  3  5  1  0

+  4  6  1  0

+  5  7  2  0

+  6  8  1  0

+  6  9  1  0

+  7 10  1  0

+  8 11  1  0

+ 10 12  2  0

+ 12 13  1  0

+ 13 14  2  0

+  1 15  1  0

+  2 16  1  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+128-95-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.9629    0.7062    0.0461 C   0  0  0

+   -0.9630   -0.7062    0.0450 C   0  0  0

+    0.3077    1.4356    0.1901 C   0  0  0

+   -2.1699    1.3959   -0.0956 C   0  0  0

+    0.3075   -1.4361    0.1876 C   0  0  0

+   -2.1708   -1.3954   -0.0921 C   0  0  0

+    1.5825    0.7033    0.0265 C   0  0  0

+    0.3093    2.6258    0.4401 O   0  0  0

+   -3.3646    0.6824   -0.2370 C   0  0  0

+   -2.1832    2.7823   -0.0965 N   0  0  0

+    1.5824   -0.7036    0.0253 C   0  0  0

+    0.3089   -2.6266    0.4361 O   0  0  0

+   -3.3660   -0.6814   -0.2272 C   0  0  0

+   -2.1846   -2.7818   -0.0937 N   0  0  0

+    2.7808    1.3933   -0.1269 C   0  0  0

+    2.7808   -1.3934   -0.1285 C   0  0  0

+    3.9635    0.6917   -0.2793 C   0  0  0

+    3.9635   -0.6918   -0.2795 C   0  0  0

+   -4.2699    1.1968    0.0000 H   0  0  0

+   -1.2865    3.3115    0.0000 H   0  0  0

+   -3.0899    3.2942    0.0000 H   0  0  0

+   -4.2719   -1.1948    0.0000 H   0  0  0

+   -3.0915   -3.2934    0.0000 H   0  0  0

+   -1.2881   -3.3114    0.0000 H   0  0  0

+    2.7876    2.4345    0.0000 H   0  0  0

+    2.7876   -2.4346    0.0000 H   0  0  0

+    4.8683    1.2070    0.0000 H   0  0  0

+    4.8683   -1.2071    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 11 16  1  0

+ 15 17  2  0

+ 16 18  2  0

+  7 11  2  0

+  9 13  2  0

+ 17 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83-79-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 55                          1 V2000

+   -1.8511    0.0565    0.3529 C   0  0  0

+   -3.2254    0.0870    0.1968 C   0  0  0

+   -1.1577    1.2352    0.0068 C   0  0  0

+   -1.2503   -1.0586    0.8188 O   0  0  0

+   -3.9007    1.2173   -0.2773 C   0  0  0

+   -4.2613   -0.9680    0.4747 C   0  0  0

+    0.3154    1.2645    0.1358 C   0  0  0

+   -1.8338    2.3660   -0.4573 C   0  0  0

+    0.0635   -1.1433    0.3034 C   0  0  0

+   -5.2281    0.9976   -0.3542 O   0  0  0

+   -3.1952    2.3829   -0.6075 C   0  0  0

+   -5.5718   -0.1406    0.4596 C   0  0  0

+    0.8963    0.0427    0.8254 C   0  0  0

+    0.9976    2.1810   -0.2726 O   0  0  0

+    0.7949   -2.4161    0.7167 C   0  0  0

+   -6.6587   -0.9337   -0.2192 C   0  0  0

+    2.3257   -0.1852    0.4150 C   0  0  0

+    1.9783   -2.5391   -0.0591 O   0  0  0

+   -6.4889   -1.3729   -1.6508 C   0  0  0

+   -7.7511   -1.2412    0.4351 C   0  0  0

+    2.7647   -1.4385    0.0248 C   0  0  0

+    3.1997    0.8901    0.4368 C   0  0  0

+    4.1067   -1.6017   -0.3298 C   0  0  0

+    4.5254    0.7260    0.0793 C   0  0  0

+    4.9795   -0.5326   -0.3042 C   0  0  0

+    5.3785    1.7859    0.1018 O   0  0  0

+    6.2821   -0.7089   -0.6530 O   0  0  0

+    4.6196    2.9179    0.5314 C   0  0  0

+    6.4359   -2.0888   -0.9910 C   0  0  0

+   -4.8624   -1.7852    0.0000 H   0  0  0

+   -3.4888   -1.6256    0.0000 H   0  0  0

+   -1.3278    3.2453    0.0000 H   0  0  0

+   -0.4726   -2.0046    0.0000 H   0  0  0

+   -3.6878    3.2698    0.0000 H   0  0  0

+   -6.3993    0.4463    0.0000 H   0  0  0

+    1.5042    0.8549    0.0000 H   0  0  0

+   -0.1703   -2.7287    0.0000 H   0  0  0

+    0.9010   -3.4250    0.0000 H   0  0  0

+   -7.4352   -1.7387    0.0000 H   0  0  0

+   -6.1231   -2.3192    0.0000 H   0  0  0

+   -5.5426   -1.0071    0.0000 H   0  0  0

+   -8.4774   -0.5329    0.0000 H   0  0  0

+   -8.0013   -2.2244    0.0000 H   0  0  0

+    2.8210    1.8313    0.0000 H   0  0  0

+    4.4854   -2.5429    0.0000 H   0  0  0

+    5.4623    3.4828    0.0000 H   0  0  0

+    4.0547    3.7606    0.0000 H   0  0  0

+    3.7769    2.3530    0.0000 H   0  0  0

+    5.4276   -2.2012    0.0000 H   0  0  0

+    6.5483   -3.0971    0.0000 H   0  0  0

+    7.4442   -1.9764    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

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+  7 14  2  0

+  9 15  1  0

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+ 17 22  1  0

+ 21 23  1  0

+ 22 24  2  0

+ 23 25  2  0

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+ 25 27  1  0

+ 26 28  1  0

+ 27 29  1  0

+  8 11  1  0

+  9 13  1  0

+ 10 12  1  0

+ 18 21  1  0

+ 24 25  1  0

+  6 30  1  0

+  6 31  1  0

+  8 32  1  0

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+ 11 34  1  0

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+ 15 37  1  0

+ 15 38  1  0

+ 19 39  1  0

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+ 20 42  1  0

+ 20 43  1  0

+ 22 44  1  0

+ 23 45  1  0

+ 28 46  1  0

+ 28 47  1  0

+ 28 48  1  0

+ 29 49  1  0

+ 29 50  1  0

+ 29 51  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+111070-55-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.4931    0.1943   -0.0041 C   0  0  0

+   -1.5825   -0.6004   -0.0041 O   0  0  0

+   -0.9170    1.4924    0.0005 C   0  0  0

+    0.9007   -0.2560   -0.0028 C   0  0  0

+   -2.6885    0.1597    0.0003 C   0  0  0

+   -2.3225    1.4587    0.0033 C   0  0  0

+    1.8668    0.6168   -0.0030 N   0  0  0

+   -4.0814   -0.3441    0.0010 N   0  3  0

+    3.1999    0.1861   -0.0017 N   0  0  0

+   -5.0128    0.4407    0.0053 O   0  0  0

+   -4.2953   -1.5432   -0.0027 O   0  5  0

+    4.2991    0.9846   -0.0017 C   0  0  0

+    3.6375   -1.1447    0.0058 N   0  0  0

+    5.3896    0.1810   -0.0004 C   0  0  0

+    4.9477   -1.1459    0.0044 C   0  0  0

+   -0.3295    2.3231    0.0000 H   0  0  0

+    1.1139   -1.2509    0.0000 H   0  0  0

+   -2.9464    2.2624    0.0000 H   0  0  0

+    4.3026    2.0021    0.0000 H   0  0  0

+    6.3594    0.4886    0.0000 H   0  0  0

+    5.5424   -1.9715    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  2  0

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+ 12 14  2  0

+ 13 15  2  0

+  5  6  2  0

+ 14 15  1  0

+  3 16  1  0

+  4 17  1  0

+  6 18  1  0

+ 12 19  1  0

+ 14 20  1  0

+ 15 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42135-22-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.1087   -0.1579   -0.0029 C   0  0  0

+   -1.4772   -0.7376   -0.0017 C   0  0  0

+   -0.2147    1.2431   -0.0012 C   0  0  0

+    1.1468   -0.7485   -0.0002 C   0  0  0

+   -2.4097    0.3127    0.0009 C   0  0  0

+   -1.9264   -2.0509   -0.0026 C   0  0  0

+   -1.6559    1.5888    0.0013 C   0  0  0

+    0.9344    2.0246   -0.0019 C   0  0  0

+    2.2856    0.0425   -0.0017 C   0  0  0

+   -3.7709    0.0306    0.0021 C   0  0  0

+   -3.2862   -2.3187   -0.0010 C   0  0  0

+   -2.1298    2.7068    0.0036 O   0  0  0

+    2.1807    1.4195   -0.0043 C   0  0  0

+    3.6223   -0.5931    0.0012 N   0  3  0

+   -4.2029   -1.2852    0.0007 C   0  0  0

+    4.6253    0.0980   -0.0002 O   0  0  0

+    3.7193   -1.8073    0.0050 O   0  5  0

+    1.2338   -1.7855    0.0000 H   0  0  0

+   -1.2419   -2.8347    0.0000 H   0  0  0

+    0.8589    3.0625    0.0000 H   0  0  0

+   -4.4640    0.8068    0.0000 H   0  0  0

+   -3.6189   -3.3047    0.0000 H   0  0  0

+    3.0411    2.0049    0.0000 H   0  0  0

+   -5.2219   -1.4962    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  5  7  1  0

+  9 13  2  0

+ 11 15  1  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2940-63-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    0.8156   -0.3190   -0.0033 C   0  0  0

+   -0.1777   -1.2268   -0.0028 C   0  0  0

+    0.4826    1.1157   -0.0019 C   0  0  0

+    2.2548   -0.7660    0.0009 C   0  0  0

+   -1.5850   -0.8134   -0.0009 C   0  0  0

+   -0.9644    1.5106    0.0001 C   0  0  0

+    1.3568    1.9570   -0.0019 O   0  0  0

+    2.3427   -2.1973    0.5342 C   0  0  0

+    2.8079   -0.7180   -1.4248 C   0  0  0

+    3.0750    0.1636    0.8976 C   0  0  0

+   -1.9464    0.4942    0.0001 C   0  0  0

+   -2.5491   -1.7621   -0.0005 O   0  0  0

+   -1.2863    2.6823    0.0018 O   0  0  0

+   -3.8030   -1.0768    0.0015 C   0  0  0

+    0.0564   -2.2388    0.0000 H   0  0  0

+    1.3059   -2.2610    0.0000 H   0  0  0

+    2.4064   -3.2341    0.0000 H   0  0  0

+    3.3795   -2.1336    0.0000 H   0  0  0

+    2.8977   -1.7528    0.0000 H   0  0  0

+    3.8427   -0.6282    0.0000 H   0  0  0

+    2.7181    0.3168    0.0000 H   0  0  0

+    3.8539   -0.5236    0.0000 H   0  0  0

+    3.7622    0.9425    0.0000 H   0  0  0

+    2.2961    0.8508    0.0000 H   0  0  0

+   -2.9530    0.7504    0.0000 H   0  0  0

+   -3.3048   -0.1653    0.0000 H   0  0  0

+   -4.7145   -0.5786    0.0000 H   0  0  0

+   -4.3012   -1.9883    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  6 11  1  0

+  2 15  1  0

+  8 16  1  0

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+  9 20  1  0

+  9 21  1  0

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+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4016-14-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.6573   -0.0999   -0.5511 C   0  0  0

+   -2.8453   -0.6854    0.2148 C   0  0  0

+   -2.5652    0.7157    0.1923 O   0  0  0

+   -0.3762   -0.3063    0.2595 C   0  0  0

+    0.7334    0.2406   -0.4558 O   0  0  0

+    1.8935    0.0179    0.3483 C   0  0  0

+    2.5145   -1.3323   -0.0153 C   0  0  0

+    2.9111    1.1320    0.0950 C   0  0  0

+   -1.2333    0.7873    0.0000 H   0  0  0

+   -3.8284   -0.7061    0.0000 H   0  0  0

+   -2.6121   -1.6406    0.0000 H   0  0  0

+   -0.8280   -1.1796    0.0000 H   0  0  0

+    0.3123   -1.0083    0.0000 H   0  0  0

+    1.2870   -0.7560    0.0000 H   0  0  0

+    1.6212   -1.7432    0.0000 H   0  0  0

+    2.9254   -2.2256    0.0000 H   0  0  0

+    3.4078   -0.9214    0.0000 H   0  0  0

+    3.6371    0.4689    0.0000 H   0  0  0

+    3.5742    1.8580    0.0000 H   0  0  0

+    2.1851    1.7951    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  6  8  1  0

+  2  3  1  0

+  1  9  1  0

+  2 10  1  0

+  2 11  1  0

+  4 12  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93793-83-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 55                          1 V2000

+    2.7628   -1.5697   -1.1813 C   0  0  0

+    1.8349   -0.9864   -0.3401 C   0  0  0

+    4.2014   -1.6887   -0.7485 C   0  0  0

+    2.3715   -2.0496   -2.4173 C   0  0  0

+    0.5108   -0.8776   -0.7388 C   0  0  0

+    4.2749   -2.4580    0.5008 N   0  0  0

+    1.0510   -1.9471   -2.8150 C   0  0  0

+    0.1216   -1.3553   -1.9821 C   0  0  0

+   -0.4039   -0.3046    0.0870 O   0  0  0

+    5.5902   -2.1825    1.0887 C   0  0  0

+    4.2531   -3.8756    0.1247 C   0  0  0

+   -1.6578   -0.3403   -0.5974 C   0  0  0

+    5.7449   -2.9591    2.3977 C   0  0  0

+    4.3342   -4.7455    1.3806 C   0  0  0

+   -2.7373    0.2931    0.2826 C   0  0  0

+    5.6526   -4.4602    2.1067 C   0  0  0

+   -4.0799    0.2549   -0.4502 C   0  0  0

+   -5.1135    0.8615    0.3924 N   0  0  0

+   -6.3841    0.9387   -0.0502 C   0  0  0

+   -7.4474    1.5626    0.8165 C   0  0  0

+   -6.6719    0.5060   -1.1461 O   0  0  0

+   -8.7215    1.5263    0.1211 O   0  0  0

+   -9.8197    2.0303    0.7056 C   0  0  0

+  -11.1421    1.9927   -0.0161 C   0  0  0

+   -9.7480    2.5142    1.8105 O   0  0  0

+   13.5004    6.1579    0.0778 Cl  0  0  0

+    2.1294   -0.1025    0.0000 H   0  0  0

+    5.1325   -1.6552    0.0000 H   0  0  0

+    4.2231   -0.7573    0.0000 H   0  0  0

+    2.7383   -2.9060    0.0000 H   0  0  0

+    0.7560   -2.8308    0.0000 H   0  0  0

+   -0.7982   -1.5038    0.0000 H   0  0  0

+    6.5033   -1.9975    0.0000 H   0  0  0

+    5.4022   -1.2700    0.0000 H   0  0  0

+    3.4368   -3.4266    0.0000 H   0  0  0

+    3.4740   -4.3865    0.0000 H   0  0  0

+   -2.3686   -0.9426    0.0000 H   0  0  0

+   -1.3246   -1.2104    0.0000 H   0  0  0

+    6.5630   -3.4049    0.0000 H   0  0  0

+    6.4954   -2.4070    0.0000 H   0  0  0

+    3.4108   -4.8691    0.0000 H   0  0  0

+    4.4946   -5.6632    0.0000 H   0  0  0

+   -2.0265    0.8954    0.0000 H   0  0  0

+   -3.0705    1.1632    0.0000 H   0  0  0

+    5.7656   -5.3850    0.0000 H   0  0  0

+    6.5838   -4.4322    0.0000 H   0  0  0

+   -4.7907   -0.3473    0.0000 H   0  0  0

+   -3.7468   -0.6152    0.0000 H   0  0  0

+   -4.8420    1.7527    0.0000 H   0  0  0

+   -6.7366    2.1649    0.0000 H   0  0  0

+   -7.7806    2.4327    0.0000 H   0  0  0

+  -11.1686    2.9240    0.0000 H   0  0  0

+  -12.0734    1.9662    0.0000 H   0  0  0

+  -11.1156    1.0614    0.0000 H   0  0  0

+   14.4321    6.1579    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  6 11  1  0

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+ 10 13  1  0

+ 11 14  1  0

+ 12 15  1  0

+ 13 16  1  0

+ 15 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+ 19 21  2  0

+ 20 22  1  0

+ 22 23  1  0

+ 23 24  1  0

+ 23 25  2  0

+  7  8  2  0

+ 14 16  1  0

+  2 27  1  0

+  3 28  1  0

+  3 29  1  0

+  4 30  1  0

+  7 31  1  0

+  8 32  1  0

+ 10 33  1  0

+ 10 34  1  0

+ 11 35  1  0

+ 11 36  1  0

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+ 20 50  1  0

+ 20 51  1  0

+ 24 52  1  0

+ 24 53  1  0

+ 24 54  1  0

+ 26 55  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-46-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    1.0329    0.9910    0.0018 C   0  0  0

+    0.3140   -0.1905    0.0005 C   0  0  0

+    2.4149    0.9590    0.0016 C   0  0  0

+    0.3097    2.3132   -0.0027 C   0  0  0

+    0.9784   -1.4040   -0.0011 C   0  0  0

+   -1.5765   -0.1473    0.0002 Br  0  0  0

+    3.0783   -0.2536    0.0001 C   0  0  0

+    2.3600   -1.4350   -0.0013 C   0  0  0

+    2.9540    1.8450    0.0000 H   0  0  0

+    1.2196    2.8109    0.0000 H   0  0  0

+   -0.1880    3.2231    0.0000 H   0  0  0

+   -0.6002    1.8155    0.0000 H   0  0  0

+    0.4397   -2.2903    0.0000 H   0  0  0

+    4.1151   -0.2773    0.0000 H   0  0  0

+    2.8582   -2.3446    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16757-81-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.0806   -0.1222   -0.0013 C   0  0  0

+   -1.4370    0.2486   -0.0010 C   0  0  0

+    0.9158    0.8702    0.0000 C   0  0  0

+    0.2843   -1.5397    0.0031 C   0  0  0

+   -2.4434   -0.7428   -0.0019 C   0  0  0

+   -1.7827    1.6197    0.0007 C   0  0  0

+    2.3158    0.4500   -0.0004 C   0  0  0

+    0.5471    2.2285    0.0021 C   0  0  0

+    1.6200   -1.9051    0.0024 C   0  0  0

+   -0.7820   -2.5419    0.0077 C   0  0  0

+   -3.7819   -0.3446   -0.0015 C   0  0  0

+   -2.0766   -2.1567   -0.0027 C   0  0  0

+   -0.7594    2.5940    0.0016 C   0  0  0

+   -3.1363    1.9771    0.0011 C   0  0  0

+    2.6325   -0.9318   -0.0019 C   0  0  0

+    3.3489    1.3953    0.0003 C   0  0  0

+   -4.1090    0.9993   -0.0008 C   0  0  0

+   -4.8740   -1.3830   -0.0025 C   0  0  0

+    3.9868   -1.3213   -0.0027 C   0  0  0

+    4.6476    0.9814   -0.0004 C   0  0  0

+    4.9640   -0.3749   -0.0019 C   0  0  0

+    1.2957    2.9713    0.0000 H   0  0  0

+    1.8802   -2.9271    0.0000 H   0  0  0

+   -0.5389   -3.5681    0.0000 H   0  0  0

+   -2.8354   -2.8891    0.0000 H   0  0  0

+   -1.0142    3.6174    0.0000 H   0  0  0

+   -3.4124    2.9949    0.0000 H   0  0  0

+    3.1226    2.4254    0.0000 H   0  0  0

+   -5.1249    1.2826    0.0000 H   0  0  0

+   -5.6007   -0.6187    0.0000 H   0  0  0

+   -5.6383   -2.1097    0.0000 H   0  0  0

+   -4.1473   -2.1473    0.0000 H   0  0  0

+    4.2423   -2.3445    0.0000 H   0  0  0

+    5.4223    1.6970    0.0000 H   0  0  0

+    5.9758   -0.6725    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+ 11 17  2  0

+ 11 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 19 21  2  0

+  8 13  2  0

+  9 15  1  0

+ 10 12  2  0

+ 14 17  1  0

+ 20 21  1  0

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+ 16 28  1  0

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+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71382-50-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 39                          1 V2000

+   -0.2051    0.1002    0.0772 C   0  0  0

+   -1.6220   -0.2715    0.0730 C   0  0  0

+    0.2129    1.4414    0.1700 C   0  0  0

+    0.7550   -0.9273   -0.0090 C   0  0  0

+   -2.6432    0.6793    0.1596 C   0  0  0

+   -1.9662   -1.6415   -0.0225 C   0  0  0

+   -0.8189    2.5435    0.2694 C   0  0  0

+    1.5253    1.7756    0.1732 C   0  0  0

+    2.1749   -0.5698   -0.0054 C   0  0  0

+    0.3538   -2.2722   -0.0965 C   0  0  0

+   -2.3024    2.1470    0.2617 C   0  0  0

+   -3.9490    0.2873    0.1518 C   0  0  0

+   -0.9522   -2.6189   -0.1123 C   0  0  0

+   -3.3194   -2.0139   -0.0274 C   0  0  0

+   -1.6148    2.5720   -0.9649 N   0  0  0

+    2.5338    0.7946    0.0844 C   0  0  0

+    3.1734   -1.5446   -0.0879 C   0  0  0

+   -4.2874   -1.0589    0.0582 C   0  0  0

+    3.8924    1.1463    0.0884 C   0  0  0

+    4.4855   -1.1694   -0.0818 C   0  0  0

+    4.8424    0.1725    0.0016 C   0  0  0

+   -0.3829    3.5015    0.0000 H   0  0  0

+    1.7970    2.7925    0.0000 H   0  0  0

+    1.0867   -3.0277    0.0000 H   0  0  0

+   -3.1574    2.7609    0.0000 H   0  0  0

+   -4.7100    1.0145    0.0000 H   0  0  0

+   -1.2165   -3.6378    0.0000 H   0  0  0

+   -3.5849   -3.0324    0.0000 H   0  0  0

+   -1.8843    3.5895    0.0000 H   0  0  0

+    2.9156   -2.5651    0.0000 H   0  0  0

+   -5.3010   -1.3426    0.0000 H   0  0  0

+    4.1754    2.1601    0.0000 H   0  0  0

+    5.2367   -1.9067    0.0000 H   0  0  0

+    5.8605    0.4396    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 12 18  1  0

+ 16 19  1  0

+ 17 20  2  0

+ 19 21  2  0

+  7 11  1  0

+  9 16  2  0

+ 10 13  2  0

+ 11 15  1  0

+ 14 18  2  0

+ 20 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+59863-59-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.0332    0.3039    0.4648 C   0  0  0

+   -0.4899   -0.6924   -0.5804 C   0  0  0

+   -0.0126    1.4622    0.4795 C   0  0  0

+   -2.6383    0.9240   -0.0736 Cl  0  0  0

+    0.8115   -0.0489   -1.1057 C   0  0  0

+   -0.1031   -2.2580    0.2259 Cl  0  0  0

+    1.2455    0.8584   -0.0179 N   0  0  0

+    2.4464    1.0740    0.4008 N   0  0  0

+    3.3848    0.4944   -0.1159 O   0  0  0

+   -1.7234   -0.4829    0.0000 H   0  0  0

+   -1.4654   -1.0716    0.0000 H   0  0  0

+    0.5247    2.3604    0.0000 H   0  0  0

+   -0.8579    2.0794    0.0000 H   0  0  0

+    0.9756   -1.0826    0.0000 H   0  0  0

+    1.8472   -0.1995    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  7  8  1  0

+  8  9  2  0

+  5  7  1  0

+  1 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  5 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54-85-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.2036    0.0977   -0.0010 C   0  0  0

+   -1.2666    0.2803   -0.0002 C   0  0  0

+    1.0642    1.1993    0.0004 C   0  0  0

+    0.7688   -1.1813    0.0028 C   0  0  0

+   -2.0792   -0.7950   -0.0015 N   0  0  0

+   -1.7399    1.3995    0.0016 O   0  0  0

+    2.4289    0.9832   -0.0005 C   0  0  0

+    2.1445   -1.3055    0.0019 C   0  0  0

+   -3.4348   -0.6267   -0.0008 N   0  0  0

+    2.9204   -0.2397   -0.0025 N   0  0  0

+    0.6866    2.1578    0.0000 H   0  0  0

+    0.1682   -2.0184    0.0000 H   0  0  0

+   -1.6779   -1.7439    0.0000 H   0  0  0

+    3.0710    1.7889    0.0000 H   0  0  0

+    2.5700   -2.2438    0.0000 H   0  0  0

+   -3.8361    0.3222    0.0000 H   0  0  0

+   -4.0559   -1.4486    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+491-26-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.6831   -0.2697    0.3450 C   0  0  0

+   -0.7746   -0.4550    0.6796 C   0  0  1

+    1.6360   -0.2377    1.3519 C   0  0  0

+    1.0875   -0.1353   -0.9694 C   0  0  0

+   -1.5667    0.6433    0.0963 N   0  3  0

+   -1.2922   -1.7706    0.0610 C   0  0  0

+    2.9650   -0.0652    0.9973 C   0  0  0

+    2.3613    0.0272   -1.2700 N   0  0  0

+   -2.5290    0.0691   -0.8681 C   0  0  0

+   -2.2941    1.3475    1.1606 C   0  0  0

+   -0.6780    1.5789   -0.5931 O   0  5  0

+   -2.7232   -1.3972   -0.4077 C   0  0  0

+    3.2938    0.0683   -0.3386 C   0  0  0

+   -1.7325   -0.5754    0.0000 H   0  0  0

+    1.7144   -1.2000    0.0000 H   0  0  0

+    0.8732    0.8061    0.0000 H   0  0  0

+   -1.5730   -2.6943    0.0000 H   0  0  0

+   -0.3804   -2.0880    0.0000 H   0  0  0

+    3.2108   -0.9988    0.0000 H   0  0  0

+   -2.8279    0.9871    0.0000 H   0  0  0

+   -3.4904   -0.0192    0.0000 H   0  0  0

+   -1.6226    2.0411    0.0000 H   0  0  0

+   -2.9877    2.0190    0.0000 H   0  0  0

+   -2.9656    0.6539    0.0000 H   0  0  0

+   -3.6743   -1.2311    0.0000 H   0  0  0

+   -2.9283   -2.3406    0.0000 H   0  0  0

+    4.2370    0.2741    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  3  7  2  0

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+  9 20  1  0

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+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92078-92-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.5960   -0.3925    0.0000 N   0  0  0

+   -0.3586    0.3989    0.0000 N   0  0  0

+    1.9696    0.1168    0.0000 C   0  0  0

+   -1.6863   -0.0933    0.0000 O   0  0  0

+    2.3388   -0.8790    0.0000 H   0  0  0

+    2.9654    0.4860    0.0000 H   0  0  0

+    1.6004    1.1126    0.0000 H   0  0  0

+   -2.6821   -0.4625    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90147-18-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+   -1.0753    0.0580   -0.0041 C   0  0  0

+   -2.2257   -0.6476   -0.0035 O   0  0  0

+   -1.4030    1.3985   -0.0012 C   0  0  0

+    0.2335   -0.4807   -0.0019 C   0  0  0

+   -3.2665    0.1965   -0.0004 C   0  0  0

+   -2.8042    1.4668    0.0012 C   0  0  0

+    1.3086    0.3482   -0.0028 C   0  0  0

+   -4.6932   -0.1986    0.0016 N   0  3  0

+    2.6152   -0.1896   -0.0006 C   0  0  0

+   -5.5616    0.6554    0.0045 O   0  0  0

+   -4.9986   -1.3777    0.0004 O   0  5  0

+    3.6843    0.6346   -0.0014 O   0  0  0

+    2.7768   -1.3959    0.0021 O   0  0  0

+    4.8467   -0.1966    0.0013 C   0  0  0

+    6.1006    0.6801    0.0004 C   0  0  0

+    7.3451   -0.2100    0.0033 C   0  0  0

+   -0.7497    2.1903    0.0000 H   0  0  0

+    0.3698   -1.4982    0.0000 H   0  0  0

+   -3.3724    2.3218    0.0000 H   0  0  0

+    1.1723    1.3657    0.0000 H   0  0  0

+    4.1590   -0.9588    0.0000 H   0  0  0

+    5.5263   -0.9660    0.0000 H   0  0  0

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+  1  2  1  0

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+  8 10  2  0

+  8 11  1  0

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+ 15 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10125-76-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.1521    0.0841   -0.0287 C   0  0  0

+   -1.6294    0.0022   -0.0049 C   0  0  0

+    0.4736    1.2769   -0.4098 C   0  0  0

+    0.6132   -1.0295    0.3354 C   0  0  0

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+   -3.6521   -1.2246   -0.4203 C   0  0  0

+   -3.7604    0.9965    0.4836 C   0  0  0

+    2.6109    0.2372   -0.0732 C   0  0  0

+   -4.3941   -0.1514    0.0405 C   0  0  0

+    3.9428    0.3109   -0.0951 N   0  0  0

+    4.6115   -0.6583    0.2164 O   0  0  0

+   -0.0767    2.1279    0.0000 H   0  0  0

+    0.1641   -1.9380    0.0000 H   0  0  0

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+    2.5169   -1.8162    0.0000 H   0  0  0

+   -4.0998   -2.1338    0.0000 H   0  0  0

+   -4.3015    1.8533    0.0000 H   0  0  0

+   -5.4062   -0.2023    0.0000 H   0  0  0

+  1  2  1  0

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+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+56211-40-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 45                          1 V2000

+   -0.1328   -1.4356    0.1570 C   0  0  0

+    0.6475   -1.1367   -0.9597 C   0  0  0

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+ 24 43  1  0

+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+54854-14-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 63 66                          1 V2000

+    0.0909   -0.3668    0.7743 C   0  0  0

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+    2.2499    2.4421   -0.3330 C   0  0  0

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+ 33 62  1  0

+ 33 63  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+70644-19-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.5934   -0.2698   -0.0016 C   0  0  0

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+ 21 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13177-32-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -1.9275   -0.0212    0.0025 C   0  0  0

+   -0.9082   -1.0696    0.0034 C   0  0  0

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+    4.0300   -0.2982   -0.0016 N   0  3  0

+    4.9315    0.5208   -0.0023 O   0  0  0

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+ 14 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+129-09-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 54                          1 V2000

+   -1.4496    0.0869   -0.3127 C   0  0  0

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+    4.1427    0.9445   -0.0937 S   0  0  0

+   -9.1415    0.8501    0.5603 C   0  0  0

+   -8.7706   -1.5123    0.3540 C   0  0  0

+    4.8065   -1.3954    0.1304 N   0  0  0

+    5.4603   -0.2474    0.1250 C   0  0  0

+   -9.6322   -0.4434    0.5247 C   0  0  0

+    6.9121   -0.0078    0.2642 C   0  0  0

+    7.7874   -1.0826    0.4281 C   0  0  0

+    7.4146    1.2943    0.2267 C   0  0  0

+    9.1415   -0.8519    0.5575 C   0  0  0

+    8.7705    1.5109    0.3573 C   0  0  0

+    9.6322    0.4412    0.5252 C   0  0  0

+   -0.7536    3.3785    0.0000 H   0  0  0

+   -3.1433    3.5834    0.0000 H   0  0  0

+    0.7542   -3.3765    0.0000 H   0  0  0

+    3.1437   -3.5809    0.0000 H   0  0  0

+   -7.4226    2.0544    0.0000 H   0  0  0

+   -6.7601   -2.1029    0.0000 H   0  0  0

+   -9.8021    1.6527    0.0000 H   0  0  0

+   -9.1434   -2.4826    0.0000 H   0  0  0

+  -10.6588   -0.6069    0.0000 H   0  0  0

+    7.4219   -2.0557    0.0000 H   0  0  0

+    6.7606    2.1023    0.0000 H   0  0  0

+    9.8019   -1.6546    0.0000 H   0  0  0

+    9.1436    2.4811    0.0000 H   0  0  0

+   10.6588    0.6045    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  7 14  1  0

+  7 15  2  0

+  9 16  2  0

+ 13 17  1  0

+ 14 18  2  0

+ 16 19  1  0

+ 17 20  1  0

+ 17 21  2  0

+ 18 22  1  0

+ 18 23  1  0

+ 20 24  2  0

+ 21 25  1  0

+ 22 26  1  0

+ 23 27  1  0

+ 24 28  1  0

+ 27 29  1  0

+ 29 30  2  0

+ 29 31  1  0

+ 30 32  1  0

+ 31 33  2  0

+ 32 34  2  0

+  8 12  1  0

+  9 14  1  0

+ 11 13  2  0

+ 19 22  2  0

+ 25 28  2  0

+ 26 27  2  0

+ 33 34  1  0

+  8 35  1  0

+ 12 36  1  0

+ 16 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+ 21 40  1  0

+ 24 41  1  0

+ 25 42  1  0

+ 28 43  1  0

+ 30 44  1  0

+ 31 45  1  0

+ 32 46  1  0

+ 33 47  1  0

+ 34 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+111901-41-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -1.1485   -0.4094    0.0959 C   0  0  0

+   -2.0915   -1.5765    0.1280 C   0  0  2

+    0.2366   -0.6450    0.0512 C   0  0  0

+   -1.6093    0.8728    0.1150 C   0  0  0

+   -3.5143   -1.2970   -0.3153 C   0  0  1

+   -3.1578   -1.4052    1.0640 O   0  0  0

+    1.1262    0.4511    0.0332 C   0  0  0

+    0.7442   -1.9651    0.0246 C   0  0  0

+   -3.0935    1.1325    0.1542 C   0  0  1

+   -0.7285    1.9502    0.0960 C   0  0  0

+   -3.8074    0.1288   -0.7503 C   0  0  1

+    2.5678    0.1884   -0.0065 C   0  0  0

+    0.6213    1.7525    0.0544 C   0  0  0

+    2.0701   -2.2073   -0.0119 C   0  0  0

+   -3.5664    0.9918    1.4953 O   0  0  0

+   -3.3804    0.3118   -2.1016 O   0  0  0

+    3.0125   -1.1528   -0.0269 C   0  0  0

+    3.4999    1.2276   -0.0238 C   0  0  0

+    1.5603    2.9310    0.0349 C   0  0  0

+    4.3894   -1.4152   -0.0612 C   0  0  0

+    4.8344    0.9389   -0.0590 C   0  0  0

+    5.2761   -0.3788   -0.0764 C   0  0  0

+   -1.7169   -2.5541    0.0000 H   0  0  0

+   -4.2878   -2.0025    0.0000 H   0  0  0

+    0.0760   -2.7711    0.0000 H   0  0  0

+   -3.1542    2.1777    0.0000 H   0  0  0

+   -1.1071    2.9263    0.0000 H   0  0  0

+   -4.8318    0.3447    0.0000 H   0  0  0

+    2.4098   -3.1976    0.0000 H   0  0  0

+   -4.5699    0.6932    0.0000 H   0  0  0

+   -2.4181    0.7242    0.0000 H   0  0  0

+    3.1772    2.2236    0.0000 H   0  0  0

+    2.3791    2.2786    0.0000 H   0  0  0

+    2.2127    3.7498    0.0000 H   0  0  0

+    0.7415    3.5834    0.0000 H   0  0  0

+    4.7360   -2.4031    0.0000 H   0  0  0

+    5.5327    1.7189    0.0000 H   0  0  0

+    6.3038   -0.5787    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  7 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 11 16  1  0

+ 12 17  2  0

+ 12 18  1  0

+ 13 19  1  0

+ 17 20  1  0

+ 18 21  2  0

+ 20 22  2  0

+  5  6  1  0

+  9 11  1  0

+ 10 13  2  0

+ 14 17  1  0

+ 21 22  1  0

+  2 23  1  0

+  5 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5845-67-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.1327    0.3353    0.3636 C   0  0  1

+    0.1283   -1.1266    0.1589 C   0  0  0

+    1.0369    1.1341    0.0235 N   0  0  0

+   -1.3160    0.7685   -0.5041 C   0  0  0

+    1.3614   -1.6383    0.0955 N   0  0  0

+   -0.8186   -1.8760    0.0458 O   0  0  0

+    2.2697    0.6222   -0.0444 C   0  0  0

+   -2.6202    0.2872    0.1349 C   0  0  0

+    2.5623   -0.8236    0.2215 C   0  0  0

+    3.1895    1.3578   -0.3338 O   0  0  0

+   -3.2887    1.4516    0.8684 C   0  0  0

+   -3.5590   -0.2360   -0.9540 C   0  0  0

+   -0.2570    1.3317    0.0000 H   0  0  0

+    0.9338    2.1329    0.0000 H   0  0  0

+   -0.7166    1.5741    0.0000 H   0  0  0

+   -1.9175    1.5725    0.0000 H   0  0  0

+    1.4630   -2.6373    0.0000 H   0  0  0

+   -2.2007   -0.6251    0.0000 H   0  0  0

+    3.0116   -1.7216    0.0000 H   0  0  0

+    3.5117   -0.4965    0.0000 H   0  0  0

+   -2.4179    1.9516    0.0000 H   0  0  0

+   -3.7887    2.3224    0.0000 H   0  0  0

+   -4.1595    0.9516    0.0000 H   0  0  0

+   -4.0478    0.6411    0.0000 H   0  0  0

+   -4.4361   -0.7248    0.0000 H   0  0  0

+   -3.0702   -1.1131    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  2  0

+  8 11  1  0

+  8 12  1  0

+  7  9  1  0

+  1 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+141691-41-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.6024    0.6480    0.0019 C   0  0  0

+    0.1898   -0.6965   -0.0003 C   0  0  0

+    1.9851    0.6253    0.0018 N   0  0  0

+   -0.3407    1.6678   -0.0015 C   0  0  0

+   -1.1710   -0.9979   -0.0004 C   0  0  0

+    1.3149   -1.4601   -0.0016 N   0  0  0

+    2.3704   -0.6851   -0.0004 C   0  0  0

+    2.8724    1.7910    0.0033 C   0  0  0

+   -1.6735    1.3703   -0.0069 C   0  0  0

+   -2.1028    0.0369    0.0017 C   0  0  0

+    3.6767   -1.1264   -0.0011 N   0  0  0

+   -3.5031   -0.2628    0.0017 C   0  0  0

+   -4.6140   -0.5005    0.0017 N   0  0  0

+   -0.0311    2.6601    0.0000 H   0  0  0

+   -1.4880   -1.9879    0.0000 H   0  0  0

+    3.6995    1.1614    0.0000 H   0  0  0

+    3.5020    2.6181    0.0000 H   0  0  0

+    2.0453    2.4206    0.0000 H   0  0  0

+   -2.3740    2.1383    0.0000 H   0  0  0

+    3.8810   -2.1456    0.0000 H   0  0  0

+    4.4572   -0.4399    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  7 11  1  0

+ 10 12  1  0

+ 12 13  3  0

+  6  7  2  0

+  9 10  1  0

+  4 14  1  0

+  5 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+580-18-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.3202    0.6455   -0.0028 C   0  0  0

+   -0.5469   -0.7536   -0.0009 C   0  0  0

+    1.0030    1.1234   -0.0024 C   0  0  0

+   -1.4144    1.5257    0.0007 C   0  0  0

+    0.4903   -1.5972    0.0017 N   0  0  0

+   -1.8689   -1.2312   -0.0014 C   0  0  0

+    2.0210    0.2065   -0.0001 C   0  0  0

+   -2.6807    1.0253    0.0058 C   0  0  0

+    1.7255   -1.1604    0.0026 C   0  0  0

+   -2.9058   -0.3496   -0.0036 C   0  0  0

+    3.3143    0.6242    0.0001 O   0  0  0

+    1.2021    2.1403    0.0000 H   0  0  0

+   -1.2590    2.5502    0.0000 H   0  0  0

+   -2.0534   -2.2509    0.0000 H   0  0  0

+   -3.4875    1.6756    0.0000 H   0  0  0

+    2.5032   -1.8451    0.0000 H   0  0  0

+   -3.8785   -0.7068    0.0000 H   0  0  0

+    4.3004    0.9427    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7  9  1  0

+  8 10  2  0

+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6926-44-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.3832    0.4592   -0.8319 C   0  0  0

+   -1.3165    0.4070    0.3794 C   0  0  0

+    1.0279    0.1662   -0.3917 C   0  0  0

+   -2.6883    0.6919   -0.0485 N   0  0  0

+    1.4923   -1.1356   -0.3810 C   0  0  0

+    1.8599    1.2001   -0.0040 C   0  0  0

+   -3.4971   -0.0721    0.1117 N   0  3  0

+    2.7869   -1.4044    0.0228 C   0  0  0

+    3.1542    0.9313    0.3997 C   0  0  0

+   -4.3059   -0.8360    0.2719 N   0  5  0

+    3.6168   -0.3715    0.4159 C   0  0  0

+    0.2114    1.2554    0.0000 H   0  0  0

+   -0.8532    1.3348    0.0000 H   0  0  0

+   -1.9111   -0.3892    0.0000 H   0  0  0

+   -0.8465   -0.4686    0.0000 H   0  0  0

+    0.8397   -1.8850    0.0000 H   0  0  0

+    1.5246    2.1356    0.0000 H   0  0  0

+    3.1226   -2.3397    0.0000 H   0  0  0

+    3.8074    1.6802    0.0000 H   0  0  0

+    4.5966   -0.5375    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  2  0

+  8  5  1  0

+  9  6  2  0

+ 10  7  2  0

+ 11  8  2  0

+  9 11  1  0

+  1 12  1  0

+  1 13  1  0

+  2 14  1  0

+  2 15  1  0

+  5 16  1  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2498-77-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.2569    0.0862   -0.0018 C   0  0  0

+   -1.7008   -0.1906   -0.0010 C   0  0  0

+    0.1898    1.4804   -0.0006 C   0  0  0

+    0.6653   -0.9468    0.0019 C   0  0  0

+   -2.6096    0.8882    0.0010 C   0  0  0

+   -2.1802   -1.5015   -0.0017 C   0  0  0

+    1.5477    1.7783   -0.0008 C   0  0  0

+   -0.8075    2.5495    0.0015 C   0  0  0

+    2.0324   -0.6533    0.0010 C   0  0  0

+   -2.1233    2.2643    0.0017 C   0  0  0

+   -3.9861    0.6222    0.0018 C   0  0  0

+   -3.5377   -1.7303   -0.0005 C   0  0  0

+   -1.2168   -2.6603   -0.0044 C   0  0  0

+    2.4828    0.7404   -0.0023 C   0  0  0

+    2.9987   -1.6788    0.0054 C   0  0  0

+   -4.4318   -0.6674    0.0007 C   0  0  0

+    3.8675    1.0052   -0.0026 C   0  0  0

+    4.3187   -1.3560    0.0049 C   0  0  0

+    4.7478   -0.0298   -0.0041 C   0  0  0

+    0.3403   -1.9434    0.0000 H   0  0  0

+    1.8682    2.7763    0.0000 H   0  0  0

+   -0.4944    3.5499    0.0000 H   0  0  0

+   -2.8163    3.0508    0.0000 H   0  0  0

+   -4.6729    1.4141    0.0000 H   0  0  0

+   -3.8993   -2.7142    0.0000 H   0  0  0

+   -2.0228   -3.3304    0.0000 H   0  0  0

+   -0.5467   -3.4663    0.0000 H   0  0  0

+   -0.4108   -1.9902    0.0000 H   0  0  0

+    2.7013   -2.6840    0.0000 H   0  0  0

+   -5.4625   -0.8585    0.0000 H   0  0  0

+    4.2156    1.9939    0.0000 H   0  0  0

+    5.0323   -2.1238    0.0000 H   0  0  0

+    5.7760    0.1743    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+ 14 17  1  0

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+ 17 19  2  0

+  8 10  2  0

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+ 12 16  1  0

+ 18 19  1  0

+  4 20  1  0

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+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88-51-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    2.3790   -0.1498    0.0000 S   0  0  0

+    0.6211   -0.0292    0.0009 C   0  0  0

+    2.7336   -1.6298    0.0195 O   0  0  0

+    2.7983    0.3310   -1.2698 O   0  0  0

+    2.8020    0.3651    1.2550 O   0  0  0

+    0.0099    1.2185   -0.0022 C   0  0  0

+   -0.1500   -1.1747   -0.0011 C   0  0  0

+   -1.3758    1.3097   -0.0020 C   0  0  0

+    0.7875    2.3787   -0.0051 N   0  0  0

+   -1.5297   -1.0816   -0.0008 C   0  0  0

+   -2.1423    0.1593    0.0014 C   0  0  0

+   -2.3679   -2.3340   -0.0030 C   0  0  0

+   -3.8747    0.2714    0.0023 Cl  0  0  0

+    2.9763   -2.6427    0.0000 H   0  0  0

+    0.3081   -2.1100    0.0000 H   0  0  0

+   -1.8369    2.2436    0.0000 H   0  0  0

+    1.8267    2.3091    0.0000 H   0  0  0

+    0.3282    3.3135    0.0000 H   0  0  0

+   -3.2335   -1.7547    0.0000 H   0  0  0

+   -2.9472   -3.1996    0.0000 H   0  0  0

+   -1.5023   -2.9133    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  2  7  2  0

+  6  8  2  0

+  6  9  1  0

+  7 10  1  0

+  8 11  1  0

+ 10 12  1  0

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+ 10 11  2  0

+  3 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5116-24-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    0.9046   -0.8433    0.4563 C   0  0  2

+   -0.5316   -0.6129    0.2817 N   0  0  0

+    1.5772    0.4224    0.6333 O   0  0  0

+    1.4950   -1.4252   -0.8472 C   0  0  0

+   -0.9866    0.6466    0.0004 C   0  0  0

+   -1.3903   -1.6425    0.3940 C   0  0  0

+    2.9526    0.1768    0.2675 C   0  0  1

+    2.8733   -0.7387   -0.9743 C   0  0  1

+   -2.3103    0.8589   -0.1606 C   0  0  0

+   -2.7146   -1.4591    0.2384 N   0  0  0

+   -0.9639   -2.7545    0.6392 O   0  0  0

+    3.6224    1.4982   -0.1150 C   0  0  0

+    3.9049   -1.7251   -0.9056 O   0  0  0

+   -3.2034   -0.2323   -0.0340 C   0  0  0

+   -2.8302    2.2390   -0.4703 C   0  0  0

+    3.6153    2.3790    1.0102 O   0  0  0

+   -4.4015   -0.0654   -0.1745 O   0  0  0

+   -1.7356    3.1547   -0.5447 O   0  0  0

+    0.4505   -1.7404    0.0000 H   0  0  0

+    0.7147   -2.0594    0.0000 H   0  0  0

+    2.0395   -2.2705    0.0000 H   0  0  0

+   -0.3453    1.4211    0.0000 H   0  0  0

+    3.9196   -0.0989    0.0000 H   0  0  0

+    3.8141   -0.3838    0.0000 H   0  0  0

+   -3.3348   -2.2506    0.0000 H   0  0  0

+    4.2983    0.7537    0.0000 H   0  0  0

+    4.5589    1.8642    0.0000 H   0  0  0

+    4.6316   -2.4200    0.0000 H   0  0  0

+   -3.3850    3.0776    0.0000 H   0  0  0

+   -3.7256    1.7815    0.0000 H   0  0  0

+    3.6072    3.3845    0.0000 H   0  0  0

+   -0.9644    3.7999    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 13 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83435-67-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 68                          1 V2000

+   -2.2845    2.0839    0.0619 C   0  0  0

+   -2.3805    1.3186    1.3074 N   0  0  0

+   -3.5489    2.9529   -0.1068 C   0  0  0

+   -1.1697    3.1432    0.1936 C   0  0  0

+   -2.2046   -0.0175    1.2927 C   0  0  0

+   -2.6678    2.0058    2.5690 C   0  0  0

+   -3.0592    4.2518   -0.7104 C   0  0  0

+   -1.6922    4.3611   -0.5379 C   0  0  0

+   -2.6657   -0.8252    0.1069 C   0  0  1

+   -1.6753   -0.5699    2.2338 O   0  0  0

+   -3.4616    1.0937    3.4684 C   0  0  0

+   -3.7548    5.2585   -1.3592 C   0  0  0

+   -1.0242    5.4768   -1.0145 C   0  0  0

+   -2.0309   -2.1495    0.1399 N   0  0  0

+   -4.1861   -0.9870    0.1602 C   0  0  0

+   -3.8801    1.5305    4.6666 O   0  0  0

+   -3.7214   -0.0309    3.1109 O   0  0  0

+   -3.0868    6.3701   -1.8341 C   0  0  0

+   -1.7196    6.4798   -1.6608 C   0  0  0

+   -1.1360   -2.2178   -1.0230 C   0  0  1

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+   -1.5509   -2.2447   -3.4567 O   0  0  0

+   -2.8760   -3.3829   -2.1032 O   0  0  0

+    1.8812   -3.7659    0.7551 C   0  0  0

+   -2.3046   -2.6688   -4.6231 C   0  0  0

+    3.1244   -3.5924    0.1756 C   0  0  0

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+   -1.6812   -2.0616   -5.8815 C   0  0  0

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+    3.9050   -5.5820    1.2549 C   0  0  0

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+   -4.0890   -1.8996    0.0000 H   0  0  0

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+   -1.0238   -1.4213    0.0000 H   0  0  0

+   -2.3215   -1.4042    0.0000 H   0  0  0

+    5.0088   -4.2164    0.0000 H   0  0  0

+    2.3948   -6.6297    0.0000 H   0  0  0

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+ 32 65  1  0

+ 33 66  1  0

+ 34 67  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+102-81-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 34                          1 V2000

+   -0.0546    0.4622   -0.3425 N   0  0  0

+   -1.2881   -0.1427   -0.8625 C   0  0  0

+    1.0630   -0.3036   -0.9102 C   0  0  0

+    0.0262    1.8133   -0.9134 C   0  0  0

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+    2.9543   -1.8451   -0.3728 C   0  0  0

+    1.2567    2.7320    0.9527 O   0  0  0

+   -4.4030   -1.5246    0.9301 C   0  0  0

+    3.8247   -2.4054    0.7539 C   0  0  0

+   -1.3906   -1.0556    0.0000 H   0  0  0

+   -0.5369   -0.6714    0.0000 H   0  0  0

+    1.9104    0.0509    0.0000 H   0  0  0

+    1.1568    0.6102    0.0000 H   0  0  0

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+   -2.1007    0.3943    0.0000 H   0  0  0

+   -2.9544    0.0101    0.0000 H   0  0  0

+    2.7254   -0.6226    0.0000 H   0  0  0

+    2.0100   -0.0408    0.0000 H   0  0  0

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+   -0.8808    2.8794    0.0000 H   0  0  0

+   -3.5904   -2.0616    0.0000 H   0  0  0

+   -2.7367   -1.6774    0.0000 H   0  0  0

+    2.1071   -2.2002    0.0000 H   0  0  0

+    2.8740   -2.7602    0.0000 H   0  0  0

+    2.1714    2.6475    0.0000 H   0  0  0

+   -4.7520   -0.6749    0.0000 H   0  0  0

+   -5.2527   -1.8736    0.0000 H   0  0  0

+   -4.0540   -2.3743    0.0000 H   0  0  0

+    3.3275   -3.1778    0.0000 H   0  0  0

+    4.5971   -2.9026    0.0000 H   0  0  0

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+  1  2  1  0

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+ 11 30  1  0

+ 11 31  1  0

+ 11 32  1  0

+ 12 33  1  0

+ 12 34  1  0

+ 12 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+213-46-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.7310   -0.7663   -0.0009 C   0  0  0

+   -0.7310   -0.7663   -0.0008 C   0  0  0

+    1.4060    0.4710   -0.0003 C   0  0  0

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+   -2.8115   -1.9767   -0.0023 C   0  0  0

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+  1  2  1  0

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+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7673-09-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    1.5892   -0.7240   -0.0027 C   0  0  0

+    0.6190   -1.6330   -0.0021 N   0  0  0

+    1.2872    0.5705   -0.0023 N   0  0  0

+    2.9100   -1.1244    0.0021 N   0  0  0

+   -0.6530   -1.2473   -0.0011 C   0  0  0

+    0.0149    0.9562   -0.0014 C   0  0  0

+    4.1579    0.0448    0.0012 Cl  0  0  0

+   -1.6601   -2.1909    0.0000 N   0  0  0

+   -0.9551    0.0474   -0.0008 N   0  0  0

+   -0.2988    2.3002   -0.0005 N   0  0  0

+   -3.2966   -1.6948    0.0012 Cl  0  0  0

+   -1.9352    2.7963    0.0007 Cl  0  0  0

+    3.1409   -2.1139    0.0000 H   0  0  0

+   -1.4292   -3.1804    0.0000 H   0  0  0

+    0.4427    2.9949    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 12  1  0

+  6  9  2  0

+  4 13  1  0

+  8 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119914-60-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 51                          1 V2000

+    0.5327   -0.4091    0.2796 C   0  0  0

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+    3.3124   -0.0684   -0.0568 C   0  0  0

+    2.9050    2.2387   -0.2427 O   0  0  0

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+    0.6103    3.3836   -0.1065 C   0  0  0

+   -3.0716    0.2235    0.5966 N   0  0  0

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+   -5.5619   -0.3280   -0.7857 N   0  0  0

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+   -1.1980   -1.5956    0.0000 H   0  0  0

+   -0.1445   -2.8289    0.0000 H   0  0  0

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+   -6.3012    1.0700    0.0000 H   0  0  0

+   -6.5785   -0.5236    0.0000 H   0  0  0

+   -6.1758   -2.5180    0.0000 H   0  0  0

+   -5.3755   -3.7439    0.0000 H   0  0  0

+   -4.1496   -2.9436    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  8 14  2  0

+  8 15  1  0

+  9 16  1  0

+ 12 17  1  0

+ 14 18  1  0

+ 16 19  1  0

+ 16 20  1  0

+ 17 21  1  0

+ 17 22  2  0

+ 19 23  1  0

+ 20 24  1  0

+ 23 25  1  0

+ 23 26  1  0

+  7 12  1  0

+  9 14  1  0

+ 10 11  1  0

+ 24 25  1  0

+  4 27  1  0

+  5 28  1  0

+  6 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 11 32  1  0

+ 11 33  1  0

+ 15 34  1  0

+ 15 35  1  0

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+ 19 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+ 21 41  1  0

+ 23 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+ 25 45  1  0

+ 26 46  1  0

+ 26 47  1  0

+ 26 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56-81-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.0000    0.0370   -0.2487 C   0  0  0

+   -1.2492    0.7483    0.2751 C   0  0  0

+    1.2492    0.7483    0.2751 C   0  0  0

+    0.0000   -1.3191    0.2018 O   0  0  0

+   -2.4160    0.0840   -0.2141 O   0  0  0

+    2.4160    0.0840   -0.2141 O   0  0  0

+    0.0000    1.0541    0.0000 H   0  0  0

+   -0.5970    1.5287    0.0000 H   0  0  0

+   -1.9014    1.5287    0.0000 H   0  0  0

+    1.9014    1.5287    0.0000 H   0  0  0

+    0.5970    1.5287    0.0000 H   0  0  0

+    0.0000   -2.3362    0.0000 H   0  0  0

+   -3.2999   -0.4192    0.0000 H   0  0  0

+    3.2999   -0.4192    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16110-13-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.6017    0.3877   -0.0302 C   0  0  0

+    0.0123   -0.9435   -0.1841 C   0  0  0

+    2.0662    0.5081    0.0183 C   0  0  0

+   -0.2073    1.5078    0.0616 C   0  0  0

+   -1.3688   -1.0938   -0.2342 C   0  0  0

+    0.8924   -2.1066   -0.2843 C   0  0  0

+    2.8573   -0.6552   -0.0842 C   0  0  0

+    2.6795    1.7535    0.1633 C   0  0  0

+   -1.5970    1.3633    0.0066 C   0  0  0

+   -2.1904    0.0319   -0.1369 C   0  0  0

+   -1.9765   -2.4637   -0.3931 C   0  0  0

+    2.2304   -1.9644   -0.2366 C   0  0  0

+    4.2537   -0.5384   -0.0378 C   0  0  0

+    4.0530    1.8357    0.2051 C   0  0  0

+   -2.4507    2.4807    0.0968 C   0  0  0

+   -3.5948   -0.0828   -0.1834 C   0  0  0

+   -2.2018   -3.0373    0.8962 O   0  0  0

+    4.8312    0.6895    0.1050 C   0  0  0

+   -3.7966    2.3023    0.0396 C   0  0  0

+   -4.3621    1.0342   -0.0853 C   0  0  0

+    0.2197    2.4618    0.0000 H   0  0  0

+    0.4771   -3.0658    0.0000 H   0  0  0

+    2.1010    2.6241    0.0000 H   0  0  0

+   -2.6041   -1.6279    0.0000 H   0  0  0

+   -3.0122   -2.6043    0.0000 H   0  0  0

+    2.8335   -2.8181    0.0000 H   0  0  0

+    4.8502   -1.3967    0.0000 H   0  0  0

+    4.5145    2.7735    0.0000 H   0  0  0

+   -2.0501    3.4461    0.0000 H   0  0  0

+   -4.0435   -1.0268    0.0000 H   0  0  0

+   -2.5839   -4.0102    0.0000 H   0  0  0

+    5.8732    0.7714    0.0000 H   0  0  0

+   -4.4221    3.1397    0.0000 H   0  0  0

+   -5.4030    0.9390    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+  5 10  1  0

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+  6 12  2  0

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+ 13 18  2  0

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+  7 12  1  0

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+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+193-39-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 39                          1 V2000

+    0.3987   -0.3643    0.0027 C   0  0  0

+   -0.9402   -0.7109    0.0022 C   0  0  0

+    0.8726    1.0087    0.0013 C   0  0  0

+    1.4394   -1.2856   -0.0015 C   0  0  0

+   -1.8904    0.3213    0.0009 C   0  0  0

+   -1.3002   -2.0782    0.0020 C   0  0  0

+    2.3438    0.8907    0.0012 C   0  0  0

+   -0.0736    1.9954    0.0002 C   0  0  0

+    2.6799   -0.4875    0.0003 C   0  0  0

+    1.0724   -2.6338   -0.0064 C   0  0  0

+   -1.4553    1.6675    0.0004 C   0  0  0

+   -3.2572   -0.0328   -0.0008 C   0  0  0

+   -0.2600   -3.0144    0.0035 C   0  0  0

+   -2.6775   -2.3907    0.0008 C   0  0  0

+    3.3597    1.8422   -0.0010 C   0  0  0

+    4.0243   -0.8567   -0.0016 C   0  0  0

+   -2.4416    2.6641   -0.0006 C   0  0  0

+   -3.6104   -1.4036   -0.0010 C   0  0  0

+   -4.2002    0.9983   -0.0018 C   0  0  0

+    4.6817    1.4502    0.0006 C   0  0  0

+    5.0119    0.1045   -0.0002 C   0  0  0

+   -3.7778    2.3154   -0.0012 C   0  0  0

+    0.2227    3.0006    0.0000 H   0  0  0

+    1.8180   -3.3702    0.0000 H   0  0  0

+   -0.4961   -4.0354    0.0000 H   0  0  0

+   -2.9824   -3.3933    0.0000 H   0  0  0

+    3.1185    2.8620    0.0000 H   0  0  0

+    4.2855   -1.8716    0.0000 H   0  0  0

+   -2.1644    3.6748    0.0000 H   0  0  0

+   -4.6251   -1.6654    0.0000 H   0  0  0

+   -5.2240    0.7745    0.0000 H   0  0  0

+    5.4402    2.1734    0.0000 H   0  0  0

+    6.0193   -0.1843    0.0000 H   0  0  0

+   -4.4981    3.0765    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 12 19  2  0

+ 15 20  2  0

+ 16 21  2  0

+ 17 22  2  0

+  7  9  2  0

+  8 11  1  0

+ 10 13  2  0

+ 14 18  2  0

+ 19 22  1  0

+ 20 21  1  0

+  8 23  1  0

+ 10 24  1  0

+ 13 25  1  0

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+ 15 27  1  0

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+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+613-93-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.2069    0.0834   -0.0010 C   0  0  0

+   -1.2612    0.2577   -0.0002 C   0  0  0

+    1.0454    1.1995    0.0003 C   0  0  0

+    0.7605   -1.1976    0.0026 C   0  0  0

+   -2.0680   -0.8219   -0.0016 N   0  0  0

+   -1.7406    1.3747    0.0016 O   0  0  0

+    2.4143    1.0299   -0.0005 C   0  0  0

+    2.1315   -1.3533    0.0018 C   0  0  0

+   -3.5228   -0.6492   -0.0008 C   0  0  0

+    2.9568   -0.2431   -0.0027 C   0  0  0

+    0.6398    2.1546    0.0000 H   0  0  0

+    0.1425   -2.0312    0.0000 H   0  0  0

+   -1.6587   -1.7755    0.0000 H   0  0  0

+    3.0386    1.8587    0.0000 H   0  0  0

+    2.5444   -2.3053    0.0000 H   0  0  0

+   -3.4005    0.3812    0.0000 H   0  0  0

+   -4.5532   -0.5269    0.0000 H   0  0  0

+   -3.6451   -1.6796    0.0000 H   0  0  0

+    3.9872   -0.3655    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

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+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2565-01-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 50                          1 V2000

+   -0.5854    0.3163    0.0050 C   0  0  0

+   -1.5569   -0.6808    0.1033 C   0  0  0

+    0.8499   -0.0626    0.0112 C   0  0  0

+   -0.9584    1.6551   -0.1037 C   0  0  0

+   -1.1344   -2.1232    0.1880 C   0  0  2

+   -2.8922   -0.3359    0.1257 C   0  0  0

+    1.1990   -1.3762   -0.2945 C   0  0  0

+    1.8176    0.8987    0.3219 C   0  0  0

+   -2.3077    1.9902   -0.1070 C   0  0  0

+   -0.0109    2.6248   -0.2052 O   0  0  0

+    0.1215   -2.3676   -0.6452 C   0  0  0

+   -2.2156   -2.9786   -0.3204 N   0  0  0

+   -3.2639    0.9962    0.0102 C   0  0  0

+   -3.9674   -1.3716    0.3039 C   0  0  0

+    2.5245   -1.7872   -0.2921 C   0  0  0

+    3.1411    0.4882    0.3198 C   0  0  0

+   -2.6871    3.2910   -0.2236 O   0  0  0

+    0.0828    2.9674   -1.5894 C   0  0  0

+   -3.3802   -2.7555    0.5359 C   0  0  0

+   -1.7920   -4.3683   -0.1032 C   0  0  0

+    3.4899   -0.8388    0.0187 C   0  0  0

+    4.2694    1.1877    0.5777 O   0  0  0

+   -2.6087    3.8629    1.0836 C   0  0  0

+    4.8350   -0.9620    0.0934 O   0  0  0

+    5.3490    0.3854    0.0558 C   0  0  0

+   -0.8900   -3.1282    0.0000 H   0  0  0

+    1.5711    1.9032    0.0000 H   0  0  0

+   -0.2849   -3.3188    0.0000 H   0  0  0

+    0.9661   -2.9647    0.0000 H   0  0  0

+   -4.2669    1.2490    0.0000 H   0  0  0

+   -4.5892   -0.5450    0.0000 H   0  0  0

+   -4.8634   -1.8883    0.0000 H   0  0  0

+    2.7683   -2.7924    0.0000 H   0  0  0

+    1.0805    2.6945    0.0000 H   0  0  0

+    0.3557    3.9651    0.0000 H   0  0  0

+   -0.9149    3.2403    0.0000 H   0  0  0

+   -4.3930   -2.9655    0.0000 H   0  0  0

+   -3.3724   -3.7898    0.0000 H   0  0  0

+   -2.7814   -4.6699    0.0000 H   0  0  0

+   -1.4904   -5.3577    0.0000 H   0  0  0

+   -0.8026   -4.0667    0.0000 H   0  0  0

+   -1.5839    3.7224    0.0000 H   0  0  0

+   -2.4682    4.8877    0.0000 H   0  0  0

+   -3.6335    4.0034    0.0000 H   0  0  0

+    6.2777   -0.0701    0.0000 H   0  0  0

+    5.8875    1.2685    0.0000 H   0  0  0

+  1  2  2  0

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+ 23 42  1  0

+ 23 43  1  0

+ 23 44  1  0

+ 25 45  1  0

+ 25 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+62625-14-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+   -2.5641    0.9416    0.0626 C   0  0  0

+   -3.3788   -0.0588    0.5583 C   0  0  0

+   -1.3092    0.6353   -0.4303 C   0  0  0

+   -3.0387    2.3435    0.0537 N   0  3  0

+   -2.9380   -1.3745    0.5621 C   0  0  0

+   -0.8626   -0.6744   -0.4298 C   0  0  0

+   -2.3220    3.2263   -0.3827 O   0  0  0

+   -4.1459    2.6144    0.4829 O   0  5  0

+   -1.6739   -1.6831    0.0656 C   0  0  0

+   -3.7614   -2.3889    1.0641 N   0  0  0

+    0.7141   -1.0541   -1.0492 Cl  0  0  0

+   -1.2366   -2.9713    0.0669 O   0  0  0

+    9.7623    0.5270    0.4004 Cl  0  0  0

+   -4.3409    0.1164    0.0000 H   0  0  0

+   -0.6492    1.3569    0.0000 H   0  0  0

+   -4.7271   -2.2348    0.0000 H   0  0  0

+   -3.4120   -3.3023    0.0000 H   0  0  0

+   -0.9223   -3.8973    0.0000 H   0  0  0

+   10.7402    0.5270    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  9 12  1  0

+  6  9  1  0

+  2 14  1  0

+  3 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+578-54-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.4540    0.3234    0.2742 C   0  0  0

+    0.1039   -0.9295    0.0550 C   0  0  0

+    0.3448    1.4496    0.2365 C   0  0  0

+   -1.9304    0.4546    0.5467 C   0  0  0

+    1.4644   -1.0453   -0.2015 C   0  0  0

+   -0.7009   -2.0704    0.0929 N   0  0  0

+    1.6984    1.3307   -0.0191 C   0  0  0

+   -2.6666    0.7470   -0.7623 C   0  0  0

+    2.2572    0.0846   -0.2378 C   0  0  0

+   -0.0869    2.3832    0.0000 H   0  0  0

+   -2.6720   -0.2582    0.0000 H   0  0  0

+   -1.5888   -0.5157    0.0000 H   0  0  0

+    1.8998   -1.9772    0.0000 H   0  0  0

+   -1.7253   -1.9772    0.0000 H   0  0  0

+   -0.2694   -3.0042    0.0000 H   0  0  0

+    2.2948    2.1688    0.0000 H   0  0  0

+   -2.2869    1.7030    0.0000 H   0  0  0

+   -3.6226    1.1267    0.0000 H   0  0  0

+   -3.0463   -0.2090    0.0000 H   0  0  0

+    3.2812   -0.0131    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  5 13  1  0

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+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+69527-46-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.3097    1.1496   -0.0479 C   0  0  0

+   -0.4762    0.0518   -0.0463 O   0  0  0

+    1.7171    1.1634   -0.0939 C   0  0  0

+   -0.5164    2.2591   -0.0023 C   0  0  0

+   -1.7621    0.4244    0.0042 C   0  0  0

+    2.4237   -0.0254   -0.0265 C   0  0  0

+   -1.8310    1.7756    0.0266 C   0  0  0

+   -2.9226   -0.4950    0.0214 N   0  3  0

+    3.8538   -0.0054    0.0446 C   0  0  0

+    1.7244   -1.2751   -0.0279 C   0  0  0

+   -4.0541   -0.0467    0.0686 O   0  0  0

+   -2.7457   -1.6996   -0.0117 O   0  5  0

+    4.9883    0.0106    0.1010 N   0  0  0

+    1.1696   -2.2664   -0.0290 N   0  0  0

+    2.2201    2.0576    0.0000 H   0  0  0

+   -0.2238    3.2425    0.0000 H   0  0  0

+   -2.6871    2.3410    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  6 10  1  0

+  8 11  2  0

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+  9 13  3  0

+ 10 14  3  0

+  5  7  2  0

+  3 15  1  0

+  4 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+552-30-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.6190    0.5276    0.0030 C   0  0  0

+   -1.0223   -0.8239    0.0013 C   0  0  0

+    0.7289    0.8469    0.0024 C   0  0  0

+   -1.8636    1.3227   -0.0008 C   0  0  0

+   -2.5015   -0.8050    0.0020 C   0  0  0

+   -0.0708   -1.8325   -0.0001 C   0  0  0

+    1.6810   -0.1763    0.0002 C   0  0  0

+   -2.9135    0.4779   -0.0044 O   0  0  0

+   -1.9298    2.5349   -0.0001 O   0  0  0

+   -3.2228   -1.7811    0.0004 O   0  0  0

+    1.2754   -1.5114    0.0002 C   0  0  0

+    3.1222    0.1570   -0.0005 C   0  0  0

+    4.0411   -0.8277   -0.0026 O   0  0  0

+    3.4768    1.3185    0.0010 O   0  0  0

+    1.0303    1.8411    0.0000 H   0  0  0

+   -0.3681   -2.8280    0.0000 H   0  0  0

+    1.9874   -2.2680    0.0000 H   0  0  0

+    4.7499   -1.5873    0.0000 H   0  0  0

+  1  2  2  0

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+  5  8  1  0

+  7 11  1  0

+  3 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 13 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19057-60-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+133141                          1 V2000

+   -7.9361    0.1562   -1.0581 C   0  0  2

+   -9.0295    1.1382   -1.4899 C   0  0  2

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+  -10.0952    1.5978    0.5883 O   0  0  0

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+  -11.1568    0.6947   -2.7444 C   0  0  0

+   -5.1468   -0.6006   -0.7607 C   0  0  2

+   -4.8161    1.1681    0.9518 C   0  0  0

+  -11.9670    0.0534    0.4787 C   0  0  0

+  -11.9465    2.1543   -0.7428 O   0  0  0

+   -4.1147   -1.5010   -0.1043 C   0  0  2

+   -3.7150    0.3210    1.5197 C   0  0  0

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+ 61133  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91182-09-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -1.5179   -0.0107   -0.0036 C   0  0  0

+   -2.7154   -0.6326   -0.0027 O   0  0  0

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+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+76600-84-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 45                          1 V2000

+   -1.2619   -0.3679   -0.7729 C   0  0  0

+   -2.5244   -0.1666   -1.3436 N   0  0  0

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+    5.2440   -1.8229    0.0000 H   0  0  0

+    3.9591    1.1448    0.0000 H   0  0  0

+    5.1458    2.9750    0.0000 H   0  0  0

+    3.8662    3.4228    0.0000 H   0  0  0

+    3.4184    2.1432    0.0000 H   0  0  0

+    6.5417    0.4959    0.0000 H   0  0  0

+    7.3693    1.5697    0.0000 H   0  0  0

+    6.2955    2.3973    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+ 13 15  1  0

+ 15 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 18 19  1  0

+ 18 20  1  0

+  7 10  1  0

+ 12 14  2  0

+  2 21  1  0

+  3 22  1  0

+  4 23  1  0

+  6 24  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 20 42  1  0

+ 20 43  1  0

+ 20 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-17-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    1.9022   -0.0323   -0.0014 C   0  0  0

+    0.5050    0.4426   -0.0003 C   0  0  0

+    2.9157    0.8558   -0.0006 O   0  0  0

+    2.1387   -1.2235    0.0020 O   0  0  0

+   -0.5050   -0.4426   -0.0011 C   0  0  0

+   -1.9022    0.0323    0.0000 C   0  0  0

+   -2.9157   -0.8558   -0.0008 O   0  0  0

+   -2.1387    1.2236    0.0016 O   0  0  0

+    0.3082    1.4339    0.0000 H   0  0  0

+    3.6758    1.5219    0.0000 H   0  0  0

+   -0.3082   -1.4339    0.0000 H   0  0  0

+   -3.6758   -1.5219    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  5  6  1  0

+  6  7  1  0

+  6  8  2  0

+  2  9  1  0

+  3 10  1  0

+  5 11  1  0

+  7 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-19-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -1.5026   -0.0102   -0.0011 C   0  0  0

+   -2.9742   -0.0131   -0.0009 C   0  0  0

+   -0.8020    1.2005    0.0003 C   0  0  0

+   -0.7974   -1.2177    0.0031 C   0  0  0

+   -3.7252   -1.3197   -0.0025 C   0  0  0

+   -3.5826    1.0358    0.0005 O   0  0  0

+    0.5766    1.1949    0.0006 C   0  0  0

+    0.5816   -1.2066    0.0033 C   0  0  0

+    1.2675   -0.0047   -0.0006 C   0  0  0

+    2.7476   -0.0017   -0.0007 N   0  3  0

+    3.3587   -1.0553   -0.0018 O   0  0  0

+    3.3545    1.0543    0.0001 O   0  5  0

+   -1.3188    2.1008    0.0000 H   0  0  0

+   -1.3106   -2.1201    0.0000 H   0  0  0

+   -4.6252   -0.8024    0.0000 H   0  0  0

+   -4.2425   -2.2197    0.0000 H   0  0  0

+   -2.8252   -1.8370    0.0000 H   0  0  0

+    1.0979    2.0926    0.0000 H   0  0  0

+    1.1065   -2.1022    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  7  9  1  0

+  9 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  8  9  2  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+  7 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6728-26-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -0.0806   -0.5747   -0.2377 C   0  0  0

+   -1.4205   -0.4422    0.4392 C   0  0  0

+    0.9986   -0.0037    0.3012 C   0  0  0

+   -2.4031    0.2515   -0.5063 C   0  0  0

+    2.2990   -0.1323   -0.3558 C   0  0  0

+   -3.7635    0.3860    0.1809 C   0  0  0

+    3.2802    0.3868    0.1341 O   0  0  0

+    0.1022   -1.5048    0.0000 H   0  0  0

+   -2.2004   -0.9809    0.0000 H   0  0  0

+   -1.1833   -1.3599    0.0000 H   0  0  0

+    0.8158    0.9264    0.0000 H   0  0  0

+   -1.6232    0.7903    0.0000 H   0  0  0

+   -2.6404    1.1692    0.0000 H   0  0  0

+    2.4818   -1.0624    0.0000 H   0  0  0

+   -3.6702    1.3293    0.0000 H   0  0  0

+   -4.7068    0.4793    0.0000 H   0  0  0

+   -3.8568   -0.5573    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  2  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-30-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.9051   -0.2692    0.0679 C   0  0  0

+   -2.0493    0.6062    0.0194 C   0  0  0

+    0.4668    0.2611    0.1164 C   0  0  0

+   -1.1535   -1.6263    0.0726 C   0  0  0

+   -3.2643    0.0253   -0.0229 C   0  0  0

+    1.5151   -0.5848    0.1611 N   0  0  0

+    0.6546    1.4630    0.1162 O   0  0  0

+   -2.8819   -1.7139    0.0133 S   0  0  0

+   -4.5936    0.6746   -0.0763 N   0  3  0

+    2.8193   -0.0872    0.0742 C   0  0  0

+   -5.6030   -0.0063   -0.1104 O   0  0  0

+   -4.6780    1.8896   -0.0862 O   0  5  0

+    3.8938   -0.9630   -0.0154 C   0  0  0

+    3.0425    1.2834    0.0716 C   0  0  0

+    5.1803   -0.4685   -0.1011 C   0  0  0

+    4.3318    1.7715   -0.0144 C   0  0  0

+    5.3996    0.8970   -0.0977 C   0  0  0

+    6.3467   -1.4179   -0.1978 C   0  0  0

+   -1.9421    1.6379    0.0000 H   0  0  0

+   -0.4694   -2.4060    0.0000 H   0  0  0

+    1.3527   -1.6093    0.0000 H   0  0  0

+    3.7301   -1.9873    0.0000 H   0  0  0

+    2.2393    1.9398    0.0000 H   0  0  0

+    4.4993    2.7951    0.0000 H   0  0  0

+    6.3694    1.2650    0.0000 H   0  0  0

+    5.6919   -2.2223    0.0000 H   0  0  0

+    7.1511   -2.0727    0.0000 H   0  0  0

+    7.0015   -0.6135    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 14 16  1  0

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+ 15 18  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 19  1  0

+  4 20  1  0

+  6 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105553-32-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -0.5380   -0.1743    0.4752 N   0  0  0

+   -1.8199    0.2464    0.1079 C   0  0  0

+    0.4912    0.6953    0.4447 C   0  0  0

+   -0.3246   -1.4983    0.8804 N   0  0  0

+   -2.8037   -0.6903   -0.1807 C   0  0  0

+   -2.1137    1.6023    0.0364 C   0  0  0

+    1.8238    0.2490   -0.0205 C   0  0  0

+    0.3253    1.8460    0.7992 O   0  0  0

+   -0.1488   -2.4226   -0.0021 N   0  0  0

+   -0.3011   -1.8332    2.3065 C   0  0  0

+   -4.0691   -0.2713   -0.5428 C   0  0  0

+   -3.3807    2.0144   -0.3262 C   0  0  0

+    2.9460    1.2028   -0.0653 C   0  0  0

+    2.0045   -0.9886   -0.3908 N   0  0  0

+   -0.2046   -2.1508   -1.1881 O   0  0  0

+   -4.3568    1.0790   -0.6181 C   0  0  0

+    3.8952    1.3049    1.1008 C   0  0  0

+    3.1058    1.9054   -1.0402 O   0  0  0

+    3.1765   -1.3523   -1.0974 O   0  0  0

+   -2.5850   -1.6658    0.0000 H   0  0  0

+   -1.3720    2.2726    0.0000 H   0  0  0

+   -1.2984   -1.9032    0.0000 H   0  0  0

+   -0.2311   -2.8305    0.0000 H   0  0  0

+    0.6962   -1.7632    0.0000 H   0  0  0

+   -4.8137   -0.9383    0.0000 H   0  0  0

+   -3.6036    2.9890    0.0000 H   0  0  0

+   -5.3124    1.3729    0.0000 H   0  0  0

+    4.0021    0.3109    0.0000 H   0  0  0

+    4.8892    1.4118    0.0000 H   0  0  0

+    3.7883    2.2989    0.0000 H   0  0  0

+    4.1313   -1.6486    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+  7 13  1  0

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+ 11 16  2  0

+ 13 17  1  0

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+ 14 19  1  0

+ 12 16  1  0

+  5 20  1  0

+  6 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+932-83-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.7059   -0.3799   -0.2408 N   0  0  0

+    0.1479   -1.5515   -0.2500 C   0  0  0

+   -0.1970    0.9206   -0.7006 C   0  0  0

+   -1.9247   -0.4804    0.1696 N   0  0  0

+    1.4301   -1.2715    0.5493 C   0  0  0

+    0.7160    1.5020    0.3801 C   0  0  0

+   -2.6468    0.5004    0.1796 O   0  0  0

+    2.3396   -0.3569   -0.2763 C   0  0  0

+    2.1582    1.0944    0.1413 C   0  0  0

+   -0.7199   -2.0161    0.0000 H   0  0  0

+    0.4884   -2.4750    0.0000 H   0  0  0

+   -0.4440    1.8734    0.0000 H   0  0  0

+   -1.1796    0.9793    0.0000 H   0  0  0

+    1.3147   -2.2490    0.0000 H   0  0  0

+    2.3164   -1.6997    0.0000 H   0  0  0

+    1.2036    2.3571    0.0000 H   0  0  0

+    0.0032    2.1808    0.0000 H   0  0  0

+    2.8682   -1.1872    0.0000 H   0  0  0

+    3.2657   -0.0234    0.0000 H   0  0  0

+    3.1425    1.0856    0.0000 H   0  0  0

+    2.2977    2.0688    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  4  7  2  0

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+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66-97-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 22                          1 V2000

+   -0.4777    0.9299   -0.0028 C   0  0  0

+   -0.5986   -0.4756   -0.0010 C   0  0  0

+    0.7831    1.5259   -0.0032 C   0  0  0

+   -1.6941    1.7484    0.0018 C   0  0  0

+    0.5361   -1.2677    0.0009 C   0  0  0

+   -1.8268   -1.0413   -0.0007 O   0  0  0

+    1.9148    0.7221   -0.0017 C   0  0  0

+   -2.8940    1.1142    0.0076 C   0  0  0

+    1.7939   -0.6822    0.0011 C   0  0  0

+   -2.9425   -0.2961   -0.0022 C   0  0  0

+    3.3596    0.9910   -0.0011 C   0  0  0

+    3.0441   -1.1884    0.0024 O   0  0  0

+   -4.0261   -0.8517   -0.0019 O   0  0  0

+    3.9614   -0.2048    0.0009 C   0  0  0

+    0.8744    2.5611    0.0000 H   0  0  0

+   -1.6390    2.7861    0.0000 H   0  0  0

+    0.4459   -2.3030    0.0000 H   0  0  0

+   -3.7748    1.6658    0.0000 H   0  0  0

+    3.8212    1.9221    0.0000 H   0  0  0

+    4.9901   -0.3520    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  7  9  2  0

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+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  8 18  1  0

+ 11 19  1  0

+ 14 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-82-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.6315    0.9486    0.0017 C   0  0  0

+   -1.2445   -0.2988    0.0001 C   0  0  0

+    0.7543    1.0378    0.0019 C   0  0  0

+   -1.4080    2.1105   -0.0026 N   0  0  0

+   -0.4737   -1.4461   -0.0014 C   0  0  0

+   -2.9766   -0.4158    0.0005 Cl  0  0  0

+    1.5194   -0.1134    0.0004 C   0  0  0

+    0.9057   -1.3539   -0.0012 C   0  0  0

+    3.2519   -0.0030    0.0000 Cl  0  0  0

+    1.2166    1.9711    0.0000 H   0  0  0

+   -0.9474    3.0446    0.0000 H   0  0  0

+   -2.4473    2.0423    0.0000 H   0  0  0

+   -0.9326   -2.3811    0.0000 H   0  0  0

+    1.4843   -2.2199    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

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+  7  8  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78914-74-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+   -1.5394   -1.4716   -0.0019 C   0  0  0

+   -2.7241   -0.7308   -0.0017 C   0  0  0

+   -0.3303   -0.8335   -0.0009 N   0  0  0

+   -1.5964   -2.8681    0.0027 C   0  0  0

+   -3.9403   -1.3815   -0.0023 C   0  0  0

+   -2.6732    0.7754   -0.0004 C   0  0  0

+    0.7616   -1.5205   -0.0012 N   0  0  0

+   -2.8196   -3.5047    0.0074 C   0  0  0

+   -3.9890   -2.7643   -0.0030 C   0  0  0

+   -4.0250    1.3053   -0.0004 O   0  0  0

+    1.9682   -0.8837   -0.0002 C   0  0  0

+   -4.2256    2.6325    0.0007 C   0  0  0

+    3.1535   -1.6270   -0.0004 C   0  0  0

+    2.0235    0.5146   -0.0047 C   0  0  0

+   -5.6287    3.1825    0.0007 C   0  0  0

+   -3.2813    3.3862    0.0017 O   0  0  0

+    4.3689   -0.9808    0.0002 C   0  0  0

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+    4.4197    0.4100    0.0009 C   0  0  0

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+    5.7069    2.5238    0.0027 C   0  0  0

+    6.8912    0.2797    0.0022 C   0  0  0

+   -0.7153   -3.4277    0.0000 H   0  0  0

+   -4.8261   -0.8294    0.0000 H   0  0  0

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+   -2.4045    1.7840    0.0000 H   0  0  0

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+   -4.9121   -3.2515    0.0000 H   0  0  0

+    3.1162   -2.6701    0.0000 H   0  0  0

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+    7.4471    1.1632    0.0000 H   0  0  0

+  1  2  2  0

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+  8  9  1  0

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+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105-76-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 35                          1 V2000

+    1.4295   -0.7902   -0.2061 C   0  0  0

+    0.6694   -2.0283    0.0527 C   0  0  0

+    2.7541   -0.7494    0.0377 O   0  0  0

+    0.8621    0.1904   -0.6436 O   0  0  0

+   -0.6696   -2.0282   -0.0507 C   0  0  0

+    3.5020    0.4689   -0.2170 C   0  0  0

+   -1.4294   -0.7896    0.2063 C   0  0  0

+    4.9731    0.2484    0.1410 C   0  0  0

+   -2.7544   -0.7494   -0.0359 O   0  0  0

+   -0.8606    0.1936    0.6361 O   0  0  0

+    5.7612    1.5321   -0.1273 C   0  0  0

+   -3.5020    0.4693    0.2169 C   0  0  0

+    7.2323    1.3117    0.2307 C   0  0  0

+   -4.9736    0.2480   -0.1387 C   0  0  0

+   -5.7614    1.5322    0.1277 C   0  0  0

+   -7.2329    1.3109   -0.2279 C   0  0  0

+    1.2014   -2.9792    0.0000 H   0  0  0

+   -1.2018   -2.9790    0.0000 H   0  0  0

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+    2.5056    0.9099    0.0000 H   0  0  0

+    4.6691   -0.7979    0.0000 H   0  0  0

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+   -2.5056    0.9102    0.0000 H   0  0  0

+   -3.8062    1.5156    0.0000 H   0  0  0

+    7.0709    0.2341    0.0000 H   0  0  0

+    8.3099    1.1503    0.0000 H   0  0  0

+    7.3937    2.3893    0.0000 H   0  0  0

+   -5.9700   -0.1929    0.0000 H   0  0  0

+   -4.6694   -0.7983    0.0000 H   0  0  0

+   -4.7650    1.9731    0.0000 H   0  0  0

+   -6.0656    2.5785    0.0000 H   0  0  0

+   -7.3949    2.3884    0.0000 H   0  0  0

+   -8.3104    1.1489    0.0000 H   0  0  0

+   -7.0709    0.2334    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 16 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17557-23-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    0.0000   -0.3319   -0.0036 C   0  0  0

+   -1.2459    0.5504    0.0971 C   0  0  0

+    1.2459    0.5524   -0.0851 C   0  0  0

+    0.0911   -1.2288    1.2326 C   0  0  0

+   -0.0911   -1.2016   -1.2591 C   0  0  0

+   -2.4096   -0.2755    0.1731 O   0  0  0

+    2.4096   -0.2717   -0.1791 O   0  0  0

+   -3.5336    0.6020    0.2649 C   0  0  0

+    3.5336    0.6076   -0.2517 C   0  0  0

+   -4.8192   -0.2232    0.3499 C   0  0  0

+    4.8192   -0.2155   -0.3546 C   0  0  0

+   -6.0228    0.7164    0.4481 C   0  0  0

+   -5.6512    0.0742   -0.7732 O   0  0  0

+    6.0228    0.7260   -0.4324 C   0  0  0

+    5.6512    0.0573    0.7747 O   0  0  0

+   -0.5335    1.3486    0.0000 H   0  0  0

+   -1.9591    1.3479    0.0000 H   0  0  0

+    1.9583    1.3506    0.0000 H   0  0  0

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+   -0.9733   -1.3369    0.0000 H   0  0  0

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+   -1.1551   -1.0901    0.0000 H   0  0  0

+   -0.2026   -2.2656    0.0000 H   0  0  0

+    0.9729   -1.3131    0.0000 H   0  0  0

+   -2.7848    1.3661    0.0000 H   0  0  0

+   -4.2089    1.4318    0.0000 H   0  0  0

+    4.2080    1.4382    0.0000 H   0  0  0

+    2.7840    1.3709    0.0000 H   0  0  0

+   -4.6978   -1.2862    0.0000 H   0  0  0

+    4.6844   -1.2768    0.0000 H   0  0  0

+   -5.7405    1.7483    0.0000 H   0  0  0

+   -7.0838    0.5790    0.0000 H   0  0  0

+    7.0854    0.6012    0.0000 H   0  0  0

+    5.7339    1.7561    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 32  1  0

+ 12 33  1  0

+ 14 34  1  0

+ 14 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+62674-12-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -0.0487   -1.9891    0.0015 Cl  0  0  0

+   -0.3093   -0.2728    0.0029 C   0  0  0

+    0.6526    0.6526    0.0015 C   0  0  0

+   -1.6175    0.3832   -0.0007 C   0  0  0

+    2.3646    0.3648   -0.0023 Cl  0  0  0

+   -0.0338    1.9986    0.0035 C   0  0  0

+   -2.6871   -0.1945   -0.0051 O   0  0  0

+   -1.4622    1.7205    0.0015 O   0  0  0

+    0.9832    2.4030    0.0000 H   0  0  0

+   -0.3419    3.0488    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

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+  7  4  2  0

+  8  4  1  0

+  6  8  1  0

+  6  9  1  0

+  6 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+148193-36-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.5137   -0.1582   -0.0666 C   0  0  0

+   -1.6241    0.7110    0.0107 C   0  0  0

+    0.7850    0.3162   -0.1116 C   0  0  0

+   -1.2675   -1.7620   -0.0740 S   0  0  0

+   -2.8931    0.0022    0.0472 C   0  0  0

+   -1.3518    2.0980    0.0406 C   0  0  0

+    1.8305   -0.5495   -0.1863 O   0  0  0

+    1.0085    1.6818   -0.0801 C   0  0  0

+   -2.9089   -1.2981    0.0180 N   0  0  0

+   -4.0591    0.6960    0.1217 O   0  0  0

+   -0.0716    2.5530   -0.0040 C   0  0  0

+    3.0203    0.2413   -0.2165 C   0  0  0

+   -5.1133   -0.2685    0.1405 C   0  0  0

+    4.2411   -0.6771   -0.3009 C   0  0  0

+    5.5150    0.1697   -0.3332 C   0  0  0

+    5.0619   -0.4856    0.8531 O   0  0  0

+   -2.1464    2.7831    0.0000 H   0  0  0

+    1.9886    2.0562    0.0000 H   0  0  0

+    0.1045    3.5873    0.0000 H   0  0  0

+    3.7416    1.0032    0.0000 H   0  0  0

+    2.3447    1.0440    0.0000 H   0  0  0

+   -5.8215    0.5056    0.0000 H   0  0  0

+   -5.8874   -0.9767    0.0000 H   0  0  0

+   -4.4051   -1.0426    0.0000 H   0  0  0

+    4.0246   -1.7037    0.0000 H   0  0  0

+    6.5416   -0.0467    0.0000 H   0  0  0

+    5.3174    1.2001    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55610-00-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 33                          1 V2000

+   -0.2496    0.3518   -0.0292 C   0  0  0

+    0.6084   -0.7429   -0.0096 C   0  0  0

+    0.3239    1.6282   -0.0522 C   0  0  0

+   -1.6821    0.0558   -0.0177 C   0  0  0

+    0.2116   -2.0858    0.0186 C   0  0  0

+    2.0055   -0.6451   -0.0148 C   0  0  0

+    1.7152    1.7462   -0.0578 C   0  0  0

+   -0.2227    2.8740   -0.0714 O   0  0  0

+   -2.0774   -1.3070    0.0176 C   0  0  0

+   -2.6471    1.0613   -0.0411 C   0  0  0

+   -1.1246   -2.3539    0.0278 C   0  0  0

+    1.3788   -2.8454    0.0299 N   0  0  0

+    2.5518    0.6317   -0.0402 C   0  0  0

+    2.4682   -2.0358    0.0107 C   0  0  0

+    2.0311    3.0772   -0.0821 O   0  0  0

+    0.8351    3.7655    0.3264 C   0  0  0

+   -3.4502   -1.6080    0.0322 C   0  0  0

+   -3.9725    0.7303   -0.0284 C   0  0  0

+    3.6291   -2.4016    0.0136 O   0  0  0

+   -4.3685   -0.6019    0.0092 C   0  0  0

+   -2.3580    2.0643    0.0000 H   0  0  0

+   -1.4502   -3.3456    0.0000 H   0  0  0

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+    1.4570    4.6038    0.0000 H   0  0  0

+    0.0745    4.4804    0.0000 H   0  0  0

+   -3.7662   -2.6028    0.0000 H   0  0  0

+   -4.6941    1.4845    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 20 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-57-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.8136    0.1190    0.0036 C   0  0  0

+    0.0282   -0.9773    0.0031 C   0  0  0

+   -0.2885    1.3980    0.0019 C   0  0  0

+   -2.2806   -0.0767   -0.0004 N   0  3  0

+    1.4035   -0.7952    0.0010 C   0  0  0

+    1.0813    1.5871   -0.0002 C   0  0  0

+   -3.0238    0.8883    0.0000 O   0  0  0

+   -2.7448   -1.2028   -0.0040 O   0  5  0

+    1.9317    0.4939   -0.0007 C   0  0  0

+    2.2581   -1.9037    0.0010 N   0  0  0

+    3.2792    0.6785   -0.0032 O   0  0  0

+   -0.3682   -1.9357    0.0000 H   0  0  0

+   -0.9237    2.2178    0.0000 H   0  0  0

+    1.4720    2.5478    0.0000 H   0  0  0

+    1.8634   -2.8628    0.0000 H   0  0  0

+    3.2860   -1.7660    0.0000 H   0  0  0

+    4.3067    0.8193    0.0000 H   0  0  0

+  1  2  2  0

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+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+540-73-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.5535   -0.4713    0.3247 N   0  0  0

+   -0.5535    0.4713    0.3247 N   0  0  0

+    1.6649    0.1828   -0.3788 C   0  0  0

+   -1.6649   -0.1828   -0.3788 C   0  0  0

+    0.4697   -1.4349    0.0000 H   0  0  0

+   -0.4697    1.4349    0.0000 H   0  0  0

+    2.1555   -0.6507    0.0000 H   0  0  0

+    2.4984    0.6734    0.0000 H   0  0  0

+    1.1743    1.0163    0.0000 H   0  0  0

+   -2.1555    0.6507    0.0000 H   0  0  0

+   -2.4984   -0.6734    0.0000 H   0  0  0

+   -1.1743   -1.0163    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+363-03-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    0.3188    0.0008   -0.0036 C   0  0  0

+   -1.1492   -0.1587   -0.0219 C   0  0  0

+    0.9207    1.3434    0.1998 C   0  0  0

+    1.1232   -1.0789   -0.1669 C   0  0  0

+   -1.7775   -0.9873    0.9130 C   0  0  0

+   -1.9179    0.5224   -0.9702 C   0  0  0

+    2.3885    1.4946    0.2173 C   0  0  0

+    0.2071    2.3137    0.3509 O   0  0  0

+    2.5815   -0.9149   -0.1474 C   0  0  0

+   -3.1483   -1.1309    0.8901 C   0  0  0

+   -3.2882    0.3690   -0.9808 C   0  0  0

+    3.1760    0.4234    0.0501 C   0  0  0

+    3.3024   -1.8827   -0.2938 O   0  0  0

+   -3.9028   -0.4571   -0.0555 C   0  0  0

+    0.7214   -2.0053    0.0000 H   0  0  0

+   -1.2817   -1.8670    0.0000 H   0  0  0

+   -1.6129    1.4851    0.0000 H   0  0  0

+    2.7976    2.4178    0.0000 H   0  0  0

+   -3.4586   -2.0919    0.0000 H   0  0  0

+   -3.7911    1.2447    0.0000 H   0  0  0

+    4.1799    0.5322    0.0000 H   0  0  0

+   -4.9074   -0.5590    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  1  0

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+  3  7  1  0

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+ 11 14  2  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-90-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.5030    0.0406   -0.3530 C   0  0  0

+   -0.7119    0.7272    0.2742 C   0  0  0

+    1.7739    0.7995    0.0339 C   0  0  0

+    0.5905   -1.3420    0.1357 N   0  0  0

+   -1.9321   -0.0015   -0.0972 N   0  0  0

+   -0.3920   -0.5203    0.0000 H   0  0  0

+   -0.0419    1.5438    0.0000 H   0  0  0

+   -1.4012    1.5275    0.0000 H   0  0  0

+    2.3154   -0.1074    0.0000 H   0  0  0

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+   -0.2891   -1.9269    0.0000 H   0  0  0

+    1.5368   -1.8113    0.0000 H   0  0  0

+   -2.8546    0.5131    0.0000 H   0  0  0

+   -1.9165   -1.0577    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23045-12-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.9340    0.3914   -0.0039 C   0  0  0

+   -0.7935   -1.0215   -0.0027 C   0  0  0

+    0.2183    1.2018   -0.0031 C   0  0  0

+   -2.2183    0.9624    0.0000 C   0  0  0

+    0.4130   -1.5856   -0.0003 N   0  0  0

+   -1.9553   -1.8205   -0.0035 C   0  0  0

+    1.4724    0.5594   -0.0010 C   0  0  0

+    0.1223    2.5767   -0.0037 N   0  0  0

+   -3.3141    0.1560    0.0048 C   0  0  0

+    1.5296   -0.8591    0.0005 C   0  0  0

+   -3.1806   -1.2325   -0.0054 C   0  0  0

+    2.6647    1.3034   -0.0001 C   0  0  0

+   -4.6900    0.7709    0.0094 C   0  0  0

+    2.7911   -1.4889    0.0030 C   0  0  0

+    3.8621    0.6573    0.0019 C   0  0  0

+    3.9229   -0.7363    0.0047 C   0  0  0

+   -2.3315    2.0064    0.0000 H   0  0  0

+   -1.8740   -2.8675    0.0000 H   0  0  0

+    0.9929    3.1638    0.0000 H   0  0  0

+   -0.8215    3.0371    0.0000 H   0  0  0

+   -4.0416   -1.8337    0.0000 H   0  0  0

+    2.6316    2.3530    0.0000 H   0  0  0

+   -4.2615    1.7296    0.0000 H   0  0  0

+   -5.6487    1.1994    0.0000 H   0  0  0

+   -5.1185   -0.1878    0.0000 H   0  0  0

+    2.8560   -2.5370    0.0000 H   0  0  0

+    4.7519    1.2149    0.0000 H   0  0  0

+    4.8591   -1.2121    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+  7 10  2  0

+  9 11  1  0

+ 15 16  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1576-87-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.7132    0.1600   -0.4784 C   0  0  0

+   -0.4171    0.2220    0.2285 C   0  0  0

+    2.0202    0.5645    0.1534 C   0  0  0

+   -1.6856   -0.1705   -0.3847 C   0  0  0

+    2.9837   -0.6240    0.1376 C   0  0  0

+   -2.7131   -0.1141    0.2579 O   0  0  0

+    0.8351   -0.8284    0.0000 H   0  0  0

+   -0.5389    1.2104    0.0000 H   0  0  0

+    2.8670    1.0886    0.0000 H   0  0  0

+    1.6076    1.4709    0.0000 H   0  0  0

+   -1.5638   -1.1589    0.0000 H   0  0  0

+    2.2101   -1.2511    0.0000 H   0  0  0

+    3.6108   -1.3976    0.0000 H   0  0  0

+    3.7573    0.0031    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  2  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1555-94-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.4790   -0.2607    0.0018 C   0  0  0

+   -1.4936    0.7277    0.0012 C   0  0  0

+    0.8724    0.1448    0.0006 C   0  0  0

+   -0.8105   -1.5546   -0.0020 N   0  0  0

+   -1.1394    2.0869   -0.0010 C   0  0  0

+   -2.8412    0.3218    0.0025 C   0  0  0

+    1.1779    1.4759   -0.0011 C   0  0  0

+    1.8641   -0.7835    0.0016 O   0  0  0

+   -2.0646   -1.9369   -0.0063 C   0  0  0

+    0.1752    2.4420   -0.0026 C   0  0  0

+   -3.1109   -1.0174    0.0042 C   0  0  0

+    3.1005   -0.0671   -0.0001 C   0  0  0

+    4.2649   -1.0595    0.0010 C   0  0  0

+   -1.8812    2.8222    0.0000 H   0  0  0

+   -3.6136    1.0249    0.0000 H   0  0  0

+    2.1790    1.7738    0.0000 H   0  0  0

+   -2.2849   -2.9579    0.0000 H   0  0  0

+    0.4351    3.4536    0.0000 H   0  0  0

+   -4.1005   -1.3515    0.0000 H   0  0  0

+    3.8635    0.6462    0.0000 H   0  0  0

+    2.4781    0.7717    0.0000 H   0  0  0

+    3.5874   -1.8544    0.0000 H   0  0  0

+    5.0598   -1.7370    0.0000 H   0  0  0

+    4.9424   -0.2646    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  8 12  1  0

+ 12 13  1  0

+  7 10  1  0

+  9 11  2  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+32959-60-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.1667   -0.1570    0.0125 C   0  0  0

+   -1.6440   -0.2091    0.0109 C   0  0  0

+    0.5827   -0.1507    1.0855 N   0  0  0

+    0.6054   -0.1150   -1.0898 O   0  0  0

+   -2.3869    0.9723    0.0197 C   0  0  0

+   -2.3020   -1.4401   -0.0052 C   0  0  0

+    1.8857   -0.0977    0.7077 C   0  0  0

+    1.8978   -0.0747   -0.6965 C   0  0  0

+   -3.7656    0.9166    0.0177 C   0  0  0

+   -1.6849    2.3057    0.0318 C   0  0  0

+   -3.6808   -1.4817   -0.0070 C   0  0  0

+    3.0933   -0.0686    1.4098 C   0  0  0

+    3.1060   -0.0238   -1.3744 C   0  0  0

+   -4.4115   -0.3066    0.0070 C   0  0  0

+    4.2831   -0.0141    0.7194 C   0  0  0

+    4.2902    0.0078   -0.6677 C   0  0  0

+   -1.7888   -2.2678    0.0000 H   0  0  0

+   -4.2851    1.7404    0.0000 H   0  0  0

+   -0.8231    1.8520    0.0000 H   0  0  0

+   -1.2312    3.1675    0.0000 H   0  0  0

+   -2.5467    2.7594    0.0000 H   0  0  0

+   -4.1410   -2.3400    0.0000 H   0  0  0

+    3.1273   -1.0419    0.0000 H   0  0  0

+    3.0725    0.9495    0.0000 H   0  0  0

+   -5.3848   -0.3409    0.0000 H   0  0  0

+    4.8737   -0.7885    0.0000 H   0  0  0

+    5.0702    0.5910    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  2  0

+ 12 15  2  0

+ 13 16  2  0

+  7  8  2  0

+ 11 14  1  0

+ 15 16  1  0

+  6 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82-50-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.9482    0.4533    0.0908 C   0  0  0

+   -0.0311    1.4643    0.0893 C   0  0  0

+    2.2903    0.7929   -0.0384 C   0  0  0

+    0.5392   -0.9623    0.2239 C   0  0  0

+   -1.4587    1.1012    0.2261 C   0  0  0

+    0.3514    2.7946   -0.0416 C   0  0  0

+    2.6543    2.1229   -0.1677 C   0  0  0

+    3.5241   -0.4650   -0.0382 S   0  0  0

+   -0.8847   -1.3221    0.0459 C   0  0  0

+    1.3630   -1.8191    0.4759 O   0  0  0

+   -1.8639   -0.3115    0.0555 C   0  0  0

+   -2.2885    1.9528    0.4759 O   0  0  0

+    1.6925    3.1158   -0.1701 C   0  0  0

+    4.8489    0.1970   -0.3893 O   0  0  0

+    3.6482   -0.8838    1.3140 O   0  0  0

+    3.2126   -1.3116   -1.1361 O   0  0  0

+   -1.2637   -2.6499   -0.1202 C   0  0  0

+   -3.2033   -0.6490   -0.1068 C   0  0  0

+   -2.6009   -2.9682   -0.2858 C   0  0  0

+   -3.5642   -1.9761   -0.2658 C   0  0  0

+   -4.2400    0.4075   -0.1090 N   0  3  0

+   -5.2373    0.2837    0.5793 O   0  0  0

+   -4.0958    1.4008   -0.7990 O   0  5  0

+   -0.3651    3.5440    0.0000 H   0  0  0

+    3.6585    2.3806    0.0000 H   0  0  0

+    1.9821    4.1113    0.0000 H   0  0  0

+    5.7763    0.6604    0.0000 H   0  0  0

+   -0.5470   -3.3991    0.0000 H   0  0  0

+   -2.8906   -3.9637    0.0000 H   0  0  0

+   -4.5681   -2.2352    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  8 14  1  0

+  8 15  2  0

+  8 16  2  0

+  9 17  1  0

+ 11 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+ 18 21  1  0

+ 21 22  2  0

+ 21 23  1  0

+  7 13  2  0

+  9 11  2  0

+ 19 20  1  0

+  6 24  1  0

+  7 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 17 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+62-56-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.4994    0.0000    0.0016 C   0  0  0

+    1.1733   -1.1672   -0.0005 N   0  0  0

+    1.1733    1.1672   -0.0005 N   0  0  0

+   -1.2126    0.0000   -0.0002 S   0  0  0

+    0.6679   -2.0426    0.0000 H   0  0  0

+    2.1841   -1.1672    0.0000 H   0  0  0

+    2.1841    1.1672    0.0000 H   0  0  0

+    0.6679    2.0426    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60784-46-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    0.2378   -0.5094   -0.4278 N   0  0  0

+   -0.7293    0.4288   -0.4604 C   0  0  0

+    1.6348   -0.1295   -0.6523 C   0  0  0

+   -0.0660   -1.7410   -0.1938 N   0  0  0

+   -2.0144    0.0793   -0.2539 N   0  0  0

+   -0.4425    1.5895   -0.6759 O   0  0  0

+    2.2883    0.2242    0.6851 C   0  0  0

+    0.8079   -2.5889   -0.1644 O   0  0  0

+   -3.0656    1.0991   -0.2893 C   0  0  0

+    4.0075    0.6918    0.4089 Cl  0  0  0

+   -4.4223    0.4424   -0.0263 C   0  0  0

+   -4.4079   -0.1824    1.2588 O   0  0  0

+    1.4548   -1.1120    0.0000 H   0  0  0

+    2.4431   -0.7163    0.0000 H   0  0  0

+   -2.2638   -0.8879    0.0000 H   0  0  0

+    2.4683    1.2067    0.0000 H   0  0  0

+    1.4800    0.8110    0.0000 H   0  0  0

+   -2.2914    1.7302    0.0000 H   0  0  0

+   -3.6024    1.9414    0.0000 H   0  0  0

+   -4.7253    1.3942    0.0000 H   0  0  0

+   -5.4075    0.2777    0.0000 H   0  0  0

+   -4.3849   -1.1810    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  7 10  1  0

+  9 11  1  0

+ 11 12  1  0

+  3 13  1  0

+  3 14  1  0

+  5 15  1  0

+  7 16  1  0

+  7 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84174-22-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.3856    0.6932    0.5509 C   0  0  0

+   -1.8072    1.0946    0.8495 C   0  0  0

+    0.5063    1.6263    0.0555 C   0  0  0

+    0.0275   -0.6061    0.7778 C   0  0  0

+   -2.7183    0.3511   -0.0242 N   0  0  0

+    1.8101    1.2590   -0.2181 C   0  0  0

+    1.3315   -0.9747    0.5045 C   0  0  0

+   -3.0846   -0.8443    0.2935 N   0  0  0

+   -3.2133    0.9651   -1.2588 C   0  0  0

+    2.2229   -0.0429    0.0039 C   0  0  0

+   -3.8421   -1.4624   -0.4330 O   0  0  0

+    3.8607   -0.5051   -0.3396 Cl  0  0  0

+   -1.3501    1.9750    0.0000 H   0  0  0

+   -2.5769    1.7204    0.0000 H   0  0  0

+    0.2449    2.5832    0.0000 H   0  0  0

+   -0.6625   -1.3188    0.0000 H   0  0  0

+    2.5001    1.9717    0.0000 H   0  0  0

+    1.5923   -1.9318    0.0000 H   0  0  0

+   -2.4410    1.5877    0.0000 H   0  0  0

+   -3.8359    1.7374    0.0000 H   0  0  0

+   -3.9856    0.3425    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  8 11  2  0

+ 10 12  1  0

+  7 10  2  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+623-24-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -2.6130    0.0131   -1.2330 C   0  0  0

+   -3.9969   -0.0017    0.1633 Br  0  0  0

+   -1.2503    0.0062   -0.5897 C   0  0  0

+   -0.6254   -1.1938   -0.3073 C   0  0  0

+   -0.6227    1.2004   -0.2871 C   0  0  0

+    0.6248   -1.2001    0.2829 C   0  0  0

+    0.6272    1.1941    0.3029 C   0  0  0

+    1.2498   -0.0063    0.5906 C   0  0  0

+    2.6125   -0.0132    1.2340 C   0  0  0

+    3.9965    0.0016   -0.1623 Br  0  0  0

+   -2.1059    0.8917    0.0000 H   0  0  0

+   -3.1250    0.8889    0.0000 H   0  0  0

+   -1.1538   -2.0598    0.0000 H   0  0  0

+   -1.1451    2.0700    0.0000 H   0  0  0

+    1.1479   -2.0693    0.0000 H   0  0  0

+    1.1563    2.0596    0.0000 H   0  0  0

+    2.1054   -0.8918    0.0000 H   0  0  0

+    3.1245   -0.8890    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

+  9  8  1  0

+ 10  9  1  0

+  7  8  1  0

+  1 11  1  0

+  1 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89873-24-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+    1.1836    0.0011   -0.8074 C   0  0  0

+    1.7395   -1.2060   -0.3330 C   0  0  0

+    1.7472    1.2061   -0.3459 C   0  0  0

+    0.1311    0.0006   -1.6947 N   0  0  0

+    2.8281   -1.1756    0.5768 C   0  0  0

+    1.2212   -2.4426   -0.7552 C   0  0  0

+    2.8698    1.1507    0.5931 C   0  0  0

+    1.2620    2.4562   -0.7610 C   0  0  0

+   -1.1695    0.0048   -1.2246 C   0  0  0

+    3.3456   -0.0226    0.9996 N   0  0  0

+    3.3642   -2.3977    1.0362 C   0  0  0

+    1.7667   -3.5986   -0.2885 C   0  0  0

+    3.4249    2.3640    1.0475 C   0  0  0

+    1.8425    3.5915   -0.2841 C   0  0  0

+   -2.2367    0.0043   -2.1313 C   0  0  0

+   -1.4105    0.0036    0.1544 C   0  0  0

+    2.8366   -3.5737    0.6058 C   0  0  0

+    2.9109    3.5434    0.6083 C   0  0  0

+   -3.5187    0.0079   -1.6791 C   0  0  0

+   -2.6856    0.0073    0.6264 C   0  0  0

+   -3.7733    0.0122   -0.2836 C   0  0  0

+   -5.0197    0.0157    0.1668 N   0  0  0

+   -5.2174    0.0191    1.2733 N   0  3  0

+   -5.4151    0.0225    2.3798 N   0  5  0

+    0.1298   -0.9490    0.0000 H   0  0  0

+    0.2719   -2.4635    0.0000 H   0  0  0

+    0.3137    2.5048    0.0000 H   0  0  0

+    4.3138   -2.4017    0.0000 H   0  0  0

+    1.2677   -4.4065    0.0000 H   0  0  0

+    4.3744    2.3554    0.0000 H   0  0  0

+    1.3653    4.4124    0.0000 H   0  0  0

+   -2.2378   -0.9453    0.0000 H   0  0  0

+   -1.4095   -0.9460    0.0000 H   0  0  0

+    3.3619   -4.3648    0.0000 H   0  0  0

+    3.4489    4.3258    0.0000 H   0  0  0

+   -3.5281   -0.9416    0.0000 H   0  0  0

+   -2.6891   -0.9423    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+548-04-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 61                          1 V2000

+    0.7006    0.0812   -0.0011 C   0  0  0

+   -0.7004    0.0824   -0.0034 C   0  0  0

+    1.4195    1.3426   -0.1389 C   0  0  0

+    1.4215   -1.1772    0.1448 C   0  0  0

+   -1.4171    1.3448    0.1370 C   0  0  0

+   -1.4236   -1.1750   -0.1468 C   0  0  0

+    0.6979    2.5572   -0.2336 C   0  0  0

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+    0.7081   -2.3961    0.1866 C   0  0  0

+    2.8326   -1.1695    0.2279 C   0  0  0

+   -0.6933    2.5579    0.2348 C   0  0  0

+   -2.8268    1.3423    0.1892 C   0  0  0

+   -0.7123   -2.3952   -0.1861 C   0  0  0

+   -2.8347   -1.1649   -0.2304 C   0  0  0

+    1.3725    3.6550   -0.7595 C   0  0  0

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+    0.6468    4.8214   -1.3853 C   0  0  0

+    4.7820    0.1020    0.1245 O   0  0  0

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+    2.7811   -3.5412    0.6733 C   0  0  0

+    0.7421   -4.6769    0.9580 O   0  0  0

+    4.8588   -2.4092    0.5329 O   0  0  0

+   -2.7423    3.6535    0.8609 C   0  0  0

+   -0.6383    4.8193    1.3912 C   0  0  0

+   -4.7816    0.1110   -0.1307 O   0  0  0

+   -4.8410    2.5763    0.5771 O   0  0  0

+   -2.7874   -3.5375   -0.6710 C   0  0  0

+   -0.7505   -4.6777   -0.9516 O   0  0  0

+   -4.8631   -2.4013   -0.5345 O   0  0  0

+    3.2412    4.5598    0.0000 H   0  0  0

+    1.5248    5.3676    0.0000 H   0  0  0

+    0.1006    5.6994    0.0000 H   0  0  0

+   -0.2312    4.2752    0.0000 H   0  0  0

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+    3.2874   -4.4428    0.0000 H   0  0  0

+    0.2208   -5.5699    0.0000 H   0  0  0

+    5.8925   -2.4368    0.0000 H   0  0  0

+   -3.2330    4.5637    0.0000 H   0  0  0

+    0.2384    4.2711    0.0000 H   0  0  0

+   -0.0901    5.6960    0.0000 H   0  0  0

+   -1.5150    5.3675    0.0000 H   0  0  0

+   -5.8742    2.6165    0.0000 H   0  0  0

+   -3.2954   -4.4382    0.0000 H   0  0  0

+   -0.2311   -5.5718    0.0000 H   0  0  0

+   -5.8968   -2.4271    0.0000 H   0  0  0

+  1  2  2  0

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+ 33 50  1  0

+ 35 51  1  0

+ 36 52  1  0

+ 37 53  1  0

+ 38 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89837-94-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+   -0.3397    0.1471   -0.0084 N   0  0  0

+    0.5397   -0.7477    0.7480 C   0  0  0

+   -1.4036   -0.4090   -0.8481 C   0  0  0

+   -0.1808    1.4249    0.0692 N   0  0  0

+    1.6935   -1.0921   -0.0635 O   0  0  0

+   -2.6643   -0.5492   -0.0344 C   0  0  0

+   -0.9119    2.1688   -0.5596 O   0  0  0

+    2.7986   -0.3317   -0.0157 C   0  0  0

+   -3.9139   -1.1018   -0.6702 C   0  0  0

+   -2.6732   -0.2186    1.1270 O   0  0  0

+    3.9961   -0.6891   -0.8580 C   0  0  0

+    2.8333    0.6392    0.7026 O   0  0  0

+   -0.3157   -1.1308    0.0000 H   0  0  0

+    0.6011   -1.6830    0.0000 H   0  0  0

+   -1.6709   -1.3073    0.0000 H   0  0  0

+   -0.6802   -1.0050    0.0000 H   0  0  0

+   -4.2930   -0.2446    0.0000 H   0  0  0

+   -4.7711   -1.4809    0.0000 H   0  0  0

+   -3.5348   -1.9590    0.0000 H   0  0  0

+    3.7280   -1.5872    0.0000 H   0  0  0

+    4.8942   -0.9572    0.0000 H   0  0  0

+    4.2642    0.2090    0.0000 H   0  0  0

+  1  2  1  0

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+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-92-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.6964    0.3492   -0.4629 C   0  0  0

+   -3.0456   -0.3670   -0.3761 C   0  0  0

+   -2.5894    0.5306    0.6379 O   0  0  0

+   -0.5798   -0.6161   -0.0599 C   0  0  0

+    0.6804    0.0528   -0.1409 O   0  0  0

+    1.6771   -0.8956    0.2452 C   0  0  0

+    3.0370   -0.2496    0.1809 C   0  0  0

+    3.1508    1.0018   -0.1893 C   0  0  0

+   -1.2330    1.2925    0.0000 H   0  0  0

+   -4.0846   -0.2091    0.0000 H   0  0  0

+   -2.8692   -1.4031    0.0000 H   0  0  0

+   -1.3597   -1.3206    0.0000 H   0  0  0

+    0.0234   -1.4767    0.0000 H   0  0  0

+    0.8652   -1.5629    0.0000 H   0  0  0

+    2.2404   -1.7828    0.0000 H   0  0  0

+    3.8990   -0.8508    0.0000 H   0  0  0

+    4.1048    1.4427    0.0000 H   0  0  0

+    2.2920    1.6075    0.0000 H   0  0  0

+  1  2  1  0

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+  4 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25834-80-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    0.8619    1.0553    0.6026 C   0  0  0

+    0.0429    0.1511   -0.0451 C   0  0  0

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+    4.0303   -3.1033    0.0000 H   0  0  0

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+   -2.4267   -2.1963    0.0000 H   0  0  0

+   -5.9723    0.6870    0.0000 H   0  0  0

+   -4.4900   -2.6413    0.0000 H   0  0  0

+    6.0560   -3.0364    0.0000 H   0  0  0

+    6.9146   -1.6837    0.0000 H   0  0  0

+   -7.1141   -0.3770    0.0000 H   0  0  0

+   -6.8797   -1.9620    0.0000 H   0  0  0

+  1  2  1  0

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+ 21 41  1  0

+ 21 42  1  0

+ 23 43  1  0

+ 23 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118745-15-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+   -0.5599    0.0456    0.0459 C   0  0  0

+   -1.9678    0.1089    0.0121 C   0  0  0

+    0.1871    1.2416   -0.0121 C   0  0  0

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+    2.4047    2.3732   -0.0359 C   0  0  0

+    2.1421   -2.4604    0.2696 N   0  0  0

+   -4.7468    0.2350   -0.0546 C   0  0  0

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+    3.7793    2.3134   -0.0040 C   0  0  0

+    2.4454   -3.0692   -0.7408 O   0  0  0

+    4.4316    1.0912    0.0849 C   0  0  0

+    0.0802    3.3629    0.0000 H   0  0  0

+   -0.2323   -3.3197    0.0000 H   0  0  0

+   -2.3138    3.4757    0.0000 H   0  0  0

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+  1  2  1  0

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+ 14 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 22 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94730-48-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 80 85                          1 V2000

+   -0.5898   -1.5554    0.1931 C   0  0  0

+   -1.4675   -2.4080    0.8140 C   0  0  0

+    0.8364   -1.9379   -0.1094 C   0  0  2

+   -1.0083   -0.2747   -0.1918 C   0  0  0

+   -2.7853   -2.0014    1.0611 C   0  0  0

+   -1.0735   -3.7920    1.2622 C   0  0  0

+    1.2606   -3.1417    0.7288 C   0  0  0

+    1.6930   -0.8330    0.1861 O   0  0  0

+   -2.3154    0.1444    0.0460 C   0  0  0

+   -0.1334    0.5640   -0.8005 O   0  0  0

+   -3.2171   -0.7310    0.6841 C   0  0  0

+   -3.6479   -2.8512    1.6717 O   0  0  0

+    0.2059   -4.2419    0.5605 C   0  0  2

+    2.6695   -0.7773   -0.8558 C   0  0  1

+   -2.7555    1.4908   -0.3601 C   0  0  0

+   -4.6023   -0.3026    0.9435 C   0  0  0

+   -0.0691   -4.4619   -0.9047 C   0  0  0

+    0.6769   -5.4557    1.1496 O   0  0  0

+    3.1873    0.6563   -0.9935 C   0  0  0

+    3.7504   -1.6533   -0.5417 O   0  0  0

+   -4.1425    1.9192   -0.1040 C   0  0  0

+   -1.9754    2.2474   -0.9062 O   0  0  0

+   -5.0429    1.0483    0.5372 C   0  0  0

+   -5.3817   -1.0588    1.4902 O   0  0  0

+    0.8166   -5.3791   -1.7082 C   0  0  0

+   -0.9991   -3.9033   -1.4351 O   0  0  0

+    3.7985    1.0969    0.3414 C   0  0  2

+    4.2034   -1.3264    0.7706 C   0  0  2

+   -4.5690    3.1944   -0.4875 C   0  0  0

+   -6.3489    1.4622    0.7779 C   0  0  0

+    0.3555   -5.4227   -3.0601 O   0  0  0

+    4.4423    2.4069    0.1764 N   0  0  0

+    4.8468    0.0622    0.7660 C   0  0  1

+    5.2313   -2.3631    1.2283 C   0  0  0

+   -5.8808    3.5865   -0.2397 C   0  0  0

+   -3.7077    4.0454   -1.0980 O   0  0  0

+   -6.7568    2.7295    0.3951 C   0  0  0

+    3.3630    3.3916    0.0250 C   0  0  0

+    5.1140    2.7101    1.4470 C   0  0  0

+    5.9354    0.0797   -0.1594 O   0  0  0

+   -4.4324    5.2488   -1.3603 C   0  0  0

+    3.9543    4.8019    0.0216 C   0  0  0

+    2.6557    3.1531   -1.2437 C   0  0  0

+    5.6615    4.1374    1.4080 C   0  0  0

+    4.5835    5.0636    1.2758 O   0  0  0

+    2.1098    2.9690   -2.2228 N   0  0  0

+    0.1512   -2.6778    0.0000 H   0  0  0

+   -2.0793   -3.8647    0.0000 H   0  0  0

+   -1.2072   -4.7916    0.0000 H   0  0  0

+    1.8714   -3.9442    0.0000 H   0  0  0

+    2.1482   -2.6629    0.0000 H   0  0  0

+    0.5946    1.2619    0.0000 H   0  0  0

+   -4.3663   -3.5589    0.0000 H   0  0  0

+    2.3599   -1.7371    0.0000 H   0  0  0

+    1.0417   -6.3959    0.0000 H   0  0  0

+    2.8884    1.6195    0.0000 H   0  0  0

+    2.1791    0.6794    0.0000 H   0  0  0

+    1.1327   -6.3368    0.0000 H   0  0  0

+    1.6798   -4.8577    0.0000 H   0  0  0

+    3.0281    1.7477    0.0000 H   0  0  0

+    3.4255   -0.6846    0.0000 H   0  0  0

+   -7.0604    0.7475    0.0000 H   0  0  0

+   -0.6485   -5.5176    0.0000 H   0  0  0

+    5.2222    0.9982    0.0000 H   0  0  0

+    4.5152   -3.0732    0.0000 H   0  0  0

+    5.9414   -3.0792    0.0000 H   0  0  0

+    5.9474   -1.6530    0.0000 H   0  0  0

+   -6.1225    4.5656    0.0000 H   0  0  0

+   -7.7358    2.9716    0.0000 H   0  0  0

+    2.6759    4.1298    0.0000 H   0  0  0

+    5.2752    1.7146    0.0000 H   0  0  0

+    6.1171    2.6066    0.0000 H   0  0  0

+    6.9437    0.0959    0.0000 H   0  0  0

+   -3.5685    5.7691    0.0000 H   0  0  0

+   -4.9527    6.1127    0.0000 H   0  0  0

+   -5.2963    4.7285    0.0000 H   0  0  0

+    3.8231    5.8018    0.0000 H   0  0  0

+    2.9548    4.9359    0.0000 H   0  0  0

+    6.5556    3.6710    0.0000 H   0  0  0

+    6.2270    4.9724    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+ 33 40  1  0

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+ 39 44  1  0

+ 42 45  1  0

+ 43 46  3  0

+  7 13  1  0

+  9 11  2  0

+ 21 23  2  0

+ 28 33  1  0

+ 35 37  1  0

+ 44 45  1  0

+  3 47  1  0

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+  6 49  1  0

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+ 10 52  1  0

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+ 41 76  1  0

+ 42 77  1  0

+ 42 78  1  0

+ 44 79  1  0

+ 44 80  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51-79-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.3538   -0.4757    0.0000 O   0  0  0

+   -0.9179   -0.0336    0.0000 C   0  0  0

+    1.4525    0.4736    0.0000 C   0  0  0

+   -1.9377   -0.9147    0.0000 N   0  0  0

+   -1.1462    1.1599    0.0000 O   0  0  0

+    2.7815   -0.2845    0.0000 C   0  0  0

+    2.0494    1.2893    0.0000 H   0  0  0

+    0.7094    1.1588    0.0000 H   0  0  0

+   -2.8924   -0.5827    0.0000 H   0  0  0

+   -1.7478   -1.9075    0.0000 H   0  0  0

+    2.2807   -1.1625    0.0000 H   0  0  0

+    3.6595   -0.7853    0.0000 H   0  0  0

+    3.2823    0.5935    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+473-90-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.0000   -0.5480   -0.0013 C   0  0  0

+   -1.2917    0.1977   -0.0004 C   0  0  0

+    1.2917    0.1977   -0.0005 C   0  0  0

+    0.0000   -1.7561    0.0024 O   0  0  0

+   -2.4571   -0.4752   -0.0012 O   0  0  0

+   -1.2917    1.4105    0.0009 O   0  0  0

+    2.4571   -0.4752   -0.0013 O   0  0  0

+    1.2917    1.4105    0.0009 O   0  0  0

+   -3.3311   -0.9799    0.0000 H   0  0  0

+    3.3311   -0.9799    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  5  9  1  0

+  7 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+478-45-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.6322    0.8075   -0.0020 C   0  0  0

+   -0.8151   -0.5884   -0.0012 C   0  0  0

+    0.7315    1.3746   -0.0017 C   0  0  0

+   -1.7440    1.6544    0.0028 C   0  0  0

+    0.3581   -1.4869    0.0000 C   0  0  0

+   -2.0998   -1.1181   -0.0010 C   0  0  0

+    1.9003    0.4810   -0.0010 C   0  0  0

+    0.8884    2.5806   -0.0024 O   0  0  0

+   -3.0259    1.1164    0.0082 C   0  0  0

+   -1.5724    2.9997    0.0025 O   0  0  0

+    1.7214   -0.9164    0.0003 C   0  0  0

+    0.2022   -2.6921    0.0010 O   0  0  0

+   -3.2062   -0.2650   -0.0016 C   0  0  0

+    3.1954    1.0143   -0.0006 C   0  0  0

+    2.8296   -1.7535    0.0009 C   0  0  0

+   -4.5732   -0.8303   -0.0015 C   0  0  0

+    4.2928    0.1631    0.0005 C   0  0  0

+    3.3772    2.3579   -0.0018 O   0  0  0

+    4.1125   -1.2108    0.0008 C   0  0  0

+   -5.6412   -0.0097   -0.0021 O   0  0  0

+   -4.7324   -2.0342   -0.0008 O   0  0  0

+    5.1924   -2.0327    0.0014 O   0  0  0

+   -2.2381   -2.1526    0.0000 H   0  0  0

+   -3.8558    1.7494    0.0000 H   0  0  0

+   -1.4403    4.0350    0.0000 H   0  0  0

+    2.7012   -2.7893    0.0000 H   0  0  0

+    5.2580    0.5602    0.0000 H   0  0  0

+    3.5171    3.3922    0.0000 H   0  0  0

+   -6.4688    0.6262    0.0000 H   0  0  0

+    6.0229   -2.6648    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  5 11  1  0

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+  6 13  2  0

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+ 11 15  1  0

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+  7 11  2  0

+  9 13  1  0

+ 17 19  1  0

+  6 23  1  0

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+ 10 25  1  0

+ 15 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 20 29  1  0

+ 22 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17987-99-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.8632    0.7501    0.0052 C   0  0  0

+   -1.4056   -0.5540   -0.0060 C   0  0  0

+    0.4688    0.9170    0.0059 N   0  3  0

+   -1.7291    1.8561    0.0213 C   0  0  0

+   -0.5634   -1.6347   -0.0165 N   0  3  0

+   -2.7892   -0.7227   -0.0058 C   0  0  0

+    1.2761   -0.1441   -0.0039 C   0  0  0

+    0.9408    2.0398    0.0151 O   0  5  0

+   -3.0776    1.6572    0.0259 C   0  0  0

+    0.7565   -1.4365   -0.0159 C   0  0  0

+   -1.0885   -2.9497   -0.0273 O   0  5  0

+   -3.6073    0.3710    0.0053 C   0  0  0

+    2.7384    0.0532   -0.0034 C   0  0  0

+    3.5613   -1.0080    0.1069 O   0  0  0

+    3.2004    1.1725   -0.1026 O   0  0  0

+   -1.3485    2.8089    0.0000 H   0  0  0

+   -3.1922   -1.6662    0.0000 H   0  0  0

+   -3.7093    2.4656    0.0000 H   0  0  0

+    1.3926   -2.2415    0.0000 H   0  0  0

+   -4.6252    0.2423    0.0000 H   0  0  0

+    4.1900   -1.8188    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+  7 10  1  0

+  9 12  1  0

+  4 16  1  0

+  6 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 14 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+371-40-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.5085    0.0001    0.0019 C   0  0  0

+   -0.8130   -1.2022    0.0013 C   0  0  0

+   -0.8132    1.2020    0.0014 C   0  0  0

+   -2.9067    0.0001   -0.0028 N   0  0  0

+    0.5680   -1.1998    0.0002 C   0  0  0

+    0.5682    1.1996    0.0003 C   0  0  0

+    1.2594    0.0001   -0.0003 C   0  0  0

+    2.6104    0.0001   -0.0010 F   0  0  0

+   -1.3311   -2.1022    0.0000 H   0  0  0

+   -1.3313    2.1020    0.0000 H   0  0  0

+   -3.4259    0.8994    0.0000 H   0  0  0

+   -3.4259   -0.8992    0.0000 H   0  0  0

+    1.0884   -2.0985    0.0000 H   0  0  0

+    1.0886    2.0983    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  6  7  2  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2319-96-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.1296   -0.2487   -0.0021 C   0  0  0

+   -1.5326   -0.6872   -0.0017 C   0  0  0

+    0.1564    1.1870   -0.0002 C   0  0  0

+    0.9040   -1.1708    0.0015 C   0  0  0

+   -2.5578    0.2819    0.0005 C   0  0  0

+   -1.8605   -2.0440   -0.0030 C   0  0  0

+    1.4722    1.6368   -0.0010 C   0  0  0

+   -0.9552    2.1362    0.0020 C   0  0  0

+    2.2287   -0.7244    0.0016 C   0  0  0

+   -2.2306    1.7039    0.0019 C   0  0  0

+   -3.8955   -0.1384    0.0009 C   0  0  0

+   -3.1833   -2.4250   -0.0021 C   0  0  0

+    2.5185    0.7116   -0.0035 C   0  0  0

+    3.3051   -1.6339    0.0060 C   0  0  0

+   -3.3484    2.7146    0.0032 C   0  0  0

+   -4.1921   -1.4701   -0.0008 C   0  0  0

+    3.8645    1.1314   -0.0039 C   0  0  0

+    4.5800   -1.1636    0.0067 C   0  0  0

+    4.8561    0.2027   -0.0059 C   0  0  0

+    0.6940   -2.1975    0.0000 H   0  0  0

+   -1.1036   -2.7688    0.0000 H   0  0  0

+    1.6777    2.6644    0.0000 H   0  0  0

+   -0.7573    3.1653    0.0000 H   0  0  0

+   -4.6674    0.5704    0.0000 H   0  0  0

+   -3.4311   -3.4432    0.0000 H   0  0  0

+    3.1236   -2.6660    0.0000 H   0  0  0

+   -2.6456    3.4919    0.0000 H   0  0  0

+   -4.1257    3.4174    0.0000 H   0  0  0

+   -4.0512    1.9373    0.0000 H   0  0  0

+   -5.1942   -1.7766    0.0000 H   0  0  0

+    4.0985    2.1529    0.0000 H   0  0  0

+    5.3758   -1.8454    0.0000 H   0  0  0

+    5.8543    0.5218    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  2  0

+ 13 17  1  0

+ 14 18  2  0

+ 17 19  2  0

+  8 10  1  0

+  9 13  1  0

+ 12 16  1  0

+ 18 19  1  0

+  4 20  1  0

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+  7 22  1  0

+  8 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

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+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1822-51-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.3564    0.0039   -1.0016 C   0  0  0

+   -2.4874   -0.0011    0.4025 Cl  0  0  0

+    0.0652    0.0018   -0.5016 C   0  0  0

+    0.7344   -1.1901   -0.2705 C   0  0  0

+    0.7370    1.1920   -0.2670 C   0  0  0

+    2.0378   -1.1528    0.1881 C   0  0  0

+    2.0399    1.1509    0.1914 C   0  0  0

+    2.6436   -0.0020    0.4055 N   0  0  0

+   -0.8679    0.8509    0.0000 H   0  0  0

+   -1.8474    0.8495    0.0000 H   0  0  0

+    0.2525   -2.0409    0.0000 H   0  0  0

+    0.2574    2.0441    0.0000 H   0  0  0

+    2.5551   -1.9826    0.0000 H   0  0  0

+    2.5593    1.9794    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

+  7  8  1  0

+  1  9  1  0

+  1 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2449-49-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+    0.3365   -0.2296    0.2839 C   0  0  0

+   -1.1184   -0.5436    0.5197 C   0  0  0

+    0.7738    1.0813    0.3107 C   0  0  0

+    1.2350   -1.2533    0.0463 C   0  0  0

+   -1.9311    0.6406    0.2110 N   0  0  0

+   -1.5428   -1.7030   -0.3839 C   0  0  0

+    2.1086    1.3693    0.0943 C   0  0  0

+    2.5693   -0.9653   -0.1699 C   0  0  0

+   -1.7823    0.8911   -1.2288 C   0  0  0

+   -3.3327    0.2595    0.4305 C   0  0  0

+    3.0057    0.3464   -0.1489 C   0  0  0

+   -2.1345   -0.6716    0.0000 H   0  0  0

+    0.0903    1.8440    0.0000 H   0  0  0

+    0.9139   -2.2258    0.0000 H   0  0  0

+   -2.5045   -1.3510    0.0000 H   0  0  0

+   -1.8948   -2.6647    0.0000 H   0  0  0

+   -0.5811   -2.0550    0.0000 H   0  0  0

+    2.4299    2.3417    0.0000 H   0  0  0

+    3.2531   -1.7277    0.0000 H   0  0  0

+   -0.9018    0.3681    0.0000 H   0  0  0

+   -1.2593    1.7716    0.0000 H   0  0  0

+   -2.6628    1.4141    0.0000 H   0  0  0

+   -3.6014    1.2478    0.0000 H   0  0  0

+   -4.3210   -0.0092    0.0000 H   0  0  0

+   -3.0640   -0.7288    0.0000 H   0  0  0

+    4.0095    0.5493    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  7 11  2  0

+  8 11  1  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

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+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+127045-41-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+    0.0779   -0.3684   -0.0683 C   0  0  0

+   -1.2938   -0.6316   -0.0774 C   0  0  0

+    0.5241    0.9609   -0.0163 C   0  0  0

+    0.9911   -1.4068   -0.1224 N   0  0  0

+   -2.1912    0.4227   -0.0521 C   0  0  0

+   -1.7713   -1.9010   -0.0962 O   0  0  0

+    1.9754    1.2238    0.0069 C   0  0  0

+   -0.3942    2.0122    0.0113 C   0  0  0

+    2.3143   -1.2059   -0.0821 C   0  0  0

+    0.4719   -2.7798   -0.2408 C   0  0  2

+   -3.6714    0.1402   -0.0718 C   0  0  0

+   -1.7450    1.7363   -0.0095 C   0  0  0

+   -0.9098   -2.7022   -0.8998 C   0  0  0

+    2.8698    0.0559   -0.0200 C   0  0  0

+    2.4147    2.3597    0.0464 O   0  0  0

+    0.3382   -3.3964    1.1531 C   0  0  0

+   -4.2292   -0.7810    1.0150 C   0  0  0

+   -4.5166    0.7209    1.0637 C   0  0  0

+   -4.2845    0.0656   -1.4046 N   0  0  0

+   -2.6385    2.7494    0.0122 F   0  0  0

+    4.3286    0.2299    0.0182 C   0  0  0

+    4.8583    1.4680    0.0784 O   0  0  0

+    5.0575   -0.7427   -0.0046 O   0  0  0

+   -0.0629    2.9933    0.0000 H   0  0  0

+    2.9438   -2.0282    0.0000 H   0  0  0

+    1.4650   -3.0735    0.0000 H   0  0  0

+   -1.8038   -3.2249    0.0000 H   0  0  0

+   -0.6672   -3.7089    0.0000 H   0  0  0

+   -0.6738   -3.1770    0.0000 H   0  0  0

+    0.1188   -4.4084    0.0000 H   0  0  0

+    1.3502   -3.6158    0.0000 H   0  0  0

+   -5.1533   -1.2483    0.0000 H   0  0  0

+   -3.5254   -1.5407    0.0000 H   0  0  0

+   -4.1729    1.6978    0.0000 H   0  0  0

+   -5.5493    0.7981    0.0000 H   0  0  0

+   -4.9068    0.8933    0.0000 H   0  0  0

+   -4.6902   -0.8872    0.0000 H   0  0  0

+    5.2656    2.4201    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

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+ 21 23  2  0

+  8 12  2  0

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+ 17 18  1  0

+  8 24  1  0

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+ 16 29  1  0

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+ 17 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+836-30-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -0.1663   -0.9517   -0.0531 C   0  0  0

+   -1.4904   -1.3966   -0.0827 N   0  0  0

+    0.4727   -0.7477    1.1637 C   0  0  0

+    0.5162   -0.7178   -1.2402 C   0  0  0

+   -2.5385   -0.4740   -0.0371 C   0  0  0

+    1.7813   -0.3080    1.1893 C   0  0  0

+    1.8250   -0.2779   -1.2072 C   0  0  0

+   -3.8490   -0.9152    0.0948 C   0  0  0

+   -2.2719    0.8873   -0.1176 C   0  0  0

+    2.4560   -0.0705    0.0055 C   0  0  0

+   -4.8828   -0.0003    0.1401 C   0  0  0

+   -3.3101    1.7964   -0.0717 C   0  0  0

+    3.8587    0.4014    0.0369 N   0  3  0

+   -4.6143    1.3534    0.0544 C   0  0  0

+    4.4542    0.6110   -1.0048 O   0  0  0

+    4.4174    0.5801    1.1043 O   0  5  0

+   -1.6948   -2.4113    0.0000 H   0  0  0

+    0.7949   -1.7313    0.0000 H   0  0  0

+    0.1835    0.2623    0.0000 H   0  0  0

+    2.1180   -1.2868    0.0000 H   0  0  0

+    1.4985    0.7043    0.0000 H   0  0  0

+   -4.0545   -1.9297    0.0000 H   0  0  0

+   -1.2924    1.2218    0.0000 H   0  0  0

+   -5.8636   -0.3311    0.0000 H   0  0  0

+   -3.1087    2.8117    0.0000 H   0  0  0

+   -5.3927    2.0356    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  4  7  1  0

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+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94-36-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    2.8907    0.2164   -0.0121 C   0  0  0

+    1.4464    0.5289   -0.0125 C   0  0  0

+    3.7564    0.9014   -0.8665 C   0  0  0

+    3.3964   -0.7612    0.8469 C   0  0  0

+    0.6158   -0.1322    0.8111 O   0  0  0

+    1.0099    1.3839   -0.7577 O   0  0  0

+    5.1039    0.6050   -0.8607 C   0  0  0

+    4.7456   -1.0476    0.8425 C   0  0  0

+   -0.6158    0.1342    0.8108 O   0  0  0

+    5.5975   -0.3685   -0.0108 C   0  0  0

+   -1.4464   -0.5290   -0.0112 C   0  0  0

+   -2.8907   -0.2165   -0.0116 C   0  0  0

+   -1.0099   -1.3857   -0.7544 O   0  0  0

+   -3.7564   -0.9035   -0.8643 C   0  0  0

+   -3.3964    0.7632    0.8451 C   0  0  0

+   -5.1039   -0.6071   -0.8593 C   0  0  0

+   -4.7456    1.0496    0.8400 C   0  0  0

+   -5.5975    0.3684   -0.0117 C   0  0  0

+    3.5708    1.7072    0.0000 H   0  0  0

+    2.8951   -1.4188    0.0000 H   0  0  0

+    5.6102    1.2587    0.0000 H   0  0  0

+    4.9357   -1.8523    0.0000 H   0  0  0

+    6.4055   -0.5443    0.0000 H   0  0  0

+   -3.5702   -1.7091    0.0000 H   0  0  0

+   -2.8948    1.4206    0.0000 H   0  0  0

+   -5.6105   -1.2606    0.0000 H   0  0  0

+   -4.9363    1.8542    0.0000 H   0  0  0

+   -6.4055    0.5439    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115066-03-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+   -0.8283    0.1088   -0.0174 C   0  0  0

+   -0.3971   -1.1761   -0.0314 C   0  0  0

+    0.2421    0.9511    0.0858 N   0  0  0

+   -2.2925    0.4657   -0.1008 C   0  0  0

+    1.0407   -1.1489    0.0745 C   0  0  0

+   -1.3515   -2.3386   -0.1491 C   0  0  0

+    1.3980    0.2241    0.1449 C   0  0  0

+   -3.0677   -0.6778    0.2675 O   0  0  0

+   -2.5943    1.6199    0.8572 C   0  0  0

+   -2.6384    0.8803   -1.5324 C   0  0  0

+    2.0144   -2.1524    0.1127 C   0  0  0

+   -2.7083   -1.7632   -0.5865 C   0  0  0

+    2.7337    0.6046    0.2524 C   0  0  0

+   -4.0789    1.9796    0.7706 C   0  0  0

+    3.3216   -1.7474    0.2200 C   0  0  0

+    3.6748   -0.4096    0.2869 C   0  0  0

+    3.1358    2.0551    0.3272 C   0  0  0

+    3.3746    2.5916   -1.0856 C   0  0  0

+    0.1875    1.9874    0.0000 H   0  0  0

+   -1.8458   -3.2510    0.0000 H   0  0  0

+   -0.4904   -2.9176    0.0000 H   0  0  0

+   -1.5609    1.7145    0.0000 H   0  0  0

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+   -3.3032    1.6771    0.0000 H   0  0  0

+   -3.4352    0.2155    0.0000 H   0  0  0

+    1.7577   -3.1578    0.0000 H   0  0  0

+   -3.7427   -1.8456    0.0000 H   0  0  0

+   -2.8745   -2.7875    0.0000 H   0  0  0

+   -3.8345    2.9881    0.0000 H   0  0  0

+   -5.0874    2.2240    0.0000 H   0  0  0

+   -4.3233    0.9711    0.0000 H   0  0  0

+    4.0707   -2.4655    0.0000 H   0  0  0

+    4.6815   -0.1579    0.0000 H   0  0  0

+    2.4850    2.8634    0.0000 H   0  0  0

+    2.1196    1.8452    0.0000 H   0  0  0

+    4.3226    2.1696    0.0000 H   0  0  0

+    3.7966    3.5396    0.0000 H   0  0  0

+    2.4266    3.0136    0.0000 H   0  0  0

+  1  2  2  0

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+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 18 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+22204-53-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -0.8065    0.6863   -0.0614 C   0  0  0

+   -1.0966   -0.6879   -0.2550 C   0  0  0

+    0.5262    1.1250   -0.1313 C   0  0  0

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+   -3.1371    1.1288    0.2466 C   0  0  0

+   -3.4246   -0.2280    0.0663 C   0  0  0

+    1.2338   -1.1227   -0.5734 C   0  0  0

+    2.9470    0.7027   -0.4578 C   0  0  1

+   -4.7130   -0.6549    0.1329 O   0  0  0

+    3.7657   -0.0005    0.5941 C   0  0  0

+    3.5172    0.3884   -1.8423 C   0  0  0

+   -5.5157    0.4955    0.4056 C   0  0  0

+    5.0756    0.2666    0.7146 O   0  0  0

+    3.2430   -0.8046    1.3289 O   0  0  0

+    0.7389    2.1303    0.0000 H   0  0  0

+   -1.6711    2.5960    0.0000 H   0  0  0

+   -2.6409   -2.1332    0.0000 H   0  0  0

+   -0.2293   -2.5952    0.0000 H   0  0  0

+   -3.9107    1.8051    0.0000 H   0  0  0

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+   -4.6730    1.0835    0.0000 H   0  0  0

+   -6.1037    1.3382    0.0000 H   0  0  0

+   -6.3584   -0.0925    0.0000 H   0  0  0

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+  1  2  1  0

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+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91540-30-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.3578    1.3735    0.9342 C   0  0  0

+   -1.2134    0.0986    0.9820 C   0  0  0

+   -1.3103    1.0473   -0.1354 N   0  0  0

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+   -2.5095    1.8611    0.1045 C   0  0  0

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+    1.2663   -2.3997   -0.4351 C   0  0  0

+   -0.7779   -3.5390    0.0722 C   0  0  0

+   -4.7099    1.1020   -0.6326 C   0  0  0

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+    0.5208   -3.5589   -0.4041 C   0  0  0

+   -0.4816    2.3572    0.0000 H   0  0  0

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+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+621-64-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+   -0.0902   -0.3077    0.0949 N   0  0  0

+   -1.3137    0.3232    0.5963 C   0  0  0

+    0.9408    0.5063   -0.5536 C   0  0  0

+    0.0816   -1.5791    0.2293 N   0  0  0

+   -2.3739    0.3281   -0.5069 C   0  0  0

+    1.9339    1.0044    0.4983 C   0  0  0

+    1.0988   -2.1035   -0.1875 O   0  0  0

+   -3.6516    0.9869    0.0167 C   0  0  0

+    3.0107    1.8545   -0.1791 C   0  0  0

+   -0.5870    0.9713    0.0000 H   0  0  0

+   -1.6584    1.2339    0.0000 H   0  0  0

+    0.9319    1.4800    0.0000 H   0  0  0

+    0.0626    0.9269    0.0000 H   0  0  0

+   -3.1006   -0.3200    0.0000 H   0  0  0

+   -2.0292   -0.5826    0.0000 H   0  0  0

+    1.9428    0.0307    0.0000 H   0  0  0

+    2.8121    0.5838    0.0000 H   0  0  0

+   -3.2054    1.8523    0.0000 H   0  0  0

+   -4.5170    1.4331    0.0000 H   0  0  0

+   -4.0978    0.1215    0.0000 H   0  0  0

+    3.6141    1.0903    0.0000 H   0  0  0

+    3.7749    2.4579    0.0000 H   0  0  0

+    2.4073    2.6187    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  1  0

+  2 10  1  0

+  2 11  1  0

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+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+486-56-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.4739   -0.7080   -0.6629 C   0  0  1

+   -0.9323   -0.3263   -0.2782 C   0  0  0

+    1.3590    0.4504   -0.4934 N   0  0  0

+    1.0033   -1.7782    0.3173 C   0  0  0

+   -1.9871   -0.5648   -1.1463 C   0  0  0

+   -1.1877    0.2608    0.9464 C   0  0  0

+    2.5001    0.1061    0.1279 C   0  0  0

+    1.0396    1.8075   -0.9432 C   0  0  0

+    2.4883   -1.3704    0.4573 C   0  0  0

+   -3.2636   -0.1970   -0.7503 C   0  0  0

+   -2.4156    0.5976    1.2901 N   0  0  0

+    3.4076    0.8682    0.3863 O   0  0  0

+   -3.4415    0.3911    0.4879 C   0  0  0

+   -0.1138   -1.4226    0.0000 H   0  0  0

+    0.1495   -2.1347    0.0000 H   0  0  0

+    1.3047   -2.6530    0.0000 H   0  0  0

+   -2.0140   -1.4896    0.0000 H   0  0  0

+   -0.5818    0.9600    0.0000 H   0  0  0

+    1.9402    2.0195    0.0000 H   0  0  0

+    0.8276    2.7081    0.0000 H   0  0  0

+    0.1390    1.5955    0.0000 H   0  0  0

+    2.6503   -2.2813    0.0000 H   0  0  0

+    3.4103   -1.2928    0.0000 H   0  0  0

+   -3.9135   -0.8555    0.0000 H   0  0  0

+   -4.2354    0.8662    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  7 12  2  0

+ 10 13  1  0

+  7  9  1  0

+ 11 13  2  0

+  1 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25152-84-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+   -0.0833   -0.8405   -0.3536 C   0  0  0

+   -1.4158   -0.9281    0.3449 C   0  0  0

+    0.9871   -0.3866    0.3041 C   0  0  0

+   -2.4343   -0.0527   -0.3879 C   0  0  0

+    2.2790   -0.3016   -0.3732 C   0  0  0

+   -3.7871   -0.1416    0.3213 C   0  0  0

+    3.3667    0.1596    0.2952 C   0  0  0

+   -4.8057    0.7338   -0.4116 C   0  0  0

+    4.6115    0.2414   -0.3574 C   0  0  0

+   -6.1584    0.6448    0.2976 C   0  0  0

+    5.5848    0.6542    0.2407 O   0  0  0

+    0.1448   -1.8000    0.0000 H   0  0  0

+   -2.2322   -1.4815    0.0000 H   0  0  0

+   -1.0955   -1.8609    0.0000 H   0  0  0

+    0.7590    0.5729    0.0000 H   0  0  0

+   -1.6179    0.5007    0.0000 H   0  0  0

+   -2.7545    0.8801    0.0000 H   0  0  0

+    2.5071   -1.2611    0.0000 H   0  0  0

+   -4.6035   -0.6951    0.0000 H   0  0  0

+   -3.4668   -1.0744    0.0000 H   0  0  0

+    3.1387    1.1192    0.0000 H   0  0  0

+   -3.9894    1.2873    0.0000 H   0  0  0

+   -5.1260    1.6666    0.0000 H   0  0  0

+    4.8396   -0.7181    0.0000 H   0  0  0

+   -6.2232    1.6289    0.0000 H   0  0  0

+   -7.1425    0.5800    0.0000 H   0  0  0

+   -6.0936   -0.3393    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  2  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  2  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16596-38-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+    1.0918   -0.2630   -0.6820 C   0  0  0

+    0.0099   -0.7322    0.1939 N   0  0  0

+    2.2600    0.2340    0.1719 C   0  0  0

+   -1.2366   -0.6140   -0.5744 C   0  0  0

+    0.2341   -2.1524    0.4106 N   0  0  0

+    3.4404    0.5878   -0.7350 C   0  0  0

+    1.8278    1.4759    0.9541 C   0  0  0

+   -1.9953    0.6367   -0.1262 C   0  0  0

+   -3.2091    0.8493   -1.0330 C   0  0  0

+   -2.4637    0.4583    1.3194 C   0  0  0

+    1.2033    0.6694    0.0000 H   0  0  0

+    0.3388    0.2980    0.0000 H   0  0  0

+    2.5791   -0.6492    0.0000 H   0  0  0

+   -2.1244   -0.9201    0.0000 H   0  0  0

+   -1.1254   -1.5465    0.0000 H   0  0  0

+   -0.4960   -2.7430    0.0000 H   0  0  0

+    1.1106   -2.4894    0.0000 H   0  0  0

+    3.7100   -0.3117    0.0000 H   0  0  0

+    4.3399    0.8574    0.0000 H   0  0  0

+    3.1708    1.4873    0.0000 H   0  0  0

+    2.7147    1.7846    0.0000 H   0  0  0

+    1.5191    2.3628    0.0000 H   0  0  0

+    0.9409    1.1672    0.0000 H   0  0  0

+   -1.4655    1.4120    0.0000 H   0  0  0

+   -3.0471    1.7743    0.0000 H   0  0  0

+   -4.1341    1.0113    0.0000 H   0  0  0

+   -3.3711   -0.0757    0.0000 H   0  0  0

+   -2.7979    1.3359    0.0000 H   0  0  0

+   -3.3413    0.1241    0.0000 H   0  0  0

+   -2.1295   -0.4193    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  8  9  1  0

+  8 10  1  0

+  1 11  1  0

+  1 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

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+  7 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+480-19-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+   -2.4858    0.4340    0.0678 C   0  0  0

+   -1.8509   -0.7812   -0.2426 C   0  0  0

+   -1.6565    1.6381    0.2351 C   0  0  0

+   -3.8781    0.4840    0.2180 C   0  0  0

+   -0.5090   -0.8218   -0.3797 O   0  0  0

+   -2.6150   -1.9271   -0.4041 C   0  0  0

+   -0.2545    1.4934    0.0705 C   0  0  0

+   -2.1551    2.7191    0.5052 O   0  0  0

+   -4.6218   -0.6701    0.0586 C   0  0  0

+   -4.4917    1.6568    0.5180 O   0  0  0

+    0.2621    0.2688   -0.2296 C   0  0  0

+   -3.9921   -1.8689   -0.2596 C   0  0  0

+    0.5674    2.5688    0.2117 O   0  0  0

+    1.7210    0.1352   -0.3968 C   0  0  0

+   -4.7328   -2.9953   -0.4198 O   0  0  0

+    2.4925   -0.4411    0.6163 C   0  0  0

+    2.3351    0.5795   -1.5711 C   0  0  0

+    3.8593   -0.5637    0.4544 C   0  0  0

+    3.6990    0.4538   -1.7254 C   0  0  0

+    4.4656   -0.1133   -0.7169 C   0  0  0

+    4.6130   -1.1236    1.4382 O   0  0  0

+    5.8098   -0.2344   -0.8740 O   0  0  0

+    3.7171   -1.4786    2.4934 C   0  0  0

+   -2.1564   -2.8295    0.0000 H   0  0  0

+   -5.6330   -0.6252    0.0000 H   0  0  0

+   -4.9609    2.5537    0.0000 H   0  0  0

+    1.1821    3.3730    0.0000 H   0  0  0

+   -5.2890   -3.8411    0.0000 H   0  0  0

+    2.1307   -1.3865    0.0000 H   0  0  0

+    2.0678    1.5558    0.0000 H   0  0  0

+    4.0598    1.3996    0.0000 H   0  0  0

+    6.8180   -0.3252    0.0000 H   0  0  0

+    3.3442   -0.5376    0.0000 H   0  0  0

+    2.7761   -1.8515    0.0000 H   0  0  0

+    4.0900   -2.4196    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+ 11 14  1  0

+ 12 15  1  0

+ 14 16  2  0

+ 14 17  1  0

+ 16 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+ 18 21  1  0

+ 20 22  1  0

+ 21 23  1  0

+  7 11  2  0

+  9 12  1  0

+ 19 20  1  0

+  6 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 22 32  1  0

+ 23 33  1  0

+ 23 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88-21-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.3521    0.1937    0.0034 C   0  0  0

+    1.1400   -0.9500    0.0006 C   0  0  0

+    0.9470    1.4403    0.0038 C   0  0  0

+   -1.4044    0.0547   -0.0010 S   0  0  0

+    2.5247   -0.8359   -0.0018 C   0  0  0

+    0.5418   -2.2121    0.0006 N   0  0  0

+    2.3252    1.5503    0.0015 C   0  0  0

+   -1.9726    1.4666    0.0078 O   0  0  0

+   -1.7454   -0.4908   -1.2680 O   0  0  0

+   -1.7502   -0.5084    1.2570 O   0  0  0

+    3.1129    0.4134   -0.0013 C   0  0  0

+    0.3591    2.2949    0.0000 H   0  0  0

+    3.1160   -1.6882    0.0000 H   0  0  0

+   -0.4921   -2.2960    0.0000 H   0  0  0

+    1.1314   -3.0656    0.0000 H   0  0  0

+    2.7695    2.4877    0.0000 H   0  0  0

+   -2.3599    2.4289    0.0000 H   0  0  0

+    4.1467    0.4993    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  4 10  2  0

+  5 11  2  0

+  7 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+36519-91-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.7159   -0.2622    0.4914 C   0  0  0

+   -2.1922   -0.4087    0.7562 C   0  0  0

+   -0.1149    0.9780    0.5966 C   0  0  0

+    0.0379   -1.3696    0.1490 C   0  0  0

+   -2.9667   -0.2069   -0.5478 C   0  0  0

+    1.2393    1.1129    0.3543 C   0  0  0

+    1.3918   -1.2360   -0.0934 C   0  0  0

+   -4.4655   -0.3556   -0.2790 C   0  0  0

+   -3.8357    0.9198   -0.4162 O   0  0  0

+    1.9931    0.0063    0.0066 C   0  0  0

+    3.6938    0.1749   -0.2979 Cl  0  0  0

+   -2.8268   -1.2255    0.0000 H   0  0  0

+   -1.6921   -1.3142    0.0000 H   0  0  0

+   -0.7070    1.8262    0.0000 H   0  0  0

+   -0.4002   -2.3066    0.0000 H   0  0  0

+   -3.0473   -1.2381    0.0000 H   0  0  0

+    1.6768    2.0502    0.0000 H   0  0  0

+    1.9837   -2.0843    0.0000 H   0  0  0

+   -5.4616   -0.0769    0.0000 H   0  0  0

+   -4.5553   -1.3861    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

+ 10 11  1  0

+  7 10  1  0

+  8  9  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1634-04-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.4104    0.0266    0.0000 C   0  0  0

+   -0.7544   -0.8012    0.0004 O   0  0  0

+    0.4083    0.9106    1.2487 C   0  0  0

+    1.6617   -0.8537    0.0005 C   0  0  0

+    0.4083    0.9093   -1.2497 C   0  0  0

+   -1.8836    0.0746    0.0000 C   0  0  0

+    1.4800    0.9131    0.0000 H   0  0  0

+    0.4058    1.9823    0.0000 H   0  0  0

+   -0.6634    0.9081    0.0000 H   0  0  0

+    1.0450   -1.7303    0.0000 H   0  0  0

+    2.5383   -1.4704    0.0000 H   0  0  0

+    2.2784    0.0229    0.0000 H   0  0  0

+    1.4800    0.9118    0.0000 H   0  0  0

+    0.4058    1.9810    0.0000 H   0  0  0

+   -0.6634    0.9068    0.0000 H   0  0  0

+   -1.2268    0.9215    0.0000 H   0  0  0

+   -2.7305    0.7314    0.0000 H   0  0  0

+   -2.5404   -0.7723    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-65-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -1.2794    0.7031   -0.0023 C   0  0  0

+   -1.2794   -0.7031   -0.0018 C   0  0  0

+    0.0000    1.4432   -0.0017 C   0  0  0

+   -2.4887    1.3923    0.0023 C   0  0  0

+    0.0000   -1.4432   -0.0005 C   0  0  0

+   -2.4887   -1.3923   -0.0019 C   0  0  0

+    1.2793    0.7032   -0.0005 C   0  0  0

+    0.0000    2.6582   -0.0027 O   0  0  0

+   -3.6821    0.6914    0.0075 C   0  0  0

+    1.2794   -0.7031    0.0001 C   0  0  0

+    0.0000   -2.6582    0.0004 O   0  0  0

+   -3.6821   -0.6914   -0.0025 C   0  0  0

+    2.4887    1.3923    0.0006 C   0  0  0

+    2.4887   -1.3923    0.0008 C   0  0  0

+    3.6821    0.6914    0.0022 C   0  0  0

+    3.6821   -0.6914    0.0009 C   0  0  0

+   -2.4955    2.4362    0.0000 H   0  0  0

+   -2.4955   -2.4362    0.0000 H   0  0  0

+   -4.5881    1.2100    0.0000 H   0  0  0

+   -4.5881   -1.2100    0.0000 H   0  0  0

+    2.4956    2.4362    0.0000 H   0  0  0

+    2.4955   -2.4362    0.0000 H   0  0  0

+    4.5881    1.2100    0.0000 H   0  0  0

+    4.5881   -1.2100    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  2  0

+  7 13  1  0

+ 10 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+  7 10  2  0

+  9 12  1  0

+ 15 16  1  0

+  4 17  1  0

+  6 18  1  0

+  9 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+119-84-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.3162    0.5611   -0.1044 C   0  0  0

+   -0.5424   -0.7951    0.0509 C   0  0  0

+    0.9441    1.0584   -0.2467 O   0  0  0

+   -1.3880    1.4461   -0.1233 C   0  0  0

+    0.5894   -1.7899    0.0875 C   0  0  0

+   -1.8409   -1.2619    0.1810 C   0  0  0

+    1.9914    0.2290   -0.0483 C   0  0  0

+   -2.6785    0.9744    0.0074 C   0  0  0

+    1.8382   -1.1885   -0.5636 C   0  0  0

+   -2.9041   -0.3812    0.1618 C   0  0  0

+    2.9976    0.5975    0.5102 O   0  0  0

+   -1.2133    2.4643    0.0000 H   0  0  0

+   -0.1899   -2.4680    0.0000 H   0  0  0

+    1.1576   -2.6526    0.0000 H   0  0  0

+   -2.0191   -2.2795    0.0000 H   0  0  0

+   -3.4735    1.6341    0.0000 H   0  0  0

+    2.1071   -2.1859    0.0000 H   0  0  0

+    2.8681   -1.1082    0.0000 H   0  0  0

+   -3.8720   -0.7423    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  7  9  1  0

+  8 10  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67809-14-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+   -0.0115   -0.0146   -0.0009 N   0  0  0

+   -1.1813    0.6547    0.0011 C   0  0  0

+    1.1032    0.6347    0.0009 N   0  0  0

+   -0.0058   -1.4796    0.0009 C   0  0  0

+   -2.2253    0.0465   -0.0006 O   0  0  0

+    2.1604    0.0298   -0.0009 O   0  0  0

+   -1.1851    1.6222    0.0000 H   0  0  0

+   -0.9733   -1.4834    0.0000 H   0  0  0

+   -0.0020   -2.4471    0.0000 H   0  0  0

+    0.9617   -1.4758    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  3  6  2  0

+  2  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24634-61-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 15                          1 V2000

+   -2.7036   -0.6469   -0.4890 C   0  0  0

+   -3.6417    0.0792    0.1839 C   0  0  0

+   -1.4723   -0.9233    0.1101 C   0  0  0

+   -4.8892    0.3592   -0.4231 C   0  0  0

+   -0.5484   -1.6384   -0.5525 O   0  0  0

+   -1.2122   -0.4739    1.3490 O   0  0  0

+   -5.8096    1.0717    0.2371 C   0  0  0

+   -7.1379    1.3698   -0.4093 C   0  0  0

+    8.6005    0.4621   -0.0831 K   0  3  0

+   -3.0824   -1.4520    0.0000 H   0  0  0

+   -3.2629    0.8843    0.0000 H   0  0  0

+   -5.2680   -0.4458    0.0000 H   0  0  0

+   -5.4308    1.8768    0.0000 H   0  0  0

+   -6.9431    2.2379    0.0000 H   0  0  0

+   -8.0060    1.5646    0.0000 H   0  0  0

+   -7.3327    0.5017    0.0000 H   0  0  0

+   -0.7665    0.2961    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  3  5  2  0

+  3  6  1  0

+  4  7  2  0

+  7  8  1  0

+  1 10  1  0

+  2 11  1  0

+  4 12  1  0

+  7 13  1  0

+  8 14  1  0

+  8 15  1  0

+  8 16  1  0

+  6 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+127-00-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    1.0665    0.0791   -0.3445 C   0  0  0

+   -0.0852    0.8258    0.3314 C   0  0  0

+    2.3879    0.7793   -0.0207 C   0  0  0

+    1.1097   -1.2658    0.1365 O   0  0  0

+   -1.6423    0.0007   -0.0502 Cl  0  0  0

+    0.1299   -0.4495    0.0000 H   0  0  0

+    0.6437    1.6167    0.0000 H   0  0  0

+   -0.7418    1.6776    0.0000 H   0  0  0

+    2.8915   -0.1710    0.0000 H   0  0  0

+    3.3382    1.2829    0.0000 H   0  0  0

+    1.8843    1.7296    0.0000 H   0  0  0

+    1.1442   -2.3408    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+180913-77-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.1517    0.0340    0.1695 C   0  0  0

+   -1.3751    0.8418    0.0260 C   0  0  0

+    1.0170    0.6262    0.2932 C   0  0  0

+   -0.2372   -1.4364    0.1808 C   0  0  0

+   -2.6833    0.1790   -0.1124 C   0  0  0

+   -1.2994    2.1556    0.0219 C   0  0  0

+    2.2403   -0.1816    0.4369 C   0  0  0

+    1.1018    2.0967    0.2884 C   0  0  0

+   -1.5460   -2.0991    0.0481 C   0  0  0

+    0.8558   -2.1581    0.3088 C   0  0  0

+   -2.7680   -1.2915   -0.1080 C   0  0  0

+   -3.7764    0.9007   -0.2396 C   0  0  0

+    0.0088    2.8184    0.1602 C   0  0  0

+   -2.5228    2.9634   -0.1214 C   0  0  0

+    2.1646   -1.4954    0.4411 C   0  0  0

+    3.4437    0.4281    0.5642 N   0  0  0

+   -1.6159   -3.3031    0.0567 O   0  0  0

+   -3.8391   -1.8342   -0.2212 O   0  0  0

+   -3.6916    2.3713   -0.2440 C   0  0  0

+    4.4451    0.1268   -0.2861 C   0  0  0

+    5.8194    0.7050   -0.0668 C   0  0  0

+    4.2402   -0.6096   -1.2277 O   0  0  0

+    2.0838    2.5891    0.0000 H   0  0  0

+    0.7927   -3.2549    0.0000 H   0  0  0

+   -4.7584    0.4082    0.0000 H   0  0  0

+    0.0717    3.9152    0.0000 H   0  0  0

+   -2.4598    4.0602    0.0000 H   0  0  0

+    3.0836   -2.0973    0.0000 H   0  0  0

+    3.3468    1.5224    0.0000 H   0  0  0

+   -4.6107    2.9731    0.0000 H   0  0  0

+    6.2454   -0.3076    0.0000 H   0  0  0

+    6.8320    1.1310    0.0000 H   0  0  0

+    5.3934    1.7176    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

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+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

+  7 16  1  0

+  9 17  2  0

+ 11 18  2  0

+ 12 19  1  0

+ 16 20  1  0

+ 20 21  1  0

+ 20 22  2  0

+  8 13  2  0

+  9 11  1  0

+ 10 15  1  0

+ 14 19  2  0

+  8 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 19 30  1  0

+ 21 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+581-89-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -1.0067    0.5561   -0.0026 C   0  0  0

+   -1.3988   -0.8061   -0.0012 C   0  0  0

+    0.3606    0.8794   -0.0020 C   0  0  0

+   -1.9933    1.5571    0.0014 C   0  0  0

+   -0.4125   -1.8066    0.0013 C   0  0  0

+   -2.7666   -1.1292   -0.0018 C   0  0  0

+    1.2882   -0.1169   -0.0001 C   0  0  0

+   -3.3082    1.2064    0.0064 C   0  0  0

+    0.9028   -1.4558    0.0022 C   0  0  0

+   -3.6938   -0.1330   -0.0037 C   0  0  0

+    2.7278    0.2274    0.0000 N   0  3  0

+    3.5654   -0.6568    0.0016 O   0  0  0

+    3.0747    1.3949   -0.0016 O   0  5  0

+    0.6639    1.8796    0.0000 H   0  0  0

+   -1.7186    2.5655    0.0000 H   0  0  0

+   -0.6872   -2.8150    0.0000 H   0  0  0

+   -3.0701   -2.1293    0.0000 H   0  0  0

+   -4.0399    1.9527    0.0000 H   0  0  0

+    1.6345   -2.2021    0.0000 H   0  0  0

+   -4.7103   -0.3760    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  7  9  2  0

+  8 10  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1709-39-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    1.0324   -0.3580   -0.7486 S   0  0  0

+   -0.6747   -0.2353   -0.3298 C   0  0  0

+    1.8911    0.4010    0.4467 N   0  0  0

+    1.3580   -1.7370   -0.6417 O   0  0  0

+    1.2027    0.4396   -1.9123 O   0  0  0

+   -1.4169    0.8460   -0.7690 C   0  0  0

+   -1.2707   -1.2231    0.4323 C   0  0  0

+    2.3490   -0.3569    1.6139 C   0  0  0

+    2.1930    1.8304    0.3371 C   0  0  0

+   -2.7549    0.9452   -0.4426 C   0  0  0

+   -2.6087   -1.1301    0.7624 C   0  0  0

+    3.6237   -1.1237    1.2560 C   0  0  0

+    1.0353    2.6424    0.9214 C   0  0  0

+   -3.3555   -0.0427    0.3278 C   0  0  0

+   -4.7087    0.0548    0.6602 N   0  0  0

+   -0.9157    1.7181    0.0000 H   0  0  0

+   -0.8068   -2.1157    0.0000 H   0  0  0

+    1.3597   -0.5388    0.0000 H   0  0  0

+    2.1690   -1.3466    0.0000 H   0  0  0

+    3.1404    1.4924    0.0000 H   0  0  0

+    2.6550    2.7240    0.0000 H   0  0  0

+   -3.2152    1.8396    0.0000 H   0  0  0

+   -3.1078   -2.0035    0.0000 H   0  0  0

+    3.1052   -1.9857    0.0000 H   0  0  0

+    4.4857   -1.6422    0.0000 H   0  0  0

+    4.1422   -0.2617    0.0000 H   0  0  0

+    1.6129    3.4659    0.0000 H   0  0  0

+    0.2118    3.2200    0.0000 H   0  0  0

+    0.4577    1.8189    0.0000 H   0  0  0

+   -5.1478    0.9598    0.0000 H   0  0  0

+   -5.2730   -0.7780    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  3  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 14 15  1  0

+ 11 14  2  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17024-17-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.3793   -0.8447   -0.0310 C   0  0  0

+   -0.6757    0.0952   -0.0032 C   0  0  0

+    1.7604   -0.3543   -0.0005 C   0  0  0

+    0.0902   -2.2093   -0.0808 C   0  0  0

+   -1.9998   -0.3637   -0.0319 C   0  0  0

+   -0.3851    1.4783    0.0535 C   0  0  0

+    1.9846    1.0397    0.0556 C   0  0  0

+    2.8471   -1.2304   -0.0251 C   0  0  0

+   -1.2110   -2.6250   -0.1022 C   0  0  0

+   -2.2512   -1.7037   -0.0862 C   0  0  0

+   -3.1215    0.6018   -0.0031 N   0  3  0

+    0.8853    1.9292    0.0820 C   0  0  0

+    3.3019    1.5188    0.0852 C   0  0  0

+    4.1185   -0.7323    0.0053 C   0  0  0

+   -4.0576    0.4253    0.7558 O   0  0  0

+   -3.1082    1.5728   -0.7384 O   0  5  0

+    4.3434    0.6382    0.0596 C   0  0  0

+    0.8662   -2.9110    0.0000 H   0  0  0

+   -1.1727    2.1669    0.0000 H   0  0  0

+    2.6881   -2.2644    0.0000 H   0  0  0

+   -1.4268   -3.6487    0.0000 H   0  0  0

+   -3.2408   -2.0429    0.0000 H   0  0  0

+    1.0619    2.9604    0.0000 H   0  0  0

+    3.4856    2.5487    0.0000 H   0  0  0

+    4.9320   -1.3901    0.0000 H   0  0  0

+    5.3250    1.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+ 11 15  2  0

+ 11 16  1  0

+ 13 17  2  0

+  7 12  1  0

+  9 10  2  0

+ 14 17  1  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67-47-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    1.0843   -0.0639   -0.2831 C   0  0  0

+    0.0350   -0.8849   -0.1549 O   0  0  0

+    0.6505    1.2169   -0.2429 C   0  0  0

+    2.5192   -0.4968   -0.4403 C   0  0  0

+   -1.0939   -0.1547   -0.0298 C   0  0  0

+   -0.7408    1.1790   -0.0813 C   0  0  0

+    3.2952    0.0251    0.6402 O   0  0  0

+   -2.4026   -0.6646    0.1259 C   0  0  0

+   -3.3428    0.0972    0.2289 O   0  0  0

+    1.2303    2.0491    0.0000 H   0  0  0

+    2.0139   -1.3761    0.0000 H   0  0  0

+    3.2612   -1.1882    0.0000 H   0  0  0

+   -1.3703    1.9742    0.0000 H   0  0  0

+    4.1368    0.5911    0.0000 H   0  0  0

+   -2.5589   -1.6667    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  2  0

+  5  6  2  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6344-63-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.3969   -0.6808   -0.0012 C   0  0  0

+   -1.0714   -0.4646   -0.0008 C   0  0  0

+    1.0462    0.5495   -0.0003 C   0  0  0

+    1.1522   -1.8552    0.0029 C   0  0  0

+   -1.3389    0.9014    0.0004 C   0  0  0

+   -2.1336   -1.3707   -0.0014 C   0  0  0

+   -0.0138    1.6235    0.0008 C   0  0  0

+    2.4303    0.6074   -0.0006 C   0  0  0

+    2.5308   -1.7917    0.0013 C   0  0  0

+   -2.6412    1.3546    0.0010 C   0  0  0

+   -3.4330   -0.9084   -0.0007 C   0  0  0

+    3.1730   -0.5683   -0.0017 C   0  0  0

+    3.0788    1.8446   -0.0001 N   0  0  0

+   -3.6890    0.4512    0.0005 C   0  0  0

+    0.6736   -2.7821    0.0000 H   0  0  0

+   -1.9446   -2.3966    0.0000 H   0  0  0

+    0.7937    2.2839    0.0000 H   0  0  0

+   -0.5961    2.4890    0.0000 H   0  0  0

+    3.0908   -2.6718    0.0000 H   0  0  0

+   -2.8365    2.3793    0.0000 H   0  0  0

+   -4.2258   -1.5864    0.0000 H   0  0  0

+    4.2153   -0.5266    0.0000 H   0  0  0

+    4.1211    1.8872    0.0000 H   0  0  0

+    2.5208    2.7260    0.0000 H   0  0  0

+   -4.6736    0.7957    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+  8 13  1  0

+ 10 14  2  0

+  5  7  1  0

+  9 12  2  0

+ 11 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+924-42-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.5335    0.0443   -0.1311 C   0  0  0

+   -0.5722    0.8033   -0.2650 N   0  0  0

+    1.8271    0.6761    0.1713 C   0  0  0

+    0.4609   -1.1633   -0.2554 O   0  0  0

+   -1.8604    0.1741   -0.5662 C   0  0  0

+    2.9182   -0.0729    0.3034 C   0  0  0

+   -2.5258   -0.1569    0.6544 O   0  0  0

+   -0.4987    1.7998    0.0000 H   0  0  0

+    1.9006    1.6726    0.0000 H   0  0  0

+   -1.7937    1.1711    0.0000 H   0  0  0

+   -2.6918    0.7284    0.0000 H   0  0  0

+    2.8404   -1.0691    0.0000 H   0  0  0

+    3.8198    0.3578    0.0000 H   0  0  0

+   -3.4204   -0.6019    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  2  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5392-40-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+   -1.3791   -0.7995   -0.2145 C   0  0  0

+    0.0372   -0.9225   -0.7145 C   0  0  0

+   -2.0245    0.3641   -0.3178 C   0  0  0

+   -2.0688   -1.9920    0.3964 C   0  0  0

+    1.0088   -0.5757    0.4154 C   0  0  0

+   -3.3991    0.4835    0.1674 C   0  0  0

+    2.4251   -0.6987   -0.0845 C   0  0  0

+   -3.9859    1.5413    0.0735 O   0  0  0

+    3.2528    0.3093    0.0379 C   0  0  0

+    3.8360    0.9588   -1.1906 C   0  0  0

+    3.6217    0.8194    1.4071 C   0  0  0

+   -0.4077   -1.8047    0.0000 H   0  0  0

+    0.6912   -1.6632    0.0000 H   0  0  0

+   -1.4867    1.1930    0.0000 H   0  0  0

+   -2.9241   -1.4973    0.0000 H   0  0  0

+   -2.5635   -2.8473    0.0000 H   0  0  0

+   -1.2135   -2.4867    0.0000 H   0  0  0

+    1.4537    0.3065    0.0000 H   0  0  0

+    0.3548    0.1650    0.0000 H   0  0  0

+   -3.9369   -0.3454    0.0000 H   0  0  0

+    2.8084   -1.6094    0.0000 H   0  0  0

+    4.5712    0.2987    0.0000 H   0  0  0

+    4.4961    1.6940    0.0000 H   0  0  0

+    3.1008    1.6189    0.0000 H   0  0  0

+    4.4223    0.2404    0.0000 H   0  0  0

+    4.2007    1.6200    0.0000 H   0  0  0

+    2.8211    1.3984    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  2  0

+  7  9  2  0

+  9 10  1  0

+  9 11  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20268-52-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.6722    0.4382    0.0035 C   0  0  0

+    0.0452   -0.8842    0.0012 C   0  0  0

+    2.1400    0.5216    0.0022 C   0  0  0

+   -0.1054    1.5846    0.0012 C   0  0  0

+   -1.3418   -0.9998    0.0018 C   0  0  0

+    0.8918   -2.0757   -0.0023 C   0  0  0

+    2.8981   -0.6679   -0.0012 C   0  0  0

+    2.7886    1.7576    0.0039 C   0  0  0

+   -1.4991    1.4754   -0.0035 C   0  0  0

+   -2.1311    0.1540    0.0047 C   0  0  0

+   -2.0872   -2.5676   -0.0016 Cl  0  0  0

+    2.2340   -1.9674   -0.0034 C   0  0  0

+    4.2978   -0.5863   -0.0025 C   0  0  0

+    4.1644    1.8049    0.0021 C   0  0  0

+   -2.3205    2.6205   -0.0064 C   0  0  0

+   -3.5385    0.0757    0.0059 C   0  0  0

+    4.9101    0.6330   -0.0004 C   0  0  0

+   -3.6717    2.4760   -0.0113 C   0  0  0

+   -4.2733    1.2186    0.0092 C   0  0  0

+    0.3490    2.5295    0.0000 H   0  0  0

+    0.4488   -3.0260    0.0000 H   0  0  0

+    2.2308    2.6454    0.0000 H   0  0  0

+    2.8168   -2.8389    0.0000 H   0  0  0

+    4.8740   -1.4623    0.0000 H   0  0  0

+    4.6531    2.7325    0.0000 H   0  0  0

+   -1.8920    3.5774    0.0000 H   0  0  0

+   -4.0151   -0.8582    0.0000 H   0  0  0

+    5.9572    0.6861    0.0000 H   0  0  0

+   -4.2771    3.3320    0.0000 H   0  0  0

+   -5.3197    1.1530    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  1  0

+ 13 17  2  0

+ 15 18  2  0

+ 16 19  2  0

+  7 12  1  0

+  9 10  1  0

+ 14 17  1  0

+ 18 19  1  0

+  4 20  1  0

+  6 21  1  0

+  8 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93673-31-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 38                          1 V2000

+    1.1909    0.9823    0.1672 C   0  0  0

+    1.8883   -0.2099    0.1086 C   0  0  0

+    2.2037    2.0965    0.2729 C   0  0  0

+   -0.1973    0.9261    0.1262 C   0  0  0

+    3.2759   -0.0770    0.1594 C   0  0  0

+    1.2428   -1.5090    0.0026 C   0  0  0

+    3.5808    1.3973    0.2671 C   0  0  0

+    3.0535    2.0741   -0.8757 O   0  0  0

+   -0.8719   -0.3722    0.0245 C   0  0  0

+   -0.9976    2.1469    0.1826 C   0  0  0

+    4.0268   -1.2086    0.1061 C   0  0  0

+   -0.1531   -1.5598   -0.0424 C   0  0  0

+    2.0766   -2.6427   -0.0477 C   0  0  0

+   -2.3425   -0.3936   -0.0156 C   0  0  0

+   -2.3423    2.0928    0.1439 C   0  0  0

+    3.4272   -2.4660    0.0036 C   0  0  0

+   -3.0540    0.8223    0.0445 C   0  0  0

+   -3.0382   -1.6001   -0.1115 C   0  0  0

+   -4.4555    0.7973    0.0074 C   0  0  0

+   -4.4143   -1.5921   -0.1458 C   0  0  0

+   -5.1142   -0.3939   -0.0867 C   0  0  0

+    1.7935    3.0578    0.0000 H   0  0  0

+    4.5986    1.6345    0.0000 H   0  0  0

+   -0.5195    3.0762    0.0000 H   0  0  0

+    5.0693   -1.1350    0.0000 H   0  0  0

+   -0.6496   -2.4794    0.0000 H   0  0  0

+    1.6665   -3.6040    0.0000 H   0  0  0

+   -2.8887    2.9837    0.0000 H   0  0  0

+    4.0412   -3.3117    0.0000 H   0  0  0

+   -2.5180   -2.5066    0.0000 H   0  0  0

+   -4.9944    1.6928    0.0000 H   0  0  0

+   -4.9372   -2.4970    0.0000 H   0  0  0

+   -6.1593   -0.4062    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

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+  5 11  1  0

+  6 12  1  0

+  6 13  2  0

+  9 14  1  0

+ 10 15  2  0

+ 11 16  2  0

+ 14 17  2  0

+ 14 18  1  0

+ 17 19  1  0

+ 18 20  2  0

+ 19 21  2  0

+  5  7  1  0

+  7  8  1  0

+  9 12  2  0

+ 13 16  1  0

+ 15 17  1  0

+ 20 21  1  0

+  3 22  1  0

+  7 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7251-61-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.2202    0.6278   -0.0029 C   0  0  0

+   -0.4600   -0.7697   -0.0009 C   0  0  0

+    1.0376    1.0818   -0.0023 N   0  0  0

+   -1.3121    1.5135    0.0005 C   0  0  0

+    0.5746   -1.6169    0.0015 N   0  0  0

+   -1.7847   -1.2408   -0.0010 C   0  0  0

+    2.0372    0.2297    0.0000 C   0  0  0

+   -2.5802    1.0207    0.0056 C   0  0  0

+    1.8011   -1.1465    0.0019 C   0  0  0

+   -2.8160   -0.3534   -0.0029 C   0  0  0

+    3.4542    0.7429    0.0006 C   0  0  0

+   -1.1522    2.5341    0.0000 H   0  0  0

+   -1.9741   -2.2563    0.0000 H   0  0  0

+   -3.3802    1.6743    0.0000 H   0  0  0

+    2.5996   -1.8019    0.0000 H   0  0  0

+   -3.7881   -0.7029    0.0000 H   0  0  0

+    3.8060   -0.2284    0.0000 H   0  0  0

+    4.4255    1.0947    0.0000 H   0  0  0

+    3.1024    1.7142    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  7  9  2  0

+  8 10  1  0

+  4 12  1  0

+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60-11-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    0.6044    0.3766   -0.0011 C   0  0  0

+   -0.7465    0.5678   -0.0013 N   0  0  0

+    1.4685    1.4769   -0.0011 C   0  0  0

+    1.1293   -0.9207    0.0049 C   0  0  0

+   -1.5417   -0.4479   -0.0014 N   0  0  0

+    2.8309    1.2798   -0.0009 C   0  0  0

+    2.4924   -1.1094    0.0051 C   0  0  0

+   -2.8953   -0.2563   -0.0016 C   0  0  0

+    3.3490   -0.0119   -0.0007 C   0  0  0

+   -3.7600   -1.3544   -0.0016 C   0  0  0

+   -3.4211    1.0383    0.0040 C   0  0  0

+    4.7277   -0.2071   -0.0010 N   0  0  0

+   -5.1242   -1.1533   -0.0019 C   0  0  0

+   -4.7879    1.2239    0.0036 C   0  0  0

+    5.2751   -1.5660   -0.0008 C   0  0  0

+    5.6308    0.9464   -0.0014 C   0  0  0

+   -5.6377    0.1320   -0.0022 C   0  0  0

+    1.0817    2.4433    0.0000 H   0  0  0

+    0.4895   -1.7418    0.0000 H   0  0  0

+    3.4744    2.0980    0.0000 H   0  0  0

+    2.8836   -2.0740    0.0000 H   0  0  0

+   -3.3752   -2.3216    0.0000 H   0  0  0

+   -2.7829    1.8606    0.0000 H   0  0  0

+   -5.7694   -1.9702    0.0000 H   0  0  0

+   -5.1810    2.1878    0.0000 H   0  0  0

+    4.3096   -1.9549    0.0000 H   0  0  0

+    5.6640   -2.5315    0.0000 H   0  0  0

+    6.2406   -1.1771    0.0000 H   0  0  0

+    6.4504    0.3047    0.0000 H   0  0  0

+    6.2725    1.7660    0.0000 H   0  0  0

+    4.8112    1.5881    0.0000 H   0  0  0

+   -6.6684    0.2779    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 12 15  1  0

+ 12 16  1  0

+ 13 17  1  0

+  7  9  1  0

+ 14 17  2  0

+  3 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+32954-58-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+    1.6713    0.1501    0.0047 C   0  0  0

+    0.3057    0.6827   -0.0149 C   0  0  0

+    2.9226    0.8996   -0.1932 C   0  0  0

+    2.0511   -1.1473    0.2168 C   0  0  0

+   -0.8657   -0.2386    0.2087 C   0  0  0

+    0.1185    1.8653   -0.2112 O   0  0  0

+    3.9112   -0.0001   -0.0888 C   0  0  0

+    3.3837   -1.2103    0.1543 O   0  0  0

+   -2.1664    0.5640    0.1386 C   0  0  0

+   -3.3557   -0.3714    0.3656 C   0  0  0

+   -4.6564    0.4311    0.2954 C   0  0  0

+   -3.3653   -1.3833   -0.6435 O   0  0  0

+    3.0271    1.9483    0.0000 H   0  0  0

+    1.3994   -1.9756    0.0000 H   0  0  0

+   -1.5202   -1.0647    0.0000 H   0  0  0

+   -0.1218   -0.9852    0.0000 H   0  0  0

+    4.9418    0.2203    0.0000 H   0  0  0

+   -1.5119    1.3901    0.0000 H   0  0  0

+   -2.9103    1.3106    0.0000 H   0  0  0

+   -2.4099   -0.8364    0.0000 H   0  0  0

+   -4.1030    1.3280    0.0000 H   0  0  0

+   -5.5533    0.9845    0.0000 H   0  0  0

+   -5.2098   -0.4658    0.0000 H   0  0  0

+   -3.3753   -2.4372    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 10 12  1  0

+  7  8  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  7 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15254-64-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    1.0844   -0.2273   -0.0013 C   0  0  0

+   -0.3802   -0.1674   -0.0009 C   0  0  0

+    1.8131    0.9834   -0.0007 C   0  0  0

+    1.7664   -1.4455    0.0036 C   0  0  0

+   -1.0076    1.0987    0.0001 C   0  0  0

+   -1.1595   -1.3258   -0.0009 C   0  0  0

+    1.1256    2.2194    0.0007 C   0  0  0

+    3.2145    0.9376   -0.0012 C   0  0  0

+    3.1322   -1.4566    0.0034 C   0  0  0

+   -0.2215    2.2745    0.0002 C   0  0  0

+   -2.4080    1.1677    0.0006 C   0  0  0

+   -2.5216   -1.2253    0.0000 C   0  0  0

+   -0.5006   -2.6812   -0.0025 C   0  0  0

+    3.8525   -0.2679   -0.0021 C   0  0  0

+   -3.1424    0.0182    0.0000 C   0  0  0

+   -4.6473    0.0977    0.0010 C   0  0  0

+    1.2321   -2.3486    0.0000 H   0  0  0

+    1.6759    3.1129    0.0000 H   0  0  0

+    3.7704    1.8276    0.0000 H   0  0  0

+    3.6435   -2.3729    0.0000 H   0  0  0

+   -0.6970    3.2099    0.0000 H   0  0  0

+   -2.8893    2.1001    0.0000 H   0  0  0

+   -3.1060   -2.0968    0.0000 H   0  0  0

+   -1.4443   -3.1400    0.0000 H   0  0  0

+   -0.0418   -3.6249    0.0000 H   0  0  0

+    0.4431   -2.2224    0.0000 H   0  0  0

+    4.9014   -0.2983    0.0000 H   0  0  0

+   -4.5919    1.1456    0.0000 H   0  0  0

+   -5.6952    0.1531    0.0000 H   0  0  0

+   -4.7027   -0.9502    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  5 10  1  0

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+  7 10  2  0

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+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+127-19-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.6420   -0.0028   -0.0016 C   0  0  0

+   -0.7052    0.0335   -0.0004 N   0  0  0

+    1.4304    1.2816   -0.0009 C   0  0  0

+    1.2199   -1.0690    0.0017 O   0  0  0

+   -1.4716   -1.2151   -0.0011 C   0  0  0

+   -1.4033    1.3215    0.0017 C   0  0  0

+    2.3668    0.7068    0.0000 H   0  0  0

+    2.0052    2.2180    0.0000 H   0  0  0

+    0.4940    1.8564    0.0000 H   0  0  0

+   -2.4080   -0.6403    0.0000 H   0  0  0

+   -2.0464   -2.1515    0.0000 H   0  0  0

+   -0.5352   -1.7899    0.0000 H   0  0  0

+   -0.4373    1.8451    0.0000 H   0  0  0

+   -1.9269    2.2875    0.0000 H   0  0  0

+   -2.3693    0.7979    0.0000 H   0  0  0

+  1  2  1  0

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+  5 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16090-02-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+104109                          1 V2000

+    5.7482   -4.0137    1.0487 C   0  0  0

+    5.1572   -4.9644    1.8561 N   0  0  0

+    5.0111   -3.0466    0.5118 N   0  0  0

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+    4.2545   -5.7440    0.9989 C   0  0  0

+    5.5804   -2.1308   -0.2660 C   0  0  0

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+    8.9835   -3.1966   -0.2105 N   0  0  0

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+    3.4235   -1.1549   -0.6968 C   0  0  0

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+    2.6276   -1.3227   -1.8250 C   0  0  0

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+    0.6638   -1.2145   -0.4450 C   0  0  0

+    0.2488   -1.5647   -3.1343 S   0  0  0

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+    0.0729   -2.9674   -3.2781 O   0  0  0

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+  -11.1940    1.1485    3.0976 C   0  0  0

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+  -11.8826   -0.6920    5.0455 C   0  0  0

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+ 60100  1  0

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+ 62102  1  0

+ 31103  1  0

+ 42104  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3096-62-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.7105   -0.0308   -0.0021 C   0  0  0

+   -0.4861   -0.7368   -0.0010 C   0  0  0

+    0.6938    1.3580   -0.0017 C   0  0  0

+    1.9276   -0.7162    0.0021 N   0  0  0

+   -1.6875   -0.0561    0.0006 C   0  0  0

+   -0.4728   -2.2437   -0.0019 C   0  0  0

+   -0.5115    2.0326   -0.0001 C   0  0  0

+    3.1462    0.0049    0.0009 O   0  0  0

+   -1.7005    1.3269    0.0006 C   0  0  0

+   -2.9859   -0.8211    0.0019 C   0  0  0

+    1.5894    1.8903    0.0000 H   0  0  0

+    1.9388   -1.7580    0.0000 H   0  0  0

+   -1.5146   -2.2529    0.0000 H   0  0  0

+   -0.4636   -3.2855    0.0000 H   0  0  0

+    0.5690   -2.2345    0.0000 H   0  0  0

+   -0.5247    3.0744    0.0000 H   0  0  0

+    4.0428    0.5355    0.0000 H   0  0  0

+   -2.6083    1.8381    0.0000 H   0  0  0

+   -3.5148    0.0765    0.0000 H   0  0  0

+   -3.8835   -1.3500    0.0000 H   0  0  0

+   -2.4570   -1.7187    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  7  9  2  0

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+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-02-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.0767    0.0001   -0.3741 N   0  0  0

+   -0.3870   -1.1782    0.1676 C   0  0  0

+   -0.3870    1.1782    0.1679 C   0  0  0

+   -2.4282    0.0000    0.2017 C   0  0  0

+    1.0829   -1.1487   -0.2533 C   0  0  0

+    1.0829    1.1488   -0.2530 C   0  0  0

+    1.7208    0.0000    0.3045 O   0  0  0

+   -1.3453   -1.5386    0.0000 H   0  0  0

+   -0.1937   -2.1836    0.0000 H   0  0  0

+   -0.1938    2.1837    0.0000 H   0  0  0

+   -1.3453    1.5386    0.0000 H   0  0  0

+   -2.4283    1.0239    0.0000 H   0  0  0

+   -3.4521   -0.0001    0.0000 H   0  0  0

+   -2.4281   -1.0239    0.0000 H   0  0  0

+    0.9242   -2.1602    0.0000 H   0  0  0

+    2.0511   -1.4817    0.0000 H   0  0  0

+    2.0511    1.4818    0.0000 H   0  0  0

+    0.9242    2.1603    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+54-91-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+   -1.2914    1.3481   -0.4478 N   0  0  0

+   -2.6297    1.3481   -0.2883 C   0  0  0

+   -0.5487    2.6131   -0.5364 C   0  0  0

+   -0.5480    0.0830   -0.5300 C   0  0  0

+   -3.3780    0.0430   -0.1991 C   0  0  0

+   -3.2319    2.3984   -0.2167 O   0  0  0

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+    0.5494    0.0889    0.5415 C   0  0  0

+   -4.8716    0.3226   -0.0212 C   0  0  0

+    1.2914    1.3481    0.4467 N   0  0  0

+   -5.8477   -1.3799    0.0953 Br  0  0  0

+    2.6297    1.3481    0.2873 C   0  0  0

+    3.3779    0.0430    0.1982 C   0  0  0

+    3.2318    2.3984    0.2154 O   0  0  0

+    4.8715    0.3226    0.0202 C   0  0  0

+    5.8476   -1.3800   -0.0960 Br  0  0  0

+   -0.3551    3.6962    0.0000 H   0  0  0

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+   -1.5793   -0.3004    0.0000 H   0  0  0

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+   -5.8812    0.7599    0.0000 H   0  0  0

+    2.3683   -0.3943    0.0000 H   0  0  0

+    3.6998   -1.0091    0.0000 H   0  0  0

+    5.8811    0.7599    0.0000 H   0  0  0

+    4.5496    1.3747    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  9 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-22-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    1.2179    0.1914   -0.0855 C   0  0  0

+   -0.0175    0.6264   -0.4404 O   0  0  0

+    1.8495   -0.9638   -0.8187 C   0  0  0

+    1.8673    0.7824    0.8961 C   0  0  0

+   -1.1092   -0.0130    0.0093 C   0  0  0

+   -2.4817    0.4934   -0.3527 C   0  0  0

+   -0.9912   -0.9944    0.7043 O   0  0  0

+    1.0023   -1.4270    0.0000 H   0  0  0

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+    2.6967   -0.5006    0.0000 H   0  0  0

+    2.7872    0.4889    0.0000 H   0  0  0

+    1.6615    1.7258    0.0000 H   0  0  0

+   -2.1475    1.3993    0.0000 H   0  0  0

+   -3.3876    0.8276    0.0000 H   0  0  0

+   -2.8159   -0.4125    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  5  7  2  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+8065-41-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 45                          1 V2000

+   -9.1380    0.8852   -0.0337 C   0  0  0

+  -10.0268   -0.1020    0.4125 C   0  0  0

+   -7.8708    0.5195   -0.5059 C   0  0  0

+   -9.5358    2.2976   -0.0121 C   0  0  0

+   -9.6548   -1.4153    0.3854 C   0  0  0

+   -7.5068   -0.7965   -0.5296 C   0  0  0

+   -8.5783    3.3576   -0.4925 C   0  0  0

+  -10.6354    2.6120    0.3924 O   0  0  0

+   -8.3934   -1.7746   -0.0850 C   0  0  0

+   -8.0189   -3.1118   -0.1104 N   0  0  0

+   -6.6932   -3.4919   -0.6046 C   0  0  0

+    8.1467    0.4621   -0.0978 C   0  0  1

+    7.1763   -0.6157    0.3894 C   0  0  1

+    9.4498   -0.1949   -0.5574 C   0  0  1

+    7.5603    1.1724   -1.1903 O   0  0  0

+    5.8732    0.0413    0.8490 C   0  0  1

+    6.8928   -1.5512   -0.7072 N   0  0  0

+   10.4056    0.8668   -1.0372 C   0  0  0

+   10.0362   -0.9052    0.5352 O   0  0  0

+    4.9028   -1.0366    1.3362 C   0  0  0

+    6.1490    0.9513    1.9157 O   0  0  0

+   11.4784    1.0012   -0.4992 O   0  0  0

+  -11.0239    0.1299    0.0000 H   0  0  0

+   -7.1429    1.2394    0.0000 H   0  0  0

+  -10.3792   -2.1387    0.0000 H   0  0  0

+   -6.5108   -1.0331    0.0000 H   0  0  0

+   -7.8186    2.6714    0.0000 H   0  0  0

+   -7.8921    4.1173    0.0000 H   0  0  0

+   -9.3380    4.0438    0.0000 H   0  0  0

+   -8.7450   -3.8335    0.0000 H   0  0  0

+   -6.9754   -4.4760    0.0000 H   0  0  0

+   -5.7091   -3.7741    0.0000 H   0  0  0

+   -6.4110   -2.5078    0.0000 H   0  0  0

+    8.7855    1.2621    0.0000 H   0  0  0

+    8.0679   -1.1187    0.0000 H   0  0  0

+    8.8110   -0.9949    0.0000 H   0  0  0

+    6.9086    1.9619    0.0000 H   0  0  0

+    4.9816    0.5443    0.0000 H   0  0  0

+    5.8959   -1.7839    0.0000 H   0  0  0

+    7.5928   -2.2982    0.0000 H   0  0  0

+    9.9317    1.7743    0.0000 H   0  0  0

+   10.6879   -1.6947    0.0000 H   0  0  0

+    4.1420   -0.3516    0.0000 H   0  0  0

+    4.2178   -1.7974    0.0000 H   0  0  0

+    5.6636   -1.7216    0.0000 H   0  0  0

+    6.4459    1.9310    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 12 13  1  0

+ 12 14  1  0

+ 12 15  1  0

+ 13 16  1  0

+ 13 17  1  0

+ 14 18  1  0

+ 14 19  1  0

+ 16 20  1  0

+ 16 21  1  0

+ 18 22  2  0

+  6  9  2  0

+  2 23  1  0

+  3 24  1  0

+  5 25  1  0

+  6 26  1  0

+  7 27  1  0

+  7 28  1  0

+  7 29  1  0

+ 10 30  1  0

+ 11 31  1  0

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+ 18 41  1  0

+ 19 42  1  0

+ 20 43  1  0

+ 20 44  1  0

+ 20 45  1  0

+ 21 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+129-15-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.5705   -0.1962   -0.0756 C   0  0  0

+    0.0090   -1.4867   -0.0488 C   0  0  0

+    1.9472   -0.0406    0.0409 C   0  0  0

+   -0.3108    0.9830   -0.2215 C   0  0  0

+   -1.4562   -1.6504   -0.1716 C   0  0  0

+    0.8356   -2.5955    0.0937 C   0  0  0

+    2.7564   -1.1556    0.1826 C   0  0  0

+    2.5463    1.3126    0.0132 N   0  3  0

+   -1.7690    0.8226   -0.0301 C   0  0  0

+    0.1574    2.0704   -0.4948 O   0  0  0

+   -2.3307   -0.4676   -0.0134 C   0  0  0

+   -1.9356   -2.7432   -0.4000 O   0  0  0

+    2.2049   -2.4230    0.2088 C   0  0  0

+    4.2484   -0.9861    0.3093 C   0  0  0

+    2.6968    1.9334    1.0503 O   0  0  0

+    2.8888    1.8054   -1.0467 O   0  5  0

+   -2.5892    1.9351    0.1239 C   0  0  0

+   -3.7019   -0.6195    0.1620 C   0  0  0

+   -3.9518    1.7662    0.3023 C   0  0  0

+   -4.5049    0.4987    0.3091 C   0  0  0

+    0.4295   -3.5496    0.0000 H   0  0  0

+    2.8265   -3.2529    0.0000 H   0  0  0

+    4.3654   -2.0164    0.0000 H   0  0  0

+    5.2787   -0.8691    0.0000 H   0  0  0

+    4.1314    0.0442    0.0000 H   0  0  0

+   -2.1796    2.8877    0.0000 H   0  0  0

+   -4.1236   -1.5668    0.0000 H   0  0  0

+   -4.5721    2.5971    0.0000 H   0  0  0

+   -5.5360    0.3893    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  7 14  1  0

+  8 15  2  0

+  8 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+  7 13  2  0

+  9 11  2  0

+ 19 20  1  0

+  6 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+ 19 28  1  0

+ 20 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141-97-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.8594   -0.9876    0.0000 C   0  0  0

+   -0.3151   -0.0433    0.0000 C   0  0  0

+    2.1412   -0.1951    0.0000 C   0  0  0

+   -1.5665   -0.5286    0.0000 O   0  0  0

+   -0.1301    1.1508    0.0000 O   0  0  0

+    3.4684   -0.9089    0.0000 C   0  0  0

+    2.1048    1.0119    0.0000 O   0  0  0

+   -2.6981    0.3813    0.0000 C   0  0  0

+   -3.9994   -0.4233    0.0000 C   0  0  0

+    0.0708   -1.7682    0.0000 H   0  0  0

+    1.5459   -1.8594    0.0000 H   0  0  0

+    2.9428   -1.8862    0.0000 H   0  0  0

+    4.4457   -1.4345    0.0000 H   0  0  0

+    3.9940    0.0684    0.0000 H   0  0  0

+   -1.9095    1.1619    0.0000 H   0  0  0

+   -3.3846    1.2531    0.0000 H   0  0  0

+   -4.5830    0.5205    0.0000 H   0  0  0

+   -4.9432   -1.0069    0.0000 H   0  0  0

+   -3.4158   -1.3671    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  1 10  1  0

+  1 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17057-98-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.4243   -0.8352    0.0111 C   0  0  0

+   -1.0446   -0.6252   -0.0099 C   0  0  0

+    1.0698    0.3894   -0.1348 C   0  0  0

+    1.1842   -1.9980    0.1515 C   0  0  0

+   -1.3169    0.7305   -0.1690 C   0  0  0

+   -2.1035   -1.5286    0.0992 C   0  0  0

+    0.0055    1.4522   -0.2575 C   0  0  0

+    2.4473    0.4519   -0.1453 C   0  0  0

+    2.5615   -1.9262    0.1382 C   0  0  0

+   -2.6208    1.1763   -0.2183 C   0  0  0

+   -3.4046   -1.0737    0.0489 C   0  0  0

+    0.1293    2.4347    0.9088 C   0  0  0

+    3.1942   -0.7048   -0.0100 C   0  0  0

+    3.1396    1.7810   -0.3037 C   0  0  0

+   -3.6653    0.2756   -0.1095 C   0  0  0

+    0.7158   -2.9203    0.0000 H   0  0  0

+   -1.9132   -2.5454    0.0000 H   0  0  0

+    0.9840    1.7878    0.0000 H   0  0  0

+    3.1218   -2.7957    0.0000 H   0  0  0

+   -2.8173    2.1919    0.0000 H   0  0  0

+   -4.1873   -1.7500    0.0000 H   0  0  0

+    1.1556    2.3054    0.0000 H   0  0  0

+    0.2586    3.4610    0.0000 H   0  0  0

+   -0.8970    2.5640    0.0000 H   0  0  0

+    4.2274   -0.6555    0.0000 H   0  0  0

+    4.0570    1.3031    0.0000 H   0  0  0

+    3.6175    2.6984    0.0000 H   0  0  0

+    2.2222    2.2589    0.0000 H   0  0  0

+   -4.6425    0.6149    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+  5 10  1  0

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+  7 12  1  0

+  8 13  2  0

+  8 14  1  0

+ 10 15  2  0

+  5  7  1  0

+  9 13  1  0

+ 11 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-47-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.6402    0.4267    0.0317 C   0  0  0

+   -0.4996   -0.3551    0.0275 C   0  0  0

+    0.5332    1.8049    0.0066 C   0  0  0

+    2.2294   -0.3329    0.0765 S   0  0  0

+   -1.7467    0.2410   -0.0018 C   0  0  0

+   -0.7135    2.4009   -0.0228 C   0  0  0

+    2.6661   -0.5596   -1.3637 O   0  0  0

+    3.1128    0.6506    0.5976 O   0  0  0

+    2.0233   -1.6272    0.6258 O   0  0  0

+   -1.8536    1.6188   -0.0269 C   0  0  0

+   -2.9673   -0.5962   -0.0068 N   0  3  0

+   -4.0659   -0.0711   -0.0327 O   0  0  0

+   -2.8730   -1.8104    0.0149 O   0  5  0

+   -0.4192   -1.3884    0.0000 H   0  0  0

+    1.3879    2.3911    0.0000 H   0  0  0

+   -0.7939    3.4342    0.0000 H   0  0  0

+    3.5860   -1.0371    0.0000 H   0  0  0

+   -2.7886    2.0659    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  4  7  1  0

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+  5 10  2  0

+  5 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  6 10  1  0

+  2 14  1  0

+  3 15  1  0

+  6 16  1  0

+  7 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+74407-29-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    1.9105    0.1871   -0.4116 C   0  0  0

+    0.5893   -0.1238    0.2433 C   0  0  0

+    3.2629   -0.2815    0.7029 S   0  0  0

+    2.0301   -0.6004   -1.7179 C   0  0  0

+    1.9916    1.6855   -0.7101 C   0  0  0

+   -0.5627    0.1421   -0.4038 N   0  0  0

+    0.5627   -0.6133    1.3526 O   0  0  0

+    4.6880    0.1912   -0.3150 C   0  0  0

+   -1.8470   -0.1602    0.2328 C   0  0  2

+   -2.2656   -1.5637   -0.1221 C   0  0  0

+   -2.9058    0.8279   -0.2607 C   0  0  0

+   -3.0098   -2.2793    0.7357 O   0  0  0

+   -1.9312   -2.0449   -1.1787 O   0  0  0

+   -2.4020    2.5174    0.1664 S   0  0  0

+    1.0237   -0.7532    0.0000 H   0  0  0

+    2.1829   -1.6068    0.0000 H   0  0  0

+    3.0365   -0.4476    0.0000 H   0  0  0

+    3.0081    1.6305    0.0000 H   0  0  0

+    2.0466    2.7020    0.0000 H   0  0  0

+    0.9751    1.7405    0.0000 H   0  0  0

+   -0.5649    1.1601    0.0000 H   0  0  0

+    5.0085   -0.7750    0.0000 H   0  0  0

+    5.6542    0.5117    0.0000 H   0  0  0

+    4.3675    1.1574    0.0000 H   0  0  0

+   -1.5854    0.8236    0.0000 H   0  0  0

+   -3.8253    1.2647    0.0000 H   0  0  0

+   -3.4782   -0.0139    0.0000 H   0  0  0

+   -3.7436   -2.9849    0.0000 H   0  0  0

+   -2.1111    3.4929    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  9  6  1  0

+  9 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+  4 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  5 20  1  0

+  6 21  1  0

+  8 22  1  0

+  8 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+602-01-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.5548   -0.1433   -0.0025 C   0  0  0

+   -0.4247    0.8324   -0.0004 C   0  0  0

+    1.8892    0.2170   -0.0023 C   0  0  0

+    0.1745   -1.5738    0.0013 N   0  3  0

+   -1.8537    0.4465   -0.0006 N   0  3  0

+   -0.0696    2.1682    0.0014 C   0  0  0

+    2.2444    1.5532   -0.0001 C   0  0  0

+    2.9569   -0.8465   -0.0041 C   0  0  0

+    0.0141   -2.1641   -1.0519 O   0  0  0

+    0.0220   -2.1606    1.0577 O   0  5  0

+   -2.7166    1.3061    0.0012 O   0  0  0

+   -2.1666   -0.7306   -0.0026 O   0  5  0

+    1.2652    2.5286    0.0015 C   0  0  0

+   -0.8040    2.8998    0.0000 H   0  0  0

+    3.2452    1.8235    0.0000 H   0  0  0

+    2.2253   -1.5810    0.0000 H   0  0  0

+    3.6914   -1.5781    0.0000 H   0  0  0

+    3.6885   -0.1120    0.0000 H   0  0  0

+    1.5316    3.5304    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  7 13  2  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+41267-76-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+    1.5250   -0.0401   -0.1403 C   0  0  0

+    0.4146   -0.8895   -0.2199 C   0  0  0

+    1.3148    1.3268   -0.0028 C   0  0  0

+    2.7620   -0.6547   -0.2216 N   0  0  0

+   -0.8688   -0.4008   -0.1217 C   0  0  0

+    0.6858   -2.3598   -0.4290 C   0  0  0

+    0.0481    1.8323    0.1110 C   0  0  0

+    2.4629    2.3096   -0.0170 C   0  0  0

+    2.8282   -1.7487    0.7439 C   0  0  0

+    3.8316    0.2690    0.1554 C   0  0  0

+   -1.0610    0.9836    0.0597 C   0  0  0

+   -1.9396   -1.2208   -0.1950 O   0  0  0

+    1.7363   -2.7904    0.5944 C   0  0  0

+    3.6877    1.5919   -0.6001 C   0  0  0

+   -2.4233    1.5015    0.1846 C   0  0  0

+   -3.1921   -0.7507   -0.0871 C   0  0  0

+   -3.4552    0.6202    0.1076 C   0  0  0

+   -2.6758    2.9724    0.3933 C   0  0  0

+   -4.1260   -1.5292   -0.1604 O   0  0  0

+   -0.3562   -2.3514    0.0000 H   0  0  0

+    0.4803   -3.3814    0.0000 H   0  0  0

+   -0.0939    2.8647    0.0000 H   0  0  0

+    3.0860    3.1448    0.0000 H   0  0  0

+    1.7018    3.0214    0.0000 H   0  0  0

+    3.3533   -2.6488    0.0000 H   0  0  0

+    3.8255   -1.4465    0.0000 H   0  0  0

+    4.3412   -0.6400    0.0000 H   0  0  0

+    4.8241    0.5866    0.0000 H   0  0  0

+    1.2104   -3.6901    0.0000 H   0  0  0

+    2.5538   -3.4367    0.0000 H   0  0  0

+    4.7241    1.4833    0.0000 H   0  0  0

+    4.0128    2.5820    0.0000 H   0  0  0

+   -4.4386    0.9649    0.0000 H   0  0  0

+   -1.6487    3.1487    0.0000 H   0  0  0

+   -2.8521    3.9995    0.0000 H   0  0  0

+   -3.7029    2.7961    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  8 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+  7 11  1  0

+  9 13  1  0

+ 10 14  1  0

+ 16 17  1  0

+  6 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 14 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101-05-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.4170    0.4972    0.0898 C   0  0  0

+   -0.8997    0.9100    0.1472 N   0  0  0

+    0.7086   -0.8004    0.0755 N   0  0  0

+    1.3961    1.3966    0.0431 N   0  0  0

+   -1.9319   -0.0302    0.0592 C   0  0  0

+    1.9704   -1.1925    0.0206 C   0  0  0

+    2.6556    0.9983   -0.0117 C   0  0  0

+   -3.2543    0.3920   -0.0155 C   0  0  0

+   -1.6377   -1.3868    0.0407 C   0  0  0

+    2.9430   -0.2947   -0.0202 N   0  0  0

+    2.3521   -2.8859    0.0025 Cl  0  0  0

+    3.9340    2.1712   -0.0732 Cl  0  0  0

+   -4.2711   -0.5396   -0.1022 C   0  0  0

+   -3.6277    2.0873    0.0007 Cl  0  0  0

+   -2.6593   -2.3128   -0.0462 C   0  0  0

+   -3.9739   -1.8903   -0.1147 C   0  0  0

+   -1.1230    1.9205    0.0000 H   0  0  0

+   -0.6523   -1.7029    0.0000 H   0  0  0

+   -5.2579   -0.2276    0.0000 H   0  0  0

+   -2.4408   -3.3244    0.0000 H   0  0  0

+   -4.7394   -2.5868    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+  8 13  2  0

+  8 14  1  0

+  9 15  1  0

+ 13 16  1  0

+  7 10  1  0

+ 15 16  2  0

+  2 17  1  0

+  9 18  1  0

+ 13 19  1  0

+ 15 20  1  0

+ 16 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100986-85-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 51                          1 V2000

+    0.0078   -1.1189   -0.1294 C   0  0  0

+   -1.3400   -0.8333   -0.3320 C   0  0  0

+    0.8421   -0.1407    0.4397 C   0  0  0

+    0.5270   -2.3497   -0.4938 N   0  0  0

+   -1.8321    0.4214    0.0145 C   0  0  0

+   -2.1912   -1.7561   -0.8486 O   0  0  0

+    2.2606   -0.4637    0.6678 C   0  0  0

+    0.3293    1.1136    0.7822 C   0  0  0

+    1.8078   -2.6817   -0.2842 C   0  0  0

+   -0.3732   -3.3157   -1.1455 C   0  0  2

+   -3.1809    0.7161   -0.1938 N   0  0  0

+   -0.9922    1.3874    0.5681 C   0  0  0

+   -1.4951   -2.5238   -1.8266 C   0  0  0

+    2.7151   -1.8089    0.2796 C   0  0  0

+    3.0261    0.3485    1.1578 O   0  0  0

+   -0.9740   -4.2457   -0.0896 C   0  0  0

+   -3.2251    1.9046   -1.0545 C   0  0  0

+   -3.7322    1.1120    1.1080 C   0  0  0

+   -1.4880    2.6011    0.8943 F   0  0  0

+    4.1117   -2.2148    0.4885 C   0  0  0

+   -4.6743    2.3610   -1.2271 C   0  0  0

+   -5.1814    1.5683    0.9354 C   0  0  0

+    4.9890   -1.3525    1.0400 O   0  0  0

+    4.4760   -3.3283    0.1641 O   0  0  0

+   -5.2255    2.7568    0.0747 N   0  0  0

+   -6.6446    3.0668   -0.1445 C   0  0  0

+   12.1704    6.8293   -1.3258 O   0  0  0

+    0.9623    1.8752    0.0000 H   0  0  0

+    2.0587   -3.6397    0.0000 H   0  0  0

+    0.4080   -3.9243    0.0000 H   0  0  0

+   -2.4452   -2.8033    0.0000 H   0  0  0

+   -1.6570   -3.5008    0.0000 H   0  0  0

+   -1.8058   -3.7083    0.0000 H   0  0  0

+   -1.5114   -5.0775    0.0000 H   0  0  0

+   -0.1422   -4.7831    0.0000 H   0  0  0

+   -2.2377    1.8285    0.0000 H   0  0  0

+   -3.0371    2.8769    0.0000 H   0  0  0

+   -2.8779    1.6129    0.0000 H   0  0  0

+   -3.8435    2.0960    0.0000 H   0  0  0

+   -5.5286    1.8601    0.0000 H   0  0  0

+   -4.5630    1.3770    0.0000 H   0  0  0

+   -6.1688    1.6444    0.0000 H   0  0  0

+   -5.3694    0.5960    0.0000 H   0  0  0

+    5.6953   -0.6583    0.0000 H   0  0  0

+   -6.4333    4.0343    0.0000 H   0  0  0

+   -7.6121    3.2781    0.0000 H   0  0  0

+   -6.8559    2.0993    0.0000 H   0  0  0

+   11.1801    6.8293    0.0000 H   0  0  0

+   13.1607    6.8293    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  2  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 14 20  1  0

+ 17 21  1  0

+ 18 22  1  0

+ 20 23  1  0

+ 20 24  2  0

+ 21 25  1  0

+ 25 26  1  0

+  8 12  2  0

+  9 14  2  0

+ 10 13  1  0

+ 22 25  1  0

+  8 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 18 38  1  0

+ 18 39  1  0

+ 21 40  1  0

+ 21 41  1  0

+ 22 42  1  0

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+ 23 44  1  0

+ 26 45  1  0

+ 26 46  1  0

+ 26 47  1  0

+ 27 48  1  0

+ 27 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1211-40-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -0.1421    0.0000   -0.0016 C   0  0  0

+   -1.6255    0.0002   -0.0016 C   0  0  0

+    0.5573    1.1636   -0.3154 C   0  0  0

+    0.5573   -1.1626    0.3179 C   0  0  0

+   -2.3235   -1.0964   -0.5045 C   0  0  0

+   -2.3235    1.0949    0.5068 C   0  0  0

+    1.9377    1.1578   -0.3134 C   0  0  0

+    1.9372   -1.1568    0.3167 C   0  0  0

+   -3.7023   -1.0942   -0.5036 C   0  0  0

+   -3.7018    1.0931    0.5058 C   0  0  0

+    2.6264    0.0000   -0.0007 C   0  0  0

+   -4.3962    0.0005   -0.0016 C   0  0  0

+    4.1067   -0.0002   -0.0008 N   0  3  0

+   -5.7918    0.0007   -0.0016 N   0  0  0

+    4.7156   -1.0186    0.2742 O   0  0  0

+    4.7158    1.0181   -0.2758 O   0  5  0

+    0.0582    2.0503    0.0000 H   0  0  0

+    0.0583   -2.0494    0.0000 H   0  0  0

+   -1.8346   -1.9888    0.0000 H   0  0  0

+   -1.8348    1.9874    0.0000 H   0  0  0

+    2.4426    2.0413    0.0000 H   0  0  0

+    2.4418   -2.0405    0.0000 H   0  0  0

+   -4.1935   -1.9854    0.0000 H   0  0  0

+   -4.1923    1.9846    0.0000 H   0  0  0

+   -6.3005    0.8820    0.0000 H   0  0  0

+   -6.3007   -0.8805    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  9 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  2  0

+ 13 16  1  0

+  8 11  1  0

+ 10 12  1  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3695-86-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.6857    0.0533   -0.0006 C   0  0  0

+   -0.3226    1.0055    0.0015 C   0  0  0

+    2.0909    0.4733   -0.0005 C   0  0  0

+    0.3549   -1.3400    0.0032 C   0  0  0

+   -1.6703    0.6026    0.0014 C   0  0  0

+    3.0716   -0.4527   -0.0025 O   0  0  0

+    2.3719    1.6566    0.0014 O   0  0  0

+    0.0925   -2.4452    0.0061 N   0  0  0

+   -2.7734    1.4403    0.0033 C   0  0  0

+   -2.1211   -0.6703   -0.0065 O   0  0  0

+    4.4628   -0.0368   -0.0024 C   0  0  0

+   -3.9018    0.6116    0.0016 C   0  0  0

+   -3.4603   -0.6684   -0.0046 C   0  0  0

+   -0.0826    2.0162    0.0000 H   0  0  0

+   -2.7651    2.4791    0.0000 H   0  0  0

+    4.7604   -1.0321    0.0000 H   0  0  0

+    5.4581    0.2608    0.0000 H   0  0  0

+    4.1652    0.9585    0.0000 H   0  0  0

+   -4.8934    0.9212    0.0000 H   0  0  0

+   -4.0639   -1.5139    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  4  8  3  0

+  5  9  2  0

+  5 10  1  0

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+  9 12  1  0

+ 10 13  1  0

+ 12 13  2  0

+  2 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-79-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.5072   -0.0501   -0.0018 C   0  0  0

+   -0.8243   -0.6757   -0.0011 C   0  0  0

+    0.6342    1.4515    0.0002 C   0  0  0

+    1.5978   -0.8090    0.0014 C   0  0  0

+   -1.9149    0.0833    0.0013 C   0  0  0

+   -0.9128   -1.7219    0.0000 H   0  0  0

+    1.6804    1.3630    0.0000 H   0  0  0

+    0.7227    2.4977    0.0000 H   0  0  0

+   -0.4120    1.5400    0.0000 H   0  0  0

+    1.5094   -1.8552    0.0000 H   0  0  0

+    2.5481   -0.3625    0.0000 H   0  0  0

+   -1.8264    1.1295    0.0000 H   0  0  0

+   -2.8652   -0.3632    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71-43-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.0691   -1.3806    0.0000 C   0  0  0

+   -1.1609   -0.7504    0.0000 C   0  0  0

+    1.2303   -0.6302    0.0000 C   0  0  0

+   -1.2302    0.6304    0.0000 C   0  0  0

+    1.1611    0.7502    0.0000 C   0  0  0

+   -0.0694    1.3806    0.0000 C   0  0  0

+    0.1210   -2.4160    0.0000 H   0  0  0

+   -2.0317   -1.3131    0.0000 H   0  0  0

+    2.1530   -1.1030    0.0000 H   0  0  0

+   -2.1529    1.1031    0.0000 H   0  0  0

+    2.0319    1.3129    0.0000 H   0  0  0

+   -0.1214    2.4160    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  3  5  2  0

+  4  6  2  0

+  5  6  1  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67508-87-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 73 77                          1 V2000

+    0.3039   -1.2121   -0.0344 C   0  0  0

+   -0.2651   -2.3510    0.4776 C   0  0  0

+    1.7766   -1.1063   -0.3370 C   0  0  2

+   -0.4906   -0.0894   -0.3020 C   0  0  0

+   -1.6425   -2.3952    0.7302 C   0  0  0

+    0.5383   -3.5854    0.7976 C   0  0  0

+    2.5558   -2.2004    0.3894 C   0  0  0

+    2.2538    0.1722    0.0870 O   0  0  0

+   -1.8617   -0.1175   -0.0572 C   0  0  0

+    0.0801    1.0342   -0.8033 O   0  0  0

+   -2.4465   -1.2871    0.4690 C   0  0  0

+   -2.1981   -3.5257    1.2326 O   0  0  0

+    1.8896   -3.5480    0.0875 C   0  0  2

+    3.1906    0.6111   -0.8989 C   0  0  1

+   -2.6971    1.0629   -0.3401 C   0  0  0

+   -3.8946   -1.3325    0.7342 C   0  0  0

+    1.6864   -3.6923   -1.3988 C   0  0  0

+    2.7147   -4.6120    0.5662 O   0  0  0

+    3.1720    2.1395   -0.9754 C   0  0  0

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+   -4.1470    1.0172   -0.0781 C   0  0  0

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+   -4.7319   -0.1479    0.4516 C   0  0  0

+   -4.4002   -2.3424    1.1844 O   0  0  0

+    2.8223   -4.1579   -2.2729 C   0  0  0

+    0.6133   -3.4350   -1.8893 O   0  0  0

+    3.5300    2.7128    0.4005 C   0  0  1

+    4.7488    0.5730    0.7953 C   0  0  2

+   -4.9475    2.1322   -0.3452 C   0  0  0

+   -6.1003   -0.1809    0.6989 C   0  0  0

+    4.8578    2.0982    0.8575 C   0  0  1

+    3.6741    4.1713    0.3007 N   0  0  0

+    6.0569   -0.0522    1.2842 C   0  0  0

+   -6.3147    2.0761   -0.0932 C   0  0  0

+   -4.3935    3.2635   -0.8474 O   0  0  0

+   -6.8806    0.9321    0.4322 C   0  0  0

+    5.9079    2.5363   -0.0070 O   0  0  0

+    2.3243    4.7164    0.1036 C   0  0  0

+    4.1313    4.6411    1.6154 C   0  0  0

+   -5.4548    4.2067   -1.0083 C   0  0  0

+    2.7927   -0.9726    0.0000 H   0  0  0

+   -0.4081   -3.9787    0.0000 H   0  0  0

+    0.7527   -4.5876    0.0000 H   0  0  0

+    3.3879   -2.7987    0.0000 H   0  0  0

+    3.2821   -1.4774    0.0000 H   0  0  0

+    0.5442    1.9480    0.0000 H   0  0  0

+   -2.6501   -4.4455    0.0000 H   0  0  0

+    3.2450   -0.4123    0.0000 H   0  0  0

+    3.3427   -5.4219    0.0000 H   0  0  0

+    2.5283    2.9370    0.0000 H   0  0  0

+    2.2077    1.7923    0.0000 H   0  0  0

+    2.4336   -5.1062    0.0000 H   0  0  0

+    3.7706   -4.5466    0.0000 H   0  0  0

+    3.2110   -3.2096    0.0000 H   0  0  0

+    2.5599    3.0433    0.0000 H   0  0  0

+    3.7726    0.8853    0.0000 H   0  0  0

+   -6.5623   -1.0958    0.0000 H   0  0  0

+    4.8774    3.1229    0.0000 H   0  0  0

+    5.6149   -0.9769    0.0000 H   0  0  0

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+ 40 72  1  0

+ 40 73  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5397-31-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+    1.1757    0.5695   -0.0889 C   0  0  0

+   -0.0207   -0.2854   -0.5116 C   0  0  0

+    2.4482    0.0228   -0.7392 C   0  0  0

+    0.9538    2.0150   -0.5385 C   0  0  0

+   -1.2092    0.2252    0.0957 O   0  0  0

+    3.4080   -0.4638    0.3484 C   0  0  0

+    1.0705    2.9481    0.6685 C   0  0  0

+   -2.2851   -0.6108   -0.3352 C   0  0  0

+    4.6224   -1.1283   -0.3033 C   0  0  0

+   -3.5944   -0.1160    0.2828 C   0  0  0

+    5.5822   -1.6149    0.7843 C   0  0  0

+   -4.7464   -1.0110   -0.1786 C   0  0  0

+   -6.0034   -0.5359    0.4148 N   0  0  0

+    1.9903    1.2000    0.0000 H   0  0  0

+   -0.5915   -1.1429    0.0000 H   0  0  0

+    0.7196   -1.0016    0.0000 H   0  0  0

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+    0.0943    1.4473    0.0000 H   0  0  0

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+    3.3628    0.5653    0.0000 H   0  0  0

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+    0.0484    3.0759    0.0000 H   0  0  0

+   -2.8185   -1.4920    0.0000 H   0  0  0

+   -1.5156   -1.2956    0.0000 H   0  0  0

+    3.7480   -1.6728    0.0000 H   0  0  0

+    4.6676   -2.1574    0.0000 H   0  0  0

+   -3.0610    0.7652    0.0000 H   0  0  0

+   -4.3638    0.5688    0.0000 H   0  0  0

+    5.1164   -2.5336    0.0000 H   0  0  0

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+   -5.2798   -1.8922    0.0000 H   0  0  0

+   -3.9770   -1.6959    0.0000 H   0  0  0

+   -6.1698    0.4806    0.0000 H   0  0  0

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+  1  2  1  0

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+ 12 35  1  0

+ 12 36  1  0

+ 13 37  1  0

+ 13 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82-39-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.9591    0.0608   -0.0028 C   0  0  0

+   -0.5387   -1.2825   -0.0014 C   0  0  0

+    0.0369    1.1472   -0.0020 C   0  0  0

+   -2.3256    0.3568    0.0009 C   0  0  0

+    0.9033   -1.6058   -0.0001 C   0  0  0

+   -1.4855   -2.3012   -0.0017 C   0  0  0

+    1.4797    0.8251    0.0003 C   0  0  0

+   -0.3276    2.3068   -0.0037 O   0  0  0

+   -3.2562   -0.6787    0.0059 C   0  0  0

+   -2.7427    1.6469   -0.0009 O   0  0  0

+    1.9017   -0.5162   -0.0002 C   0  0  0

+    1.2673   -2.7651    0.0016 O   0  0  0

+   -2.8368   -1.9930   -0.0034 C   0  0  0

+    2.4264    1.8453    0.0011 C   0  0  0

+   -4.1715    1.6190    0.0037 C   0  0  0

+    3.2623   -0.8109    0.0005 C   0  0  0

+    3.7750    1.5349    0.0032 C   0  0  0

+    4.1901    0.2157   -0.0001 C   0  0  0

+   -1.1781   -3.2989    0.0000 H   0  0  0

+   -4.2769   -0.4594    0.0000 H   0  0  0

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+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+152-84-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 68                          1 V2000

+    1.1827    2.2440   -0.5403 C   0  0  0

+    1.3918    3.1980    0.4782 C   0  0  0

+    2.3255    1.4724   -1.0651 C   0  0  0

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+    3.6045    1.4802   -0.3212 C   0  0  0

+    2.2175    0.8375   -2.0960 O   0  0  0

+   -1.1731    2.7748   -0.5200 C   0  0  0

+   -0.3149    1.1208   -2.0167 O   0  0  0

+    3.8136    2.4313    0.6943 C   0  0  0

+    2.9985    4.3862    1.6942 O   0  0  0

+   -0.9560    3.7154    0.4727 C   0  0  0

+    4.6007    0.5556   -0.6162 C   0  0  0

+   -2.4272    2.5754   -0.9997 O   0  0  0

+    5.0152    2.4392    1.3950 C   0  0  0

+    5.7906    0.5773    0.0905 C   0  0  0

+   -3.0287    1.5719   -0.1791 C   0  0  2

+    5.9961    1.5121    1.0889 C   0  0  0

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+   -4.5473    1.6031   -0.3658 C   0  0  1

+   -3.0035   -0.6542    0.4070 C   0  0  2

+   -5.1843    0.5481    0.5458 C   0  0  2

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+ 37 63  1  0

+ 38 64  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-25-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.3823    0.0001   -0.0008 C   0  0  0

+   -2.8625    0.0001   -0.0009 N   0  3  0

+   -0.6913    1.1970    0.0006 C   0  0  0

+   -0.6911   -1.1973    0.0035 C   0  0  0

+   -3.4715   -1.0548   -0.0021 O   0  0  0

+   -3.4715    1.0549    0.0004 O   0  5  0

+    0.6913    1.1970    0.0006 C   0  0  0

+    0.6911   -1.1973    0.0036 C   0  0  0

+    1.3824    0.0001   -0.0009 C   0  0  0

+    2.8625    0.0001   -0.0009 N   0  3  0

+    3.4715   -1.0548   -0.0021 O   0  0  0

+    3.4715    1.0549    0.0004 O   0  5  0

+   -1.2096    2.0947    0.0000 H   0  0  0

+   -1.2094   -2.0950    0.0000 H   0  0  0

+    1.2096    2.0947    0.0000 H   0  0  0

+    1.2094   -2.0950    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 12  1  0

+  8  9  1  0

+  3 13  1  0

+  4 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13024-49-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.4094   -0.0001    0.4050 C   0  0  0

+   -0.0701    0.0000    0.6918 C   0  0  0

+    2.0868    1.1986    0.2737 C   0  0  0

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+   -2.3247    0.0001   -0.3406 C   0  0  0

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+   -3.0030    1.1971   -0.2091 C   0  0  0

+   -3.0045   -1.1972   -0.2147 C   0  0  0

+    5.4970   -0.0003   -0.3877 N   0  0  0

+   -4.3603    1.1972    0.0540 C   0  0  0

+   -4.3613   -1.1971    0.0483 C   0  0  0

+   -5.0388    0.0003    0.1855 C   0  0  0

+    0.4459    0.8936    0.0000 H   0  0  0

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+   -2.4854   -2.0890    0.0000 H   0  0  0

+    6.0129   -0.8940    0.0000 H   0  0  0

+    6.0130    0.8933    0.0000 H   0  0  0

+   -4.8797    2.0888    0.0000 H   0  0  0

+   -4.8812   -2.0885    0.0000 H   0  0  0

+   -6.0707    0.0007    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+192-65-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 43                          1 V2000

+    0.1889   -0.4561   -0.0030 C   0  0  0

+   -0.9944   -1.2255   -0.0021 C   0  0  0

+    0.1215    1.0045   -0.0021 C   0  0  0

+    1.4379   -1.1022    0.0012 C   0  0  0

+   -2.2606   -0.6054   -0.0003 C   0  0  0

+   -0.9007   -2.6368   -0.0026 C   0  0  0

+   -1.2020    1.6567   -0.0008 C   0  0  0

+    1.2807    1.7503   -0.0021 C   0  0  0

+    2.6507   -0.2843    0.0004 C   0  0  0

+    1.5019   -2.5081    0.0070 C   0  0  0

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+   -3.4049   -1.3952    0.0011 C   0  0  0

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+   -2.0760   -3.4004   -0.0016 C   0  0  0

+   -1.3108    3.0464    0.0000 C   0  0  0

+    2.5418    1.1275   -0.0027 C   0  0  0

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+    4.9324    1.2905   -0.0028 C   0  0  0

+    1.2213    2.7998    0.0000 H   0  0  0

+    2.4384   -2.9855    0.0000 H   0  0  0

+   -4.3530   -0.9412    0.0000 H   0  0  0

+    0.4387   -4.3026    0.0000 H   0  0  0

+   -2.0202   -4.4501    0.0000 H   0  0  0

+   -0.4450    3.6426    0.0000 H   0  0  0

+    4.0076   -1.9271    0.0000 H   0  0  0

+   -4.4918    0.9007    0.0000 H   0  0  0

+   -4.1783   -3.3594    0.0000 H   0  0  0

+   -2.6366    4.6851    0.0000 H   0  0  0

+    3.6552    2.9522    0.0000 H   0  0  0

+    5.9842   -0.5485    0.0000 H   0  0  0

+   -4.6475    3.3210    0.0000 H   0  0  0

+    5.8065    1.8744    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  1  0

+  8 16  2  0

+  9 17  1  0

+ 11 18  1  0

+ 12 19  2  0

+ 15 20  2  0

+ 16 21  1  0

+ 17 22  2  0

+ 18 23  2  0

+ 21 24  2  0

+  7 11  1  0

+  9 16  1  0

+ 10 13  2  0

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+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23564-05-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+    0.6187   -1.4040    0.3761 C   0  0  0

+   -0.5946   -1.3692   -0.3104 C   0  0  0

+    1.2472   -0.2103    0.7525 N   0  0  0

+    1.1985   -2.6243    0.6900 C   0  0  0

+   -1.1882   -0.1405   -0.6259 N   0  0  0

+   -1.2117   -2.5551   -0.6803 C   0  0  0

+    2.4656    0.0933    0.2629 C   0  0  0

+    0.5737   -3.8011    0.3226 C   0  0  0

+   -2.4427    0.1277   -0.2128 C   0  0  0

+   -0.6239   -3.7665   -0.3683 C   0  0  0

+    3.1176    1.1858    0.7077 N   0  0  0

+    3.1851   -0.9088   -0.9242 S   0  0  0

+   -3.0595    1.2550   -0.6191 N   0  0  0

+   -3.2528   -0.9637    0.8282 S   0  0  0

+    4.3361    1.4893    0.2181 C   0  0  0

+   -4.3140    1.5232   -0.2060 C   0  0  0

+    4.9873    2.5804    0.6624 O   0  0  0

+    4.8466    0.7783   -0.6242 O   0  0  0

+   -4.9301    2.6491   -0.6119 O   0  0  0

+   -4.8889    0.7488    0.5326 O   0  0  0

+    6.2999    2.9074    0.1349 C   0  0  0

+   -6.2816    2.9380   -0.1668 C   0  0  0

+    0.6532    0.5469    0.0000 H   0  0  0

+    2.1606   -2.6457    0.0000 H   0  0  0

+   -0.5938    0.6164    0.0000 H   0  0  0

+   -2.1740   -2.5416    0.0000 H   0  0  0

+    1.0576   -4.6329    0.0000 H   0  0  0

+   -1.1464   -4.5746    0.0000 H   0  0  0

+    2.5441    1.9586    0.0000 H   0  0  0

+   -2.4845    2.0267    0.0000 H   0  0  0

+    6.5325    1.9736    0.0000 H   0  0  0

+    7.2337    3.1400    0.0000 H   0  0  0

+    6.0673    3.8412    0.0000 H   0  0  0

+   -6.0804    3.8791    0.0000 H   0  0  0

+   -7.2227    3.1392    0.0000 H   0  0  0

+   -6.4828    1.9969    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+ 15 18  2  0

+ 16 19  1  0

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+ 17 21  1  0

+ 19 22  1  0

+  8 10  1  0

+  3 23  1  0

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+  5 25  1  0

+  6 26  1  0

+  8 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 13 30  1  0

+ 21 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97672-08-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.1165   -0.8459   -0.3042 C   0  0  0

+   -1.1399   -0.3249    0.0463 C   0  0  0

+    0.9751    0.3122   -0.5933 C   0  0  0

+    0.3174   -2.2246   -0.3230 C   0  0  0

+   -1.0424    1.0586   -0.0276 N   0  0  0

+   -2.1717   -1.1908    0.3765 C   0  0  0

+    0.2337    1.4114   -0.4125 C   0  0  0

+    2.4211    0.2692   -1.0154 C   0  0  0

+   -0.7220   -3.0706    0.0036 C   0  0  0

+   -1.9991    1.8864    0.2244 N   0  0  0

+   -1.9584   -2.5551    0.3588 C   0  0  0

+    3.2818    0.2985    0.1784 C   0  0  0

+   -1.8078    3.0855    0.1292 O   0  0  0

+    3.9459    0.3212    1.0998 N   0  0  0

+    1.2540   -2.5894    0.0000 H   0  0  0

+   -3.1128   -0.8379    0.0000 H   0  0  0

+    0.5820    2.3543    0.0000 H   0  0  0

+    1.9112   -0.5970    0.0000 H   0  0  0

+    2.9347   -0.5948    0.0000 H   0  0  0

+   -0.5777   -4.0653    0.0000 H   0  0  0

+   -2.7491   -3.1757    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+ 10 13  2  0

+ 12 14  3  0

+  5  7  1  0

+  9 11  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3958-57-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -3.1639    0.7826    0.0536 N   0  3  0

+   -4.2384    0.4311    0.5068 O   0  5  0

+   -3.0056    1.9323   -0.3162 O   0  0  0

+   -2.0485   -0.1857   -0.0420 C   0  0  0

+   -0.8292    0.2132   -0.5563 C   0  0  0

+   -2.2246   -1.4877    0.3883 C   0  0  0

+    0.2126   -0.6913   -0.6457 C   0  0  0

+   -1.1831   -2.3920    0.2990 C   0  0  0

+    1.5421   -0.2564   -1.2064 C   0  0  0

+    0.0350   -1.9943   -0.2203 C   0  0  0

+    2.6811    0.4108    0.2505 Br  0  0  0

+   -0.6338    1.1799    0.0000 H   0  0  0

+   -3.1474   -1.8358    0.0000 H   0  0  0

+   -1.3788   -3.3587    0.0000 H   0  0  0

+    1.4082   -1.2336    0.0000 H   0  0  0

+    2.3624   -0.8039    0.0000 H   0  0  0

+    0.7923   -2.6262    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  2  0

+  9  7  1  0

+ 10  7  2  0

+ 11  9  1  0

+  8 10  1  0

+  5 12  1  0

+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+  9 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104145-44-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 46                          1 V2000

+   -1.1358   -0.6253   -0.0021 C   0  0  0

+   -2.5401   -0.7016   -0.0025 C   0  0  0

+   -0.5325    0.6448   -0.0003 C   0  0  0

+   -0.6326   -1.9033    0.0017 N   0  0  0

+   -2.8809   -2.1332   -0.0040 C   0  0  0

+   -3.2789    0.4779   -0.0014 C   0  0  0

+    0.9450    0.7572    0.0001 C   0  0  0

+   -1.2732    1.7387    0.0015 N   0  0  0

+   -1.6613   -2.8280    0.0039 C   0  0  0

+   -4.0836   -2.8362   -0.0049 C   0  0  0

+   -2.6013    1.6962   -0.0001 C   0  0  0

+    1.6829   -0.3457   -0.0013 N   0  0  0

+    1.5369    2.0212   -0.0038 C   0  0  0

+   -1.6706   -4.2197    0.0078 C   0  0  0

+   -4.0716   -4.2140   -0.0062 C   0  0  0

+   -3.3708    2.9581    0.0006 C   0  0  0

+    3.0034   -0.2946   -0.0010 C   0  0  0

+    2.9183    2.1229   -0.0035 C   0  0  0

+   -2.8677   -4.9020    0.0093 C   0  0  0

+   -2.7254    4.1406    0.0019 O   0  0  0

+   -4.5852    2.9290   -0.0001 O   0  0  0

+    3.6664    0.9444    0.0008 C   0  0  0

+    3.8085   -1.5424   -0.0021 C   0  0  0

+   -3.4814    5.3803    0.0025 C   0  0  0

+    5.1429    0.9820    0.0020 C   0  0  0

+    5.2807   -1.4640   -0.0012 C   0  0  0

+    3.2561   -2.6238   -0.0032 O   0  0  0

+    5.9082   -0.2801    0.0015 C   0  0  0

+    5.7254    2.0481    0.0031 O   0  0  0

+    0.3833   -2.1430    0.0000 H   0  0  0

+   -4.3224    0.4508    0.0000 H   0  0  0

+   -4.9912   -2.3207    0.0000 H   0  0  0

+    0.9448    2.8808    0.0000 H   0  0  0

+   -0.7698   -4.7471    0.0000 H   0  0  0

+   -4.9721   -4.7418    0.0000 H   0  0  0

+    3.3872    3.0555    0.0000 H   0  0  0

+   -2.8683   -5.9458    0.0000 H   0  0  0

+   -2.5902    5.9238    0.0000 H   0  0  0

+   -4.0249    6.2715    0.0000 H   0  0  0

+   -4.3726    4.8368    0.0000 H   0  0  0

+    5.8425   -2.3438    0.0000 H   0  0  0

+    6.9516   -0.2500    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

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+  7 12  2  0

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+  9 14  1  0

+ 10 15  2  0

+ 11 16  1  0

+ 12 17  1  0

+ 13 18  2  0

+ 14 19  2  0

+ 16 20  1  0

+ 16 21  2  0

+ 17 22  2  0

+ 17 23  1  0

+ 20 24  1  0

+ 22 25  1  0

+ 23 26  1  0

+ 23 27  2  0

+ 25 28  1  0

+ 25 29  2  0

+  5  9  2  0

+  8 11  1  0

+ 15 19  1  0

+ 18 22  1  0

+ 26 28  2  0

+  4 30  1  0

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+ 10 32  1  0

+ 13 33  1  0

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+ 15 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+ 24 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+ 26 41  1  0

+ 28 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+736-31-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+   -4.6158   -0.0423    0.0031 C   0  0  0

+   -4.0724   -1.3147    0.0011 C   0  0  0

+   -3.7916    1.0696    0.0040 C   0  0  0

+   -6.0860    0.1307   -0.0018 N   0  3  0

+   -2.7033   -1.4836   -0.0001 C   0  0  0

+   -2.4212    0.9162    0.0029 C   0  0  0

+   -6.5675    1.2494    0.0000 O   0  0  0

+   -6.8140   -0.8458   -0.0077 O   0  5  0

+   -1.8650   -0.3659    0.0008 C   0  0  0

+   -0.4012   -0.5381    0.0001 C   0  0  0

+    0.4012    0.5381    0.0010 C   0  0  0

+    1.8650    0.3659    0.0002 C   0  0  0

+    2.7033    1.4836    0.0011 C   0  0  0

+    2.4212   -0.9162    0.0043 C   0  0  0

+    4.0724    1.3147    0.0004 C   0  0  0

+    3.7916   -1.0696    0.0036 C   0  0  0

+    4.6158    0.0423   -0.0013 C   0  0  0

+    6.0860   -0.1307   -0.0021 N   0  3  0

+    6.5675   -1.2494   -0.0036 O   0  0  0

+    6.8140    0.8458   -0.0013 O   0  5  0

+   -4.6962   -2.1439    0.0000 H   0  0  0

+   -4.2059    2.0210    0.0000 H   0  0  0

+   -2.2970   -2.4385    0.0000 H   0  0  0

+   -1.8044    1.7507    0.0000 H   0  0  0

+    0.0091   -1.4912    0.0000 H   0  0  0

+   -0.0091    1.4912    0.0000 H   0  0  0

+    2.2970    2.4385    0.0000 H   0  0  0

+    1.8044   -1.7507    0.0000 H   0  0  0

+    4.6962    2.1439    0.0000 H   0  0  0

+    4.2059   -2.0210    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  9 10  1  0

+ 10 11  2  0

+ 11 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+ 17 18  1  0

+ 18 19  2  0

+ 18 20  1  0

+  6  9  1  0

+ 16 17  1  0

+  2 21  1  0

+  3 22  1  0

+  5 23  1  0

+  6 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10312-83-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.1268   -0.4790    0.2741 C   0  0  0

+   -1.1982    0.2287    0.3951 C   0  0  0

+    1.1437    0.4678   -0.0600 O   0  0  0

+   -2.1178   -0.0846   -0.3222 O   0  0  0

+    2.3692   -0.2603   -0.1600 C   0  0  0

+   -0.4699   -1.3498    0.0000 H   0  0  0

+    0.9267   -1.1678    0.0000 H   0  0  0

+   -1.1127    1.2808    0.0000 H   0  0  0

+    1.8300   -1.1678    0.0000 H   0  0  0

+    3.2767   -0.7995    0.0000 H   0  0  0

+    2.9084    0.6472    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+933-88-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.2811    0.2561   -0.1702 C   0  0  0

+    0.9387   -0.9770   -0.1476 C   0  0  0

+    1.0033    1.4300    0.0647 C   0  0  0

+   -1.1647    0.3191   -0.4460 C   0  0  0

+    2.2935   -1.0275    0.1057 C   0  0  0

+    0.1695   -2.2481   -0.4000 C   0  0  0

+    2.3572    1.3635    0.3166 C   0  0  0

+   -1.5583    0.6100   -1.5560 O   0  0  0

+   -2.3051   -0.0229    0.8174 Cl  0  0  0

+    3.0015    0.1386    0.3372 C   0  0  0

+    0.5238    2.3398    0.0000 H   0  0  0

+    2.7811   -1.9330    0.0000 H   0  0  0

+   -0.7104   -1.7157    0.0000 H   0  0  0

+   -0.3629   -3.1280    0.0000 H   0  0  0

+    1.0494   -2.7805    0.0000 H   0  0  0

+    2.9103    2.2305    0.0000 H   0  0  0

+    4.0294    0.1070    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6164-98-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.3508   -0.1975    0.0040 C   0  0  0

+    0.5216   -1.2862    0.0023 C   0  0  0

+    0.1617    1.1005    0.0035 C   0  0  0

+   -1.7076   -0.4022    0.0004 N   0  0  0

+    1.8850   -1.0742    0.0001 C   0  0  0

+   -0.0241   -2.6909    0.0022 C   0  0  0

+    1.5266    1.3001    0.0014 C   0  0  0

+   -2.5196    0.6158    0.0021 C   0  0  0

+    2.3877    0.2156   -0.0003 C   0  0  0

+   -3.8725    0.4117   -0.0015 N   0  0  0

+    4.1043    0.4746   -0.0025 Cl  0  0  0

+   -4.7860    1.5570    0.0004 C   0  0  0

+   -4.4075   -0.9521   -0.0071 C   0  0  0

+   -0.4832    1.9146    0.0000 H   0  0  0

+    2.5354   -1.8839    0.0000 H   0  0  0

+   -0.9922   -2.3148    0.0000 H   0  0  0

+   -0.4002   -3.6590    0.0000 H   0  0  0

+    0.9440   -3.0670    0.0000 H   0  0  0

+    1.9092    2.2657    0.0000 H   0  0  0

+   -2.1403    1.5826    0.0000 H   0  0  0

+   -3.9741    2.2046    0.0000 H   0  0  0

+   -5.4336    2.3689    0.0000 H   0  0  0

+   -5.5979    0.9094    0.0000 H   0  0  0

+   -5.3744   -0.5728    0.0000 H   0  0  0

+   -4.7868   -1.9190    0.0000 H   0  0  0

+   -3.4406   -1.3314    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

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+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3491-12-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+   -1.0780   -0.8678   -0.0371 C   0  0  0

+   -2.1364   -1.7202   -0.0778 O   0  0  0

+   -0.5863   -0.4300    1.1843 C   0  0  0

+   -0.4861   -0.4403   -1.2166 C   0  0  0

+   -3.2594   -0.9539   -0.0511 C   0  0  0

+    0.4887    0.4357    1.2256 C   0  0  0

+    0.5892    0.4257   -1.1753 C   0  0  0

+   -4.5050   -1.5532    0.0693 C   0  0  0

+   -3.1587    0.4267   -0.1386 C   0  0  0

+    1.0771    0.8679    0.0456 C   0  0  0

+   -5.6457   -0.7757    0.0969 C   0  0  0

+   -4.2989    1.2058   -0.1111 C   0  0  0

+    2.1355    1.7203    0.0863 O   0  0  0

+   -5.5461    0.6065    0.0041 C   0  0  0

+    3.2585    0.9544    0.0520 C   0  0  0

+   -6.7017    1.3950    0.0319 N   0  0  0

+    4.5034    1.5543   -0.0730 C   0  0  0

+    3.1594   -0.4258    0.1477 C   0  0  0

+    5.6442    0.7772   -0.1074 C   0  0  0

+    4.2997   -1.2044    0.1134 C   0  0  0

+    5.5455   -0.6052   -0.0169 C   0  0  0

+    6.7011   -1.3933   -0.0518 N   0  0  0

+   -1.2556    0.3602    0.0000 H   0  0  0

+    0.1420   -1.2636    0.0000 H   0  0  0

+   -0.1427    1.2565    0.0000 H   0  0  0

+    1.2620   -0.3615    0.0000 H   0  0  0

+   -4.5825   -2.5858    0.0000 H   0  0  0

+   -2.2259    0.8764    0.0000 H   0  0  0

+   -6.5780   -1.2264    0.0000 H   0  0  0

+   -4.2205    2.2384    0.0000 H   0  0  0

+   -6.6239    2.4276    0.0000 H   0  0  0

+   -7.6348    0.9460    0.0000 H   0  0  0

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+    2.2270   -0.8762    0.0000 H   0  0  0

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+    4.2217   -2.2370    0.0000 H   0  0  0

+    6.6236   -2.4259    0.0000 H   0  0  0

+    7.6341   -0.9441    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86780-90-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 49                          1 V2000

+   -0.7092   -0.3709   -0.3601 C   0  0  0

+   -0.4667    0.7133    0.6580 C   0  0  0

+    0.3827   -1.3986   -0.2672 C   0  0  0

+   -2.0522   -0.9979   -0.1138 C   0  0  0

+   -0.2938    2.0214    0.2467 C   0  0  0

+   -0.4227    0.4003    2.0040 C   0  0  0

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+   -2.1658   -2.2108    0.4543 C   0  0  0

+   -3.2220   -0.2966   -0.4872 C   0  0  0

+   -0.0712    3.0161    1.1808 C   0  0  0

+   -0.3465    2.3574   -1.1939 N   0  3  0

+   -0.2002    1.3947    2.9378 C   0  0  0

+   -1.0543   -2.9200    0.8205 N   0  0  0

+    1.2991   -3.5924    0.3859 C   0  0  0

+    2.6294   -0.6221    0.0137 O   0  0  0

+    1.8860   -1.2743   -1.9778 O   0  0  0

+   -3.5339   -2.7967    0.6908 C   0  0  0

+   -3.8816    0.4489    0.4240 O   0  0  0

+   -3.6338   -0.3653   -1.6302 O   0  0  0

+   -0.0220    2.7024    2.5260 C   0  0  0

+    0.2975    1.7044   -1.9954 O   0  0  0

+   -1.0337    3.2868   -1.5777 O   0  5  0

+    3.7860   -0.4221   -0.8014 C   0  0  0

+   -5.0042    1.0242   -0.2476 C   0  0  0

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+    4.7401    0.3048    1.2260 O   0  0  0

+   -1.4197    0.2001    0.0000 H   0  0  0

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+   -0.0418    3.9271    0.0000 H   0  0  0

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+   -1.1947   -3.8206    0.0000 H   0  0  0

+    0.6953   -4.2752    0.0000 H   0  0  0

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+    1.9029   -2.9096    0.0000 H   0  0  0

+   -3.8927   -1.9588    0.0000 H   0  0  0

+   -4.3718   -3.1555    0.0000 H   0  0  0

+   -3.1751   -3.6346    0.0000 H   0  0  0

+    0.8895    2.7116    0.0000 H   0  0  0

+    3.5505   -1.3027    0.0000 H   0  0  0

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+   -4.5885    1.8354    0.0000 H   0  0  0

+   -5.8154    1.4399    0.0000 H   0  0  0

+   -5.4199    0.2130    0.0000 H   0  0  0

+    6.4473   -0.4784    0.0000 H   0  0  0

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+    6.0517    1.3012    0.0000 H   0  0  0

+  1  2  1  0

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+  9 14  1  0

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+ 25 44  1  0

+ 25 45  1  0

+ 27 46  1  0

+ 27 47  1  0

+ 27 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82085-94-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 46                          1 V2000

+   -1.4762   -0.2914    0.5865 C   0  0  0

+   -2.4914    0.6482    1.0891 C   0  0  0

+   -0.1192    0.0395    0.6509 C   0  0  0

+   -1.8636   -1.5225    0.0473 C   0  0  0

+   -3.7432    0.9033    0.2899 C   0  0  1

+   -2.3204    1.2171    2.1461 O   0  0  0

+    0.8260   -0.8463    0.1779 C   0  0  0

+   -0.9066   -2.3973   -0.4214 C   0  0  0

+   -4.9678    0.7266    1.1900 C   0  0  0

+   -3.7157    2.3312   -0.2591 C   0  0  0

+    0.4345   -2.0600   -0.3594 C   0  0  0

+   -6.2388    0.9856    0.3786 C   0  0  0

+   -4.9867    2.5902   -1.0705 C   0  0  0

+    1.4739   -3.0221   -0.8740 C   0  0  0

+   -6.2112    2.4134   -0.1704 C   0  0  1

+    1.9115   -3.9537    0.2580 C   0  0  0

+   -7.4822    2.6725   -0.9818 C   0  0  0

+    2.9509   -4.9158   -0.2566 C   0  0  0

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+ 19 43  1  0

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+ 20 45  1  0

+ 22 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4337-51-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.5461    0.6434    0.0035 C   0  0  0

+   -1.0546   -0.6737    0.0016 C   0  0  0

+    0.8105    0.9007    0.0031 C   0  0  0

+   -2.0042    1.6504   -0.0009 S   0  0  0

+   -2.5118   -0.7253    0.0026 C   0  0  0

+   -0.1127   -1.7246   -0.0008 C   0  0  0

+    1.7005   -0.1539    0.0007 C   0  0  0

+   -3.1976    0.4291   -0.0050 N   0  0  0

+   -3.0958   -1.7952    0.0011 O   0  0  0

+    1.2216   -1.4577   -0.0013 C   0  0  0

+    3.1582    0.1031   -0.0004 N   0  3  0

+    3.9411   -0.8300   -0.0025 O   0  0  0

+    3.5749    1.2476    0.0009 O   0  5  0

+    1.1581    1.8795    0.0000 H   0  0  0

+   -0.4407   -2.7101    0.0000 H   0  0  0

+   -4.2289    0.5523    0.0000 H   0  0  0

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+  1  2  2  0

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+  5  8  1  0

+  7 10  1  0

+  3 14  1  0

+  6 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88321-09-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 54                          1 V2000

+   -2.9190    0.7665   -0.8838 C   0  0  2

+   -2.9645   -0.7596   -0.9838 C   0  0  2

+   -3.2576    0.0890   -2.0956 O   0  0  0

+   -1.4872    1.2318   -0.9516 C   0  0  0

+   -4.2517   -1.2641   -0.3840 C   0  0  0

+   -0.5996    0.8181   -0.0256 N   0  0  0

+   -1.1337    1.9785   -1.8395 O   0  0  0

+   -4.5348   -1.0150    0.9042 O   0  0  0

+   -5.0288   -1.8928   -1.0627 O   0  0  0

+    0.7923    1.2704   -0.0916 C   0  0  2

+   -5.7749   -1.5011    1.4821 C   0  0  0

+    1.6930    0.2103    0.4880 C   0  0  0

+    0.9465    2.5645    0.7099 C   0  0  0

+   -5.8505   -1.0838    2.9522 C   0  0  0

+    2.8096   -0.1588   -0.1703 N   0  0  0

+    1.4130   -0.3107    1.5468 O   0  0  0

+    2.3545    3.1269    0.5046 C   0  0  0

+    3.6852   -1.1894    0.3931 C   0  0  0

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+    6.7952   -3.6489    0.0000 H   0  0  0

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+ 23 50  1  0

+ 23 51  1  0

+ 24 52  1  0

+ 24 53  1  0

+ 24 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2107-76-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -1.2029   -2.7811    0.0013 C   0  0  0

+   -1.2185   -1.2742    0.0025 C   0  0  0

+   -0.0051   -0.5400    0.0015 C   0  0  0

+   -2.3952   -0.5951   -0.0013 C   0  0  0

+   -0.0479    0.8665    0.0022 C   0  0  0

+    1.2354   -1.2027   -0.0005 C   0  0  0

+   -2.3924    0.8140   -0.0005 C   0  0  0

+    1.1355    1.5875    0.0013 C   0  0  0

+   -1.2393    1.5046    0.0033 O   0  0  0

+    1.2848   -2.5588   -0.0016 O   0  0  0

+    2.4027   -0.4654   -0.0018 C   0  0  0

+   -3.4516    1.4156   -0.0039 O   0  0  0

+    2.3532    0.9251   -0.0003 C   0  0  0

+    3.5076    1.6393   -0.0012 O   0  0  0

+   -2.2421   -2.7919    0.0000 H   0  0  0

+   -1.1921   -3.8203    0.0000 H   0  0  0

+   -0.1637   -2.7703    0.0000 H   0  0  0

+   -3.2957   -1.1139    0.0000 H   0  0  0

+    1.1100    2.6265    0.0000 H   0  0  0

+    1.3226   -3.5974    0.0000 H   0  0  0

+    3.3217   -0.9508    0.0000 H   0  0  0

+    4.3914    2.1861    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  2  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  5  1  0

+  9  5  1  0

+ 10  6  1  0

+ 11  6  2  0

+ 12  7  2  0

+ 13  8  2  0

+ 14 13  1  0

+  7  9  1  0

+ 11 13  1  0

+  1 15  1  0

+  1 16  1  0

+  1 17  1  0

+  4 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3731-39-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    0.7968    0.4955   -0.0013 C   0  0  0

+   -0.5459    0.7377   -0.0014 N   0  0  0

+    1.7022    1.5626   -0.0014 C   0  0  0

+    1.2721   -0.8203    0.0049 C   0  0  0

+   -1.3789   -0.2472   -0.0013 N   0  0  0

+    3.0557    1.3143   -0.0012 C   0  0  0

+    2.6276   -1.0605    0.0050 C   0  0  0

+   -2.7244   -0.0045   -0.0015 C   0  0  0

+    3.5247    0.0035   -0.0010 C   0  0  0

+   -3.6297   -1.0688   -0.0014 C   0  0  0

+   -3.2009    1.3094    0.0039 C   0  0  0

+    4.8951   -0.2437   -0.0008 N   0  0  0

+   -4.9857   -0.8163   -0.0016 C   0  0  0

+   -3.1258   -2.4891   -0.0005 C   0  0  0

+   -4.5593    1.5464    0.0037 C   0  0  0

+    5.3907   -1.6223   -0.0005 C   0  0  0

+    5.8411    0.8749   -0.0009 C   0  0  0

+   -5.4501    0.4871   -0.0020 C   0  0  0

+    1.3513    2.5456    0.0000 H   0  0  0

+    0.5999   -1.6188    0.0000 H   0  0  0

+    3.7316    2.1097    0.0000 H   0  0  0

+    2.9830   -2.0419    0.0000 H   0  0  0

+   -2.5302    2.1092    0.0000 H   0  0  0

+   -5.6632   -1.6104    0.0000 H   0  0  0

+   -4.1095   -2.8381    0.0000 H   0  0  0

+   -2.7768   -3.4728    0.0000 H   0  0  0

+   -2.1421   -2.1401    0.0000 H   0  0  0

+   -4.9167    2.5271    0.0000 H   0  0  0

+    4.4085   -1.9754    0.0000 H   0  0  0

+    5.7438   -2.6045    0.0000 H   0  0  0

+    6.3729   -1.2692    0.0000 H   0  0  0

+    6.6381    0.2009    0.0000 H   0  0  0

+    6.5151    1.6719    0.0000 H   0  0  0

+    5.0441    1.5489    0.0000 H   0  0  0

+   -6.4773    0.6724    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 12 17  1  0

+ 13 18  2  0

+  7  9  2  0

+ 15 18  1  0

+  3 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 11 23  1  0

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+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5003-48-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+   -2.5610    0.8347    0.2397 C   0  0  0

+   -3.5253   -0.1554    0.4736 C   0  0  0

+   -1.1303    0.4811    0.1973 C   0  0  0

+   -2.9641    2.1579    0.0412 C   0  0  0

+   -4.8681    0.1885    0.5109 C   0  0  0

+   -3.1465   -1.4448    0.6622 O   0  0  0

+   -0.2066    1.4360   -0.0278 O   0  0  0

+   -0.7841   -0.6715    0.3654 O   0  0  0

+   -4.3032    2.4808    0.0765 C   0  0  0

+   -5.2523    1.5009    0.3183 C   0  0  0

+   -3.1104   -2.2932   -0.3784 C   0  0  0

+    1.0991    1.0939   -0.1906 C   0  0  0

+   -2.8093   -3.7522   -0.1510 C   0  0  0

+   -3.3193   -1.8866   -1.4969 O   0  0  0

+    2.0271    2.0564   -0.5604 C   0  0  0

+    1.5039   -0.2168    0.0188 C   0  0  0

+    3.3535    1.7096   -0.7255 C   0  0  0

+    2.8296   -0.5648   -0.1459 C   0  0  0

+    3.7583    0.3973   -0.5213 C   0  0  0

+    5.1034    0.0449   -0.6890 N   0  0  0

+    5.7728   -0.5559    0.3148 C   0  0  0

+    7.2438   -0.8495    0.1698 C   0  0  0

+    5.1913   -0.8603    1.3347 O   0  0  0

+   -2.2598    2.9051    0.0000 H   0  0  0

+   -5.5817   -0.5498    0.0000 H   0  0  0

+   -4.5893    3.4669    0.0000 H   0  0  0

+   -6.2491    1.7473    0.0000 H   0  0  0

+   -3.8149   -3.9597    0.0000 H   0  0  0

+   -2.6018   -4.7578    0.0000 H   0  0  0

+   -1.8037   -3.5447    0.0000 H   0  0  0

+    1.7493    3.0449    0.0000 H   0  0  0

+    0.7936   -0.9582    0.0000 H   0  0  0

+    4.0636    2.4513    0.0000 H   0  0  0

+    3.1066   -1.5535    0.0000 H   0  0  0

+    5.5901    0.9490    0.0000 H   0  0  0

+    7.0428   -1.8564    0.0000 H   0  0  0

+    8.2507   -1.0505    0.0000 H   0  0  0

+    7.4448    0.1574    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+ 11 13  1  0

+ 11 14  2  0

+ 12 15  2  0

+ 12 16  1  0

+ 15 17  1  0

+ 16 18  2  0

+ 17 19  2  0

+ 19 20  1  0

+ 20 21  1  0

+ 21 22  1  0

+ 21 23  2  0

+  9 10  1  0

+ 18 19  1  0

+  4 24  1  0

+  5 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 20 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107673-66-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+    1.2423    0.2357   -0.0033 C   0  0  0

+    0.1413    1.0789   -0.0032 C   0  0  0

+    2.5735    0.6606   -0.0018 C   0  0  0

+    1.1843   -1.2169    0.0013 C   0  0  0

+   -1.1807    0.4378   -0.0026 C   0  0  0

+    0.3815    2.4526   -0.0033 C   0  0  0

+    3.3878   -0.5555   -0.0002 C   0  0  0

+    2.7829    2.0386   -0.0028 C   0  0  0

+   -0.0552   -1.8157    0.0047 C   0  0  0

+    2.5861   -1.6502    0.0016 C   0  0  0

+   -1.2371   -1.0311   -0.0061 C   0  0  0

+   -2.3407    1.1882    0.0017 C   0  0  0

+    1.6936    2.8989   -0.0027 C   0  0  0

+    4.8679   -0.5867    0.0024 N   0  3  0

+   -2.4781   -1.6710   -0.0077 C   0  0  0

+   -3.5840    0.5471    0.0021 C   0  0  0

+    5.4546   -1.6541    0.0036 O   0  0  0

+    5.4990    0.4551    0.0034 O   0  5  0

+   -3.6513   -0.9164   -0.0034 C   0  0  0

+   -4.7852    1.2820    0.0086 C   0  0  0

+   -4.9182   -1.5361   -0.0047 C   0  0  0

+   -5.9744    0.6232    0.0085 C   0  0  0

+   -6.0397   -0.7690    0.0013 C   0  0  0

+   -0.4132    3.1330    0.0000 H   0  0  0

+    3.7561    2.4225    0.0000 H   0  0  0

+   -0.1263   -2.8595    0.0000 H   0  0  0

+    2.9147   -2.6435    0.0000 H   0  0  0

+   -2.2894    2.2331    0.0000 H   0  0  0

+    1.8709    3.9300    0.0000 H   0  0  0

+   -2.5280   -2.7160    0.0000 H   0  0  0

+   -4.7626    2.3280    0.0000 H   0  0  0

+   -4.9940   -2.5795    0.0000 H   0  0  0

+   -6.8631    1.1753    0.0000 H   0  0  0

+   -6.9762   -1.2353    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

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+  7 14  1  0

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+ 12 16  2  0

+ 14 17  2  0

+ 14 18  1  0

+ 15 19  2  0

+ 16 20  1  0

+ 19 21  1  0

+ 20 22  2  0

+ 21 23  2  0

+  7 10  2  0

+  8 13  1  0

+  9 11  2  0

+ 16 19  1  0

+ 22 23  1  0

+  6 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+ 22 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+185-70-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.6988    0.0000   -0.2164 C   0  0  0

+   -2.2016    0.0000   -0.4875 C   0  0  0

+   -1.6613    0.0000    0.8360 O   0  0  0

+    0.0778   -1.2924   -0.4785 C   0  0  0

+    0.0778    1.2924   -0.4785 C   0  0  0

+    1.3897   -1.2516    0.3117 C   0  0  0

+    1.3897    1.2516    0.3117 C   0  0  0

+    2.1786    0.0000   -0.0762 C   0  0  0

+   -2.7564    0.9610    0.0000 H   0  0  0

+   -2.7564   -0.9610    0.0000 H   0  0  0

+   -0.9563   -1.6948    0.0000 H   0  0  0

+    0.2994   -2.3797    0.0000 H   0  0  0

+    0.2994    2.3797    0.0000 H   0  0  0

+   -0.9563    1.6948    0.0000 H   0  0  0

+    1.2055   -2.3458    0.0000 H   0  0  0

+    2.4264   -1.6472    0.0000 H   0  0  0

+    2.4264    1.6472    0.0000 H   0  0  0

+    1.2055    2.3458    0.0000 H   0  0  0

+    3.0193   -0.7242    0.0000 H   0  0  0

+    3.0193    0.7242    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  2  3  1  0

+  7  8  1  0

+  2  9  1  0

+  2 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7083-63-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.8248   -0.2531   -0.0013 C   0  0  0

+   -0.6528   -0.1286   -0.0006 C   0  0  0

+    1.3971    1.0163   -0.0010 C   0  0  0

+    1.6528   -1.3778    0.0030 C   0  0  0

+   -1.0055    1.2171    0.0002 C   0  0  0

+   -1.6614   -1.1033   -0.0006 C   0  0  0

+    0.2715    2.0215    0.0000 C   0  0  0

+    2.7683    1.1604   -0.0009 C   0  0  0

+    3.0232   -1.2238    0.0021 C   0  0  0

+   -2.3338    1.5886    0.0010 C   0  0  0

+   -2.9932   -0.7167    0.0002 C   0  0  0

+   -1.3260   -2.4570   -0.0018 N   0  0  0

+    3.5824    0.0417   -0.0011 C   0  0  0

+   -3.3267    0.6241    0.0010 C   0  0  0

+    1.2355   -2.3323    0.0000 H   0  0  0

+    1.0347    2.7305    0.0000 H   0  0  0

+   -0.3634    2.8474    0.0000 H   0  0  0

+    3.1916    2.1122    0.0000 H   0  0  0

+    3.6397   -2.0635    0.0000 H   0  0  0

+   -2.5906    2.5982    0.0000 H   0  0  0

+   -3.7439   -1.4389    0.0000 H   0  0  0

+   -2.0764   -3.1795    0.0000 H   0  0  0

+   -0.3251   -2.7456    0.0000 H   0  0  0

+    4.6182    0.1524    0.0000 H   0  0  0

+   -4.3284    0.9100    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  2  0

+  5  7  1  0

+  9 13  1  0

+ 11 14  1  0

+  4 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-57-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.2815   -0.7578    0.1170 N   0  0  0

+   -1.0425   -0.5428   -0.0151 C   0  0  0

+    1.1986    0.3773    0.2462 C   0  0  0

+   -1.8862   -1.5871   -0.1340 N   0  0  0

+   -1.6525    1.0567   -0.0320 S   0  0  0

+    2.6111   -0.1308    0.3789 C   0  0  0

+    3.5158    0.2109   -0.5047 C   0  0  0

+    0.6567   -1.7392    0.0000 H   0  0  0

+    1.6620    1.3203    0.0000 H   0  0  0

+    0.3130    0.9426    0.0000 H   0  0  0

+   -2.9241   -1.4239    0.0000 H   0  0  0

+   -1.5086   -2.5676    0.0000 H   0  0  0

+    2.6194   -1.1815    0.0000 H   0  0  0

+    4.3288   -0.4547    0.0000 H   0  0  0

+    3.6858    1.2477    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  6  7  2  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+83-44-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 71                          1 V2000

+    1.3908   -1.1296   -0.2238 C   0  0  1

+    0.1834   -0.8580    0.6534 C   0  0  1

+    2.1948    0.1770   -0.3105 C   0  0  1

+    2.2680   -2.2168    0.3991 C   0  0  0

+   -0.6897    0.1857   -0.0945 C   0  0  1

+   -0.7983   -2.0241    0.8128 C   0  0  0

+    3.4220   -0.0467   -1.1953 C   0  0  2

+    1.3518    1.3194   -0.8664 C   0  0  0

+    3.5030   -2.4389   -0.4766 C   0  0  0

+   -2.0160    0.1352    0.6565 C   0  0  2

+    0.0564    1.5048   -0.0580 C   0  0  2

+   -0.8968   -0.2540   -1.5453 C   0  0  0

+   -2.1234   -1.3118    1.1995 C   0  0  0

+    4.3004   -1.1370   -0.5769 C   0  0  2

+    4.2214    1.2541   -1.2968 C   0  0  0

+    2.9727   -0.4834   -2.5911 C   0  0  0

+   -3.1646    0.4005   -0.3187 C   0  0  1

+    0.3817    1.8307    1.2948 O   0  0  0

+    4.7420   -0.7010    0.8218 C   0  0  0

+    4.6630    1.6903    0.1017 C   0  0  0

+   -4.4943    0.0496    0.3519 C   0  0  0

+   -3.1672    1.8786   -0.7138 C   0  0  0

+    5.5393    0.6009    0.7227 C   0  0  1

+   -5.6430    0.3148   -0.6233 C   0  0  0

+    5.9509    1.0080    2.0292 O   0  0  0

+   -6.9527   -0.0308    0.0372 C   0  0  0

+   -8.1045    0.1233   -0.6346 O   0  0  0

+   -6.9659   -0.4466    1.1716 O   0  0  0

+    0.8541   -1.9922    0.0000 H   0  0  0

+    0.7124    0.0093    0.0000 H   0  0  0

+    2.7324    1.0390    0.0000 H   0  0  0

+    1.3297   -2.6061    0.0000 H   0  0  0

+    2.3772   -3.2268    0.0000 H   0  0  0

+   -1.3397   -2.8837    0.0000 H   0  0  0

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+   -4.1831    1.8768    0.0000 H   0  0  0

+    6.3355   -0.0301    0.0000 H   0  0  0

+   -5.0788    1.1596    0.0000 H   0  0  0

+   -6.2332    1.1416    0.0000 H   0  0  0

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+   -9.1114    0.2580    0.0000 H   0  0  0

+  1  2  1  0

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+ 23 64  1  0

+ 24 65  1  0

+ 24 66  1  0

+ 25 67  1  0

+ 27 68  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19077-98-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    0.0837   -1.0157    0.0621 C   0  0  0

+   -1.4909   -1.7294   -0.2784 S   0  0  0

+    0.8305   -1.4709    1.1334 C   0  0  0

+    0.5724   -0.0057   -0.7457 C   0  0  0

+   -2.6215   -0.8580    0.5611 N   0  0  0

+   -1.7442   -1.4684   -1.6521 O   0  0  0

+   -1.4699   -3.0162    0.3240 O   0  0  0

+    2.0649   -0.9136    1.4029 C   0  0  0

+    1.8065    0.5560   -0.4815 C   0  0  0

+   -2.7743    0.5015    0.3150 C   0  0  0

+    2.5562    0.1051    0.5967 C   0  0  0

+   -3.7258    1.2276    1.0237 C   0  0  0

+   -2.0090    1.0950   -0.5882 N   0  0  0

+    3.8066    0.6720    0.8671 N   0  0  0

+   -3.8673    2.5799    0.7688 C   0  0  0

+   -2.1219    2.3829   -0.8518 C   0  0  0

+    4.7460    0.7237   -0.0979 C   0  0  0

+   -3.0494    3.1626   -0.1899 C   0  0  0

+    6.0421    1.4513    0.1504 C   0  0  0

+    4.5481    0.1847   -1.1663 O   0  0  0

+    0.7745   -2.3779    0.0000 H   0  0  0

+   -0.0626    0.6444    0.0000 H   0  0  0

+   -3.4133   -1.3040    0.0000 H   0  0  0

+    2.6993   -1.5643    0.0000 H   0  0  0

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+   -3.0131    4.0706    0.0000 H   0  0  0

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+    6.8345    1.8962    0.0000 H   0  0  0

+    5.5972    2.2437    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+183249-37-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -0.2432   -0.3151   -0.0021 C   0  0  0

+   -1.3934    0.5008   -0.0010 C   0  0  0

+    1.1011    0.2634   -0.0008 C   0  0  0

+   -0.3790   -1.7195    0.0017 C   0  0  0

+   -2.6469   -0.1022   -0.0018 C   0  0  0

+   -1.5638    1.9634    0.0008 C   0  0  0

+    2.2152   -0.6070   -0.0013 C   0  0  0

+    1.3030    1.6459    0.0003 C   0  0  0

+   -1.6610   -2.2896    0.0058 C   0  0  0

+    0.7754   -2.5381    0.0018 C   0  0  0

+   -2.7731   -1.4800   -0.0029 C   0  0  0

+   -3.6578    1.0199   -0.0004 C   0  0  0

+   -2.8449    2.2934    0.0012 C   0  0  0

+    2.0144   -2.0066   -0.0034 C   0  0  0

+    3.5075   -0.0632   -0.0001 C   0  0  0

+    2.5745    2.1437    0.0010 C   0  0  0

+    3.6722    1.2908    0.0014 C   0  0  0

+   -0.7711    2.6549    0.0000 H   0  0  0

+    0.4794    2.3002    0.0000 H   0  0  0

+   -1.7717   -3.3357    0.0000 H   0  0  0

+    0.6643   -3.5841    0.0000 H   0  0  0

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+   -3.2305    3.2721    0.0000 H   0  0  0

+    2.8492   -2.6466    0.0000 H   0  0  0

+    4.3470   -0.6971    0.0000 H   0  0  0

+    2.7251    3.1848    0.0000 H   0  0  0

+    4.6433    1.6952    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+158366-45-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.7278   -0.5285   -0.0706 C   0  0  0

+   -0.6436   -0.4525    0.0496 N   0  0  0

+    1.6224    0.5628   -0.1529 C   0  0  0

+    1.0678   -1.8703   -0.0897 C   0  0  0

+   -1.3936    0.7292    0.1110 N   0  3  0

+   -1.1435   -1.7042    0.0978 C   0  0  0

+    1.6533    1.4200   -1.3920 C   0  0  0

+    2.3661    0.8096    0.7749 O   0  0  0

+   -0.1215   -2.5927    0.0209 C   0  0  0

+   -2.4525    0.8101   -0.4854 O   0  0  0

+   -0.9867    1.6757    0.7607 O   0  5  0

+    2.0078   -2.2549    0.0000 H   0  0  0

+   -2.1306   -1.9433    0.0000 H   0  0  0

+    2.6683    1.3834    0.0000 H   0  0  0

+    1.6899    2.4350    0.0000 H   0  0  0

+    0.6383    1.4566    0.0000 H   0  0  0

+   -0.2076   -3.6047    0.0000 H   0  0  0

+  1  2  1  0

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+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55028-70-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 60                          1 V2000

+    2.7090    0.3943   -0.2867 C   0  0  2

+    2.6535   -0.8893    0.5607 C   0  0  2

+    4.0859    0.4387   -0.9258 C   0  0  0

+    2.5285    1.6128    0.6209 C   0  0  0

+    4.0311   -1.5672    0.3993 C   0  0  1

+    1.5796   -1.7998    0.0233 C   0  0  0

+    4.9676   -0.4031   -0.0096 C   0  0  0

+    4.4109    1.0136   -1.9368 O   0  0  0

+    2.5830    2.8696   -0.2088 C   0  0  0

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+    0.5774   -2.1539    0.7891 C   0  0  0

+    1.5559    3.6824   -0.2346 C   0  0  0

+   -0.4965   -3.0645    0.2517 C   0  0  2

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+   -0.5517   -4.3405    1.0941 C   0  0  0

+   -0.2001   -3.4017   -1.1049 O   0  0  0

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+   -2.2542    3.3470   -0.4141 C   0  0  0

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+   -4.6376    3.6993    0.1255 O   0  0  0

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+   -6.7339   -2.7752   -0.6456 C   0  0  0

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+   -1.4383    4.6672    0.0000 H   0  0  0

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+   -1.7132    2.5243    0.0000 H   0  0  0

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+   -5.5980    3.4822    0.0000 H   0  0  0

+   -6.2748   -1.9042    0.0000 H   0  0  0

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+ 23 56  1  0

+ 24 57  1  0

+ 26 58  1  0

+ 26 59  1  0

+ 26 60  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98-83-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.2752   -0.0178    0.0189 C   0  0  0

+    0.4403   -1.1681   -0.3167 C   0  0  0

+    0.4103    1.1559    0.3336 C   0  0  0

+   -1.7530   -0.0413    0.0349 C   0  0  0

+    1.8194   -1.1380   -0.3353 C   0  0  0

+    1.7900    1.1727    0.3112 C   0  0  0

+   -2.5311    0.8816   -0.8673 C   0  0  0

+   -2.3940   -0.8742    0.8429 C   0  0  0

+    2.4932    0.0292   -0.0222 C   0  0  0

+   -0.0435   -2.0615    0.0000 H   0  0  0

+   -0.1009    2.0340    0.0000 H   0  0  0

+    2.3370   -2.0123    0.0000 H   0  0  0

+    2.2803    2.0625    0.0000 H   0  0  0

+   -1.7543    1.5365    0.0000 H   0  0  0

+   -3.1860    1.6584    0.0000 H   0  0  0

+   -3.3079    0.2267    0.0000 H   0  0  0

+   -3.4011   -0.7401    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+623-30-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.8175   -0.3449   -0.0021 C   0  0  0

+   -1.9522   -1.1340   -0.0007 C   0  0  0

+   -1.2136    0.9455   -0.0009 O   0  0  0

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+  1  2  2  0

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+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4485-12-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 55                          1 V2000

+    1.2206   -0.3546   -0.2155 C   0  0  0

+   -0.0346    0.1503    0.4989 C   0  0  0

+    2.4617    0.0745    0.5697 C   0  0  0

+   -1.2757   -0.2788   -0.2863 C   0  0  0

+    3.7169   -0.4303   -0.1447 C   0  0  0

+   -2.5309    0.2261    0.4281 C   0  0  0

+    4.9580   -0.0012    0.6406 C   0  0  0

+   -3.7720   -0.2030   -0.3571 C   0  0  0

+    6.2132   -0.5061   -0.0738 C   0  0  0

+   -5.0272    0.3019    0.3573 C   0  0  0

+    7.4543   -0.0770    0.7114 C   0  0  0

+   -6.2683   -0.1272   -0.4279 C   0  0  0

+    8.6907   -0.5743    0.0077 C   0  0  0

+   -7.5235    0.3777    0.2864 C   0  0  0

+    9.7968   -0.3374    0.4737 O   0  0  0

+    8.5883   -1.2150   -1.0296 O   0  0  0

+   -8.7646   -0.0514   -0.4988 C   0  0  0

+  -10.0198    0.4535    0.2156 C   0  0  0

+  -11.2609    0.0244   -0.5696 C   0  0  0

+  -12.5162    0.5292    0.1448 C   0  0  0

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+    0.6109   -1.1280    0.0000 H   0  0  0

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+   -6.8780   -0.9006    0.0000 H   0  0  0

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+   -6.9138    1.1511    0.0000 H   0  0  0

+   -8.0942    1.1804    0.0000 H   0  0  0

+   -9.3743   -0.8248    0.0000 H   0  0  0

+   -8.1939   -0.8541    0.0000 H   0  0  0

+   -9.4101    1.2269    0.0000 H   0  0  0

+  -10.5905    1.2562    0.0000 H   0  0  0

+  -11.8706   -0.7491    0.0000 H   0  0  0

+  -10.6902   -0.7783    0.0000 H   0  0  0

+  -12.1487    1.4430    0.0000 H   0  0  0

+  -13.4300    0.8967    0.0000 H   0  0  0

+  -12.8837   -0.3846    0.0000 H   0  0  0

+    8.4329   -2.1875    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 53  1  0

+ 20 54  1  0

+ 20 55  1  0

+ 20 56  1  0

+ 16 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+133561-39-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.3352   -0.6377   -0.0715 C   0  0  0

+   -0.1431   -0.5212   -0.0808 C   0  0  0

+    2.1265    0.5063   -0.1702 C   0  0  0

+    1.9360   -1.8905    0.0419 C   0  0  0

+   -0.8257   -0.1383    1.0797 C   0  0  0

+   -0.8585   -0.7865   -1.2460 C   0  0  0

+    3.5004    0.3956   -0.1608 C   0  0  0

+    1.4915    1.8384   -0.2855 N   0  3  0

+    3.3107   -1.9965    0.0508 C   0  0  0

+   -2.2090   -0.0322    1.0608 C   0  0  0

+   -0.1181    0.1349    2.2508 N   0  0  0

+   -2.2344   -0.6767   -1.2498 C   0  0  0

+    4.0974   -0.8554   -0.0530 C   0  0  0

+    2.1823    2.8407   -0.3283 O   0  0  0

+    0.2782    1.9323   -0.3375 O   0  5  0

+   -2.9078   -0.3036   -0.0997 C   0  0  0

+    5.4893   -0.9651   -0.0441 N   0  0  0

+   -4.3836   -0.1889   -0.1146 N   0  3  0

+   -5.0026   -0.4275   -1.1361 O   0  0  0

+   -4.9788    0.1441    0.8945 O   0  5  0

+    1.3519   -2.7438    0.0000 H   0  0  0

+   -0.7165   -1.8108    0.0000 H   0  0  0

+    4.0868    1.2473    0.0000 H   0  0  0

+    3.7559   -2.9298    0.0000 H   0  0  0

+   -2.3604    0.9907    0.0000 H   0  0  0

+    0.6868   -0.5143    0.0000 H   0  0  0

+    0.0417    1.1566    0.0000 H   0  0  0

+   -2.5329   -1.6668    0.0000 H   0  0  0

+    5.9344   -1.8985    0.0000 H   0  0  0

+    6.0751   -0.1129    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  2  0

+  2  5  2  0

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+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+475-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 34                          1 V2000

+   -0.3331    0.3199    0.0227 C   0  0  0

+   -0.2102   -1.0833    0.0087 C   0  0  0

+    0.8713    1.1682    0.0181 C   0  0  0

+   -1.6035    0.8938    0.0466 C   0  0  0

+    1.0509   -1.7154   -0.0126 C   0  0  0

+   -1.3780   -1.8887    0.0166 C   0  0  0

+    2.1497    0.5752   -0.0031 C   0  0  0

+    0.7589    2.5581    0.0351 C   0  0  0

+   -2.7500    0.0815    0.0588 C   0  0  0

+   -1.9974    2.1973    0.0612 O   0  0  0

+    2.2757   -0.8907   -0.0204 C   0  0  0

+    1.1274   -3.0374   -0.0249 N   0  0  0

+   -2.6442   -1.2803    0.0368 C   0  0  0

+   -1.2194   -3.2830    0.0033 C   0  0  0

+    3.2881    1.3849   -0.0075 C   0  0  0

+    1.8949    3.3394    0.0307 C   0  0  0

+   -3.8500    0.8911    0.0815 O   0  0  0

+   -3.3815    2.1874   -0.3331 C   0  0  0

+    3.3736   -1.4159   -0.0402 O   0  0  0

+    0.0577   -3.8078   -0.0176 C   0  0  0

+    3.1531    2.7559    0.0094 C   0  0  0

+   -0.1853    3.0070    0.0000 H   0  0  0

+   -3.5070   -1.8708    0.0000 H   0  0  0

+   -2.0536   -3.9133    0.0000 H   0  0  0

+    4.2397    0.9517    0.0000 H   0  0  0

+    1.8071    4.3812    0.0000 H   0  0  0

+   -3.2659    3.2265    0.0000 H   0  0  0

+   -4.3998    2.4246    0.0000 H   0  0  0

+    0.1799   -4.8461    0.0000 H   0  0  0

+    4.0056    3.3611    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+ 16 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 20 29  1  0

+ 21 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42583-46-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 41                          1 V2000

+   -1.2693    0.2215    0.2888 C   0  0  0

+   -2.3988    1.2204    0.4586 C   0  0  1

+    0.0853    0.3916    0.0884 C   0  0  0

+   -1.8319   -1.0486    0.3529 C   0  0  0

+   -2.9277    1.5912   -0.9432 C   0  0  0

+   -3.5283    0.3176    1.0341 C   0  0  2

+    0.9166   -0.7538    0.0088 C   0  0  0

+    0.6035    1.6356   -0.0622 O   0  0  0

+   -3.1790   -0.9799    0.5304 O   0  0  0

+   -1.0133   -2.1757    0.2319 C   0  0  0

+   -4.4300    1.2674   -0.8993 C   0  0  0

+   -3.4812    0.4154   -1.5408 O   0  0  0

+   -4.7334    0.7650    0.4038 O   0  0  0

+    2.3043   -0.5510   -0.1033 C   0  0  0

+    0.3479   -2.0376    0.0584 C   0  0  0

+    1.9080    1.8753    0.2418 C   0  0  0

+    2.8270    0.7454   -0.0051 C   0  0  0

+    3.4162   -1.5252   -0.3272 C   0  0  0

+    1.1339   -3.1359   -0.0641 O   0  0  0

+    2.2898    2.9425    0.6844 O   0  0  0

+    4.2637    0.7428   -0.1637 C   0  0  0

+    4.7091   -0.6897   -0.3730 C   0  0  0

+    0.2724   -4.2724    0.0263 C   0  0  0

+    4.9865    1.7174   -0.1342 O   0  0  0

+   -1.7536    2.0385    0.0000 H   0  0  0

+   -2.7211    2.6124    0.0000 H   0  0  0

+   -4.2983   -0.3842    0.0000 H   0  0  0

+   -1.4389   -3.1267    0.0000 H   0  0  0

+   -5.0353    2.1154    0.0000 H   0  0  0

+    2.6602   -2.2420    0.0000 H   0  0  0

+    4.0601   -2.3442    0.0000 H   0  0  0

+    5.1929   -1.6124    0.0000 H   0  0  0

+    5.6718   -0.2915    0.0000 H   0  0  0

+   -0.5579   -3.6430    0.0000 H   0  0  0

+   -0.3570   -5.1027    0.0000 H   0  0  0

+    1.1027   -4.9018    0.0000 H   0  0  0

+  1  2  1  0

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+  6  9  1  0

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+ 21 22  1  0

+  2 25  1  0

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+ 10 28  1  0

+ 11 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+ 23 34  1  0

+ 23 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+143-27-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 51                          1 V2000

+   -0.0934   -0.4141   -0.0045 C   0  0  0

+   -1.3430    0.4687    0.0051 C   0  0  0

+    1.1555    0.4697    0.0051 C   0  0  0

+   -2.5919   -0.4151   -0.0045 C   0  0  0

+    2.4051   -0.4131   -0.0045 C   0  0  0

+   -3.8414    0.4678    0.0051 C   0  0  0

+    3.6539    0.4707    0.0051 C   0  0  0

+   -5.0903   -0.4160   -0.0045 C   0  0  0

+    4.9035   -0.4121   -0.0045 C   0  0  0

+   -6.3399    0.4668    0.0051 C   0  0  0

+    6.1524    0.4717    0.0051 C   0  0  0

+   -7.5888   -0.4170   -0.0045 C   0  0  0

+    7.4020   -0.4111   -0.0045 C   0  0  0

+   -8.8384    0.4658    0.0051 C   0  0  0

+    8.6509    0.4727    0.0052 C   0  0  0

+  -10.0872   -0.4180   -0.0046 C   0  0  0

+    9.8506   -0.3749   -0.0041 N   0  0  0

+   -0.8572   -1.2704    0.0000 H   0  0  0

+    0.6711   -1.2698    0.0000 H   0  0  0

+   -0.5792    1.3250    0.0000 H   0  0  0

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+    5.6680   -1.2678    0.0000 H   0  0  0

+   -5.5761    1.3231    0.0000 H   0  0  0

+   -7.1044    1.3225    0.0000 H   0  0  0

+    6.9162    1.3280    0.0000 H   0  0  0

+    5.3879    1.3274    0.0000 H   0  0  0

+   -8.3526   -1.2733    0.0000 H   0  0  0

+   -6.8243   -1.2727    0.0000 H   0  0  0

+    6.6382   -1.2674    0.0000 H   0  0  0

+    8.1665   -1.2668    0.0000 H   0  0  0

+   -8.0746    1.3221    0.0000 H   0  0  0

+   -9.6029    1.3215    0.0000 H   0  0  0

+    9.4147    1.3290    0.0000 H   0  0  0

+    7.8864    1.3284    0.0000 H   0  0  0

+  -10.7501    0.5186    0.0000 H   0  0  0

+  -11.0238   -1.0809    0.0000 H   0  0  0

+   -9.4243   -1.3546    0.0000 H   0  0  0

+    9.7458   -1.5176    0.0000 H   0  0  0

+   10.8926    0.1057    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 48  1  0

+ 16 49  1  0

+ 16 50  1  0

+ 17 51  1  0

+ 17 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-34-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    1.1498   -0.7552   -0.0034 C   0  0  0

+    0.0001   -1.4209   -0.0025 N   0  0  0

+    1.1465    0.5757   -0.0026 N   0  0  0

+    2.3462   -1.4429    0.0005 N   0  0  0

+   -1.1499   -0.7551   -0.0007 C   0  0  0

+    0.0001    1.2357   -0.0008 C   0  0  0

+    3.6136   -0.7081   -0.0005 C   0  0  0

+   -1.1466    0.5756    0.0001 N   0  0  0

+   -2.3463   -1.4428   -0.0002 N   0  0  0

+    0.0001    2.9717    0.0009 Cl  0  0  0

+    4.7783   -1.7001    0.0045 C   0  0  0

+   -3.6136   -0.7080    0.0017 C   0  0  0

+   -4.7784   -1.7001    0.0019 C   0  0  0

+    2.3481   -2.4779    0.0000 H   0  0  0

+    4.3695   -0.0011    0.0000 H   0  0  0

+    2.9966    0.1228    0.0000 H   0  0  0

+   -2.3482   -2.4778    0.0000 H   0  0  0

+    4.1072   -2.4880    0.0000 H   0  0  0

+    5.5662   -2.3712    0.0000 H   0  0  0

+    5.4494   -0.9122    0.0000 H   0  0  0

+   -2.9966    0.1229    0.0000 H   0  0  0

+   -4.3695   -0.0010    0.0000 H   0  0  0

+   -5.4495   -0.9122    0.0000 H   0  0  0

+   -5.5663   -2.3712    0.0000 H   0  0  0

+   -4.1073   -2.4880    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+  9 12  1  0

+ 12 13  1  0

+  6  8  1  0

+  4 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+152-18-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -0.0051   -0.0763   -0.1069 P   0  0  0

+   -1.3336   -0.2073   -1.0069 O   0  0  0

+   -0.0998   -1.0898    1.1405 O   0  0  0

+    1.2850   -0.4413   -0.9983 O   0  0  0

+    0.1490    1.6709    0.5226 S   0  0  0

+   -2.3872    0.4322   -0.2836 C   0  0  0

+   -0.2286   -2.4045    0.5956 C   0  0  0

+    2.4289    0.0243   -0.2793 C   0  0  0

+   -1.8731    1.2791    0.0000 H   0  0  0

+   -3.2341    0.9463    0.0000 H   0  0  0

+   -2.9013   -0.4147    0.0000 H   0  0  0

+   -1.2146   -2.3079    0.0000 H   0  0  0

+   -0.3252   -3.3905    0.0000 H   0  0  0

+    0.7574   -2.5011    0.0000 H   0  0  0

+    2.8024   -0.8933    0.0000 H   0  0  0

+    3.3465    0.3978    0.0000 H   0  0  0

+    2.0554    0.9419    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+608-93-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.0002   -0.9411   -0.0019 C   0  0  0

+   -1.1987   -0.2487   -0.0010 C   0  0  0

+    1.1986   -0.2488   -0.0014 C   0  0  0

+    0.0002   -2.6771    0.0036 Cl  0  0  0

+   -1.1982    1.1356    0.0004 C   0  0  0

+   -2.7023   -1.1163   -0.0023 Cl  0  0  0

+    1.1980    1.1359    0.0000 C   0  0  0

+    2.7023   -1.1162   -0.0019 Cl  0  0  0

+    0.0001    1.8271    0.0009 C   0  0  0

+   -2.7014    2.0040    0.0009 Cl  0  0  0

+    2.7011    2.0044    0.0007 Cl  0  0  0

+    0.0001    2.8656    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+  7  9  2  0

+  9 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2646-17-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    2.1150   -0.4473   -0.0538 C   0  0  0

+    0.9835    0.4397   -0.3227 C   0  0  0

+    3.3993    0.1189    0.1331 C   0  0  0

+    1.9518   -1.8347    0.0272 C   0  0  0

+   -0.2650   -0.0636   -0.5076 N   0  0  0

+    1.2151    1.8166   -0.3849 C   0  0  0

+    3.5603    1.5141    0.0574 C   0  0  0

+    4.4907   -0.7275    0.3918 C   0  0  0

+    3.0325   -2.6270    0.2802 C   0  0  0

+   -1.2648    0.4398    0.1335 N   0  0  0

+    2.4989    2.3251   -0.1937 C   0  0  0

+    0.1845    2.6632   -0.6331 O   0  0  0

+    4.2979   -2.0741    0.4586 C   0  0  0

+   -2.5020   -0.1307    0.0269 C   0  0  0

+   -3.6102    0.4787    0.6225 C   0  0  0

+   -2.6666   -1.3232   -0.6831 C   0  0  0

+   -4.8554   -0.1029    0.5106 C   0  0  0

+   -3.4443    1.7677    1.3853 C   0  0  0

+   -3.9183   -1.8931   -0.7864 C   0  0  0

+   -5.0096   -1.2871   -0.1893 C   0  0  0

+    1.0156   -2.2422    0.0000 H   0  0  0

+    4.5000    1.9133    0.0000 H   0  0  0

+    5.4372   -0.3445    0.0000 H   0  0  0

+    2.9201   -3.6418    0.0000 H   0  0  0

+    2.6390    3.3365    0.0000 H   0  0  0

+   -0.6045    3.3113    0.0000 H   0  0  0

+    5.1104   -2.6924    0.0000 H   0  0  0

+   -1.8479   -1.9332    0.0000 H   0  0  0

+   -5.6794    0.5000    0.0000 H   0  0  0

+   -2.4316    1.6374    0.0000 H   0  0  0

+   -3.3140    2.7804    0.0000 H   0  0  0

+   -4.4570    1.8980    0.0000 H   0  0  0

+   -3.9590   -2.9133    0.0000 H   0  0  0

+   -5.9212   -1.7470    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  1  0

+ 17 20  1  0

+  7 11  1  0

+  9 13  1  0

+ 19 20  2  0

+  4 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+619-89-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -2.3021   -0.0107    0.0037 C   0  0  0

+   -1.8047   -1.3026    0.0032 C   0  0  0

+   -1.4389    1.0708    0.0032 C   0  0  0

+   -3.7650    0.2149   -0.0013 N   0  3  0

+   -0.4435   -1.5210    0.0021 C   0  0  0

+   -0.0747    0.8689    0.0021 C   0  0  0

+   -4.2061    1.3502   -0.0009 O   0  0  0

+   -4.5276   -0.7348   -0.0060 O   0  5  0

+    0.4356   -0.4330    0.0016 C   0  0  0

+    1.8902   -0.6574    0.0005 C   0  0  0

+    2.7350    0.3945    0.0000 C   0  0  0

+    4.1802    0.1716   -0.0012 C   0  0  0

+    5.0250    1.2235   -0.0017 O   0  0  0

+    4.6207   -0.9620   -0.0017 O   0  0  0

+   -2.4571   -2.1074    0.0000 H   0  0  0

+   -1.8185    2.0348    0.0000 H   0  0  0

+   -0.0727   -2.4884    0.0000 H   0  0  0

+    0.5704    1.6796    0.0000 H   0  0  0

+    2.2654   -1.6231    0.0000 H   0  0  0

+    2.3598    1.3602    0.0000 H   0  0  0

+    5.6738    2.0313    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  2  0

+ 11 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+  6  9  2  0

+  2 15  1  0

+  3 16  1  0

+  5 17  1  0

+  6 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+627-05-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -0.1241   -0.5059   -0.5881 C   0  0  0

+   -1.4002   -0.0143   -0.0626 N   0  3  0

+    1.0280    0.1343    0.1889 C   0  0  0

+   -1.6521    1.1770   -0.0912 O   0  0  0

+   -2.2091   -0.7969    0.4028 O   0  5  0

+    2.3607   -0.3791   -0.3599 C   0  0  0

+    3.5128    0.2611    0.4171 C   0  0  0

+   -0.6820   -1.3219    0.0000 H   0  0  0

+    0.5418   -1.2365    0.0000 H   0  0  0

+    1.5859    0.9503    0.0000 H   0  0  0

+    0.3621    0.8649    0.0000 H   0  0  0

+    1.8028   -1.1951    0.0000 H   0  0  0

+    3.0266   -1.1097    0.0000 H   0  0  0

+    3.9929   -0.6030    0.0000 H   0  0  0

+    4.3769    0.7412    0.0000 H   0  0  0

+    3.0326    1.1252    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  2  5  1  0

+  3  6  1  0

+  6  7  1  0

+  1  8  1  0

+  1  9  1  0

+  3 10  1  0

+  3 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14953-62-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.4052   -0.8891    0.0847 C   0  0  0

+   -1.0044   -0.4410    0.0801 C   0  0  0

+    1.5096   -0.1039   -0.0380 C   0  0  0

+    0.8581   -2.1820    0.2199 N   0  0  0

+   -1.9477   -1.1040   -0.7055 C   0  0  0

+   -1.3976    0.6431    0.8661 C   0  0  0

+    2.5858   -0.8970    0.0164 N   0  0  0

+    1.5188    1.3673   -0.2026 N   0  3  0

+    2.2071   -2.1373    0.1700 C   0  0  0

+   -3.2611   -0.6809   -0.7053 C   0  0  0

+   -2.7137    1.0561    0.8573 C   0  0  0

+    2.4987    2.0109    0.1275 O   0  0  0

+    0.5464    1.9342   -0.6682 O   0  5  0

+   -3.6433    0.3980    0.0716 C   0  0  0

+    0.2917   -3.0093    0.0000 H   0  0  0

+   -1.7974   -2.0953    0.0000 H   0  0  0

+   -0.7043    1.3675    0.0000 H   0  0  0

+    2.8169   -2.9332    0.0000 H   0  0  0

+   -3.9598   -1.4000    0.0000 H   0  0  0

+   -2.8695    2.0466    0.0000 H   0  0  0

+   -4.5990    0.7011    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+  8 13  1  0

+ 10 14  2  0

+  7  9  2  0

+ 11 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 14 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-61-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.5099   -0.2743    0.0023 C   0  0  0

+    0.4334   -1.2937    0.0012 C   0  0  0

+   -0.0952    1.0517    0.0015 C   0  0  0

+   -1.8724   -0.5815   -0.0017 N   0  0  0

+    1.7801   -0.9864   -0.0006 C   0  0  0

+    1.2526    1.3519   -0.0003 C   0  0  0

+   -2.8661    0.4950   -0.0006 C   0  0  0

+    2.1893    0.3343   -0.0014 C   0  0  0

+    0.1263   -2.2868    0.0000 H   0  0  0

+   -0.7987    1.8169    0.0000 H   0  0  0

+   -2.1814   -1.5740    0.0000 H   0  0  0

+    2.4866   -1.7489    0.0000 H   0  0  0

+    1.5636    2.3438    0.0000 H   0  0  0

+   -2.1023    1.2001    0.0000 H   0  0  0

+   -3.5712    1.2588    0.0000 H   0  0  0

+   -3.6299   -0.2101    0.0000 H   0  0  0

+    3.2033    0.5630    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  6  8  1  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3778-73-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    1.3952    0.7377   -0.3671 N   0  0  0

+   -0.1699    0.5629    0.2163 P   0  0  1

+    1.9196    2.0007    0.1626 C   0  0  0

+    2.1934   -0.3374    0.2370 C   0  0  0

+   -0.8024    1.7408   -0.6726 O   0  0  0

+   -0.8241   -0.9400   -0.1657 N   0  0  0

+   -0.2594    0.8492    1.6655 O   0  0  0

+    1.1313    3.1709   -0.4294 C   0  0  0

+    3.3232   -0.7313   -0.7167 C   0  0  0

+   -0.3564    2.9804   -0.1291 C   0  0  0

+   -2.1813   -0.9646    0.3958 C   0  0  0

+    4.3029   -2.0508    0.0248 Cl  0  0  0

+   -3.1954   -1.1747   -0.7305 C   0  0  0

+   -4.8612   -1.2050   -0.0413 Cl  0  0  0

+    2.7696    1.4336    0.0000 H   0  0  0

+    2.6406    2.7249    0.0000 H   0  0  0

+    1.2215   -0.6530    0.0000 H   0  0  0

+    2.1824   -1.3592    0.0000 H   0  0  0

+   -0.2563   -1.7896    0.0000 H   0  0  0

+    2.0568    3.6040    0.0000 H   0  0  0

+    0.8464    4.1523    0.0000 H   0  0  0

+    4.2951   -0.4157    0.0000 H   0  0  0

+    3.3342    0.2905    0.0000 H   0  0  0

+   -0.3255    4.0018    0.0000 H   0  0  0

+   -1.3603    3.1712    0.0000 H   0  0  0

+   -1.7429   -0.0416    0.0000 H   0  0  0

+   -2.8125   -0.1610    0.0000 H   0  0  0

+   -3.6338   -2.0978    0.0000 H   0  0  0

+   -2.5642   -1.9783    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  9 12  1  0

+ 11 13  1  0

+ 13 14  1  0

+  8 10  1  0

+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+28361-96-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    2.2491   -0.4161   -0.3321 C   0  0  1

+    0.9284    0.2756    0.0116 C   0  0  0

+    3.3995    0.4785    0.0521 C   0  0  0

+    2.3455   -1.6821    0.4067 N   0  0  0

+   -0.4563   -0.8012   -0.4508 S   0  0  0

+    3.8895    1.3595   -0.8341 O   0  0  0

+    3.8807    0.4026    1.1578 O   0  0  0

+   -1.8503    0.2434    0.0555 C   0  0  0

+   -3.1648   -0.4789   -0.2466 C   0  0  0

+   -4.5504    0.5593    0.2566 Cl  0  0  0

+    3.2715   -0.8689    0.0000 H   0  0  0

+    1.5826    1.1824    0.0000 H   0  0  0

+    0.1236    1.0519    0.0000 H   0  0  0

+    1.4224   -2.3131    0.0000 H   0  0  0

+    3.3535   -2.1660    0.0000 H   0  0  0

+    4.4330    2.3367    0.0000 H   0  0  0

+   -1.0601    1.0345    0.0000 H   0  0  0

+   -2.5218    1.1375    0.0000 H   0  0  0

+   -3.9550   -1.2700    0.0000 H   0  0  0

+   -2.4933   -1.3729    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  8  9  1  0

+  9 10  1  0

+  1 11  1  0

+  2 12  1  0

+  2 13  1  0

+  4 14  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+9003-01-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.3783   -0.0130   -0.0013 C   0  0  0

+   -0.8975    0.7162    0.0010 C   0  0  0

+    1.5427    0.6661    0.0001 O   0  0  0

+    0.3836   -1.2283    0.0005 O   0  0  0

+   -2.0471    0.0457   -0.0004 C   0  0  0

+   -0.9019    1.7207    0.0000 H   0  0  0

+    2.4105    1.1722    0.0000 H   0  0  0

+   -2.9193    0.5441    0.0000 H   0  0  0

+   -2.0427   -0.9588    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  5  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106636-49-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.4353    0.3946    0.0340 C   0  0  0

+   -1.2247   -0.6988   -0.0514 C   0  0  0

+    1.0481    0.4023    0.0327 C   0  0  0

+   -1.2382    1.4832    0.1150 N   0  0  0

+   -2.5497   -0.2643   -0.0160 N   0  0  0

+   -0.7654   -2.1063   -0.1627 N   0  3  0

+    1.7417    1.3912   -0.6631 C   0  0  0

+    1.7529   -0.5757    0.7319 C   0  0  0

+   -2.4845    1.0891    0.0818 C   0  0  0

+   -3.8646   -0.9004   -0.0649 C   0  0  0

+   -0.5780   -2.6008   -1.2599 O   0  0  0

+   -0.5760   -2.7664    0.8432 O   0  5  0

+    3.1214    1.3943   -0.6607 C   0  0  0

+    3.1330   -0.5638    0.7280 C   0  0  0

+   -4.1595    1.6835    0.1229 S   0  0  0

+   -5.0432    0.0827    0.0137 C   0  0  0

+    3.8170    0.4173    0.0312 C   0  0  0

+    5.5530    0.4264    0.0298 Cl  0  0  0

+    1.2675    2.3005    0.0000 H   0  0  0

+    1.2895   -1.4905    0.0000 H   0  0  0

+   -4.6261   -1.5873    0.0000 H   0  0  0

+   -3.2921   -1.7512    0.0000 H   0  0  0

+    3.5903    2.3063    0.0000 H   0  0  0

+    3.6114   -1.4709    0.0000 H   0  0  0

+   -5.9077    0.6344    0.0000 H   0  0  0

+   -5.6487   -0.7450    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  7 13  2  0

+  8 14  1  0

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+  5  9  1  0

+ 14 17  2  0

+ 15 16  1  0

+  7 19  1  0

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+ 10 21  1  0

+ 10 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98046-72-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.0063   -0.7178   -0.0004 C   0  0  0

+   -1.3733   -0.7913   -0.0004 N   0  0  0

+    0.3253    0.6538    0.0004 C   0  0  0

+    0.9657   -1.6298    0.0039 N   0  0  0

+   -1.8514    0.4954    0.0003 C   0  0  0

+   -2.2351   -1.8499   -0.0013 C   0  0  0

+   -0.8315    1.3412    0.0007 N   0  0  0

+    1.6735    1.0373    0.0001 C   0  0  0

+    2.2384   -1.2957    0.0027 C   0  0  0

+   -3.2460    0.7170    0.0001 C   0  0  0

+   -3.5699   -1.6517   -0.0016 C   0  0  0

+    2.6363    0.0401   -0.0008 C   0  0  0

+    2.0652    2.4925    0.0004 C   0  0  0

+   -4.0917   -0.3473   -0.0009 C   0  0  0

+   -3.7921    2.1215    0.0003 C   0  0  0

+    3.9954    0.3715   -0.0012 N   0  0  0

+    4.9737   -0.6522   -0.0021 O   0  0  0

+   -1.8591   -2.8191    0.0000 H   0  0  0

+    2.9614   -2.0428    0.0000 H   0  0  0

+   -4.2145   -2.4673    0.0000 H   0  0  0

+    3.0691    2.2223    0.0000 H   0  0  0

+    2.3354    3.4964    0.0000 H   0  0  0

+    1.0613    2.7627    0.0000 H   0  0  0

+   -5.1203   -0.1966    0.0000 H   0  0  0

+   -2.8232    2.4982    0.0000 H   0  0  0

+   -4.1688    3.0904    0.0000 H   0  0  0

+   -4.7610    1.7448    0.0000 H   0  0  0

+    4.2871    1.3693    0.0000 H   0  0  0

+    5.6920   -1.4038    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+  8 13  1  0

+ 10 14  2  0

+ 10 15  1  0

+ 12 16  1  0

+ 16 17  1  0

+  5  7  2  0

+  9 12  1  0

+ 11 14  1  0

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+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+124-30-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 57                          1 V2000

+   -0.0948   -0.4664   -0.0051 C   0  0  0

+   -1.3437    0.4174    0.0046 C   0  0  0

+    1.1547    0.4165    0.0045 C   0  0  0

+   -2.5933   -0.4655   -0.0051 C   0  0  0

+    2.4037   -0.4672   -0.0051 C   0  0  0

+   -3.8422    0.4182    0.0046 C   0  0  0

+    3.6532    0.4157    0.0045 C   0  0  0

+   -5.0917   -0.4647   -0.0051 C   0  0  0

+    4.9021   -0.4680   -0.0051 C   0  0  0

+   -6.3407    0.4190    0.0046 C   0  0  0

+    6.1516    0.4149    0.0045 C   0  0  0

+   -7.5902   -0.4639   -0.0051 C   0  0  0

+    7.4006   -0.4688   -0.0051 C   0  0  0

+   -8.8391    0.4198    0.0046 C   0  0  0

+    8.6501    0.4141    0.0045 C   0  0  0

+  -10.0886   -0.4631   -0.0051 C   0  0  0

+    9.8990   -0.4696   -0.0051 C   0  0  0

+  -11.3376    0.4206    0.0046 C   0  0  0

+   11.0987    0.3781    0.0041 N   0  0  0

+   -0.8593   -1.3221    0.0000 H   0  0  0

+    0.6691   -1.3227    0.0000 H   0  0  0

+   -0.5792    1.2731    0.0000 H   0  0  0

+   -2.1075    1.2737    0.0000 H   0  0  0

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+   -3.3577   -1.3213    0.0000 H   0  0  0

+   -1.8295   -1.3218    0.0000 H   0  0  0

+    1.6393   -1.3230    0.0000 H   0  0  0

+    3.1676   -1.3235    0.0000 H   0  0  0

+   -3.0778    1.2740    0.0000 H   0  0  0

+   -4.6061    1.2745    0.0000 H   0  0  0

+    4.4176    1.2715    0.0000 H   0  0  0

+    2.8893    1.2720    0.0000 H   0  0  0

+   -5.8561   -1.3205    0.0000 H   0  0  0

+   -4.3278   -1.3210    0.0000 H   0  0  0

+    4.1377   -1.3238    0.0000 H   0  0  0

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+   -8.3546   -1.3197    0.0000 H   0  0  0

+   -6.8263   -1.3202    0.0000 H   0  0  0

+    6.6362   -1.3246    0.0000 H   0  0  0

+    8.1645   -1.3251    0.0000 H   0  0  0

+   -8.0747    1.2756    0.0000 H   0  0  0

+   -9.6030    1.2761    0.0000 H   0  0  0

+    9.4145    1.2699    0.0000 H   0  0  0

+    7.8862    1.2704    0.0000 H   0  0  0

+  -10.8530   -1.3189    0.0000 H   0  0  0

+   -9.3247   -1.3194    0.0000 H   0  0  0

+    9.1346   -1.3254    0.0000 H   0  0  0

+   10.6629   -1.3259    0.0000 H   0  0  0

+  -10.6748    1.3573    0.0000 H   0  0  0

+  -12.2743    1.0834    0.0000 H   0  0  0

+  -12.0004   -0.5161    0.0000 H   0  0  0

+   12.1407   -0.1024    0.0000 H   0  0  0

+   10.9938    1.5208    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

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+  1 20  1  0

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+  2 22  1  0

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+  3 25  1  0

+  4 26  1  0

+  4 27  1  0

+  5 28  1  0

+  5 29  1  0

+  6 30  1  0

+  6 31  1  0

+  7 32  1  0

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+  8 35  1  0

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+ 17 53  1  0

+ 18 54  1  0

+ 18 55  1  0

+ 18 56  1  0

+ 19 57  1  0

+ 19 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71382-45-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    0.8748    2.1773   -0.2372 C   0  0  0

+   -0.1286    1.0506   -0.1435 C   0  0  0

+    2.3672    1.8167   -0.2347 C   0  0  0

+    1.6723    2.2182    0.9957 N   0  0  0

+    0.3155   -0.2778   -0.0585 C   0  0  0

+   -1.4549    1.3483   -0.1429 C   0  0  0

+    2.7462    0.3582   -0.1408 C   0  0  0

+    1.7602   -0.6179   -0.0572 C   0  0  0

+   -0.6043   -1.3120    0.0276 C   0  0  0

+   -2.4095    0.3204   -0.0561 C   0  0  0

+   -1.9029    2.7842   -0.2352 C   0  0  0

+    4.0801    0.0013   -0.1372 C   0  0  0

+    2.1342   -1.9622    0.0297 C   0  0  0

+   -1.9769   -1.0271    0.0293 C   0  0  0

+   -3.7856    0.6032   -0.0522 C   0  0  0

+    4.4424   -1.3305   -0.0517 C   0  0  0

+    3.4683   -2.3092    0.0333 C   0  0  0

+   -2.9345   -2.0536    0.1161 C   0  0  0

+   -4.6835   -0.4163    0.0341 C   0  0  0

+   -4.2589   -1.7412    0.1156 C   0  0  0

+    0.4229    3.1195    0.0000 H   0  0  0

+    3.1987    2.4496    0.0000 H   0  0  0

+    1.9170    3.2341    0.0000 H   0  0  0

+   -0.2760   -2.3041    0.0000 H   0  0  0

+   -0.9053    3.0954    0.0000 H   0  0  0

+   -2.2141    3.7818    0.0000 H   0  0  0

+   -2.9005    2.4730    0.0000 H   0  0  0

+    4.8175    0.7418    0.0000 H   0  0  0

+    1.4015   -2.7073    0.0000 H   0  0  0

+   -4.1173    1.5941    0.0000 H   0  0  0

+    5.4526   -1.5978    0.0000 H   0  0  0

+    3.7437   -3.3173    0.0000 H   0  0  0

+   -2.6314   -3.0537    0.0000 H   0  0  0

+   -5.7064   -0.2026    0.0000 H   0  0  0

+   -4.9683   -2.5085    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  8 13  1  0

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+  3  4  1  0

+  7  8  2  0

+ 10 14  2  0

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+  1 21  1  0

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+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+471-34-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  5                          1 V2000

+   -3.9061    0.0000   -0.0307 C   0  0  0

+   -4.6798   -0.9895    0.4219 O   0  0  0

+   -2.7835   -0.2816   -0.6967 O   0  0  0

+   -4.2577    1.2712    0.1778 O   0  0  0

+    5.8495    0.0000    0.0479 Ca  0  2  0

+   -1.8698   -0.5108    0.0000 H   0  0  0

+   -4.5088    2.1792    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  3  6  1  0

+  4  7  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+10353-99-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    1.0234    0.0883   -0.0015 C   0  0  0

+   -0.1518   -0.4423   -0.0185 C   0  0  0

+    1.3189    1.5185    0.0640 C   0  0  0

+    2.2929   -0.6351   -0.0508 C   0  0  0

+   -1.3081    0.4660    0.0323 C   0  0  0

+   -0.2338   -1.9097   -0.0877 C   0  0  0

+    0.2858    2.3304    0.1090 C   0  0  0

+    2.7840    1.6081    0.0586 C   0  0  0

+    3.3284    0.4041   -0.0056 C   0  0  0

+    2.2198   -1.9460   -0.1188 C   0  0  0

+   -1.0805    1.7687    0.0922 C   0  0  0

+   -2.5735   -0.0185    0.0187 N   0  3  0

+    0.8950   -2.5999   -0.1285 C   0  0  0

+   -3.4074    0.4772   -0.7178 O   0  0  0

+   -2.8769   -0.9496    0.7429 O   0  5  0

+   -1.1337   -2.3818    0.0000 H   0  0  0

+    0.4256    3.3370    0.0000 H   0  0  0

+    3.3087    2.4784    0.0000 H   0  0  0

+    4.3283    0.2227    0.0000 H   0  0  0

+    3.0676   -2.5063    0.0000 H   0  0  0

+   -1.8727    2.4052    0.0000 H   0  0  0

+    0.8491   -3.6151    0.0000 H   0  0  0

+  1  2  2  0

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+  8  9  2  0

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+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+32066-79-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+   -7.1385   -0.0919   -0.1038 S   0  0  0

+   -7.9337   -1.2220    0.5341 O   0  0  0

+   -5.9681   -0.6963   -0.6368 O   0  0  0

+   -8.0799    0.6722   -0.8449 O   0  0  0

+   -6.6597    0.8176    1.0186 O   0  0  0

+    5.8217    0.9147    0.0426 C   0  0  0

+    5.0923   -0.1219    0.6278 C   0  0  0

+    7.0424    0.6381   -0.5767 C   0  0  0

+    5.3446    2.1827    0.0704 N   0  3  0

+    5.5812   -1.4115    0.5908 C   0  0  0

+    7.5194   -0.6557   -0.6064 C   0  0  0

+    4.9808    3.1498    0.0917 N   0  0  0

+    6.7913   -1.6785   -0.0243 C   0  0  0

+    7.3191   -3.0896   -0.0603 C   0  0  0

+   -8.4808   -1.9994    0.0000 H   0  0  0

+    4.1491   -0.0030    0.0000 H   0  0  0

+    7.6694    1.3527    0.0000 H   0  0  0

+    4.9595   -2.1307    0.0000 H   0  0  0

+    8.4617   -0.7815    0.0000 H   0  0  0

+    6.4287   -3.4226    0.0000 H   0  0  0

+    7.6521   -3.9800    0.0000 H   0  0  0

+    8.2095   -2.7566    0.0000 H   0  0  0

+   -6.2169    1.6588    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  2  0

+  1  5  1  0

+  6  7  2  0

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+  2 15  1  0

+  7 16  1  0

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+ 10 18  1  0

+ 11 19  1  0

+ 14 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+  5 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35231-44-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.8705    0.2060    0.0013 C   0  0  0

+   -1.6454   -0.9686    0.0009 C   0  0  0

+    0.5895    0.0928    0.0010 C   0  0  0

+   -1.4962    1.4581   -0.0037 C   0  0  0

+   -3.0288   -0.8719    0.0012 C   0  0  0

+   -1.0380   -2.1746   -0.0002 O   0  0  0

+    1.1368   -1.1506    0.0003 C   0  0  0

+    1.4612    1.3221    0.0009 C   0  0  0

+   -2.8586    1.5352   -0.0091 C   0  0  0

+   -3.6313    0.3754    0.0019 C   0  0  0

+    0.2997   -2.2852   -0.0009 C   0  0  0

+    3.3522    0.7845    0.0005 Br  0  0  0

+   -4.9856    0.4687    0.0021 O   0  0  0

+    0.8034   -3.3942   -0.0019 O   0  0  0

+   -5.3036    1.8619    0.0028 C   0  0  0

+   -0.9231    2.3291    0.0000 H   0  0  0

+   -3.6135   -1.7352    0.0000 H   0  0  0

+    2.1731   -1.2656    0.0000 H   0  0  0

+    1.8579    2.2864    0.0000 H   0  0  0

+    0.5480    1.8252    0.0000 H   0  0  0

+   -3.3245    2.4679    0.0000 H   0  0  0

+   -4.2871    2.0939    0.0000 H   0  0  0

+   -5.5356    2.8784    0.0000 H   0  0  0

+   -6.3201    1.6299    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  8 12  1  0

+ 10 13  1  0

+ 11 14  2  0

+ 13 15  1  0

+  7 11  1  0

+  9 10  1  0

+  4 16  1  0

+  5 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 15 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119-90-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    0.7147   -0.1980    0.2341 C   0  0  0

+   -0.7147    0.1982    0.2339 C   0  0  0

+    1.6904    0.7095   -0.1760 C   0  0  0

+    1.0843   -1.4760    0.6497 C   0  0  0

+   -1.6903   -0.7094   -0.1762 C   0  0  0

+   -1.0844    1.4764    0.6491 C   0  0  0

+    3.0220    0.3371   -0.1747 C   0  0  0

+    2.4139   -1.8447    0.6499 C   0  0  0

+   -3.0220   -0.3371   -0.1748 C   0  0  0

+   -2.4141    1.8449    0.6494 C   0  0  0

+    3.3863   -0.9442    0.2364 C   0  0  0

+    3.9759    1.2203   -0.5747 O   0  0  0

+   -3.3864    0.9441    0.2364 C   0  0  0

+   -3.9758   -1.2204   -0.5747 O   0  0  0

+    4.7335   -1.3212    0.2373 N   0  0  0

+    3.2984    2.4272   -0.9301 C   0  0  0

+   -4.7337    1.3208    0.2378 N   0  0  0

+   -3.2981   -2.4273   -0.9302 C   0  0  0

+    1.4545    1.6806    0.0000 H   0  0  0

+    0.3815   -2.1865    0.0000 H   0  0  0

+   -1.4543   -1.6805    0.0000 H   0  0  0

+   -0.3817    2.1870    0.0000 H   0  0  0

+    2.6498   -2.8158    0.0000 H   0  0  0

+   -2.6501    2.8160    0.0000 H   0  0  0

+    4.9815   -2.2893    0.0000 H   0  0  0

+    5.4479   -0.6224    0.0000 H   0  0  0

+    4.1699    2.9164    0.0000 H   0  0  0

+    2.8092    3.2987    0.0000 H   0  0  0

+    2.4269    1.9380    0.0000 H   0  0  0

+   -4.9819    2.2889    0.0000 H   0  0  0

+   -5.4480    0.6218    0.0000 H   0  0  0

+   -4.1695   -2.9166    0.0000 H   0  0  0

+   -2.8088   -3.2987    0.0000 H   0  0  0

+   -2.4267   -1.9380    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  7 12  1  0

+  9 13  2  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 13 17  1  0

+ 14 18  1  0

+  8 11  1  0

+ 10 13  1  0

+  3 19  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-30-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 49                          1 V2000

+   -0.0183   -0.0153    0.0893 P   0  0  0

+    0.0652   -1.5521   -0.3836 O   0  0  0

+    1.2761    0.7809   -0.4424 O   0  0  0

+   -1.3493    0.6603   -0.5142 O   0  0  0

+   -0.0615    0.0443    1.5674 O   0  0  0

+    1.2818   -2.0169    0.0046 C   0  0  0

+    1.1266    2.0755   -0.0570 C   0  0  0

+   -2.4002   -0.0799   -0.0730 C   0  0  0

+    2.2793   -2.2234   -0.9369 C   0  0  0

+    1.5300   -2.2804    1.3440 C   0  0  0

+    0.7989    3.0455   -0.9928 C   0  0  0

+    1.2961    2.4283    1.2742 C   0  0  0

+   -3.0692   -0.9256   -0.9455 C   0  0  0

+   -2.8022    0.0049    1.2523 C   0  0  0

+    3.5153   -2.6961   -0.5398 C   0  0  0

+    2.0149   -1.9328   -2.3918 C   0  0  0

+    2.7673   -2.7529    1.7360 C   0  0  0

+    0.6475    4.3610   -0.5985 C   0  0  0

+    0.6085    2.6648   -2.4385 C   0  0  0

+    1.1437    3.7448    1.6633 C   0  0  0

+   -4.1374   -1.6770   -0.4945 C   0  0  0

+   -2.6317   -1.0243   -2.3842 C   0  0  0

+   -3.8706   -0.7484    1.6982 C   0  0  0

+    3.7583   -2.9633    0.7947 C   0  0  0

+    0.8225    4.7109    0.7274 C   0  0  0

+   -4.5395   -1.5865    0.8250 C   0  0  0

+    1.0926   -2.9336    0.0000 H   0  0  0

+    2.0713    2.2982    0.0000 H   0  0  0

+   -2.9608    0.7748    0.0000 H   0  0  0

+    3.9585   -2.0469    0.0000 H   0  0  0

+    2.5963   -1.4038    0.0000 H   0  0  0

+    1.4859   -1.3514    0.0000 H   0  0  0

+    1.4335   -2.4618    0.0000 H   0  0  0

+    2.5448   -3.5068    0.0000 H   0  0  0

+   -0.1266    4.4975    0.0000 H   0  0  0

+   -0.0945    3.0164    0.0000 H   0  0  0

+    0.2569    1.9618    0.0000 H   0  0  0

+    1.3115    2.3132    0.0000 H   0  0  0

+    1.9111    3.9149    0.0000 H   0  0  0

+   -3.9845   -2.4480    0.0000 H   0  0  0

+   -2.8047   -1.7911    0.0000 H   0  0  0

+   -1.8649   -1.1973    0.0000 H   0  0  0

+   -2.4587   -0.2575    0.0000 H   0  0  0

+   -4.4097   -0.1763    0.0000 H   0  0  0

+    4.4401   -3.3546    0.0000 H   0  0  0

+    0.8786    5.4950    0.0000 H   0  0  0

+   -5.2811   -1.8471    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  2  0

+  6 10  1  0

+  7 11  2  0

+  7 12  1  0

+  8 13  2  0

+  8 14  1  0

+  9 15  1  0

+  9 16  1  0

+ 10 17  2  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  2  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  2  0

+ 15 24  2  0

+ 18 25  2  0

+ 21 26  2  0

+ 17 24  1  0

+ 20 25  1  0

+ 23 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+ 21 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+ 22 43  1  0

+ 23 44  1  0

+ 24 45  1  0

+ 25 46  1  0

+ 26 47  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102791-34-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 30                          1 V2000

+   -0.2194   -0.7342    0.0149 C   0  0  0

+   -1.5461   -0.1306    0.0228 C   0  0  0

+    0.9159    0.0865    0.0967 C   0  0  0

+   -0.1138   -2.1379   -0.0698 C   0  0  0

+   -1.6486    1.2773    0.0168 C   0  0  0

+   -2.6892   -0.9496    0.0301 C   0  0  0

+    2.1613   -0.5046    0.0119 C   0  0  0

+    0.7616    1.4210    0.2926 O   0  0  0

+    1.1655   -2.7024   -0.1421 C   0  0  0

+   -1.2940   -2.9176   -0.0726 C   0  0  0

+   -0.3901    2.0395   -0.0750 C   0  0  0

+   -2.9055    1.8558    0.0800 C   0  0  0

+   -2.5229   -2.3538   -0.0227 C   0  0  0

+   -3.9441   -0.3306    0.0881 C   0  0  0

+    2.2732   -1.8840   -0.1114 C   0  0  0

+    3.3805    0.3339    0.0531 N   0  3  0

+   -0.3834    3.1896   -0.4692 O   0  0  0

+   -4.0332    1.0459    0.1192 C   0  0  0

+    4.4797   -0.1855   -0.0216 O   0  0  0

+    3.2845    1.5432    0.1615 O   0  5  0

+    1.2802   -3.7374    0.0000 H   0  0  0

+   -1.2141   -3.9558    0.0000 H   0  0  0

+   -3.0050    2.8923    0.0000 H   0  0  0

+   -3.3647   -2.9667    0.0000 H   0  0  0

+   -4.8102   -0.9087    0.0000 H   0  0  0

+    3.2211   -2.3150    0.0000 H   0  0  0

+   -4.9746    1.4910    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  1  0

+  7 16  1  0

+ 11 17  2  0

+ 12 18  2  0

+ 16 19  2  0

+ 16 20  1  0

+  8 11  1  0

+  9 15  2  0

+ 10 13  2  0

+ 14 18  1  0

+  9 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 18 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-12-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.7806   -0.6589    0.0000 C   0  0  0

+   -0.5995   -0.1468    0.0000 C   0  0  0

+    1.7605    0.5161    0.0000 C   0  0  0

+   -1.6645    0.2484    0.0000 N   0  0  0

+    0.2820   -1.6439    0.0000 H   0  0  0

+    1.7030   -1.2656    0.0000 H   0  0  0

+    2.6084   -0.1910    0.0000 H   0  0  0

+    2.4676    1.3640    0.0000 H   0  0  0

+    0.9126    1.2232    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  3  0

+  1  5  1  0

+  1  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16219-75-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.4490   -1.0415    0.4544 C   0  0  2

+   -0.7920   -0.1926    0.1336 C   0  0  0

+    1.2882   -0.0205    1.3057 C   0  0  0

+    1.2533   -1.0203   -0.8505 C   0  0  0

+   -0.2462    1.2161   -0.0681 C   0  0  0

+   -2.0375   -0.5904    0.0519 C   0  0  0

+    1.2907    1.0601    0.1628 C   0  0  2

+    1.7417    0.1924   -1.0187 C   0  0  0

+   -3.1248    0.4000   -0.2766 C   0  0  0

+    0.1701   -1.9871    0.0000 H   0  0  0

+    1.8349   -0.8410    0.0000 H   0  0  0

+    2.2322    0.2640    0.0000 H   0  0  0

+    1.8158   -1.8300    0.0000 H   0  0  0

+   -0.0594    2.1842    0.0000 H   0  0  0

+   -1.1937    1.4887    0.0000 H   0  0  0

+   -2.2477   -1.5537    0.0000 H   0  0  0

+    1.8444    1.8759    0.0000 H   0  0  0

+    2.7265    0.2399    0.0000 H   0  0  0

+   -2.4609    1.1289    0.0000 H   0  0  0

+   -3.8537    1.0639    0.0000 H   0  0  0

+   -3.7887   -0.3289    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  6  9  1  0

+  5  7  1  0

+  7  8  1  0

+  1 10  1  0

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+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+79-29-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.6853    0.0000   -0.3399 C   0  0  0

+   -0.6853    0.0000    0.3399 C   0  0  0

+    1.4627    1.2492    0.0796 C   0  0  0

+    1.4627   -1.2493    0.0796 C   0  0  0

+   -1.4627    1.2493   -0.0796 C   0  0  0

+   -1.4627   -1.2492   -0.0796 C   0  0  0

+    0.1494    0.9647    0.0000 H   0  0  0

+   -0.1494   -0.9647    0.0000 H   0  0  0

+    2.3996    0.6661    0.0000 H   0  0  0

+    2.0458    2.1861    0.0000 H   0  0  0

+    0.5258    1.8322    0.0000 H   0  0  0

+    0.5258   -1.8323    0.0000 H   0  0  0

+    2.0457   -2.1862    0.0000 H   0  0  0

+    2.3996   -0.6663    0.0000 H   0  0  0

+   -0.5258    1.8323    0.0000 H   0  0  0

+   -2.0457    2.1862    0.0000 H   0  0  0

+   -2.3996    0.6663    0.0000 H   0  0  0

+   -2.3996   -0.6661    0.0000 H   0  0  0

+   -2.0458   -2.1861    0.0000 H   0  0  0

+   -0.5258   -1.8322    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+625-45-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.4248   -0.6647    0.0000 C   0  0  0

+   -0.9358   -0.0168    0.0000 C   0  0  0

+    1.4341    0.3470    0.0000 O   0  0  0

+   -2.0415   -0.7778    0.0000 O   0  0  0

+   -1.0314    1.1877    0.0000 O   0  0  0

+    2.6943   -0.3268    0.0000 C   0  0  0

+   -0.1424   -1.5741    0.0000 H   0  0  0

+    1.2642   -1.3310    0.0000 H   0  0  0

+   -2.9244   -1.3854    0.0000 H   0  0  0

+    2.1890   -1.2719    0.0000 H   0  0  0

+    3.6394   -0.8321    0.0000 H   0  0  0

+    3.1996    0.6183    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  1  7  1  0

+  1  8  1  0

+  4  9  1  0

+  6 10  1  0

+  6 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13177-27-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -1.0770   -0.0439    0.0020 C   0  0  0

+   -0.5173   -1.2096    0.0017 C   0  0  0

+   -0.0757    1.0216    0.0011 C   0  0  0

+   -2.5103    0.2233   -0.0024 C   0  0  0

+    0.9392   -1.0010    0.0003 C   0  0  0

+   -1.4278   -2.3704    0.0028 C   0  0  0

+    1.2060    0.3000    0.0003 C   0  0  0

+   -0.5157    2.2552    0.0008 C   0  0  0

+   -2.9071    1.6417   -0.0015 C   0  0  0

+   -3.3206   -0.8078   -0.0065 C   0  0  0

+    2.0557   -1.9647   -0.0017 C   0  0  0

+   -2.7330   -2.1657    0.0039 C   0  0  0

+    2.6015    0.7653    0.0000 C   0  0  0

+   -1.9561    2.5584    0.0012 C   0  0  0

+    3.3006   -1.5445   -0.0026 C   0  0  0

+    3.5916   -0.1005   -0.0006 C   0  0  0

+    2.8684    2.0937    0.0009 N   0  0  0

+   -1.0267   -3.3893    0.0000 H   0  0  0

+    0.2046    3.0800    0.0000 H   0  0  0

+   -3.9638    1.9290    0.0000 H   0  0  0

+   -4.4066   -0.6671    0.0000 H   0  0  0

+    1.8454   -3.0394    0.0000 H   0  0  0

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+   -2.2585    3.6109    0.0000 H   0  0  0

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+    3.9060    2.4437    0.0000 H   0  0  0

+    2.0465    2.8173    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+ 11 15  2  0

+ 13 16  2  0

+ 13 17  1  0

+  5  7  2  0

+  9 14  2  0

+ 10 12  1  0

+ 15 16  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53340-16-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 52                          1 V2000

+   -4.0071    1.8065   -0.0637 C   0  0  0

+   -3.7322    3.2474   -0.1825 C   0  0  0

+   -2.9665    0.9295    0.4797 C   0  0  0

+   -5.1688    1.3019   -0.4316 N   0  0  0

+   -2.4749    3.7360    0.2313 C   0  0  0

+   -4.6847    4.1272   -0.6916 C   0  0  0

+   -3.2136   -0.3920    0.5906 O   0  0  0

+   -1.7472    1.4563    0.8730 C   0  0  0

+   -5.4038   -0.0076   -0.3173 C   0  0  0

+   -1.4764    2.8076    0.7658 C   0  0  0

+   -2.2001    5.1032    0.1241 C   0  0  0

+   -4.3920    5.4713   -0.7878 C   0  0  0

+   -4.4123   -0.8770    0.1994 C   0  0  0

+   -6.6518   -0.5348   -0.7147 C   0  0  0

+   -0.2507    3.2877    1.1681 N   0  0  0

+   -3.1560    5.9550   -0.3824 C   0  0  0

+   -4.6799   -2.2319    0.3078 C   0  0  0

+   -6.8944   -1.8662   -0.5997 C   0  0  0

+   -5.9120   -2.7282   -0.0946 C   0  0  0

+   -6.1768   -4.0847    0.0151 N   0  3  0

+   -5.7721   -4.8151    1.2189 C   0  0  0

+   -6.8613   -4.7877   -1.0727 C   0  0  0

+   -7.0146   -5.1962    2.0261 C   0  0  0

+   -5.8486   -5.1558   -2.1589 C   0  0  0

+   13.0357   -0.7939   -0.0635 Cl  0  0  0

+   12.2918    0.2832    0.3182 O   0  0  0

+   13.9791   -1.0541    0.8859 O   0  0  0

+   12.2233   -1.8796   -0.2066 O   0  0  0

+   13.7637   -0.4744   -1.4750 O   0  0  0

+   -5.6348    3.8278    0.0000 H   0  0  0

+   -0.9728    0.8296    0.0000 H   0  0  0

+   -1.2552    5.4187    0.0000 H   0  0  0

+   -5.1500    6.1177    0.0000 H   0  0  0

+   -7.4291    0.0882    0.0000 H   0  0  0

+    0.5277    2.6661    0.0000 H   0  0  0

+   -0.1016    4.2727    0.0000 H   0  0  0

+   -2.9802    6.9355    0.0000 H   0  0  0

+   -3.9125   -2.8671    0.0000 H   0  0  0

+   -7.8351   -2.1939    0.0000 H   0  0  0

+   -5.4146   -5.7449    0.0000 H   0  0  0

+   -4.8693   -4.3939    0.0000 H   0  0  0

+   -7.6657   -4.2001    0.0000 H   0  0  0

+   -7.3299   -5.6668    0.0000 H   0  0  0

+   -7.3067   -4.2438    0.0000 H   0  0  0

+   -7.9670   -5.4883    0.0000 H   0  0  0

+   -6.7225   -6.1486    0.0000 H   0  0  0

+   -6.1889   -6.0920    0.0000 H   0  0  0

+   -4.9124   -5.4961    0.0000 H   0  0  0

+   -5.5083   -4.2196    0.0000 H   0  0  0

+   14.6759   -0.0741    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+ 23 45  1  0

+ 23 46  1  0

+ 24 47  1  0

+ 24 48  1  0

+ 24 49  1  0

+ 29 50  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5709-68-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -1.0520    0.5731   -0.0608 C   0  0  0

+   -1.0702   -0.8241    0.0856 C   0  0  0

+    0.2798    0.9350   -0.0987 N   0  0  0

+   -2.2472    1.2761   -0.1293 C   0  0  0

+    0.2236   -1.2342    0.1285 N   0  0  0

+   -2.2956   -1.4921    0.1557 C   0  0  0

+    1.0124   -0.2051    0.0207 C   0  0  0

+    0.8064    2.2946   -0.2416 C   0  0  0

+   -3.4443    0.5967   -0.0531 C   0  0  0

+   -3.4617   -0.7845    0.0816 C   0  0  0

+    2.4912   -0.2660    0.0262 N   0  3  0

+    3.1269    0.4390    0.7895 O   0  0  0

+    3.0725   -1.0210   -0.7325 O   0  5  0

+   -2.2392    2.3098    0.0000 H   0  0  0

+   -2.3195   -2.5255    0.0000 H   0  0  0

+    1.7703    1.9213    0.0000 H   0  0  0

+    1.1797    3.2585    0.0000 H   0  0  0

+   -0.1575    2.6679    0.0000 H   0  0  0

+   -4.3343    1.1225    0.0000 H   0  0  0

+   -4.3657   -1.2859    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  5  7  2  0

+  9 10  1  0

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+  6 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13010-47-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    2.4419   -0.0438   -0.2591 C   0  0  0

+    1.1936    0.6890   -0.0329 N   0  0  0

+    3.5856    0.9502   -0.4704 C   0  0  0

+    2.7462   -0.9205    0.9573 C   0  0  0

+    0.0176    0.1494   -0.4100 C   0  0  0

+    4.8892    0.1850   -0.7067 C   0  0  0

+    4.0499   -1.6857    0.7210 C   0  0  0

+   -1.1308    0.8235   -0.2019 N   0  0  0

+   -0.0074   -0.9447   -0.9377 O   0  0  0

+    5.1936   -0.6917    0.5098 C   0  0  0

+   -2.4091    0.2370   -0.6119 C   0  0  0

+   -1.1043    1.9852    0.3584 N   0  0  0

+   -2.9842   -0.5889    0.5406 C   0  0  0

+   -2.1420    2.5944    0.5465 O   0  0  0

+   -4.5575   -1.3107    0.0360 Cl  0  0  0

+    1.6698   -0.6772    0.0000 H   0  0  0

+    1.2438    1.6865    0.0000 H   0  0  0

+    4.1812    1.7519    0.0000 H   0  0  0

+    2.8529    1.6289    0.0000 H   0  0  0

+    1.7485   -0.9662    0.0000 H   0  0  0

+    2.5064   -1.8900    0.0000 H   0  0  0

+    5.8869    0.2308    0.0000 H   0  0  0

+    5.1290    1.1545    0.0000 H   0  0  0

+    3.4543   -2.4874    0.0000 H   0  0  0

+    4.7826   -2.3644    0.0000 H   0  0  0

+    5.7479   -1.5225    0.0000 H   0  0  0

+    6.0879   -0.2472    0.0000 H   0  0  0

+   -2.4929    1.2322    0.0000 H   0  0  0

+   -3.3737    0.4958    0.0000 H   0  0  0

+   -2.9004   -1.5841    0.0000 H   0  0  0

+   -2.0196   -0.8477    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+72917-35-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.0523    0.1465   -0.0050 C   0  0  0

+   -1.5076   -0.0911    0.0064 C   0  0  0

+    0.1243    1.5378   -0.0277 C   0  0  0

+    1.0564   -0.6969    0.0075 C   0  0  0

+   -2.1173    1.1716   -0.0101 C   0  0  0

+   -2.2896   -1.2439    0.0282 C   0  0  0

+   -1.1228    2.1361   -0.0305 N   0  0  0

+    1.4140    2.0611   -0.0426 C   0  0  0

+    2.3254   -0.1599   -0.0087 C   0  0  0

+    0.8685   -2.1918    0.0390 C   0  0  0

+   -3.5060    1.2602   -0.0042 C   0  0  0

+   -3.6679   -1.1377    0.0334 C   0  0  0

+    2.5018    1.2152   -0.0356 C   0  0  0

+    1.6208    3.5536   -0.0671 C   0  0  0

+    3.5047   -1.0544    0.0045 N   0  3  0

+   -4.2717    0.1150    0.0178 C   0  0  0

+   -4.4350   -2.2605    0.0546 O   0  0  0

+    4.2361   -1.0836    0.9780 O   0  0  0

+    3.7437   -1.7612   -0.9582 O   0  5  0

+   -1.8370   -2.1835    0.0000 H   0  0  0

+   -1.2904    3.1655    0.0000 H   0  0  0

+   -0.1663   -2.0617    0.0000 H   0  0  0

+    0.7384   -3.2266    0.0000 H   0  0  0

+    1.9033   -2.3219    0.0000 H   0  0  0

+   -3.9680    2.1953    0.0000 H   0  0  0

+    3.4660    1.6128    0.0000 H   0  0  0

+    2.6539    3.4105    0.0000 H   0  0  0

+    1.7639    4.5867    0.0000 H   0  0  0

+    0.5877    3.6967    0.0000 H   0  0  0

+   -5.3121    0.1881    0.0000 H   0  0  0

+   -5.0234   -3.1217    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  5  7  1  0

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+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1007-36-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.6733   -0.3864    0.2807 C   0  0  0

+   -0.6418   -0.7979    0.5246 N   0  0  0

+    1.0644    0.9103    0.5862 C   0  0  0

+    1.5915   -1.2759   -0.2620 C   0  0  0

+   -1.6728   -0.1039    0.0032 C   0  0  0

+    2.3635    1.3133    0.3448 C   0  0  0

+    2.8886   -0.8669   -0.5010 C   0  0  0

+   -2.9387   -0.4273    0.3338 N   0  0  0

+   -1.4608    0.8141   -0.7654 O   0  0  0

+    3.2738    0.4270   -0.2005 C   0  0  0

+   -4.0594    0.3271   -0.2330 C   0  0  0

+   -0.7877   -1.7998    0.0000 H   0  0  0

+    0.3456    1.6234    0.0000 H   0  0  0

+    1.3587   -2.2613    0.0000 H   0  0  0

+    2.5999    2.2978    0.0000 H   0  0  0

+    3.6103   -1.5771    0.0000 H   0  0  0

+   -3.1112   -1.4250    0.0000 H   0  0  0

+    4.2536    0.6821    0.0000 H   0  0  0

+   -3.4940    1.1670    0.0000 H   0  0  0

+   -4.8993    0.8925    0.0000 H   0  0  0

+   -4.6248   -0.5128    0.0000 H   0  0  0

+  1  2  1  0

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+  7 16  1  0

+  8 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61841-39-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.1884   -0.5662    0.0899 C   0  0  0

+   -1.6333   -0.2358    0.0333 C   0  0  0

+    0.7641    0.4389   -0.0700 C   0  0  0

+    0.2190   -1.8815    0.3089 C   0  0  0

+   -2.5214   -1.0959   -0.6114 C   0  0  0

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+    1.5624   -2.1863    0.3611 C   0  0  0

+   -3.8638   -0.7870   -0.6628 C   0  0  0

+   -3.4498    1.2372    0.5755 C   0  0  0

+    2.5107   -1.1833    0.1951 C   0  0  0

+    3.1188    1.1964   -0.1868 N   0  3  0

+   -4.3324    0.3813   -0.0725 C   0  0  0

+    3.8708   -1.4944    0.2479 N   0  0  0

+    3.0966    2.1773    0.5349 O   0  0  0

+    3.9738    1.0933   -1.0482 O   0  5  0

+   -5.6926    0.6923   -0.1259 N   0  0  0

+    0.4658    1.4280    0.0000 H   0  0  0

+   -0.4828   -2.6397    0.0000 H   0  0  0

+   -2.2442   -2.0912    0.0000 H   0  0  0

+   -1.4369    1.7192    0.0000 H   0  0  0

+    1.8629   -3.1748    0.0000 H   0  0  0

+   -4.5355   -1.5720    0.0000 H   0  0  0

+   -3.7287    2.2320    0.0000 H   0  0  0

+    4.1749   -2.4818    0.0000 H   0  0  0

+    4.5739   -0.7374    0.0000 H   0  0  0

+   -5.9967    1.6797    0.0000 H   0  0  0

+   -6.3956   -0.0648    0.0000 H   0  0  0

+  1  2  1  0

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+  9 23  1  0

+ 10 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16423-68-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+   -1.0904   -1.8028    0.4906 C   0  0  0

+   -2.1860   -0.9652   -0.1151 C   0  0  0

+    0.1201   -0.9320    0.7020 C   0  0  0

+   -1.5384   -2.4101    1.7801 C   0  0  0

+   -0.7609   -2.9079   -0.3970 O   0  0  0

+   -2.1672    0.4107    0.0407 C   0  0  0

+   -3.1990   -1.5817   -0.8254 C   0  0  0

+   -0.0267    0.4426    0.7864 C   0  0  0

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+   -1.2208    1.0593    0.7419 O   0  0  0

+   -3.1825    1.1683   -0.5460 C   0  0  0

+   -4.2062   -0.8295   -1.3987 C   0  0  0

+    1.1122    1.2319    0.9556 C   0  0  0

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+   -1.8162   -4.6758    2.6414 C   0  0  0

+   -2.3132   -2.7272    3.9868 C   0  0  0

+   -0.7985   -5.1755   -0.2196 O   0  0  0

+   -4.1942    0.5517   -1.2595 C   0  0  0

+   -3.1740    3.2535   -0.3435 I   0  0  0

+   -5.7420   -1.7675   -2.4713 I   0  0  0

+    2.3617    0.6474    1.0546 C   0  0  0

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+   -2.2414   -4.0971    3.8274 C   0  0  0

+   -5.1783    1.2992   -1.8253 O   0  0  0

+    3.4637    1.4256    1.2200 O   0  0  0

+   13.9370   -0.1224   -1.7845 Na  0  3  0

+   22.2163   -0.0478   -4.3237 Na  0  3  0

+   -3.2469   -2.5924    0.0000 H   0  0  0

+    1.4546   -2.5247    0.0000 H   0  0  0

+   -2.0981   -0.8477    0.0000 H   0  0  0

+   -1.6921   -5.6800    0.0000 H   0  0  0

+   -3.3114   -2.5620    0.0000 H   0  0  0

+   -3.1943   -4.4374    0.0000 H   0  0  0

+   -5.9840    1.9112    0.0000 H   0  0  0

+    4.2902    2.0093    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

+  3  9  1  0

+  4 10  2  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

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+  9 17  2  0

+ 10 18  1  0

+ 11 19  2  0

+ 12 20  2  0

+ 14 21  2  0

+ 14 22  1  0

+ 15 23  1  0

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+ 21 28  1  0

+ 24 29  1  0

+  8 13  1  0

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+ 15 21  1  0

+ 17 24  1  0

+ 19 27  1  0

+  7 32  1  0

+  9 33  1  0

+ 11 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 27 37  1  0

+ 28 38  1  0

+ 29 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+262-20-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+   -1.1494    0.7475    0.2449 C   0  0  0

+   -1.3407   -0.6185    0.0785 C   0  0  0

+    0.0002    1.3063    0.6433 O   0  0  0

+   -2.2256    1.6021   -0.0007 C   0  0  0

+   -0.0004   -1.7368    0.3249 S   0  0  0

+   -2.5809   -1.1202   -0.2896 C   0  0  0

+    1.1504    0.7467    0.2477 C   0  0  0

+   -3.4545    1.1006   -0.3773 C   0  0  0

+    1.3392   -0.6184    0.0747 C   0  0  0

+   -3.6399   -0.2614   -0.5179 C   0  0  0

+    2.2284    1.6008    0.0061 C   0  0  0

+    2.5786   -1.1202   -0.2979 C   0  0  0

+    3.4560    1.0994   -0.3729 C   0  0  0

+    3.6393   -0.2626   -0.5198 C   0  0  0

+   -2.0804    2.6186    0.0000 H   0  0  0

+   -2.7328   -2.1358    0.0000 H   0  0  0

+   -4.2661    1.7296    0.0000 H   0  0  0

+   -4.5946   -0.6395    0.0000 H   0  0  0

+    2.0840    2.6174    0.0000 H   0  0  0

+    2.7296   -2.1359    0.0000 H   0  0  0

+    4.2682    1.7277    0.0000 H   0  0  0

+    4.5935   -0.6421    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

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+  7  9  2  0

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+  4 15  1  0

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+  8 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+87-66-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.0002   -0.6574   -0.0014 C   0  0  0

+   -1.2024    0.0394   -0.0006 C   0  0  0

+    1.2026    0.0393   -0.0009 C   0  0  0

+   -0.0004   -2.0184    0.0029 O   0  0  0

+   -1.1979    1.4263    0.0008 C   0  0  0

+   -2.3819   -0.6376   -0.0015 O   0  0  0

+    1.1985    1.4257    0.0005 C   0  0  0

+    2.3818   -0.6382   -0.0012 O   0  0  0

+    0.0002    2.1153    0.0013 C   0  0  0

+   -0.0006   -3.0553    0.0000 H   0  0  0

+   -2.0946    1.9470    0.0000 H   0  0  0

+   -3.2812   -1.1538    0.0000 H   0  0  0

+    2.0954    1.9461    0.0000 H   0  0  0

+    3.2809   -1.1548    0.0000 H   0  0  0

+    0.0004    3.1522    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  7  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87406-72-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+   -0.0180   -0.2389    0.0831 N   0  0  0

+   -0.7163    0.8743    0.7306 C   0  0  0

+    1.1935    0.0132   -0.7011 C   0  0  0

+   -0.4869   -1.4957    0.2136 C   0  0  0

+   -1.8714    1.3382   -0.1590 C   0  0  0

+    2.4195   -0.0828    0.2092 C   0  0  0

+   -1.4050   -2.0466   -0.7952 C   0  0  0

+   -0.1510   -2.1744    1.1652 O   0  0  0

+   -2.6007    2.5009    0.5172 C   0  0  0

+   -1.6614    2.6990   -0.5413 O   0  0  0

+    3.6847    0.1805   -0.6099 C   0  0  0

+    3.0965    1.1755    0.2305 O   0  0  0

+   -1.9070   -3.2684   -0.6408 C   0  0  0

+    0.2064    1.1062    0.0000 H   0  0  0

+   -0.6518    1.8235    0.0000 H   0  0  0

+    1.6557    0.8448    0.0000 H   0  0  0

+    0.6297    0.7795    0.0000 H   0  0  0

+   -2.4816    0.6082    0.0000 H   0  0  0

+    2.4799   -1.0323    0.0000 H   0  0  0

+   -2.1265   -1.4264    0.0000 H   0  0  0

+   -2.9048    3.4024    0.0000 H   0  0  0

+   -3.4604    2.0933    0.0000 H   0  0  0

+    3.9792   -0.7242    0.0000 H   0  0  0

+    4.5517    0.5722    0.0000 H   0  0  0

+   -2.8499   -3.3953    0.0000 H   0  0  0

+   -1.3257   -4.0215    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  9 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117760-93-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+   -0.0332    0.4352   -0.1338 C   0  0  0

+   -0.7604   -0.7693   -0.0101 C   0  0  0

+    1.3775    0.3779   -0.1979 C   0  0  0

+   -0.7040    1.6722   -0.1980 C   0  0  0

+   -2.2248   -0.7185    0.0542 C   0  0  0

+   -0.0812   -1.9890    0.0479 C   0  0  0

+    2.0244   -0.8503   -0.1394 C   0  0  0

+    2.1781    1.6096   -0.3257 C   0  0  0

+   -2.0592    1.7494   -0.1458 C   0  0  0

+   -2.8665    0.5377   -0.0091 C   0  0  0

+   -2.9907   -1.8798    0.1756 C   0  0  0

+    1.2939   -2.0218   -0.0169 C   0  0  0

+    3.5289   -0.8948   -0.2116 C   0  0  2

+    3.4668    1.5881   -0.0072 C   0  0  0

+   -2.6839    2.9924   -0.2127 N   0  0  0

+   -4.2635    0.5988    0.0501 C   0  0  0

+   -4.3525   -1.7887    0.2312 C   0  0  0

+    4.1179    0.3273    0.4901 C   0  0  1

+    3.9401   -0.9025   -1.5801 O   0  0  0

+   -4.9860   -0.5533    0.1684 C   0  0  0

+    3.9154    0.2107    1.8999 O   0  0  0

+   -0.1450    2.5532    0.0000 H   0  0  0

+   -0.6206   -2.8821    0.0000 H   0  0  0

+    1.6881    2.5307    0.0000 H   0  0  0

+   -2.5271   -2.8145    0.0000 H   0  0  0

+    1.7892   -2.9401    0.0000 H   0  0  0

+    3.5037   -1.9378    0.0000 H   0  0  0

+    4.0169    2.4746    0.0000 H   0  0  0

+   -2.1108    3.8643    0.0000 H   0  0  0

+   -3.7255    3.0528    0.0000 H   0  0  0

+   -4.7485    1.5226    0.0000 H   0  0  0

+   -4.9259   -2.6603    0.0000 H   0  0  0

+    5.1612    0.3417    0.0000 H   0  0  0

+    4.9833   -0.9220    0.0000 H   0  0  0

+   -6.0284   -0.5083    0.0000 H   0  0  0

+    3.0112   -0.3099    0.0000 H   0  0  0

+  1  2  2  0

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+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3351-32-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.0870    0.5841    0.0022 C   0  0  0

+   -0.7288   -0.5633    0.0010 C   0  0  0

+    1.5406    0.4079    0.0016 C   0  0  0

+   -0.4922    1.8647   -0.0018 C   0  0  0

+   -2.1820   -0.3870    0.0010 C   0  0  0

+   -0.1491   -1.8442   -0.0007 C   0  0  0

+    2.0679   -0.9046    0.0000 C   0  0  0

+    2.4086    1.5030    0.0020 C   0  0  0

+   -1.8347    2.0329   -0.0073 C   0  0  0

+   -2.7091    0.9256    0.0025 C   0  0  0

+   -3.0506   -1.4821   -0.0008 C   0  0  0

+    1.1931   -2.0122   -0.0016 C   0  0  0

+    3.4597   -1.0820   -0.0008 C   0  0  0

+    3.7578    1.2958    0.0009 C   0  0  0

+   -4.1014    1.1032    0.0024 C   0  0  0

+   -4.3994   -1.2746   -0.0012 C   0  0  0

+    4.2801    0.0070    0.0001 C   0  0  0

+   -4.9217    0.0147    0.0010 C   0  0  0

+    5.7743   -0.1889   -0.0007 C   0  0  0

+    0.1324    2.7118    0.0000 H   0  0  0

+   -0.7736   -2.6914    0.0000 H   0  0  0

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+   -2.2337    3.0068    0.0000 H   0  0  0

+   -2.6663   -2.4619    0.0000 H   0  0  0

+    1.5922   -2.9861    0.0000 H   0  0  0

+    3.8688   -2.0517    0.0000 H   0  0  0

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+   -4.5103    2.0730    0.0000 H   0  0  0

+   -5.0524   -2.1000    0.0000 H   0  0  0

+   -5.9652    0.1516    0.0000 H   0  0  0

+    5.6375   -1.2325    0.0000 H   0  0  0

+    6.8179   -0.3257    0.0000 H   0  0  0

+    5.9111    0.8547    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2274-11-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    2.6978    0.0213   -0.0108 C   0  0  0

+    1.3976   -0.1922    0.2733 O   0  0  0

+    3.3744    1.2211    0.5011 C   0  0  0

+    3.3119   -0.7810   -0.6863 O   0  0  0

+    0.7290   -1.3777   -0.2325 C   0  0  0

+    4.6581    1.4319    0.2205 C   0  0  0

+   -0.7290   -1.3780    0.2311 C   0  0  0

+   -1.3978   -0.1924   -0.2743 O   0  0  0

+   -2.6981    0.0208    0.0100 C   0  0  0

+   -3.3749    1.2207   -0.5015 C   0  0  0

+   -3.3107   -0.7794    0.6894 O   0  0  0

+   -4.6587    1.4311   -0.2208 C   0  0  0

+    2.8082    2.0311    0.0000 H   0  0  0

+    0.5608   -2.3515    0.0000 H   0  0  0

+    1.6599   -1.7094    0.0000 H   0  0  0

+    5.2844    0.6674    0.0000 H   0  0  0

+    5.0070    2.3565    0.0000 H   0  0  0

+   -1.6599   -1.7099    0.0000 H   0  0  0

+   -0.5605   -2.3518    0.0000 H   0  0  0

+   -2.8089    2.0308    0.0000 H   0  0  0

+   -5.0079    2.3556    0.0000 H   0  0  0

+   -5.2847    0.6664    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86674-50-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+   -0.0266   -0.1911    0.0470 C   0  0  0

+   -1.2267    0.6466    0.0515 C   0  0  0

+    1.2391    0.4285    0.0477 C   0  0  0

+   -0.1471   -1.5807    0.1027 C   0  0  0

+   -2.4819    0.0683   -0.1425 C   0  0  0

+   -1.0851    2.0392    0.2177 C   0  0  0

+    2.3783   -0.3822   -0.0507 C   0  0  0

+    1.3203    1.8351    0.1715 C   0  0  0

+   -1.5049   -2.2073    0.2574 C   0  0  2

+    0.9839   -2.3417    0.0271 C   0  0  0

+   -2.5882   -1.4001   -0.4473 C   0  0  2

+   -3.5907    0.8605   -0.0600 C   0  0  0

+    0.2113    2.6018    0.2691 C   0  0  0

+   -2.2453    2.8197    0.3162 C   0  0  0

+    2.2354   -1.7404   -0.0624 C   0  0  0

+    3.7238    0.2281   -0.1415 N   0  3  0

+   -1.8222   -2.3196    1.6462 O   0  0  0

+   -2.4904   -1.6019   -1.8586 O   0  0  0

+   -3.4672    2.2255    0.1796 C   0  0  0

+    3.9156    1.1712   -0.8879 O   0  0  0

+    4.6392   -0.2130    0.5301 O   0  5  0

+    2.2539    2.2908    0.0000 H   0  0  0

+   -1.1135   -3.1697    0.0000 H   0  0  0

+    0.9090   -3.3779    0.0000 H   0  0  0

+   -3.6085   -1.5958    0.0000 H   0  0  0

+   -4.5350    0.4273    0.0000 H   0  0  0

+    0.3127    3.6358    0.0000 H   0  0  0

+   -2.1729    3.8561    0.0000 H   0  0  0

+    3.0846   -2.3389    0.0000 H   0  0  0

+   -2.8016   -2.6662    0.0000 H   0  0  0

+   -2.0373   -2.5368    0.0000 H   0  0  0

+   -4.3222    2.8157    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-90-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.8566    0.6768   -0.0039 C   0  0  0

+   -0.2065   -0.2313   -0.0036 C   0  0  0

+    0.5939    2.0496   -0.0009 C   0  0  0

+    2.2467    0.1891   -0.0011 C   0  0  0

+   -1.5049    0.2327   -0.0005 C   0  0  0

+   -0.7102    2.4985    0.0022 C   0  0  0

+    3.1668    0.9796   -0.0013 O   0  0  0

+    2.5681   -1.5169    0.0025 Cl  0  0  0

+   -1.7571    1.5937    0.0029 C   0  0  0

+   -2.6318   -0.7269   -0.0003 N   0  3  0

+   -3.7793   -0.3187    0.0025 O   0  0  0

+   -2.4115   -1.9248   -0.0028 O   0  5  0

+   -0.0188   -1.2521    0.0000 H   0  0  0

+    1.3782    2.7295    0.0000 H   0  0  0

+   -0.9068    3.5177    0.0000 H   0  0  0

+   -2.7365    1.9373    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  9  2  0

+  2 13  1  0

+  3 14  1  0

+  6 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80-30-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+    1.3738   -0.4663    0.0656 C   0  0  0

+    0.1216   -1.7054    0.0334 S   0  0  0

+    1.5414    0.3182    1.1917 C   0  0  0

+    2.1924   -0.2823   -1.0328 C   0  0  0

+   -1.2018   -1.0524   -0.7180 N   0  0  0

+    0.6020   -2.7172   -0.8410 O   0  0  0

+   -0.2614   -1.9025    1.3876 O   0  0  0

+    2.5237    1.2902    1.2169 C   0  0  0

+    3.1750    0.6900   -1.0075 C   0  0  0

+   -1.8687    0.1175   -0.1411 C   0  0  0

+    3.3387    1.4780    0.1161 C   0  0  0

+   -2.0364    1.1914   -1.2179 C   0  0  0

+   -3.2440   -0.2903    0.3910 C   0  0  0

+    4.4097    2.5378    0.1436 C   0  0  0

+   -2.7330    2.4132   -0.6154 C   0  0  0

+   -3.9406    0.9315    0.9935 C   0  0  0

+   -4.1083    2.0055   -0.0833 C   0  0  0

+    0.6437    0.8093    0.0000 H   0  0  0

+    2.6835   -1.1799    0.0000 H   0  0  0

+   -1.9034   -1.7972    0.0000 H   0  0  0

+    2.0302    2.1865    0.0000 H   0  0  0

+    4.0741    0.2015    0.0000 H   0  0  0

+   -0.9029    0.4554    0.0000 H   0  0  0

+   -1.0444    0.9406    0.0000 H   0  0  0

+   -1.4171    2.0059    0.0000 H   0  0  0

+   -4.1691   -0.7275    0.0000 H   0  0  0

+   -2.8789   -1.2461    0.0000 H   0  0  0

+    5.1294    1.8105    0.0000 H   0  0  0

+    5.1370    3.2575    0.0000 H   0  0  0

+    3.6900    3.2651    0.0000 H   0  0  0

+   -1.8079    2.8504    0.0000 H   0  0  0

+   -3.0981    3.3691    0.0000 H   0  0  0

+   -4.9326    1.1823    0.0000 H   0  0  0

+   -4.5599    0.1170    0.0000 H   0  0  0

+   -4.3553    2.9985    0.0000 H   0  0  0

+   -5.1112    1.8029    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  2  7  2  0

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+ 15 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-96-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 40                          1 V2000

+   -1.3717    0.4716    0.2406 C   0  0  0

+   -2.7557    0.4582    0.4517 N   0  0  0

+   -0.7002    1.6804    0.1163 C   0  0  0

+   -0.6698   -0.7241    0.1611 C   0  0  0

+   -3.6415   -0.1618   -0.5369 C   0  0  0

+    0.6652    1.6937   -0.0915 C   0  0  0

+    0.6951   -0.7108   -0.0466 C   0  0  0

+   -4.8095   -0.8416    0.1803 C   0  0  0

+   -4.1801    0.9126   -1.4837 C   0  0  0

+    1.3661    0.4982   -0.1761 C   0  0  0

+   -4.2709   -1.9159    1.1272 C   0  0  0

+    2.7501    0.5117   -0.3868 N   0  0  0

+    3.6343   -0.2416    0.5060 C   0  0  0

+    4.8275   -0.7754   -0.2892 C   0  0  0

+    4.1352    0.6774    1.6220 C   0  0  0

+    4.3265   -1.6943   -1.4052 C   0  0  0

+   -3.0666    1.4282    0.0000 H   0  0  0

+   -1.2211    2.5558    0.0000 H   0  0  0

+   -1.1716   -1.6106    0.0000 H   0  0  0

+   -3.0928   -1.0200    0.0000 H   0  0  0

+    1.1673    2.5800    0.0000 H   0  0  0

+    1.2161   -1.5861    0.0000 H   0  0  0

+   -5.3035    0.0492    0.0000 H   0  0  0

+   -5.7104   -1.3170    0.0000 H   0  0  0

+   -3.2695    1.3691    0.0000 H   0  0  0

+   -4.6366    1.8232    0.0000 H   0  0  0

+   -5.0907    0.4561    0.0000 H   0  0  0

+   -5.1815   -2.3724    0.0000 H   0  0  0

+   -3.8144   -2.8265    0.0000 H   0  0  0

+   -3.3603   -1.4594    0.0000 H   0  0  0

+    3.0974    1.4693    0.0000 H   0  0  0

+    3.0905   -1.1029    0.0000 H   0  0  0

+    5.7343   -1.2395    0.0000 H   0  0  0

+    5.2677    0.1432    0.0000 H   0  0  0

+    5.0296    0.1899    0.0000 H   0  0  0

+    4.6227    1.5718    0.0000 H   0  0  0

+    3.2408    1.1649    0.0000 H   0  0  0

+    3.4321   -1.2067    0.0000 H   0  0  0

+    3.8389   -2.5887    0.0000 H   0  0  0

+    5.2209   -2.1819    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  4  7  2  0

+  5  8  1  0

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+  7 10  1  0

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+  3 18  1  0

+  4 19  1  0

+  5 20  1  0

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+  7 22  1  0

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+ 15 35  1  0

+ 15 36  1  0

+ 15 37  1  0

+ 16 38  1  0

+ 16 39  1  0

+ 16 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+142-83-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.0922   -0.4167    0.0000 C   0  0  0

+   -1.3743    0.2840    0.0000 C   0  0  0

+    1.0672    0.2894    0.0000 C   0  0  0

+   -2.5152   -0.4108    0.0000 C   0  0  0

+    2.3026   -0.3857    0.0000 C   0  0  0

+   -3.8376    0.3119    0.0000 C   0  0  0

+    3.3400    0.2461    0.0000 O   0  0  0

+   -0.0679   -1.4534    0.0000 H   0  0  0

+   -1.3986    1.3207    0.0000 H   0  0  0

+    1.0429    1.3261    0.0000 H   0  0  0

+   -2.4909   -1.4475    0.0000 H   0  0  0

+    2.3269   -1.4224    0.0000 H   0  0  0

+   -3.3403    1.2219    0.0000 H   0  0  0

+   -4.7476    0.8092    0.0000 H   0  0  0

+   -4.3349   -0.5981    0.0000 H   0  0  0

+  1  2  1  0

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+  2  4  2  0

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+  5  7  2  0

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+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+132-86-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.5770    0.4905   -0.0023 C   0  0  0

+   -0.3963   -0.9151   -0.0016 C   0  0  0

+    0.5519    1.3355   -0.0014 C   0  0  0

+   -1.8787    1.0171    0.0020 C   0  0  0

+    0.9047   -1.4441   -0.0001 C   0  0  0

+   -1.5238   -1.7549   -0.0021 C   0  0  0

+    1.8046    0.7930    0.0001 C   0  0  0

+    0.3935    2.6842   -0.0015 O   0  0  0

+   -2.9474    0.1736    0.0067 C   0  0  0

+    1.9859   -0.5920    0.0008 C   0  0  0

+   -2.7704   -1.2086   -0.0031 C   0  0  0

+    3.2444   -1.1042    0.0022 O   0  0  0

+   -2.0265    2.0517    0.0000 H   0  0  0

+    1.0512   -2.4789    0.0000 H   0  0  0

+   -1.4053   -2.7933    0.0000 H   0  0  0

+    2.6390    1.4223    0.0000 H   0  0  0

+    0.2716    3.7222    0.0000 H   0  0  0

+   -3.9150    0.5687    0.0000 H   0  0  0

+   -3.6071   -1.8349    0.0000 H   0  0  0

+    4.2124   -1.4982    0.0000 H   0  0  0

+  1  2  1  0

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+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+139953-95-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+    0.6943   -0.2412    0.1123 C   0  0  0

+   -0.5197    0.4663    0.0266 C   0  0  0

+    1.8770    0.4311    0.0835 C   0  0  0

+   -1.7008   -0.2051    0.0553 C   0  0  0

+    3.0919   -0.2768    0.1693 C   0  0  0

+   -2.9204    0.5055   -0.0308 C   0  0  0

+    4.2712    0.3936    0.1406 C   0  0  0

+   -4.0894   -0.1590   -0.0023 C   0  0  0

+    5.5315   -0.3408    0.2296 C   0  0  0

+   -5.2561    0.5208   -0.0847 O   0  0  0

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+   -6.3041   -0.4489   -0.0283 C   0  0  0

+    7.9921   -0.4383    0.2931 C   0  0  0

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+    8.8247   -0.1765   -0.9635 C   0  0  0

+   -8.7803   -0.7806   -0.0568 C   0  0  0

+    0.6886   -1.2950    0.0000 H   0  0  0

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+ 15 33  1  0

+ 15 34  1  0

+ 15 35  1  0

+ 16 36  1  0

+ 16 37  1  0

+ 16 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-33-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.9053    0.6121    0.0048 C   0  0  0

+   -0.7946   -0.7816    0.0036 C   0  0  0

+    0.2506    1.3980    0.0034 C   0  0  0

+   -2.2336    1.2492    0.0014 C   0  0  0

+    0.4521   -1.3706    0.0011 C   0  0  0

+    1.4907    0.7943    0.0008 C   0  0  0

+   -2.3262    2.4588    0.0025 O   0  0  0

+   -3.6664    0.2690   -0.0041 Cl  0  0  0

+    1.5922   -0.5857   -0.0003 C   0  0  0

+    0.5716   -2.8459    0.0003 N   0  3  0

+    2.7160    1.6247   -0.0011 N   0  3  0

+    1.6721   -3.3678   -0.0019 O   0  0  0

+   -0.4307   -3.5381    0.0019 O   0  5  0

+    3.8119    1.0931   -0.0034 O   0  0  0

+    2.6284    2.8395   -0.0005 O   0  5  0

+   -1.6486   -1.3713    0.0000 H   0  0  0

+    0.1759    2.4331    0.0000 H   0  0  0

+    2.5279   -1.0345    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 14  2  0

+ 11 15  1  0

+  6  9  2  0

+  2 16  1  0

+  3 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+49562-28-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 47                          1 V2000

+   -1.1027   -0.9241   -0.0013 C   0  0  0

+   -2.3973   -1.6062   -0.1863 C   0  0  0

+   -0.4287   -1.0183    1.2202 C   0  0  0

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+   -3.6537   -0.8306   -0.1428 C   0  0  0

+   -2.4303   -2.8070   -0.3746 O   0  0  0

+    0.7794   -0.3799    1.3886 C   0  0  0

+    0.6654    0.4491   -0.8722 C   0  0  0

+   -4.8672   -1.4427   -0.4648 C   0  0  0

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+    2.5202    0.9855    0.5166 O   0  0  0

+   -6.0095    0.6238   -0.0614 C   0  0  0

+    3.5328   -0.0191    0.4311 C   0  0  0

+   -7.4860    1.5354   -0.0104 Cl  0  0  0

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+    7.4025    0.5548   -1.8643 C   0  0  0

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+ 15 17  1  0

+ 16 18  1  0

+ 16 19  1  0

+ 16 20  1  0

+ 18 21  1  0

+ 18 22  2  0

+ 21 23  1  0

+ 23 24  1  0

+ 23 25  1  0

+  8 11  1  0

+ 13 15  1  0

+  3 26  1  0

+  4 27  1  0

+  7 28  1  0

+  8 29  1  0

+  9 30  1  0

+ 10 31  1  0

+ 12 32  1  0

+ 13 33  1  0

+ 19 34  1  0

+ 19 35  1  0

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+ 20 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 23 40  1  0

+ 24 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+ 25 44  1  0

+ 25 45  1  0

+ 25 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+135295-00-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -1.5856   -0.0054   -0.0032 C   0  0  0

+   -0.6343   -1.1138    0.0643 C   0  0  0

+   -0.9754    1.1345    0.0185 C   0  0  0

+   -3.0267   -0.2095   -0.0891 C   0  0  0

+    0.6761   -0.4492    0.1309 C   0  0  0

+   -1.1281   -2.3268    0.0501 C   0  0  0

+    0.4680    0.8621    0.1043 C   0  0  0

+   -1.8318    2.3341   -0.0452 C   0  0  0

+   -3.4853   -1.6090   -0.1039 C   0  0  0

+   -3.7889    0.8562   -0.1460 C   0  0  0

+    2.0474   -0.9753    0.2136 C   0  0  0

+   -2.5782   -2.5664   -0.0306 C   0  0  0

+    1.6244    1.7758    0.1596 C   0  0  0

+   -3.1426    2.1869   -0.1194 C   0  0  0

+    3.0734   -0.1539    0.2623 C   0  0  0

+    2.8474    1.3014    0.2330 C   0  0  0

+    4.4756   -0.6997    0.3465 C   0  0  0

+    5.2279   -0.2567   -0.7848 O   0  0  0

+   -0.4444   -3.1828    0.0000 H   0  0  0

+   -1.3856    3.3346    0.0000 H   0  0  0

+   -4.5542   -1.8490    0.0000 H   0  0  0

+   -4.8805    0.7639    0.0000 H   0  0  0

+    2.2159   -2.0578    0.0000 H   0  0  0

+   -2.9273   -3.6048    0.0000 H   0  0  0

+    1.4614    2.8591    0.0000 H   0  0  0

+   -3.7749    3.0815    0.0000 H   0  0  0

+    3.7010    1.9880    0.0000 H   0  0  0

+    3.8628   -1.6077    0.0000 H   0  0  0

+    5.2261   -1.4978    0.0000 H   0  0  0

+    6.1719    0.2992    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 11 15  2  0

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+  5  7  2  0

+  9 12  2  0

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+  9 21  1  0

+ 10 22  1  0

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+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-77-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.0844    0.5958    0.0028 C   0  0  0

+   -0.4344   -0.7438    0.0003 C   0  0  0

+    1.2489    0.9624    0.0028 C   0  0  0

+   -1.3197    1.8155   -0.0015 Cl  0  0  0

+    0.5488   -1.7173   -0.0021 C   0  0  0

+   -2.1087   -1.2025    0.0007 Cl  0  0  0

+    2.2350   -0.0127    0.0004 C   0  0  0

+    1.8816   -1.3544   -0.0020 C   0  0  0

+    3.5461    0.3456    0.0000 O   0  0  0

+    1.5116    1.9671    0.0000 H   0  0  0

+    0.2846   -2.7215    0.0000 H   0  0  0

+    2.6189   -2.0856    0.0000 H   0  0  0

+    4.5478    0.6193    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  5 11  1  0

+  8 12  1  0

+  9 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78859-43-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+   -1.3432   -1.4282   -0.5507 C   0  0  0

+   -2.2351   -1.5840    0.6110 C   0  0  0

+   -0.1435   -2.1800   -0.5507 C   0  0  0

+   -1.6433   -0.5904   -1.6191 C   0  0  0

+   -2.0871   -2.7583    1.3270 N   0  0  0

+   -3.1214   -0.6591    0.9486 N   0  0  0

+    0.1356   -3.0493    0.5942 C   0  0  0

+    0.7326   -2.0710   -1.6304 C   0  0  0

+   -0.7603   -0.4981   -2.6748 C   0  0  0

+   -0.8001   -3.3004    1.4662 N   0  0  0

+   -3.1230    0.4825    0.3478 N   0  0  0

+    0.4183   -1.2323   -2.6778 C   0  0  0

+   -3.9330    1.4315    0.7469 C   0  0  0

+   -4.0468    2.6676   -0.0247 C   0  0  0

+   -4.7474    1.2488    2.0017 C   0  0  0

+   -3.0044    3.4971   -0.1142 C   0  0  0

+   -3.1708    4.8495   -0.7581 C   0  0  0

+   -1.6616    3.0811    0.4286 C   0  0  0

+   12.2150    1.0609    0.4903 Cl  0  0  0

+   -2.3948   -0.1179    0.0000 H   0  0  0

+   -2.7944   -3.2946    0.0000 H   0  0  0

+    0.9151   -3.4741    0.0000 H   0  0  0

+    1.4920   -2.5306    0.0000 H   0  0  0

+   -0.5610    0.3669    0.0000 H   0  0  0

+    1.1051   -0.6699    0.0000 H   0  0  0

+   -4.8632    3.0161    0.0000 H   0  0  0

+   -4.9417    2.1150    0.0000 H   0  0  0

+   -5.6136    1.0545    0.0000 H   0  0  0

+   -4.5531    0.3826    0.0000 H   0  0  0

+   -2.2898    4.9579    0.0000 H   0  0  0

+   -3.2792    5.7305    0.0000 H   0  0  0

+   -4.0518    4.7411    0.0000 H   0  0  0

+   -1.9243    2.2332    0.0000 H   0  0  0

+   -0.8137    2.8184    0.0000 H   0  0  0

+   -1.3989    3.9290    0.0000 H   0  0  0

+   13.1027    1.0609    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  8 12  2  0

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+ 13 14  1  0

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+ 16 17  1  0

+ 16 18  1  0

+  7 10  2  0

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+ 15 28  1  0

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+ 17 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+505-23-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.0004    1.7647   -0.3166 C   0  0  0

+   -1.2538    1.1893    0.3321 C   0  0  0

+    1.2533    1.1898    0.3321 C   0  0  0

+   -1.4816   -0.5363   -0.1700 S   0  0  0

+    1.4819   -0.5356   -0.1700 S   0  0  0

+    0.0003   -1.2823    0.5600 C   0  0  0

+    0.7692    2.7425    0.0000 H   0  0  0

+   -0.7704    2.7422    0.0000 H   0  0  0

+   -1.5534    2.3970    0.0000 H   0  0  0

+   -2.4962    1.1197    0.0000 H   0  0  0

+    2.4957    1.1208    0.0000 H   0  0  0

+    1.5524    2.3977    0.0000 H   0  0  0

+   -0.7811   -2.2507    0.0000 H   0  0  0

+    0.7821   -2.2504    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+781-43-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.2042    0.7334   -0.0023 C   0  0  0

+   -1.2042   -0.7333   -0.0018 C   0  0  0

+   -0.0001    1.4347   -0.0018 C   0  0  0

+   -2.4424    1.4115    0.0028 C   0  0  0

+   -0.0001   -1.4346   -0.0005 C   0  0  0

+   -2.4423   -1.4115   -0.0024 C   0  0  0

+    1.2045    0.7334   -0.0010 C   0  0  0

+   -0.0003    2.9417   -0.0027 C   0  0  0

+   -3.5969    0.6976    0.0079 C   0  0  0

+    1.2045   -0.7333    0.0004 C   0  0  0

+   -0.0002   -2.9416    0.0004 C   0  0  0

+   -3.5969   -0.6978   -0.0032 C   0  0  0

+    2.4422    1.4113   -0.0001 C   0  0  0

+    2.4421   -1.4114    0.0013 C   0  0  0

+    3.5971    0.6974    0.0012 C   0  0  0

+    3.5971   -0.6975    0.0018 C   0  0  0

+   -2.4700    2.4575    0.0000 H   0  0  0

+   -2.4698   -2.4575    0.0000 H   0  0  0

+    1.0461    2.9418    0.0000 H   0  0  0

+   -0.0004    3.9881    0.0000 H   0  0  0

+   -1.0467    2.9416    0.0000 H   0  0  0

+   -4.5109    1.2070    0.0000 H   0  0  0

+   -1.0466   -2.9415    0.0000 H   0  0  0

+   -0.0003   -3.9880    0.0000 H   0  0  0

+    1.0462   -2.9417    0.0000 H   0  0  0

+   -4.5108   -1.2073    0.0000 H   0  0  0

+    2.4697    2.4573    0.0000 H   0  0  0

+    2.4695   -2.4574    0.0000 H   0  0  0

+    4.5110    1.2069    0.0000 H   0  0  0

+    4.5110   -1.2070    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+28434-86-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -3.0448    0.2934   -0.3253 C   0  0  0

+   -3.5519   -0.4995    0.6975 C   0  0  0

+   -1.8277   -0.0172   -0.9004 C   0  0  0

+   -3.9439    1.6691   -0.8846 Cl  0  0  0

+   -2.8347   -1.6025    1.1399 C   0  0  0

+   -4.7849   -0.1856    1.2814 N   0  0  0

+   -1.1120   -1.1202   -0.4570 C   0  0  0

+   -1.6178   -1.9115    0.5636 C   0  0  0

+    0.0857   -1.4256   -1.0238 O   0  0  0

+    1.0295   -0.7065   -0.3597 C   0  0  0

+    2.3406   -0.6967   -0.8140 C   0  0  0

+    0.6800    0.0213    0.7681 C   0  0  0

+    3.3000    0.0337   -0.1397 C   0  0  0

+    1.6380    0.7523    1.4436 C   0  0  0

+    2.9511    0.7586    0.9938 C   0  0  0

+    4.9405    0.0458   -0.7074 Cl  0  0  0

+    3.9224    1.4989    1.6783 N   0  0  0

+   -1.2829    0.7418    0.0000 H   0  0  0

+   -3.3787   -2.3621    0.0000 H   0  0  0

+   -5.0380    0.7138    0.0000 H   0  0  0

+   -5.4373   -0.8545    0.0000 H   0  0  0

+   -1.2741   -2.7803    0.0000 H   0  0  0

+    2.6426   -1.5809    0.0000 H   0  0  0

+   -0.2285    0.2394    0.0000 H   0  0  0

+    1.3367    1.6367    0.0000 H   0  0  0

+    4.7844    1.1385    0.0000 H   0  0  0

+    3.8035    2.4256    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  8 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26078-25-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -2.8001   -2.5530    0.0009 C   0  0  0

+   -2.3181   -1.1251    0.0023 C   0  0  0

+   -0.8877   -0.8146    0.0016 C   0  0  0

+   -3.1998   -0.0910   -0.0015 C   0  0  0

+   -0.4828    0.5337    0.0024 C   0  0  0

+    0.0711   -1.8350   -0.0004 C   0  0  0

+   -2.7243    1.2359   -0.0006 C   0  0  0

+    0.8692    0.8388    0.0017 C   0  0  0

+   -1.4112    1.5143    0.0034 O   0  0  0

+    1.3979   -1.5190   -0.0014 C   0  0  0

+   -3.5254    2.1533   -0.0045 O   0  0  0

+    1.8063   -0.1843    0.0003 C   0  0  0

+    2.4293   -2.6177   -0.0030 C   0  0  0

+    3.1635    0.1226   -0.0004 N   0  0  0

+    3.5983    1.5216    0.0004 C   0  0  0

+    5.1271    1.5806   -0.0006 C   0  0  0

+   -3.7920   -2.2182    0.0000 H   0  0  0

+   -3.1349   -3.5449    0.0000 H   0  0  0

+   -1.8082   -2.8878    0.0000 H   0  0  0

+   -4.2295   -0.2794    0.0000 H   0  0  0

+   -0.2296   -2.8377    0.0000 H   0  0  0

+    1.1822    1.8377    0.0000 H   0  0  0

+    1.6661   -3.3342    0.0000 H   0  0  0

+    3.1458   -3.3809    0.0000 H   0  0  0

+    3.1925   -1.9012    0.0000 H   0  0  0

+    3.8739   -0.6463    0.0000 H   0  0  0

+    3.6765    2.5655    0.0000 H   0  0  0

+    2.5699    1.7173    0.0000 H   0  0  0

+    5.1675    0.5345    0.0000 H   0  0  0

+    6.1732    1.6210    0.0000 H   0  0  0

+    5.0867    2.6267    0.0000 H   0  0  0

+  2  1  1  0

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+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+581-29-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.8423    0.5280   -0.0046 C   0  0  0

+   -0.7589   -0.9365   -0.0022 C   0  0  0

+    0.2601    1.2715   -0.0044 N   0  0  0

+   -2.1165    1.1285   -0.0011 C   0  0  0

+    0.4921   -1.5557    0.0007 C   0  0  0

+   -1.9485   -1.6951   -0.0026 C   0  0  0

+    1.4689    0.7192   -0.0021 C   0  0  0

+   -3.2398    0.3353    0.0043 C   0  0  0

+    1.6260   -0.7381    0.0013 C   0  0  0

+   -3.1485   -1.0641   -0.0050 C   0  0  0

+    2.6311    1.5196   -0.0015 C   0  0  0

+   -4.4967    0.9353    0.0077 N   0  0  0

+    2.9241   -1.2867    0.0038 C   0  0  0

+    3.8539    0.9290    0.0013 C   0  0  0

+    4.0006   -0.4577    0.0038 C   0  0  0

+   -2.2077    2.1714    0.0000 H   0  0  0

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+   -1.9048   -2.7411    0.0000 H   0  0  0

+   -4.0265   -1.6342    0.0000 H   0  0  0

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+  1  2  2  0

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+ 11 14  2  0

+ 13 15  2  0

+  7  9  1  0

+  8 10  1  0

+ 14 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13608-87-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.3180    0.8417    0.0030 C   0  0  0

+   -0.5760   -0.3456    0.0020 C   0  0  0

+   -0.6540    2.0737    0.0024 C   0  0  0

+   -2.7873    0.7945   -0.0013 C   0  0  0

+    0.8043   -0.2921    0.0003 C   0  0  0

+   -1.3881   -1.8799    0.0022 Cl  0  0  0

+    0.7230    2.1110    0.0007 C   0  0  0

+   -3.5823    2.0748   -0.0001 C   0  0  0

+   -3.3596   -0.2746   -0.0057 O   0  0  0

+    1.4527    0.9324    0.0001 C   0  0  0

+    1.7283   -1.7618   -0.0011 Cl  0  0  0

+    3.1877    0.9909   -0.0009 Cl  0  0  0

+   -1.2043    2.9678    0.0000 H   0  0  0

+    1.2214    3.0350    0.0000 H   0  0  0

+   -2.6904    2.6286    0.0000 H   0  0  0

+   -4.1361    2.9667    0.0000 H   0  0  0

+   -4.4742    1.5210    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  5 11  1  0

+ 10 12  1  0

+  7 10  1  0

+  3 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91259-16-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.6723   -0.9590   -0.0019 C   0  0  0

+   -1.7602   -0.0568   -0.0017 C   0  0  0

+    0.6567   -0.4889   -0.0012 C   0  0  0

+   -0.9241   -2.3500    0.0032 C   0  0  0

+   -1.5439    1.3366   -0.0003 C   0  0  0

+   -3.0805   -0.5611   -0.0024 C   0  0  0

+    0.9169    0.9611    0.0002 C   0  0  0

+    1.7057   -1.4022   -0.0014 C   0  0  0

+    0.1552   -3.2404    0.0031 C   0  0  0

+   -2.2589   -2.8223    0.0078 C   0  0  0

+   -0.1670    1.8602   -0.0001 C   0  0  0

+   -2.6350    2.1986    0.0003 C   0  0  0

+   -3.2982   -1.9602   -0.0030 C   0  0  0

+   -4.1552    0.3354   -0.0022 C   0  0  0

+    2.2217    1.4541    0.0008 C   0  0  0

+    1.4477   -2.7621   -0.0023 C   0  0  0

+    3.1046   -0.9176   -0.0013 N   0  3  0

+    0.0761    3.2336    0.0017 C   0  0  0

+   -3.9242    1.6936   -0.0004 C   0  0  0

+    2.4402    2.8141    0.0021 C   0  0  0

+    3.6799   -0.7174   -1.0560 O   0  0  0

+    3.6802   -0.7192    1.0536 O   0  5  0

+    1.3724    3.6999    0.0024 C   0  0  0

+   -0.0194   -4.2719    0.0000 H   0  0  0

+   -2.4423   -3.8522    0.0000 H   0  0  0

+   -2.4811    3.2333    0.0000 H   0  0  0

+   -4.2765   -2.3307    0.0000 H   0  0  0

+   -5.1366   -0.0268    0.0000 H   0  0  0

+    3.0322    0.7927    0.0000 H   0  0  0

+    2.2465   -3.4376    0.0000 H   0  0  0

+   -0.7238    3.9078    0.0000 H   0  0  0

+   -4.7357    2.3538    0.0000 H   0  0  0

+    3.4194    3.1821    0.0000 H   0  0  0

+    1.5531    4.7303    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+ 15 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1165-39-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.3886   -0.3850    0.3263 C   0  0  0

+   -1.7544   -0.1899    0.3510 C   0  0  0

+    0.4724    0.7228    0.1688 C   0  0  0

+    0.1300   -1.6307    0.4738 O   0  0  0

+   -2.2957    1.0855    0.2379 C   0  0  0

+   -2.9097   -1.1587    0.5004 C   0  0  0

+    1.8657    0.5214    0.0866 C   0  0  0

+   -0.0758    2.0183    0.0848 C   0  0  0

+    1.3612   -1.8773   -0.0429 C   0  0  0

+   -3.6542    1.0470    0.2631 O   0  0  0

+   -1.4431    2.1868    0.1150 C   0  0  0

+   -4.0942   -0.1967    0.8293 C   0  0  0

+   -3.3023   -1.6622   -0.8760 C   0  0  0

+    2.3361   -0.7818    0.0080 C   0  0  0

+    2.8126    1.6882    0.0783 C   0  0  0

+    0.7400    3.0962   -0.0250 O   0  0  0

+    1.6435   -2.9580   -0.5260 O   0  0  0

+   -5.1361   -0.7300   -0.0104 O   0  0  0

+   -4.5693   -1.3637   -1.0612 C   0  0  0

+    3.7810   -1.0418   -0.0370 C   0  0  0

+    4.2052    1.2511    0.5359 C   0  0  0

+    0.6088    3.5788   -1.3636 C   0  0  0

+    4.5905    0.0435   -0.1866 O   0  0  0

+    4.2312   -2.1674    0.0549 O   0  0  0

+   -2.1712   -1.8714    0.0000 H   0  0  0

+   -1.8377    3.1342    0.0000 H   0  0  0

+   -4.8665    0.4791    0.0000 H   0  0  0

+   -2.9614   -2.6302    0.0000 H   0  0  0

+    3.2404    2.6210    0.0000 H   0  0  0

+    1.9409    2.2297    0.0000 H   0  0  0

+   -5.0936   -2.2459    0.0000 H   0  0  0

+    5.2259    1.3582    0.0000 H   0  0  0

+    4.3075    2.2723    0.0000 H   0  0  0

+    1.5991    3.8480    0.0000 H   0  0  0

+    0.3396    4.5691    0.0000 H   0  0  0

+   -0.3815    3.3096    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  8  2  0

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+  8 11  1  0

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+ 15 29  1  0

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+ 19 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+790-60-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 33                          1 V2000

+   -0.9451   -2.0364   -0.0004 C   0  0  0

+   -2.2327   -1.6231   -0.0002 C   0  0  0

+    0.1237   -1.1136   -0.0008 C   0  0  0

+   -1.9537   -2.9690    0.0012 O   0  0  0

+   -2.5849   -0.2580   -0.0006 C   0  0  0

+   -0.1732    0.3239   -0.0012 C   0  0  0

+    1.4469   -1.5517   -0.0004 C   0  0  0

+   -1.5809    0.7398   -0.0012 C   0  0  0

+   -3.9341    0.1346    0.0007 C   0  0  0

+    0.8519    1.2538   -0.0010 C   0  0  0

+    2.4828   -0.6167   -0.0004 C   0  0  0

+   -1.9410    2.0874   -0.0004 C   0  0  0

+   -4.2537    1.4600    0.0012 C   0  0  0

+    2.1803    0.8175   -0.0005 C   0  0  0

+    3.8331   -1.0243    0.0005 C   0  0  0

+   -3.2627    2.4351    0.0009 C   0  0  0

+    3.2485    1.7362    0.0001 C   0  0  0

+    4.8161   -0.0866    0.0011 C   0  0  0

+    4.5277    1.2772    0.0010 C   0  0  0

+    1.6622   -2.5755    0.0000 H   0  0  0

+   -4.6909   -0.5877    0.0000 H   0  0  0

+    0.6341    2.2770    0.0000 H   0  0  0

+   -1.2027    2.8286    0.0000 H   0  0  0

+   -5.2596    1.7475    0.0000 H   0  0  0

+    4.0760   -2.0419    0.0000 H   0  0  0

+   -3.5317    3.4461    0.0000 H   0  0  0

+    3.0582    2.7649    0.0000 H   0  0  0

+    5.8154   -0.3961    0.0000 H   0  0  0

+    5.3160    1.9649    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 14 17  2  0

+ 15 18  1  0

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+  2  4  1  0

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+ 13 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+470-90-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    1.9113    0.4074    0.1096 P   0  0  0

+    1.2316   -0.5181   -1.0189 O   0  0  0

+    3.0587    1.3161   -0.5610 O   0  0  0

+    0.7919    1.3576    0.7702 O   0  0  0

+    2.5102   -0.4505    1.1563 O   0  0  0

+    0.3327   -1.3160   -0.3837 C   0  0  0

+    3.6793    2.0466    0.4989 C   0  0  0

+    0.5234    0.8355    2.0730 C   0  0  0

+   -1.0658   -0.8641   -0.2117 C   0  0  0

+    0.7109   -2.5047    0.0838 C   0  0  0

+    4.7855    2.9351   -0.0735 C   0  0  0

+   -0.5382    1.6975    2.7591 C   0  0  0

+   -1.5564    0.2006   -0.9695 C   0  0  0

+   -1.9008   -1.5041    0.7045 C   0  0  0

+    2.3740   -2.9908   -0.0241 Cl  0  0  0

+   -2.8625    0.6176   -0.8042 C   0  0  0

+   -0.5269    0.9991   -2.1168 Cl  0  0  0

+   -3.2036   -1.0787    0.8609 C   0  0  0

+   -3.6839   -0.0182    0.1107 C   0  0  0

+   -5.3246    0.5115    0.3139 Cl  0  0  0

+    3.4740    2.9807    0.0000 H   0  0  0

+    2.7513    2.2776    0.0000 H   0  0  0

+   -0.0268    0.0533    0.0000 H   0  0  0

+    1.3417    0.3405    0.0000 H   0  0  0

+    0.0427   -3.1889    0.0000 H   0  0  0

+    5.3844    2.1895    0.0000 H   0  0  0

+    5.5311    3.5340    0.0000 H   0  0  0

+    4.1866    3.6807    0.0000 H   0  0  0

+    0.0646    2.4399    0.0000 H   0  0  0

+   -1.2806    2.3003    0.0000 H   0  0  0

+   -1.1410    0.9551    0.0000 H   0  0  0

+   -1.7398   -2.4468    0.0000 H   0  0  0

+   -3.0289    1.5594    0.0000 H   0  0  0

+   -3.8418   -1.7910    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 12 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 14 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108342-09-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.5756   -0.2874   -0.4413 C   0  0  1

+   -1.8928    0.3096   -0.0172 C   0  0  0

+    0.4874    0.0199    0.6153 C   0  0  0

+   -0.7201   -1.7425   -0.5819 N   0  0  0

+   -2.2118    1.5607   -0.3840 O   0  0  0

+   -2.6616   -0.3381    0.6531 O   0  0  0

+    1.7678   -0.5604    0.2029 N   0  0  0

+    2.6613    0.1034    0.0467 N   0  3  0

+    3.5548    0.7671   -0.1096 N   0  5  0

+   -0.5107    0.6118    0.0000 H   0  0  0

+    1.0775    0.7016    0.0000 H   0  0  0

+    0.0014    0.7793    0.0000 H   0  0  0

+   -1.5416   -2.1139    0.0000 H   0  0  0

+    0.0123   -2.2682    0.0000 H   0  0  0

+   -2.4346    2.4343    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  2  6  2  0

+  3  7  1  0

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+  1 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122-04-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.9701   -0.3094   -0.0013 C   0  0  0

+   -2.4344   -0.4710   -0.0011 C   0  0  0

+   -0.4044    0.9692   -0.0002 C   0  0  0

+   -0.1394   -1.4334    0.0032 C   0  0  0

+   -2.9220   -1.5818   -0.0020 O   0  0  0

+   -3.4621    0.9281    0.0006 Cl  0  0  0

+    0.9669    1.1125    0.0000 C   0  0  0

+    1.2306   -1.2741    0.0033 C   0  0  0

+    1.7831   -0.0054   -0.0009 C   0  0  0

+    3.2542    0.1570   -0.0006 N   0  3  0

+    3.9753   -0.8246   -0.0014 O   0  0  0

+    3.7438    1.2723    0.0003 O   0  5  0

+   -1.0152    1.8084    0.0000 H   0  0  0

+   -0.5525   -2.3856    0.0000 H   0  0  0

+    1.3883    2.0611    0.0000 H   0  0  0

+    1.8487   -2.1079    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 12  1  0

+  8  9  2  0

+  3 13  1  0

+  4 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-92-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 79 81                          1 V2000

+   -1.4494    1.0354   -0.0738 C   0  0  1

+    0.0279    0.5974    0.0356 C   0  0  2

+   -1.4846    1.9253   -1.3364 C   0  0  2

+   -2.2732   -0.1143   -0.2782 O   0  0  0

+    0.4220    0.5898    1.4092 O   0  0  0

+    0.7682    1.6158   -0.6719 O   0  0  0

+   -0.0244    1.9196   -1.8404 C   0  0  1

+   -1.9161    3.3254   -0.9837 C   0  0  0

+   -2.3561    1.3643   -2.3202 O   0  0  0

+   -2.8584   -0.4331    0.9859 C   0  0  1

+    1.7143   -0.0176    1.4648 C   0  0  2

+    0.1523    0.8101   -2.8790 C   0  0  0

+   -2.9102    3.7948   -1.4833 O   0  0  0

+   -4.2724    0.1483    1.0545 C   0  0  2

+   -2.9105   -1.8499    1.1419 O   0  0  0

+    2.7421    0.9097    0.8132 C   0  0  2

+    1.6836   -1.3513    0.7157 C   0  0  1

+   -5.1090   -0.4367   -0.0891 C   0  0  1

+   -4.2083    1.6094    0.9165 N   0  0  0

+   -3.5570   -2.3874   -0.0103 C   0  0  2

+    4.1257    0.2594    0.8727 C   0  0  1

+    2.7715    2.1868    1.5304 N   0  0  0

+    3.0672   -2.0016    0.7752 C   0  0  2

+    0.7237   -2.2175    1.3243 O   0  0  0

+   -5.0281   -1.9660   -0.0232 C   0  0  2

+   -6.4695   -0.0249    0.0571 O   0  0  0

+   -4.6565    2.1744    2.1962 C   0  0  0

+   -3.4642   -3.9143    0.0187 C   0  0  0

+    4.0950   -1.0743    0.1236 C   0  0  2

+    5.0857    1.1255    0.2640 O   0  0  0

+    2.9194    3.3630    0.8342 C   0  0  0

+    3.0385   -3.2473    0.0755 O   0  0  0

+   -5.6742   -2.5268   -1.1678 O   0  0  0

+   -2.1008   -4.3117   -0.1407 O   0  0  0

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+    7.2870   -3.6327    0.0000 H   0  0  0

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+ 40 79  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58336-35-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    1.3865   -0.0269   -0.1322 C   0  0  0

+    0.1906   -0.7489   -0.2278 C   0  0  0

+    1.3256    1.3488    0.0558 C   0  0  0

+    2.5495   -0.7672   -0.2501 N   0  0  0

+   -1.0320   -0.1295   -0.0969 C   0  0  0

+    0.3003   -2.2313   -0.4917 C   0  0  0

+    0.1216    1.9826    0.2027 C   0  0  0

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+    2.5058   -1.8962    0.6756 C   0  0  0

+    3.7154    0.0224    0.1460 C   0  0  0

+   -1.0726    1.2601    0.1353 C   0  0  0

+   -2.1853   -0.8267   -0.1858 O   0  0  0

+    1.3070   -2.8088    0.5031 C   0  0  0

+    3.7082    1.3795   -0.5609 C   0  0  0

+   -2.3702    1.9162    0.2949 C   0  0  0

+   -3.3791   -0.2294   -0.0462 C   0  0  0

+   -3.4915    1.1539    0.1997 C   0  0  0

+   -4.3919   -0.9001   -0.1352 O   0  0  0

+   -0.7257   -2.1030    0.0000 H   0  0  0

+   -0.0275   -3.2119    0.0000 H   0  0  0

+    0.0908    3.0161    0.0000 H   0  0  0

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+    2.9282   -2.8399    0.0000 H   0  0  0

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+    0.6780   -3.6295    0.0000 H   0  0  0

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+    4.1264    2.3251    0.0000 H   0  0  0

+   -2.4368    2.9480    0.0000 H   0  0  0

+   -4.4242    1.6002    0.0000 H   0  0  0

+  1  2  2  0

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+ 15 32  1  0

+ 17 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-85-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.5978   -0.0501   -0.0018 C   0  0  0

+   -0.7365   -0.6491   -0.0011 C   0  0  0

+    0.7506    1.4492    0.0002 C   0  0  0

+    1.6799   -0.8311    0.0014 C   0  0  0

+   -1.7203    0.0609    0.0010 O   0  0  0

+   -0.8429   -1.6926    0.0000 H   0  0  0

+    1.7941    1.3429    0.0000 H   0  0  0

+    0.8569    2.4927    0.0000 H   0  0  0

+   -0.2929    1.5555    0.0000 H   0  0  0

+    1.5735   -1.8746    0.0000 H   0  0  0

+    2.6368   -0.4015    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+132742-04-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.5437    0.0178    0.0482 C   0  0  0

+   -0.7552    0.5565    0.0345 C   0  0  0

+    1.6606    0.8790    0.0938 C   0  0  0

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+    3.1652   -1.1138    0.0938 C   0  0  0

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+   -3.3648    1.6196    0.0085 C   0  0  0

+   -4.3558   -0.6481   -0.0784 N   0  3  0

+    4.5501   -1.7087    0.1599 C   0  0  0

+    5.3700    0.6175   -0.1637 C   0  0  0

+   -5.2622   -0.4201   -0.8594 O   0  0  0

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+   -0.2581   -3.2665    0.0000 H   0  0  0

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+   -2.4574    3.5338    0.0000 H   0  0  0

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+    5.3629   -2.3807    0.0000 H   0  0  0

+    6.2108    1.2541    0.0000 H   0  0  0

+    6.0663   -1.7256    0.0000 H   0  0  0

+    6.5342   -0.4821    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 23 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2782-57-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+    0.0001   -1.7244   -0.0020 C   0  0  0

+   -1.1497   -1.0593   -0.0013 N   0  0  0

+    1.1496   -1.0594   -0.0015 N   0  0  0

+    0.0000   -3.0774    0.0024 O   0  0  0

+   -1.1473    0.2633   -0.0001 C   0  0  0

+    1.1473    0.2634   -0.0003 C   0  0  0

+    0.0001    0.9244    0.0004 N   0  0  0

+   -2.6496    1.1333    0.0003 Cl  0  0  0

+    2.6496    1.1334    0.0004 Cl  0  0  0

+   -0.0001   -4.0734    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  5  7  1  0

+  5  8  1  0

+  6  9  1  0

+  6  7  2  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+72-48-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.8330    0.2677    0.0852 C   0  0  0

+   -0.5634   -1.1172    0.0625 C   0  0  0

+    0.2794    1.2270    0.2231 C   0  0  0

+   -2.1474    0.7176   -0.0285 C   0  0  0

+    0.8299   -1.5913    0.1766 C   0  0  0

+   -1.6100   -2.0240   -0.0681 C   0  0  0

+    1.6681    0.7550    0.0280 C   0  0  0

+    0.0578    2.3913    0.4933 O   0  0  0

+   -3.1867   -0.2114   -0.1644 C   0  0  0

+   -2.4182    2.0463   -0.0073 O   0  0  0

+    1.9376   -0.6257    0.0054 C   0  0  0

+    1.0643   -2.7613    0.4082 O   0  0  0

+   -2.9127   -1.5685   -0.1760 C   0  0  0

+    2.7084    1.6638   -0.1340 C   0  0  0

+   -4.4689    0.2203   -0.2761 O   0  0  0

+    3.2425   -1.0707   -0.1787 C   0  0  0

+    4.0012    1.2042   -0.3161 C   0  0  0

+    4.2662   -0.1531   -0.3386 C   0  0  0

+   -1.4152   -3.0433    0.0000 H   0  0  0

+   -2.6254    3.0632    0.0000 H   0  0  0

+   -3.6951   -2.2503    0.0000 H   0  0  0

+    2.5142    2.6832    0.0000 H   0  0  0

+   -5.4524    0.5514    0.0000 H   0  0  0

+    3.4498   -2.0876    0.0000 H   0  0  0

+    4.7875    1.8815    0.0000 H   0  0  0

+    5.2501   -0.4831    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+162050-09-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.0931    0.0216    0.0055 C   0  0  0

+    0.7505   -1.1585    0.0051 O   0  0  0

+    1.0388    1.0306    0.0024 C   0  0  0

+   -1.3072    0.1939    0.0032 C   0  0  0

+    2.0706   -0.9339    0.0019 C   0  0  0

+    2.2928    0.4006    0.0001 C   0  0  0

+    0.7346    2.7397    0.0010 Cl  0  0  0

+   -2.2144   -1.0094    0.0006 C   0  0  0

+   -1.7816    1.3121    0.0034 O   0  0  0

+    3.1192   -1.9787    0.0000 N   0  3  0

+    3.8404    1.1870   -0.0041 Cl  0  0  0

+   -4.0890   -0.4168   -0.0021 Br  0  0  0

+    2.8060   -3.1558    0.0010 O   0  0  0

+    4.2951   -1.6613   -0.0024 O   0  5  0

+   -2.6399   -1.9637    0.0000 H   0  0  0

+   -1.3143   -1.5401    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 13  2  0

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+  5  6  2  0

+  8 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+959-23-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    0.2496    1.3526   -0.0038 C   0  0  0

+   -0.9326    0.4910   -0.0033 C   0  0  0

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+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 13  1  0

+ 17 14  2  0

+ 18 16  1  0

+ 10 13  1  0

+ 15 17  1  0

+  2 19  1  0

+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6393-01-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -1.1765    0.7340    0.0016 C   0  0  0

+   -1.2207   -0.6537    0.0006 C   0  0  0

+    0.0411    1.3861    0.0016 C   0  0  0

+   -2.4569    1.5288   -0.0035 C   0  0  0

+   -0.0408   -1.3861   -0.0004 C   0  0  0

+   -2.4549   -1.3146    0.0010 N   0  0  0

+    1.2207    0.6539    0.0006 C   0  0  0

+    1.1764   -0.7342   -0.0004 C   0  0  0

+    2.4548    1.3148    0.0002 N   0  0  0

+    2.4568   -1.5290   -0.0015 C   0  0  0

+    0.0743    2.4271    0.0000 H   0  0  0

+   -1.9076    2.4137    0.0000 H   0  0  0

+   -3.3418    2.0781    0.0000 H   0  0  0

+   -3.0062    0.6439    0.0000 H   0  0  0

+   -0.0740   -2.4271    0.0000 H   0  0  0

+   -3.3398   -0.7652    0.0000 H   0  0  0

+   -2.4882   -2.3556    0.0000 H   0  0  0

+    3.3397    0.7655    0.0000 H   0  0  0

+    2.4881    2.3558    0.0000 H   0  0  0

+    1.9075   -2.4139    0.0000 H   0  0  0

+    3.3417   -2.0783    0.0000 H   0  0  0

+    3.0061   -0.6441    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  8 10  1  0

+  7  8  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+612-23-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.2559    0.6961   -0.4569 C   0  0  0

+    0.7304   -0.5331   -0.0393 C   0  0  0

+    1.0855    1.8019   -0.4325 C   0  0  0

+   -1.1637    0.8296   -0.9447 C   0  0  0

+    2.0345   -0.6568    0.4028 C   0  0  0

+   -0.1576   -1.7171   -0.0658 N   0  3  0

+    2.3892    1.6782    0.0095 C   0  0  0

+   -2.2422    1.2235    0.4454 Cl  0  0  0

+    2.8636    0.4487    0.4276 C   0  0  0

+   -0.4229   -2.3026    0.9687 O   0  0  0

+   -0.6229   -2.1058   -1.1222 O   0  5  0

+    0.6859    2.7057    0.0000 H   0  0  0

+   -1.8645    0.1329    0.0000 H   0  0  0

+   -0.8301   -0.1006    0.0000 H   0  0  0

+    2.4342   -1.5606    0.0000 H   0  0  0

+    2.9861    2.4657    0.0000 H   0  0  0

+    3.8425    0.3131    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7  9  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  7 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99346-49-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+   -4.2424   -0.9427   -0.3564 N   0  0  0

+   -5.1849    0.0173   -0.4567 C   0  0  0

+   -3.0945   -0.6937    0.3014 C   0  0  0

+   -4.9404    1.3255    0.1575 C   0  0  0

+   -6.2254   -0.2003   -1.0495 O   0  0  0

+   -2.8662    0.5050    0.8668 N   0  0  0

+   -2.2515   -1.5659    0.3860 O   0  0  0

+   -3.8166    1.5298    0.7866 N   0  0  0

+    8.3769   -0.9389   -0.0778 C   0  0  0

+    7.3080    0.1498   -0.1916 C   0  0  0

+    9.5237   -0.4218    0.6807 N   0  0  0

+    7.8537    1.2844   -0.8676 O   0  0  0

+   -4.5126   -1.8467    0.0000 H   0  0  0

+   -5.6059    1.9943    0.0000 H   0  0  0

+   -1.9594    0.7655    0.0000 H   0  0  0

+    7.6308   -1.5164    0.0000 H   0  0  0

+    8.8629   -1.7476    0.0000 H   0  0  0

+    6.5105    0.6539    0.0000 H   0  0  0

+    6.7154   -0.5843    0.0000 H   0  0  0

+   10.2896   -0.9728    0.0000 H   0  0  0

+    9.6179    0.5170    0.0000 H   0  0  0

+    8.2626    2.1347    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+  9 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+844-26-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.3496    0.1734    0.9185 C   0  0  0

+   -0.0289    0.2807    2.0106 S   0  0  0

+    1.7856    1.3010    0.2386 C   0  0  0

+    2.0003   -1.0326    0.7433 C   0  0  0

+   -1.3379   -0.0788    0.8872 C   0  0  0

+    0.0811   -0.9729    2.6706 O   0  0  0

+    2.8721    1.2141   -0.6208 C   0  0  0

+    1.1493    2.4897    0.4135 O   0  0  0

+    3.0833   -1.1179   -0.1138 C   0  0  0

+   -2.2250    0.9193    0.5136 C   0  0  0

+   -1.4776   -1.3542    0.3738 C   0  0  0

+    3.5171    0.0041   -0.7972 C   0  0  0

+    3.4201    2.6233   -1.4737 Cl  0  0  0

+    3.8989   -2.6348   -0.3318 Cl  0  0  0

+   -3.2557    0.6335   -0.3717 C   0  0  0

+   -2.0860    2.1757    1.0138 O   0  0  0

+   -2.5049   -1.6375   -0.5082 C   0  0  0

+   -3.3952   -0.6447   -0.8785 C   0  0  0

+   -4.3685    1.8805   -0.8412 Cl  0  0  0

+   -2.6777   -3.2406   -1.1515 Cl  0  0  0

+    1.4545   -1.8707    0.0000 H   0  0  0

+    0.6773    3.3715    0.0000 H   0  0  0

+   -0.7161   -2.0026    0.0000 H   0  0  0

+    4.5154    0.0645    0.0000 H   0  0  0

+   -1.9760    3.1698    0.0000 H   0  0  0

+   -4.3473   -0.9509    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

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+  9 12  2  0

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+  4 21  1  0

+  8 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 16 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25956-17-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 48                          1 V2000

+   -4.2813    0.8386    0.4323 C   0  0  0

+   -5.3885    1.4469    1.0723 C   0  0  0

+   -3.8178   -0.4642    0.9082 C   0  0  0

+   -3.6590    1.4879   -0.6399 C   0  0  0

+   -5.8390    2.6987    0.6200 C   0  0  0

+   -6.0164    0.7900    2.1455 C   0  0  0

+   -2.7582   -1.0815    0.3213 N   0  0  0

+   -4.4878   -1.0602    1.9796 C   0  0  0

+   -4.1256    2.6995   -1.0568 C   0  0  0

+   -5.2070    3.3057   -0.4226 C   0  0  0

+   -5.5737   -0.4211    2.5757 C   0  0  0

+   -1.8048   -1.5569    1.0487 N   0  0  0

+   -4.0795   -2.2687    2.4420 O   0  0  0

+   -5.7756    4.8751   -0.9870 S   0  0  0

+   -0.7410   -2.1766    0.4596 C   0  0  0

+   -5.0532    5.8406   -0.2352 O   0  0  0

+   -5.8024    4.7888   -2.4051 O   0  0  0

+   -7.2278    5.0157   -0.5537 O   0  0  0

+    0.2984   -2.6953    1.2468 C   0  0  0

+   -0.6831   -2.3035   -0.9310 C   0  0  0

+    1.3730   -3.3221    0.6382 C   0  0  0

+    0.2510   -2.5827    2.5990 O   0  0  0

+    0.3946   -2.9307   -1.5194 C   0  0  0

+    1.4205   -3.4358   -0.7387 C   0  0  0

+    1.4362   -3.1991    3.1065 C   0  0  0

+    0.4559   -3.0675   -3.0190 C   0  0  0

+    2.7919   -4.2343   -1.5045 S   0  0  0

+    2.3063   -5.4936   -1.9492 O   0  0  0

+    3.4008   -3.2499   -2.3288 O   0  0  0

+    3.8058   -4.5443   -0.4126 O   0  0  0

+   15.2415    3.1252    0.1884 Na  0  3  0

+   23.5454    5.4938    0.8481 Na  0  3  0

+   -2.7555    1.3064    0.0000 H   0  0  0

+   -6.7363    2.9088    0.0000 H   0  0  0

+   -6.9184    0.9787    0.0000 H   0  0  0

+   -3.4290    3.3028    0.0000 H   0  0  0

+   -6.2817   -1.0110    0.0000 H   0  0  0

+   -3.7845   -3.1418    0.0000 H   0  0  0

+   -1.3662   -2.9221    0.0000 H   0  0  0

+    2.0663   -2.7150    0.0000 H   0  0  0

+    1.0110   -4.0167    0.0000 H   0  0  0

+    2.2538   -3.6243    0.0000 H   0  0  0

+    1.8614   -2.3815    0.0000 H   0  0  0

+   -0.3851   -3.4443    0.0000 H   0  0  0

+    0.8327   -3.9085    0.0000 H   0  0  0

+    1.2969   -2.6907    0.0000 H   0  0  0

+   -8.1451    5.1045    0.0000 H   0  0  0

+    4.6871   -4.8137    0.0000 H   0  0  0

+  1  2  1  0

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+ 26 44  1  0

+ 26 45  1  0

+ 26 46  1  0

+ 18 47  1  0

+ 30 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2415-85-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+   -0.2232   -1.2169    0.1123 N   0  0  0

+   -1.2965   -0.4031    0.0670 C   0  0  0

+    1.0668   -0.6773    0.0586 C   0  0  0

+   -2.6827   -0.9882   -0.0185 C   0  0  0

+   -1.1468    0.8002    0.0951 O   0  0  0

+    2.1690   -1.5170   -0.0308 C   0  0  0

+    1.2470    0.6996    0.0889 C   0  0  0

+   -3.6967    0.1260   -0.0556 C   0  0  0

+    3.4411   -0.9811   -0.0841 C   0  0  0

+    2.5212    1.2290    0.0352 C   0  0  0

+   -5.1665   -0.1955   -0.1414 C   0  0  0

+   -3.3315    1.2764   -0.0166 O   0  0  0

+    3.6174    0.3898   -0.0485 C   0  0  0

+    5.0066    0.9709   -0.1063 C   0  0  0

+   -0.3539   -2.2466    0.0000 H   0  0  0

+   -3.5242   -1.5958    0.0000 H   0  0  0

+   -2.1738   -1.8928    0.0000 H   0  0  0

+    2.0384   -2.5467    0.0000 H   0  0  0

+    0.4230    1.3307    0.0000 H   0  0  0

+    4.2674   -1.6092    0.0000 H   0  0  0

+    2.6555    2.2582    0.0000 H   0  0  0

+   -5.3883    0.8185    0.0000 H   0  0  0

+   -6.1805   -0.4173    0.0000 H   0  0  0

+   -4.9447   -1.2095    0.0000 H   0  0  0

+    5.4071    0.0134    0.0000 H   0  0  0

+    5.9641    1.3714    0.0000 H   0  0  0

+    4.6061    1.9284    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

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+  7  3  1  0

+  8  4  1  0

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+  1 15  1  0

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+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13360-63-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    0.0192   -0.4832    0.0000 C   0  0  0

+   -1.2413    0.3841    0.0000 C   0  0  0

+    1.2076    0.3803    0.0000 N   0  0  0

+   -2.4791   -0.5152    0.0000 C   0  0  0

+    2.3762   -0.5099    0.0000 C   0  0  0

+   -3.7396    0.3520    0.0000 C   0  0  0

+    3.6560    0.3286    0.0000 C   0  0  0

+   -0.7339   -1.3490    0.0000 H   0  0  0

+    0.7943   -1.3293    0.0000 H   0  0  0

+   -0.4882    1.2499    0.0000 H   0  0  0

+   -2.0164    1.2303    0.0000 H   0  0  0

+    1.2206    1.5277    0.0000 H   0  0  0

+   -3.2322   -1.3810    0.0000 H   0  0  0

+   -1.7040   -1.3614    0.0000 H   0  0  0

+    1.5821   -1.3383    0.0000 H   0  0  0

+    3.1095   -1.3925    0.0000 H   0  0  0

+   -3.0892    1.2974    0.0000 H   0  0  0

+   -4.6850    1.0024    0.0000 H   0  0  0

+   -4.3900   -0.5934    0.0000 H   0  0  0

+    4.2849   -0.6312    0.0000 H   0  0  0

+    4.6158    0.9575    0.0000 H   0  0  0

+    3.0271    1.2884    0.0000 H   0  0  0

+  1  2  1  0

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+  6 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  7 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2645-07-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.1870   -0.6494   -0.0045 C   0  0  0

+   -1.1979   -1.6121   -0.0037 C   0  0  0

+   -0.5221    0.7054   -0.0031 C   0  0  0

+    1.2324   -1.0631   -0.0006 C   0  0  0

+   -2.5201   -1.2193   -0.0016 C   0  0  0

+   -1.8487    1.0848   -0.0009 C   0  0  0

+    2.2060   -0.1312   -0.0014 N   0  0  0

+    1.5212   -2.2438    0.0032 O   0  0  0

+   -2.8455    0.1256   -0.0001 C   0  0  0

+    3.6124   -0.5412    0.0024 C   0  0  0

+   -4.2665    0.5399    0.0017 N   0  3  0

+    4.4923    0.6823    0.0007 C   0  0  0

+   -4.5560    1.7230    0.0029 O   0  0  0

+   -5.1464   -0.3023    0.0019 O   0  5  0

+    5.8279    0.5484    0.0036 O   0  0  0

+    3.9955    1.7837   -0.0033 O   0  0  0

+   -0.9555   -2.6195    0.0000 H   0  0  0

+    0.2237    1.4248    0.0000 H   0  0  0

+   -3.2714   -1.9329    0.0000 H   0  0  0

+   -2.0988    2.0903    0.0000 H   0  0  0

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+  6  9  2  0

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+  3 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60692-90-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+   -0.1154   -0.3448   -0.1046 C   0  0  0

+   -0.0182   -1.7190   -0.1918 C   0  0  0

+    1.0786    0.5303   -0.0864 C   0  0  0

+   -1.4015    0.2500   -0.0238 C   0  0  0

+    1.3392   -2.3787   -0.2718 C   0  0  0

+   -1.1609   -2.5147   -0.2068 C   0  0  0

+    2.3697    0.0150   -0.1550 C   0  0  0

+    0.8996    1.9145    0.0029 C   0  0  0

+   -2.5523   -0.5728   -0.0357 C   0  0  0

+   -1.5483    1.6418    0.0681 C   0  0  0

+    2.5826   -1.4771   -0.2520 C   0  0  0

+    2.0685   -2.1026    0.9256 O   0  0  0

+   -2.4049   -1.9671   -0.1366 C   0  0  0

+    3.4587    0.8612   -0.1358 C   0  0  0

+    1.9942    2.7524    0.0214 C   0  0  0

+   -3.8241    0.0210    0.0447 C   0  0  0

+   -2.7956    2.1840    0.1447 C   0  0  0

+    3.2730    2.2297   -0.0475 C   0  0  0

+   -3.9301    1.3753    0.1329 C   0  0  0

+    1.2920   -3.4220    0.0000 H   0  0  0

+   -1.0600   -3.5541    0.0000 H   0  0  0

+   -0.0645    2.3158    0.0000 H   0  0  0

+   -0.7062    2.2595    0.0000 H   0  0  0

+    3.5882   -1.7588    0.0000 H   0  0  0

+   -3.2483   -2.5830    0.0000 H   0  0  0

+    4.4255    0.4664    0.0000 H   0  0  0

+    1.8561    3.7876    0.0000 H   0  0  0

+   -4.6824   -0.5739    0.0000 H   0  0  0

+   -2.9047    3.2226    0.0000 H   0  0  0

+    4.0988    2.8690    0.0000 H   0  0  0

+   -4.8764    1.8170    0.0000 H   0  0  0

+  1  2  2  0

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+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54-31-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -0.0006    1.3294   -0.0334 C   0  0  0

+   -0.6963    0.1090   -0.0316 C   0  0  0

+    1.3974    1.3273   -0.0323 C   0  0  0

+   -0.7392    2.6030   -0.0424 C   0  0  0

+    0.0116   -1.0854   -0.0288 C   0  0  0

+   -2.0847    0.0973   -0.0321 N   0  0  0

+    2.0827    0.1328   -0.0296 C   0  0  0

+   -0.0742    3.7686    0.0831 O   0  0  0

+   -1.9485    2.6033   -0.1630 O   0  0  0

+    1.3930   -1.0710   -0.0279 C   0  0  0

+   -2.8064   -1.1775   -0.0303 C   0  0  0

+    3.8447    0.1334   -0.0283 S   0  0  0

+    2.2713   -2.5684   -0.0238 Cl  0  0  0

+   -4.2903   -0.9147   -0.0313 C   0  0  0

+    4.3390   -0.6540    1.3421 N   0  0  0

+    4.2318   -0.6991   -1.1129 O   0  0  0

+    4.2302    1.4900    0.1456 O   0  0  0

+   -5.0645   -0.7792   -1.1230 C   0  0  0

+   -5.0652   -0.7816    1.0575 O   0  0  0

+   -6.3814   -0.5452   -0.6648 C   0  0  0

+   -6.3339   -0.5553    0.6794 C   0  0  0

+    1.9185    2.2254    0.0000 H   0  0  0

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+   -3.1019   -2.1729    0.0000 H   0  0  0

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+    5.3766   -0.6156    0.0000 H   0  0  0

+   -5.2448   -1.8017    0.0000 H   0  0  0

+   -7.4005   -0.3464    0.0000 H   0  0  0

+   -6.5331   -1.5743    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 15 28  1  0

+ 15 29  1  0

+ 18 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89415-69-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.6688   -0.3331   -0.0007 C   0  0  0

+   -0.6688    0.3331    0.0001 C   0  0  0

+    1.7904    0.4100    0.0002 O   0  0  0

+    0.7433   -1.5433    0.0029 O   0  0  0

+   -1.7904   -0.4100   -0.0008 O   0  0  0

+   -0.7433    1.5433    0.0016 O   0  0  0

+    3.0901   -0.2373   -0.0006 C   0  0  0

+   -3.0901    0.2373    0.0000 C   0  0  0

+    4.1897    0.8266    0.0007 C   0  0  0

+   -4.1897   -0.8266   -0.0012 C   0  0  0

+    5.9495   -0.0498   -0.0004 Br  0  0  0

+   -5.9495    0.0498   -0.0002 Br  0  0  0

+    2.4976   -1.1510    0.0000 H   0  0  0

+    3.9309   -0.9293    0.0000 H   0  0  0

+   -2.4976    1.1510    0.0000 H   0  0  0

+   -3.9309    0.9293    0.0000 H   0  0  0

+    4.7822    1.7403    0.0000 H   0  0  0

+    3.3489    1.5186    0.0000 H   0  0  0

+   -4.7822   -1.7403    0.0000 H   0  0  0

+   -3.3489   -1.5186    0.0000 H   0  0  0

+  2  1  1  0

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+  8 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-87-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+   -1.9174    0.9158    0.3166 C   0  0  0

+   -2.2329   -0.5387    0.3999 C   0  0  0

+   -2.3473    0.1727   -0.8301 O   0  0  0

+   -0.4921    1.3638    0.1369 C   0  0  0

+   -1.1132   -1.5399    0.3657 C   0  0  0

+    0.5250    0.3006    0.5323 C   0  0  0

+    0.1751   -0.9855   -0.2288 C   0  0  0

+    1.9277    0.7635    0.1336 C   0  0  0

+    2.9491   -0.3042    0.5306 C   0  0  0

+    2.4815   -0.1543   -0.8114 O   0  0  0

+   -2.5912    1.7569    0.0000 H   0  0  0

+   -3.1785   -1.0557    0.0000 H   0  0  0

+    0.3910    1.9815    0.0000 H   0  0  0

+   -0.9681    2.3307    0.0000 H   0  0  0

+   -1.9401   -2.2311    0.0000 H   0  0  0

+   -0.5487   -2.4579    0.0000 H   0  0  0

+    1.3070   -0.4409    0.0000 H   0  0  0

+    0.3706   -2.0453    0.0000 H   0  0  0

+    1.2519   -1.0304    0.0000 H   0  0  0

+    2.1885    1.8092    0.0000 H   0  0  0

+    3.0004   -1.3807    0.0000 H   0  0  0

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+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26921-17-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 57                          1 V2000

+   -4.7646   -2.6655   -0.2863 C   0  0  0

+   -5.3834   -1.4423   -0.4710 C   0  0  0

+   -3.6855   -2.8078    0.5953 N   0  0  0

+   -5.2314   -3.6932   -0.9663 N   0  0  0

+   -4.9661   -0.3332    0.1971 O   0  0  0

+   -6.3910   -1.3905   -1.3164 N   0  0  0

+   -2.5697   -3.3544   -0.1880 C   0  0  0

+   -4.0665   -3.8432    1.5651 C   0  0  0

+   -6.5141   -3.0053   -1.8614 S   0  0  0

+   -5.8092    0.7422   -0.2207 C   0  0  0

+   -1.4091   -3.6985    0.7465 C   0  0  0

+   -2.8685   -4.1751    2.4557 C   0  0  0

+   -5.3909    2.0268    0.4975 C   0  0  2

+   -1.8131   -4.7167    1.6618 O   0  0  0

+   -6.2936    3.1783    0.0502 C   0  0  0

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+   -5.5300    6.5436    0.0000 H   0  0  0

+   -6.1806    7.6904    0.0000 H   0  0  0

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+   12.0567    0.3761    0.0000 H   0  0  0

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+ 22 54  1  0

+ 23 55  1  0

+ 26 56  1  0

+ 28 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99520-58-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 40                          1 V2000

+    0.0159   -0.5050    0.0029 C   0  0  0

+   -1.3542   -0.6938    0.0020 C   0  0  0

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+   -3.2747   -2.1604   -0.0007 C   0  0  0

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+   -4.0866   -1.0715   -0.0018 C   0  0  0

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+   -3.8210    2.6414   -0.0010 C   0  0  0

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+   -1.2994   -4.0474    0.0000 H   0  0  0

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+ 19 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60564-31-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.6426   -0.4610    0.0267 C   0  0  0

+   -2.1170   -0.4365    0.0229 C   0  0  0

+   -0.2218    0.8740   -0.0562 C   0  0  0

+    0.2975   -1.4867    0.0974 C   0  0  0

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+   -3.0919   -1.4297    0.0835 C   0  0  0

+   -1.3459    1.6833   -0.1086 N   0  0  0

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+   -3.8451    1.2426   -0.0856 C   0  0  0

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+    2.0635    0.1432   -0.0061 C   0  0  0

+    2.5963   -2.2097    0.1501 N   0  0  0

+   -4.7990    0.2499   -0.0256 C   0  0  0

+    3.5094    0.4599   -0.0237 N   0  3  0

+    3.9752    1.2258    0.8009 O   0  0  0

+    4.2333   -0.0454   -0.8628 O   0  5  0

+   -0.0142   -2.4813    0.0000 H   0  0  0

+   -2.8138   -2.4342    0.0000 H   0  0  0

+   -1.3291    2.7254    0.0000 H   0  0  0

+    1.4602    2.1544    0.0000 H   0  0  0

+   -4.1360    2.2435    0.0000 H   0  0  0

+   -5.1553   -1.8266    0.0000 H   0  0  0

+    2.2869   -3.2050    0.0000 H   0  0  0

+    3.6129   -1.9800    0.0000 H   0  0  0

+   -5.8099    0.5038    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+  9 13  1  0

+ 10 14  2  0

+ 12 15  1  0

+ 15 16  2  0

+ 15 17  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 14  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+746-53-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.7431    0.1502   -0.0020 C   0  0  0

+   -0.7431    0.1503   -0.0017 C   0  0  0

+    1.1920    1.4811   -0.0002 C   0  0  0

+    1.6690   -0.8837    0.0013 C   0  0  0

+   -1.1920    1.4812    0.0005 C   0  0  0

+   -1.6690   -0.8837   -0.0030 C   0  0  0

+    0.0000    2.3619    0.0014 C   0  0  0

+    2.5554    1.7524    0.0002 C   0  0  0

+    3.0256   -0.5999   -0.0001 C   0  0  0

+    1.2075   -2.2901    0.0070 N   0  3  0

+   -2.5554    1.7525    0.0006 C   0  0  0

+   -3.0256   -0.5998   -0.0017 C   0  0  0

+   -1.2075   -2.2901   -0.0052 N   0  3  0

+    0.0000    3.5762    0.0032 O   0  0  0

+    3.4665    0.7094   -0.0012 C   0  0  0

+    1.0077   -2.8613    1.0640 O   0  0  0

+    1.0274   -2.8762   -1.0455 O   0  5  0

+   -3.4665    0.7094   -0.0014 C   0  0  0

+   -1.0077   -2.8638   -1.0609 O   0  0  0

+   -1.0274   -2.8737    1.0486 O   0  5  0

+    4.9182    0.9985   -0.0013 N   0  3  0

+   -4.9182    0.9985   -0.0008 N   0  3  0

+    5.7215    0.0830   -0.0025 O   0  0  0

+    5.3094    2.1520   -0.0001 O   0  5  0

+   -5.7215    0.0830   -0.0025 O   0  0  0

+   -5.3094    2.1520    0.0015 O   0  5  0

+    2.8905    2.7364    0.0000 H   0  0  0

+    3.7158   -1.3772    0.0000 H   0  0  0

+   -2.8905    2.7365    0.0000 H   0  0  0

+   -3.7158   -1.3771    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  6 13  1  0

+  7 14  2  0

+  8 15  2  0

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+ 10 17  1  0

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+ 13 19  2  0

+ 13 20  1  0

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+ 18 22  1  0

+ 21 23  2  0

+ 21 24  1  0

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+ 22 26  1  0

+  5  7  1  0

+  9 15  1  0

+ 12 18  1  0

+  8 27  1  0

+  9 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6673-35-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 41                          1 V2000

+   -0.8447   -0.6527   -0.4912 C   0  0  0

+   -1.9596   -1.4321   -0.7644 C   0  0  0

+   -0.9976    0.6855   -0.1598 C   0  0  0

+    0.3978   -1.2023   -0.5429 O   0  0  0

+   -3.2220   -0.8760   -0.7066 C   0  0  0

+   -2.2598    1.2430   -0.1017 C   0  0  0

+    1.3231   -0.1630   -0.2176 C   0  0  0

+   -3.3757    0.4637   -0.3749 C   0  0  0

+    2.7483   -0.7180   -0.2578 C   0  0  0

+   -4.6565    1.0286   -0.3161 N   0  0  0

+    3.7389    0.3948    0.0904 C   0  0  0

+    2.8727   -1.7803    0.6898 O   0  0  0

+   -5.6025    0.4736    0.4671 C   0  0  0

+    5.1073   -0.1380    0.0518 N   0  0  0

+   -7.0135    1.0020    0.4340 C   0  0  0

+   -5.3183   -0.4513    1.1986 O   0  0  0

+    6.0034    0.9747    0.3935 C   0  0  0

+    7.2523    0.4288    1.0885 C   0  0  0

+    6.4116    1.7115   -0.8838 C   0  0  0

+   -1.8600   -2.4495    0.0000 H   0  0  0

+   -0.1742    1.2913    0.0000 H   0  0  0

+   -4.0450   -1.4824    0.0000 H   0  0  0

+   -2.3587    2.2605    0.0000 H   0  0  0

+    1.8042    0.7389    0.0000 H   0  0  0

+    0.4845    0.4216    0.0000 H   0  0  0

+    3.7232   -1.0254    0.0000 H   0  0  0

+   -4.7153    2.0492    0.0000 H   0  0  0

+    4.2200    1.2968    0.0000 H   0  0  0

+    2.9002    0.9793    0.0000 H   0  0  0

+    2.9916   -2.7956    0.0000 H   0  0  0

+    5.3708   -1.1257    0.0000 H   0  0  0

+   -6.6550    1.9593    0.0000 H   0  0  0

+   -7.9708    1.3605    0.0000 H   0  0  0

+   -7.3720    0.0447    0.0000 H   0  0  0

+    5.1551    1.5451    0.0000 H   0  0  0

+    6.8429   -0.5079    0.0000 H   0  0  0

+    8.1890    0.0194    0.0000 H   0  0  0

+    7.6617    1.3655    0.0000 H   0  0  0

+    7.3058    1.2161    0.0000 H   0  0  0

+    6.9070    2.6057    0.0000 H   0  0  0

+    5.5174    2.2069    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

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+  6  8  2  0

+  2 20  1  0

+  3 21  1  0

+  5 22  1  0

+  6 23  1  0

+  7 24  1  0

+  7 25  1  0

+  9 26  1  0

+ 10 27  1  0

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+ 12 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 15 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93261-88-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -0.4801   -0.2794   -0.0024 C   0  0  0

+   -1.6342    0.5501   -0.0291 C   0  0  0

+    0.6137    0.5814   -0.0068 C   0  0  0

+   -0.4482   -1.7584    0.0301 C   0  0  0

+   -1.1936    1.8378   -0.0479 C   0  0  0

+   -3.0475    0.0988   -0.0349 C   0  0  0

+    0.1440    1.8469   -0.0345 O   0  0  0

+    1.9697    0.2000    0.0146 C   0  0  0

+    0.1782   -2.4685   -0.9953 C   0  0  0

+   -1.0390   -2.4489    1.0889 C   0  0  0

+   -2.0584    3.0389   -0.0792 N   0  3  0

+   -3.9075    0.4793    0.9937 C   0  0  0

+   -3.5215   -0.7022   -1.0717 C   0  0  0

+    3.0486    1.2521    0.0064 C   0  0  0

+    2.2693   -0.9772    0.0396 O   0  0  0

+    0.2049   -3.8472   -0.9589 C   0  0  0

+   -1.0053   -3.8280    1.1135 C   0  0  0

+   -1.5581    4.1493   -0.0941 O   0  0  0

+   -3.2702    2.9168   -0.0900 O   0  5  0

+   -5.2210    0.0567    0.9833 C   0  0  0

+   -4.8374   -1.1192   -1.0720 C   0  0  0

+    4.8117    0.3830    0.0412 Br  0  0  0

+   -0.3875   -4.5262    0.0913 C   0  0  0

+   -5.6848   -0.7433   -0.0457 C   0  0  0

+    1.1256   -2.0998    0.0000 H   0  0  0

+   -1.9968   -2.1083    0.0000 H   0  0  0

+   -3.8540    1.4945    0.0000 H   0  0  0

+   -2.8889   -1.4980    0.0000 H   0  0  0

+    3.5983    2.1072    0.0000 H   0  0  0

+    2.2611    1.8950    0.0000 H   0  0  0

+    1.1602   -4.1948    0.0000 H   0  0  0

+   -1.9514   -4.1998    0.0000 H   0  0  0

+   -5.8589    0.8482    0.0000 H   0  0  0

+   -4.8936   -2.1342    0.0000 H   0  0  0

+   -0.3839   -5.5428    0.0000 H   0  0  0

+   -6.6517   -1.0572    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  5  7  1  0

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+ 13 28  1  0

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+ 16 31  1  0

+ 17 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 23 35  1  0

+ 24 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88598-56-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+    0.5829   -0.6558    0.0005 C   0  0  0

+   -0.8144   -0.8097   -0.0101 C   0  0  0

+    1.1463    0.6365    0.0131 C   0  0  0

+    1.4148   -1.7977   -0.0073 C   0  0  0

+   -1.6433    0.3344   -0.0087 C   0  0  0

+   -1.3758   -2.1063   -0.0227 C   0  0  0

+    2.5434    0.7792    0.0237 C   0  0  0

+    0.2929    1.7676    0.0154 C   0  0  0

+    2.7958   -1.6153    0.0051 C   0  0  0

+    0.8253   -3.0856   -0.0265 C   0  0  0

+   -3.0297    0.1607   -0.0193 C   0  0  0

+   -1.0517    1.6211    0.0029 C   0  0  0

+   -0.5190   -3.2342   -0.0255 C   0  0  0

+   -2.7665   -2.2370   -0.0329 C   0  0  0

+    3.3473   -0.3388    0.0256 C   0  0  0

+    3.0982    2.1800    0.0246 C   0  0  0

+   -3.5682   -1.1114   -0.0310 C   0  0  0

+   -3.9228    1.3416   -0.0175 N   0  3  0

+    4.8527   -0.2470    0.0478 C   0  0  0

+    4.5601    2.1810    0.4653 C   0  0  0

+   -4.8723    1.3859    0.7442 O   0  0  0

+   -3.7081    2.2687   -0.7777 O   0  5  0

+    5.3158    1.1447   -0.3751 C   0  0  0

+    0.7112    2.7354    0.0000 H   0  0  0

+    3.4315   -2.4564    0.0000 H   0  0  0

+    1.4429   -3.9401    0.0000 H   0  0  0

+   -1.6679    2.4766    0.0000 H   0  0  0

+   -0.9349   -4.2030    0.0000 H   0  0  0

+   -3.2051   -3.1957    0.0000 H   0  0  0

+    3.2299    3.2261    0.0000 H   0  0  0

+    2.0770    2.4420    0.0000 H   0  0  0

+   -4.6162   -1.2263    0.0000 H   0  0  0

+    4.7827   -1.2990    0.0000 H   0  0  0

+    5.8873   -0.4501    0.0000 H   0  0  0

+    5.5227    2.6112    0.0000 H   0  0  0

+    4.3398    3.2120    0.0000 H   0  0  0

+    6.2267    0.6138    0.0000 H   0  0  0

+    6.0222    1.9274    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

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+ 11 17  2  0

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+  8 12  2  0

+  9 15  1  0

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+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 23 37  1  0

+ 23 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+420-46-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.0000    0.0000   -0.1013 C   0  0  0

+    0.0000    0.0000   -1.6313 C   0  0  0

+   -0.0125    1.3189    0.3651 F   0  0  0

+   -1.1360   -0.6703    0.3651 F   0  0  0

+    1.1485   -0.6486    0.3651 F   0  0  0

+    0.0000    0.9892    0.0000 H   0  0  0

+   -0.9892    0.0000    0.0000 H   0  0  0

+    0.0000   -0.9892    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+832-69-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    1.0321   -0.3925   -0.0015 C   0  0  0

+   -0.4201   -0.5894   -0.0011 C   0  0  0

+    1.5382    0.9271   -0.0008 C   0  0  0

+    1.9166   -1.4728    0.0033 C   0  0  0

+   -1.2592    0.5480   -0.0001 C   0  0  0

+   -0.9852   -1.8661   -0.0014 C   0  0  0

+    0.6455    2.0238    0.0007 C   0  0  0

+    2.9260    1.1269   -0.0011 C   0  0  0

+    3.2632   -1.2449    0.0027 C   0  0  0

+   -0.6907    1.8426    0.0001 C   0  0  0

+   -2.6502    0.3711    0.0003 C   0  0  0

+   -2.3438   -2.0050   -0.0006 C   0  0  0

+    3.7648    0.0513   -0.0021 C   0  0  0

+   -3.1724   -0.8890   -0.0004 C   0  0  0

+   -3.5649    1.5688    0.0019 C   0  0  0

+    1.5491   -2.4534    0.0000 H   0  0  0

+   -0.3700   -2.7135    0.0000 H   0  0  0

+    1.0304    2.9976    0.0000 H   0  0  0

+    3.3171    2.0983    0.0000 H   0  0  0

+    3.9254   -2.0561    0.0000 H   0  0  0

+   -1.3210    2.6788    0.0000 H   0  0  0

+   -2.7661   -2.9632    0.0000 H   0  0  0

+    4.8007    0.2042    0.0000 H   0  0  0

+   -4.2117   -1.0174    0.0000 H   0  0  0

+   -2.7327    2.2044    0.0000 H   0  0  0

+   -4.2005    2.4010    0.0000 H   0  0  0

+   -4.3971    0.9332    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+124-19-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    0.7417   -0.3449   -0.1483 C   0  0  0

+   -0.4927    0.5524   -0.0391 C   0  0  0

+    2.0028    0.4943    0.0673 C   0  0  0

+   -1.7538   -0.2868   -0.2548 C   0  0  0

+    3.2372   -0.4030   -0.0419 C   0  0  0

+   -2.9883    0.6105   -0.1455 C   0  0  0

+    4.4983    0.4361    0.1737 C   0  0  0

+   -4.2304   -0.2160   -0.3579 C   0  0  0

+    5.7328   -0.4611    0.0645 C   0  0  0

+   -5.0649   -0.2863    0.5120 O   0  0  0

+   -0.0301   -1.1786    0.0000 H   0  0  0

+    1.4784   -1.2098    0.0000 H   0  0  0

+    0.2791    1.3861    0.0000 H   0  0  0

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+    2.7746    1.3280    0.0000 H   0  0  0

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+    3.7616    1.3010    0.0000 H   0  0  0

+   -3.8563   -1.2887    0.0000 H   0  0  0

+    5.0649   -1.3801    0.0000 H   0  0  0

+    6.6518   -1.1290    0.0000 H   0  0  0

+    6.4007    0.4579    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  2  0

+  1 11  1  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  4 18  1  0

+  5 19  1  0

+  5 20  1  0

+  6 21  1  0

+  6 22  1  0

+  7 23  1  0

+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+  9 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122033-85-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+   -0.3141   -0.2410   -0.0205 C   0  0  0

+   -1.1869   -1.3706   -0.4715 C   0  0  2

+    1.0849   -0.3824    0.0423 C   0  0  0

+   -0.8636    0.9423    0.3763 C   0  0  0

+   -2.6392   -1.0529   -0.7774 C   0  0  1

+   -2.2372   -1.6777    0.4417 O   0  0  0

+    1.8806    0.7963    0.0921 C   0  0  0

+    1.7594   -1.6089    0.1275 C   0  0  0

+   -2.3531    1.0946    0.5057 C   0  0  1

+   -0.0635    2.0630    0.6193 C   0  0  0

+   -3.0701    0.3893   -0.6280 C   0  0  1

+    1.2833    2.0142    0.4509 C   0  0  0

+    3.2458    0.7218   -0.2287 C   0  0  0

+    3.0971   -1.6591   -0.1435 C   0  0  0

+    1.0863   -2.8753    0.5901 C   0  0  0

+   -2.7927    0.5928    1.7665 O   0  0  0

+   -2.8572    1.0905   -1.8546 O   0  0  0

+    3.8350   -0.4986   -0.3593 C   0  0  0

+    4.0513    1.9792   -0.4276 C   0  0  0

+   -0.6073   -2.2201    0.0000 H   0  0  0

+   -3.5736   -1.4826    0.0000 H   0  0  0

+   -2.6938    2.0650    0.0000 H   0  0  0

+   -0.5176    2.9858    0.0000 H   0  0  0

+   -4.0985    0.3916    0.0000 H   0  0  0

+    1.8430    2.8770    0.0000 H   0  0  0

+    3.5752   -2.5697    0.0000 H   0  0  0

+    0.1782   -2.3926    0.0000 H   0  0  0

+    0.6036   -3.7834    0.0000 H   0  0  0

+    1.9944   -3.3580    0.0000 H   0  0  0

+   -3.4704   -0.1808    0.0000 H   0  0  0

+   -2.5584    2.0746    0.0000 H   0  0  0

+    4.8617   -0.5585    0.0000 H   0  0  0

+    4.9173    1.4245    0.0000 H   0  0  0

+    4.6060    2.8452    0.0000 H   0  0  0

+    3.1853    2.5339    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  7 12  1  0

+  7 13  1  0

+  8 14  2  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 13 18  2  0

+ 13 19  1  0

+  5  6  1  0

+  9 11  1  0

+ 10 12  2  0

+ 14 18  1  0

+  2 20  1  0

+  5 21  1  0

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+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2798-25-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.7779    0.7934    0.2503 C   0  0  0

+   -0.7952   -0.6081    0.1683 C   0  0  0

+    0.3294    1.5078    0.4756 O   0  0  0

+   -1.9879    1.4726    0.1070 C   0  0  0

+    0.4940   -1.3238    0.2478 C   0  0  0

+   -1.9945   -1.3107    0.0029 C   0  0  0

+    1.4993    0.9317    0.1774 C   0  0  0

+   -3.1692    0.7773   -0.0806 C   0  0  0

+    1.6764   -0.4537    0.0648 C   0  0  0

+    0.5764   -2.5227    0.4458 O   0  0  0

+   -3.1814   -0.6124   -0.1262 C   0  0  0

+   -1.9927   -2.6670   -0.0311 O   0  0  0

+    2.6141    1.7549   -0.0316 C   0  0  0

+   -4.3329    1.4614   -0.2216 O   0  0  0

+    2.9311   -1.0028   -0.2161 C   0  0  0

+    3.8476    1.2072   -0.3216 C   0  0  0

+    2.4795    3.1063    0.0525 O   0  0  0

+   -5.3651    0.4888   -0.3971 C   0  0  0

+    4.0157   -0.1645   -0.4114 C   0  0  0

+    3.0852   -2.3493   -0.2963 O   0  0  0

+   -1.9985    2.5030    0.0000 H   0  0  0

+   -4.0781   -1.1200    0.0000 H   0  0  0

+   -1.9913   -3.6975    0.0000 H   0  0  0

+    4.6757    1.8205    0.0000 H   0  0  0

+    2.3774    4.1317    0.0000 H   0  0  0

+   -6.0718    1.2388    0.0000 H   0  0  0

+   -6.1151   -0.2179    0.0000 H   0  0  0

+   -4.6584   -0.2612    0.0000 H   0  0  0

+    4.9666   -0.5614    0.0000 H   0  0  0

+    3.2024   -3.3731    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 13 16  2  0

+ 13 17  1  0

+ 14 18  1  0

+ 15 19  2  0

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+  7  9  2  0

+  8 11  1  0

+ 16 19  1  0

+  4 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-52-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    0.7420   -0.0002   -0.0019 C   0  0  0

+   -0.7420    0.0003   -0.0021 C   0  0  0

+    1.4414    1.1330   -0.4113 C   0  0  0

+    1.4409   -1.1321    0.4131 C   0  0  0

+   -1.4414   -1.1329   -0.4115 C   0  0  0

+   -1.4410    1.1322    0.4129 C   0  0  0

+    2.8218    1.1271   -0.4092 C   0  0  0

+    2.8209   -1.1270    0.4112 C   0  0  0

+   -2.8217   -1.1272   -0.4092 C   0  0  0

+   -2.8209    1.1269    0.4112 C   0  0  0

+    3.5104   -0.0010   -0.0017 C   0  0  0

+   -3.5104    0.0007   -0.0014 C   0  0  0

+    0.9566    2.0062    0.0000 H   0  0  0

+    0.9560   -2.0052    0.0000 H   0  0  0

+   -0.9566   -2.0061    0.0000 H   0  0  0

+   -0.9562    2.0054    0.0000 H   0  0  0

+    3.3124    1.9970    0.0000 H   0  0  0

+    3.3107   -1.9974    0.0000 H   0  0  0

+   -3.3122   -1.9972    0.0000 H   0  0  0

+   -3.3108    1.9973    0.0000 H   0  0  0

+    4.5091   -0.0017    0.0000 H   0  0  0

+   -4.5091    0.0013    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  9 12  2  0

+  8 11  1  0

+ 10 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88-16-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.3108   -0.5073   -0.0005 C   0  0  0

+   -1.8127   -1.8131   -0.0014 F   0  0  0

+   -1.7598    0.1657   -1.1418 F   0  0  0

+   -1.7583    0.1636    1.1427 F   0  0  0

+    0.1957   -0.5481   -0.0016 C   0  0  0

+    0.9197    0.6306   -0.0009 C   0  0  0

+    0.8543   -1.7635    0.0026 C   0  0  0

+    0.0933    2.1573    0.0011 Cl  0  0  0

+    2.3029    0.5923   -0.0014 C   0  0  0

+    2.2360   -1.8011    0.0021 C   0  0  0

+    2.9602   -0.6233   -0.0026 C   0  0  0

+    0.3117   -2.6472    0.0000 H   0  0  0

+    2.8461    1.4756    0.0000 H   0  0  0

+    2.7296   -2.7130    0.0000 H   0  0  0

+    3.9968   -0.6521    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  1  1  0

+  6  5  2  0

+  7  5  1  0

+  8  6  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  9  2  0

+ 10 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 11 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-83-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    1.2960    0.1540    0.8321 C   0  0  0

+    0.0000    0.0001    0.0786 C   0  0  0

+    2.4658    0.1233   -0.1536 C   0  0  0

+   -1.2960   -0.1541    0.8321 C   0  0  0

+    0.0000    0.0003   -1.1290 O   0  0  0

+    3.6401    0.9160    0.4238 C   0  0  0

+    2.8957   -1.3260   -0.3897 C   0  0  0

+   -2.4657   -0.1233   -0.1536 C   0  0  0

+   -3.6399   -0.9164    0.4235 C   0  0  0

+   -2.8960    1.3260   -0.3892 C   0  0  0

+    1.7667    1.0122    0.0000 H   0  0  0

+    0.7484    0.9654    0.0000 H   0  0  0

+    2.1917    1.0630    0.0000 H   0  0  0

+   -1.7667   -1.0123    0.0000 H   0  0  0

+   -0.7483   -0.9654    0.0000 H   0  0  0

+    4.1878    0.1047    0.0000 H   0  0  0

+    4.4514    1.4637    0.0000 H   0  0  0

+    3.0924    1.7273    0.0000 H   0  0  0

+    1.9573   -1.6044    0.0000 H   0  0  0

+    3.1741   -2.2644    0.0000 H   0  0  0

+    3.8341   -1.0476    0.0000 H   0  0  0

+   -2.1916   -1.0630    0.0000 H   0  0  0

+   -4.1878   -0.1052    0.0000 H   0  0  0

+   -4.4511   -1.4643    0.0000 H   0  0  0

+   -3.0920   -1.7276    0.0000 H   0  0  0

+   -1.9576    1.6046    0.0000 H   0  0  0

+   -3.1746    2.2644    0.0000 H   0  0  0

+   -3.8344    1.0474    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  8  9  1  0

+  8 10  1  0

+  1 11  1  0

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+  4 14  1  0

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+  7 19  1  0

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+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99601-30-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.4129    0.5496   -0.0495 C   0  0  0

+   -1.1841   -0.6078   -0.1834 C   0  0  0

+    1.0414    0.4222    0.0034 C   0  0  0

+   -1.2630    1.6005   -0.0014 N   0  0  0

+   -2.5033   -0.1889   -0.2052 N   0  0  0

+   -0.5708   -1.8605   -0.2647 C   0  0  0

+    1.6151   -0.8709   -0.0831 C   0  0  0

+    1.8285    1.4894    0.1293 N   0  0  0

+   -2.4983    1.1703   -0.0962 C   0  0  0

+   -3.6848   -1.0459   -0.3312 C   0  0  0

+    0.7786   -1.9952   -0.2171 C   0  0  0

+    2.9448   -1.0026   -0.0361 N   0  0  0

+    3.1345    1.3350    0.1724 C   0  0  0

+   -3.6220    1.9706   -0.0822 N   0  0  0

+   -4.0711   -1.5877    1.0465 C   0  0  0

+    3.7021    0.0646    0.0894 C   0  0  0

+    5.2005   -0.0869    0.1421 C   0  0  0

+   -1.1614   -2.7100    0.0000 H   0  0  0

+   -3.9024   -0.0344    0.0000 H   0  0  0

+   -4.6981   -0.8365    0.0000 H   0  0  0

+    1.1965   -2.9417    0.0000 H   0  0  0

+    3.7475    2.1685    0.0000 H   0  0  0

+   -3.5236    3.0006    0.0000 H   0  0  0

+   -4.5632    1.5408    0.0000 H   0  0  0

+   -4.9136   -0.9870    0.0000 H   0  0  0

+   -4.6718   -2.4302    0.0000 H   0  0  0

+   -3.2286   -2.1884    0.0000 H   0  0  0

+    5.0964   -1.1163    0.0000 H   0  0  0

+    6.2299   -0.1910    0.0000 H   0  0  0

+    5.3046    0.9425    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

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+ 12 16  2  0

+ 16 17  1  0

+  5  9  1  0

+  7 11  1  0

+ 13 16  1  0

+  6 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 14 23  1  0

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+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91134-58-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+   -1.4009    0.0120   -0.0399 C   0  0  0

+   -2.5717   -0.6496    0.0726 O   0  0  0

+   -1.6879    1.3521   -0.2017 C   0  0  0

+   -0.1093   -0.5647    0.0060 C   0  0  0

+   -3.5862    0.2218   -0.0120 C   0  0  0

+   -3.0859    1.4661   -0.1813 C   0  0  0

+    0.9901    0.2216   -0.1210 C   0  0  0

+   -5.0238   -0.1229    0.0676 N   0  3  0

+    2.2795   -0.3541   -0.0752 C   0  0  0

+   -5.8658    0.7527   -0.0219 O   0  0  0

+   -5.3645   -1.2819    0.2226 O   0  5  0

+    3.3727    0.4278   -0.2016 O   0  0  0

+    2.4047   -1.5550    0.0782 O   0  0  0

+    4.5093   -0.4341   -0.1151 C   0  0  0

+    5.7887    0.3937   -0.2516 C   0  0  0

+    5.8479    1.4301    0.8723 C   0  0  0

+    7.0055   -0.5291   -0.1590 C   0  0  0

+   -1.0190    2.1138    0.0000 H   0  0  0

+   -0.0076   -1.5733    0.0000 H   0  0  0

+   -3.6188    2.3284    0.0000 H   0  0  0

+    0.8884    1.2302    0.0000 H   0  0  0

+    3.8075   -1.1656    0.0000 H   0  0  0

+    5.1547   -1.2158    0.0000 H   0  0  0

+    4.9124    0.9034    0.0000 H   0  0  0

+    6.8600    1.3723    0.0000 H   0  0  0

+    5.9057    2.4422    0.0000 H   0  0  0

+    4.8358    1.4879    0.0000 H   0  0  0

+    6.3929   -1.3368    0.0000 H   0  0  0

+    7.8132   -1.1417    0.0000 H   0  0  0

+    7.6181    0.2786    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

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+ 12 14  1  0

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+  5  6  2  0

+  3 18  1  0

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+ 14 22  1  0

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+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122-40-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+    1.8564   -0.2475   -0.4019 C   0  0  0

+    0.9690   -1.3198   -0.8757 C   0  0  0

+    2.4139   -0.3108    0.8798 C   0  0  0

+    2.1525    0.8392   -1.2326 C   0  0  0

+   -0.1751   -1.5963   -0.2074 C   0  0  0

+    3.2455    0.6987    1.3164 C   0  0  0

+    2.9857    1.8401   -0.7810 C   0  0  0

+   -0.8884   -0.5053    0.5489 C   0  0  0

+   -0.6996   -2.9053   -0.2188 C   0  0  0

+    3.5291    1.7725    0.4906 C   0  0  0

+   -1.9391    0.1400   -0.3569 C   0  0  0

+   -1.7261   -3.1534    0.3809 O   0  0  0

+   -2.7470    1.1612    0.4464 C   0  0  0

+   -3.7977    1.8066   -0.4594 C   0  0  0

+   -4.6056    2.8278    0.3440 C   0  0  0

+    1.4589   -2.1042    0.0000 H   0  0  0

+    2.7607   -1.1682    0.0000 H   0  0  0

+    1.3322    1.2664    0.0000 H   0  0  0

+    4.0685    0.2769    0.0000 H   0  0  0

+    2.6458    2.7002    0.0000 H   0  0  0

+    0.0175   -0.3194    0.0000 H   0  0  0

+   -0.7281    0.4055    0.0000 H   0  0  0

+   -0.0944   -3.6046    0.0000 H   0  0  0

+    4.2953    2.2904    0.0000 H   0  0  0

+   -2.8322   -0.1001    0.0000 H   0  0  0

+   -2.0719   -0.7752    0.0000 H   0  0  0

+   -1.8539    1.4013    0.0000 H   0  0  0

+   -2.6142    2.0764    0.0000 H   0  0  0

+   -4.6908    1.5665    0.0000 H   0  0  0

+   -3.9305    0.8914    0.0000 H   0  0  0

+   -3.8803    3.4016    0.0000 H   0  0  0

+   -5.1794    3.5531    0.0000 H   0  0  0

+   -5.3309    2.2540    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

+  8 11  1  0

+  9 12  2  0

+ 11 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+  7 10  1  0

+  2 16  1  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2491-06-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 16                          1 V2000

+   -2.4012   -0.9855    0.0774 C   0  0  0

+   -2.9465    0.2912    0.6637 C   0  0  0

+   -1.2428   -1.4907    0.5299 O   0  0  0

+   -3.0091   -1.5570   -0.7965 O   0  0  0

+   -4.1304    0.7128   -0.0971 N   0  0  0

+   -5.0078    1.4202    0.8452 C   0  0  0

+   -3.6712    1.7082   -1.0750 C   0  0  0

+    8.3035    0.2693   -0.0145 Cl  0  0  0

+   -2.0633    0.4293    0.0000 H   0  0  0

+   -2.8630    1.1812    0.0000 H   0  0  0

+   -0.4234   -1.8480    0.0000 H   0  0  0

+   -4.4467    2.1161    0.0000 H   0  0  0

+   -5.7037    1.9813    0.0000 H   0  0  0

+   -5.5689    0.7243    0.0000 H   0  0  0

+   -2.8595    1.3337    0.0000 H   0  0  0

+   -3.2967    2.5199    0.0000 H   0  0  0

+   -4.4829    2.0827    0.0000 H   0  0  0

+    9.1974    0.2693    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  5  7  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3416-21-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 43                          1 V2000

+    0.2556   -0.9443    0.1496 C   0  0  0

+    1.1911   -2.1258    0.2524 C   0  0  0

+    0.7736    0.3597    0.0641 C   0  0  0

+   -1.0864   -1.1615    0.1355 C   0  0  0

+    2.7021   -1.8529    0.2543 C   0  0  0

+    1.9864   -2.2033   -0.9321 O   0  0  0

+    2.2373    0.6119    0.0634 C   0  0  0

+   -0.0709    1.4627   -0.0236 C   0  0  0

+   -1.9330   -0.0604    0.0462 C   0  0  0

+   -1.9551   -2.3952    0.1961 C   0  0  0

+    3.1644   -0.4191    0.1526 C   0  0  0

+    2.6891    1.9317   -0.0305 C   0  0  0

+   -1.4571    1.2612   -0.0304 C   0  0  0

+   -3.2882   -0.3722    0.0386 C   0  0  0

+   -3.4071   -1.8740    0.1308 C   0  0  0

+    4.5171   -0.1409    0.1479 C   0  0  0

+    4.0410    2.2007   -0.0340 C   0  0  0

+   -2.4054    2.2960   -0.1124 C   0  0  0

+   -4.1802    0.6536   -0.0439 C   0  0  0

+    4.9563    1.1670    0.0546 C   0  0  0

+   -3.7316    1.9748   -0.1138 C   0  0  0

+   -5.6587    0.3623   -0.0557 C   0  0  0

+    0.6903   -3.0444    0.0000 H   0  0  0

+    3.4930   -2.5378    0.0000 H   0  0  0

+    0.3235    2.4318    0.0000 H   0  0  0

+   -2.3953   -3.3443    0.0000 H   0  0  0

+   -1.0492   -2.9186    0.0000 H   0  0  0

+    2.0003    2.7192    0.0000 H   0  0  0

+   -4.4387   -1.6995    0.0000 H   0  0  0

+   -3.6721   -2.8861    0.0000 H   0  0  0

+    5.2108   -0.9241    0.0000 H   0  0  0

+    4.3749    3.1922    0.0000 H   0  0  0

+   -2.1005    3.2968    0.0000 H   0  0  0

+    5.9816    1.3752    0.0000 H   0  0  0

+   -4.4375    2.7470    0.0000 H   0  0  0

+   -5.8609    1.3888    0.0000 H   0  0  0

+   -6.6852    0.1601    0.0000 H   0  0  0

+   -5.4565   -0.6642    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 12 17  2  0

+ 13 18  1  0

+ 14 19  2  0

+ 16 20  2  0

+ 18 21  2  0

+ 19 22  1  0

+  5  6  1  0

+  7 11  2  0

+  9 13  2  0

+ 14 15  1  0

+ 17 20  1  0

+ 19 21  1  0

+  2 23  1  0

+  5 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1854-26-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.1498   -0.0339    0.0988 N   0  0  0

+    0.1226   -0.8918    0.0429 C   0  0  0

+    0.7126    1.2766   -0.4051 C   0  0  0

+    2.4935   -0.3494    0.5899 C   0  0  0

+   -1.0058   -0.3571   -0.4418 N   0  0  0

+    0.2067   -2.0510    0.4002 O   0  0  0

+   -0.7665    1.0548   -0.7761 C   0  0  0

+    0.8010    2.2436    0.6432 O   0  0  0

+    3.3001   -0.8136   -0.4945 O   0  0  0

+   -2.2764   -1.0661   -0.6119 C   0  0  0

+   -1.5926    1.8848    0.0429 O   0  0  0

+   -3.0557   -0.9395    0.5792 O   0  0  0

+    1.6763    1.3883    0.0000 H   0  0  0

+    3.2818    0.2160    0.0000 H   0  0  0

+    2.3048    0.6022    0.0000 H   0  0  0

+   -0.4618    1.9758    0.0000 H   0  0  0

+    0.8893    3.2097    0.0000 H   0  0  0

+    4.1409   -1.2975    0.0000 H   0  0  0

+   -2.7082   -1.9348    0.0000 H   0  0  0

+   -1.5743   -1.7355    0.0000 H   0  0  0

+   -2.2770    2.5724    0.0000 H   0  0  0

+   -4.0133   -0.7839    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  7 11  1  0

+ 10 12  1  0

+  5  7  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97461-40-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -1.2467   -0.0067    0.0373 C   0  0  0

+   -2.4225   -0.6065   -0.2430 O   0  0  0

+   -1.5227    1.2476    0.5409 C   0  0  0

+    0.0407   -0.5671   -0.1470 C   0  0  0

+   -3.4302    0.2218    0.0647 C   0  0  0

+   -2.9200    1.3751    0.5509 C   0  0  0

+    1.1452    0.1497    0.1782 C   0  0  0

+   -4.8703   -0.0780   -0.1018 N   0  3  0

+    2.4320   -0.4105   -0.0060 C   0  0  0

+   -5.7053    0.7515    0.2117 O   0  0  0

+   -5.2202   -1.1541   -0.5524 O   0  5  0

+    3.5296    0.3018    0.3171 N   0  0  0

+    2.5474   -1.5360   -0.4564 O   0  0  0

+    4.8614   -0.2780    0.1265 C   0  0  0

+    5.8659    0.8378   -0.1688 C   0  0  0

+    5.2816   -1.0192    1.3973 C   0  0  0

+    5.4457    1.5791   -1.4395 C   0  0  0

+   -0.8737    1.9837    0.0000 H   0  0  0

+    0.1216   -1.5451    0.0000 H   0  0  0

+   -3.4175    2.2210    0.0000 H   0  0  0

+    1.0643    1.1277    0.0000 H   0  0  0

+    3.4487    1.2798    0.0000 H   0  0  0

+    4.2049   -1.0074    0.0000 H   0  0  0

+    6.5207    0.1068    0.0000 H   0  0  0

+    6.6628    1.4104    0.0000 H   0  0  0

+    4.4279   -1.5032    0.0000 H   0  0  0

+    5.7656   -1.8729    0.0000 H   0  0  0

+    6.1353   -0.5352    0.0000 H   0  0  0

+    6.2994    2.0630    0.0000 H   0  0  0

+    4.9618    2.4328    0.0000 H   0  0  0

+    4.5920    1.0952    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+  9 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+  5  6  2  0

+  3 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+638-07-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+   -0.2716   -1.0481    0.0000 C   0  0  0

+   -1.4129   -0.0640    0.0000 C   0  0  0

+    1.0366   -0.3001    0.0000 C   0  0  0

+   -2.6803   -0.5061    0.0000 O   0  0  0

+   -1.1872    1.1230    0.0000 O   0  0  0

+    2.3386   -1.0590    0.0000 C   0  0  0

+    1.0417    0.9075    0.0000 O   0  0  0

+   -3.7800    0.4421    0.0000 C   0  0  0

+    3.7138    0.1069    0.0000 Cl  0  0  0

+   -5.1082   -0.3174    0.0000 C   0  0  0

+   -1.1017   -1.8151    0.0000 H   0  0  0

+    0.3967   -1.9596    0.0000 H   0  0  0

+    1.6627   -1.9649    0.0000 H   0  0  0

+    3.1622   -1.8329    0.0000 H   0  0  0

+   -2.9499    1.2092    0.0000 H   0  0  0

+   -4.4483    1.3535    0.0000 H   0  0  0

+   -5.6692    0.6637    0.0000 H   0  0  0

+   -6.0893   -0.8784    0.0000 H   0  0  0

+   -4.5472   -1.2985    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  6  9  1  0

+  8 10  1  0

+  1 11  1  0

+  1 12  1  0

+  6 13  1  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-59-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.8835    0.3272   -0.0007 C   0  0  0

+   -0.4152    0.7274    0.0002 O   0  0  0

+    1.9010    1.2701    0.0003 C   0  0  0

+    1.1940   -1.0251    0.0030 C   0  0  0

+   -1.2127   -0.4584   -0.0013 C   0  0  0

+    3.2206    0.8607   -0.0007 C   0  0  0

+    2.5148   -1.4292    0.0020 C   0  0  0

+   -2.6720   -0.0822   -0.0003 C   0  0  0

+    3.5273   -0.4873   -0.0027 C   0  0  0

+   -3.6121   -1.0404   -0.0014 O   0  0  0

+   -2.9959    1.0818    0.0015 O   0  0  0

+    1.6714    2.2812    0.0000 H   0  0  0

+    0.4352   -1.7317    0.0000 H   0  0  0

+   -1.5833   -1.4267    0.0000 H   0  0  0

+   -0.2925   -0.9361    0.0000 H   0  0  0

+    3.9815    1.5650    0.0000 H   0  0  0

+    2.7473   -2.4396    0.0000 H   0  0  0

+    4.5182   -0.7926    0.0000 H   0  0  0

+   -4.3382   -1.7805    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  7  9  1  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105427-00-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    2.8809    0.2454   -0.4242 C   0  0  0

+    1.7784   -0.5424    0.2353 C   0  0  0

+    2.9855    1.7364   -0.0972 C   0  0  0

+    3.9124    0.7749    0.4111 O   0  0  0

+    3.2650   -0.2036   -1.8355 C   0  0  0

+    0.4908   -0.1998    0.0321 N   0  0  0

+    2.0498   -1.4847    0.9489 O   0  0  0

+   -0.5809   -0.9657    0.6732 C   0  0  0

+   -1.9156   -0.3824    0.2866 C   0  0  0

+   -2.5724   -0.8452   -0.8379 C   0  0  0

+   -2.4856    0.6118    1.0601 C   0  0  0

+   -3.7969   -0.3100   -1.1926 C   0  0  0

+   -3.7097    1.1467    0.7056 C   0  0  0

+   -4.3641    0.6878   -0.4225 C   0  0  0

+    3.5096    2.5739    0.0000 H   0  0  0

+    2.0461    2.0421    0.0000 H   0  0  0

+    2.5143   -0.8458    0.0000 H   0  0  0

+    3.9072   -0.9543    0.0000 H   0  0  0

+    4.0157    0.4386    0.0000 H   0  0  0

+    0.3137    0.7721    0.0000 H   0  0  0

+   -1.1317   -1.7858    0.0000 H   0  0  0

+    0.1278   -1.6541    0.0000 H   0  0  0

+   -2.4729   -1.8281    0.0000 H   0  0  0

+   -1.8260    1.3473    0.0000 H   0  0  0

+   -4.4579   -1.0442    0.0000 H   0  0  0

+   -3.8081    2.1297    0.0000 H   0  0  0

+   -5.3280    0.9045    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  6  8  1  0

+  8  9  1  0

+  9 10  2  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  2  0

+ 12 14  2  0

+  3  4  1  0

+ 13 14  1  0

+  3 15  1  0

+  3 16  1  0

+  5 17  1  0

+  5 18  1  0

+  5 19  1  0

+  6 20  1  0

+  8 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1197-55-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.1285    0.0084   -0.6285 C   0  0  0

+    0.5329   -1.1925   -0.4493 C   0  0  0

+    0.5350    1.2043   -0.4227 C   0  0  0

+   -1.5738    0.0142   -1.0552 C   0  0  0

+    1.8593   -1.2014   -0.0639 C   0  0  0

+    1.8609    1.2027   -0.0373 C   0  0  0

+   -2.4578   -0.0021    0.1652 C   0  0  0

+    2.5286   -0.0022    0.1437 C   0  0  0

+   -3.7930   -0.0001    0.0268 O   0  0  0

+   -1.9648   -0.0169    1.2682 O   0  0  0

+    3.8697   -0.0075    0.5339 N   0  0  0

+    0.0183   -2.0567    0.0000 H   0  0  0

+    0.0252    2.0714    0.0000 H   0  0  0

+   -1.0739    0.8870    0.0000 H   0  0  0

+   -2.0862    0.8797    0.0000 H   0  0  0

+    2.3656   -2.0705    0.0000 H   0  0  0

+    2.3720    2.0690    0.0000 H   0  0  0

+   -4.7988    0.0014    0.0000 H   0  0  0

+    4.3692   -0.8806    0.0000 H   0  0  0

+    4.3761    0.8616    0.0000 H   0  0  0

+  1  2  2  0

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+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2113-57-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -0.9610   -0.6737    0.0878 C   0  0  0

+   -2.3179   -0.0763    0.0261 C   0  0  0

+    0.1661    0.1385   -0.0195 C   0  0  0

+   -0.8094   -2.0481    0.2589 C   0  0  0

+   -3.3386   -0.7286   -0.6628 C   0  0  0

+   -2.5776    1.1360    0.6616 C   0  0  0

+    1.4264   -0.4228    0.0391 C   0  0  0

+    0.4550   -2.5990    0.3162 C   0  0  0

+   -4.5986   -0.1684   -0.7170 C   0  0  0

+   -3.8417    1.6873    0.6010 C   0  0  0

+    1.5706   -1.7896    0.2044 C   0  0  0

+    2.9576    0.6773   -0.1063 Br  0  0  0

+   -4.8494    1.0384   -0.0890 C   0  0  0

+    0.0601    1.1673    0.0000 H   0  0  0

+   -1.6421   -2.6615    0.0000 H   0  0  0

+   -3.2610   -1.7599    0.0000 H   0  0  0

+   -1.7768    1.7906    0.0000 H   0  0  0

+    0.5669   -3.6272    0.0000 H   0  0  0

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+   -3.9248    2.7182    0.0000 H   0  0  0

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+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+606-37-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -1.1515    0.3402   -0.0209 C   0  0  0

+   -0.5057   -0.9073    0.0070 C   0  0  0

+   -0.3738    1.5253   -0.0278 C   0  0  0

+   -2.5534    0.4361   -0.0480 C   0  0  0

+    0.8543   -0.9613    0.0270 C   0  0  0

+   -1.3001   -2.1563    0.0151 N   0  3  0

+    1.0278    1.4295   -0.0065 C   0  0  0

+   -1.0198    2.7732   -0.0562 C   0  0  0

+   -3.1441    1.6618   -0.0751 C   0  0  0

+    1.6188    0.2035    0.0203 C   0  0  0

+   -2.2481   -2.2702    0.7714 O   0  0  0

+   -1.0059   -3.0701   -0.7345 O   0  5  0

+   -2.3794    2.8272   -0.0767 C   0  0  0

+    3.0957    0.1065    0.0431 N   0  3  0

+    3.7727    1.1190    0.0374 O   0  0  0

+    3.6339   -0.9859    0.0675 O   0  5  0

+   -3.1391   -0.4293    0.0000 H   0  0  0

+    1.3323   -1.8905    0.0000 H   0  0  0

+    1.6134    2.2949    0.0000 H   0  0  0

+   -0.4591    3.6550    0.0000 H   0  0  0

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+  9 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-47-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.5716    0.6911    0.0018 C   0  0  0

+   -0.5716   -0.6911    0.0005 C   0  0  0

+    0.6257    1.3823    0.0017 C   0  0  0

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+  7 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16757-82-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.0203   -0.2591   -0.0015 C   0  0  0

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+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16354-50-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    0.5459    0.2102   -0.0372 C   0  0  0

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+ 21 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33703-08-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 74 73                          1 V2000

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+ 27 69  1  0

+ 27 70  1  0

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+ 28 72  1  0

+ 28 73  1  0

+ 28 74  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120-80-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.4688    0.6958    0.0019 C   0  0  0

+   -0.4688   -0.6958    0.0007 C   0  0  0

+    0.7329    1.3855    0.0016 C   0  0  0

+   -1.6457    1.3772   -0.0021 O   0  0  0

+    0.7329   -1.3855   -0.0009 C   0  0  0

+   -1.6457   -1.3772    0.0006 O   0  0  0

+    1.9284    0.6913    0.0000 C   0  0  0

+    1.9284   -0.6913   -0.0013 C   0  0  0

+    0.7355    2.4224    0.0000 H   0  0  0

+   -2.5430    1.8967    0.0000 H   0  0  0

+    0.7355   -2.4224    0.0000 H   0  0  0

+   -2.5430   -1.8967    0.0000 H   0  0  0

+    2.8270    1.2086    0.0000 H   0  0  0

+    2.8270   -1.2086    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+38134-58-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 46                          1 V2000

+    0.5166   -1.2899    0.0520 C   0  0  1

+    1.2704   -2.5250   -0.3692 C   0  0  0

+    1.1014   -0.1151   -0.5992 N   0  0  0

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+    2.5124    0.1995    1.0837 O   0  0  0

+   -3.5797    0.1994   -0.1928 C   0  0  0

+    1.0380   -6.1410    0.3684 C   0  0  0

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+   -4.2538    1.3040    0.1839 N   0  0  0

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+   -0.0694   -3.8572    0.0000 H   0  0  0

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+ 23 46  1  0

+ 24 47  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+621-95-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    1.8614    0.0000    0.3998 C   0  0  0

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+   -2.5417   -1.1985   -0.2839 C   0  0  0

+    5.9601   -0.0001   -0.3337 N   0  0  0

+   -3.9001    1.2021   -0.0352 C   0  0  0

+   -3.9009   -1.2021   -0.0409 C   0  0  0

+   -4.5852    0.0002    0.0874 C   0  0  0

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+   -4.4179    2.0960    0.0000 H   0  0  0

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+  1  2  1  0

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+ 16 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55256-57-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 53                          1 V2000

+    3.0304    0.0740    0.2426 C   0  0  0

+    2.4062   -1.1491    0.4698 C   0  0  0

+    4.5131   -0.1943    0.0945 C   0  0  1

+    2.2921    1.2378    0.1840 C   0  0  0

+    1.0307   -1.1929    0.6747 C   0  0  0

+    3.3065   -2.1690    0.4401 O   0  0  0

+    4.6306   -1.6517    0.6421 C   0  0  1

+    4.8334   -0.3972   -1.3744 C   0  0  0

+    0.9043    1.1816    0.3541 C   0  0  0

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+   -2.5454   -4.3027    0.0000 H   0  0  0

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+  1  2  2  0

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+ 28 46  1  0

+ 28 47  1  0

+ 28 48  1  0

+ 29 49  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+962-58-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 40                          1 V2000

+    0.5917   -1.1692   -0.3602 O   0  0  0

+   -0.5779   -0.5398   -0.0908 C   0  0  0

+    1.7714   -0.1425    0.0224 P   0  0  0

+   -1.7353   -1.0898   -0.4393 N   0  0  0

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+   -4.9171   -0.2252   -1.5623 C   0  0  0

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+    3.0372   -2.9445    0.0000 H   0  0  0

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+   -5.5483    0.5438    0.0000 H   0  0  0

+   -5.6861   -0.8564    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 37  1  0

+ 19 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90147-19-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+   -1.5315    0.0472   -0.0041 C   0  0  0

+   -2.6930   -0.6398   -0.0034 O   0  0  0

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+   -0.2315   -0.5125   -0.0020 C   0  0  0

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+    0.8568    0.2990   -0.0030 C   0  0  0

+   -5.1530   -0.1513    0.0018 N   0  3  0

+    2.1546   -0.2596   -0.0008 C   0  0  0

+   -6.0076    0.7166    0.0047 O   0  0  0

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+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+494-03-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    0.1269    0.1047   -0.2700 C   0  0  0

+   -1.2430   -0.0552   -0.0531 N   0  0  0

+    1.0111   -0.1186    0.7623 C   0  0  0

+    0.5883    0.4848   -1.5363 C   0  0  0

+   -1.9125   -1.2880   -0.4752 C   0  0  0

+   -2.0110    1.0098    0.5967 C   0  0  0

+    2.3884    0.0428    0.5402 C   0  0  0

+    1.9161    0.6473   -1.7759 C   0  0  0

+   -1.5414   -2.4231    0.4812 C   0  0  0

+   -2.4008    2.0637   -0.4416 C   0  0  0

+    2.8461    0.4330   -0.7434 C   0  0  0

+    3.3222   -0.1762    1.5681 C   0  0  0

+   -2.3654   -3.9403   -0.0383 Cl  0  0  0

+   -3.3459    3.3745    0.3581 Cl  0  0  0

+    4.2250    0.5932   -0.9627 C   0  0  0

+    4.6498   -0.0111    1.3184 C   0  0  0

+    5.0998    0.3725    0.0563 C   0  0  0

+    0.9497   -1.0568    0.0000 H   0  0  0

+    0.2175    1.3488    0.0000 H   0  0  0

+   -2.6005   -0.6471    0.0000 H   0  0  0

+   -2.7049   -1.7941    0.0000 H   0  0  0

+   -2.9483    1.0842    0.0000 H   0  0  0

+   -2.4721    0.1904    0.0000 H   0  0  0

+    1.9653    1.5862    0.0000 H   0  0  0

+   -0.8534   -3.0640    0.0000 H   0  0  0

+   -0.7490   -1.9170    0.0000 H   0  0  0

+   -1.4635    1.9893    0.0000 H   0  0  0

+   -1.9396    2.8831    0.0000 H   0  0  0

+    3.2721   -1.1151    0.0000 H   0  0  0

+    4.2868    1.5314    0.0000 H   0  0  0

+    5.0287   -0.8716    0.0000 H   0  0  0

+    6.0154    0.5863    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  1  0

+  7 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 15 17  2  0

+  8 11  1  0

+ 16 17  1  0

+  3 18  1  0

+  4 19  1  0

+  5 20  1  0

+  5 21  1  0

+  6 22  1  0

+  6 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17526-24-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    1.3821   -0.5028    0.0298 C   0  0  0

+    0.2818    0.4079    0.3513 C   0  0  0

+    2.7436    0.0437   -0.0656 C   0  0  0

+    1.1411   -1.8512   -0.1736 C   0  0  0

+   -1.0180   -0.0751    0.4500 C   0  0  0

+    0.5683    1.8253    0.5665 C   0  0  0

+    2.9503    1.4216    0.1538 C   0  0  0

+    3.8282   -0.7809   -0.3689 C   0  0  0

+   -0.1636   -2.3437   -0.0705 C   0  0  0

+   -1.2681   -1.4335    0.2407 C   0  0  0

+   -2.1511    0.8616    0.7814 C   0  0  0

+    1.8261    2.2962    0.4722 C   0  0  0

+    4.2494    1.9409    0.0623 C   0  0  0

+    5.0920   -0.2413   -0.4512 C   0  0  0

+   -0.4456   -3.7096   -0.2711 C   0  0  0

+   -2.5735   -1.9582    0.3322 C   0  0  0

+   -2.7058    1.4035   -0.4462 O   0  0  0

+    5.2945    1.1159   -0.2358 C   0  0  0

+   -1.7257   -4.1526   -0.1628 C   0  0  0

+   -2.7788   -3.2847    0.1219 C   0  0  0

+   -3.7322    2.2669   -0.3950 C   0  0  0

+   -4.3080    2.8293   -1.6691 C   0  0  0

+   -4.1946    2.5932    0.6725 O   0  0  0

+    1.9358   -2.5116    0.0000 H   0  0  0

+   -0.2180    2.4957    0.0000 H   0  0  0

+    3.7012   -1.8063    0.0000 H   0  0  0

+   -3.1379    0.5551    0.0000 H   0  0  0

+   -2.3512   -0.1521    0.0000 H   0  0  0

+    1.9820    3.3176    0.0000 H   0  0  0

+    4.3977    2.9635    0.0000 H   0  0  0

+    5.9097   -0.8729    0.0000 H   0  0  0

+    0.3308   -4.3914    0.0000 H   0  0  0

+   -3.3827   -1.3157    0.0000 H   0  0  0

+    6.2551    1.4965    0.0000 H   0  0  0

+   -1.9087   -5.1695    0.0000 H   0  0  0

+   -3.7444   -3.6525    0.0000 H   0  0  0

+   -3.5860    3.5685    0.0000 H   0  0  0

+   -5.0472    3.5513    0.0000 H   0  0  0

+   -5.0300    2.0901    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

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+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 13 18  2  0

+ 15 19  2  0

+ 16 20  2  0

+ 17 21  1  0

+ 21 22  1  0

+ 21 23  2  0

+  7 12  1  0

+  9 10  2  0

+ 14 18  1  0

+ 19 20  1  0

+  4 24  1  0

+  6 25  1  0

+  8 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141691-42-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.3371    0.3244   -0.0035 C   0  0  0

+    0.5542   -1.0659   -0.0007 C   0  0  0

+    1.5934    0.9104   -0.0015 N   0  0  0

+   -0.9520    0.8230   -0.0024 C   0  0  0

+    1.8964   -1.2592    0.0028 N   0  0  0

+   -0.5401   -1.9392   -0.0018 C   0  0  0

+    2.5100   -0.1005    0.0023 C   0  0  0

+    1.8830    2.3465   -0.0037 C   0  0  0

+   -2.0327   -0.0603    0.0016 C   0  0  0

+   -1.8093   -1.4441   -0.0057 C   0  0  0

+    3.8766    0.0708    0.0044 N   0  0  0

+   -3.3715    0.4478    0.0028 C   0  0  0

+   -4.4336    0.8509    0.0038 N   0  0  0

+   -1.1154    1.8482    0.0000 H   0  0  0

+   -0.3841   -2.9656    0.0000 H   0  0  0

+    2.9007    2.1413    0.0000 H   0  0  0

+    2.0882    3.3642    0.0000 H   0  0  0

+    0.8653    2.5517    0.0000 H   0  0  0

+   -2.6169   -2.0964    0.0000 H   0  0  0

+    4.5035   -0.7567    0.0000 H   0  0  0

+    4.2798    1.0274    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  6 10  2  0

+  7 11  1  0

+  9 12  1  0

+ 12 13  3  0

+  5  7  2  0

+  9 10  1  0

+  4 14  1  0

+  6 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142457-04-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -0.7776    0.2193   -0.3722 C   0  0  0

+    0.3305   -0.8483   -0.3802 C   0  0  0

+   -0.3946   -0.4824   -1.5563 O   0  0  0

+   -0.0698    1.5442   -0.2462 C   0  0  0

+   -2.1282    0.0275    0.2682 C   0  0  0

+    1.6308   -0.0392   -0.2465 C   0  0  0

+    0.2238   -2.2255    0.2778 C   0  0  0

+    1.2554    1.3719   -0.1775 N   0  0  0

+   -0.6264    2.6212   -0.2122 O   0  0  0

+   -2.9351   -0.9602   -0.1502 O   0  0  0

+   -2.4848    0.7628    1.1582 O   0  0  0

+    2.3677   -0.4452    1.0314 C   0  0  0

+    2.4659   -0.2690   -1.3831 O   0  0  0

+   -4.2365   -1.1450    0.4667 C   0  0  0

+    3.2731   -1.6435    0.7393 C   0  0  0

+    3.2174    0.7276    1.5247 C   0  0  0

+   -0.7755   -2.1481    0.0000 H   0  0  0

+    0.1464   -3.2248    0.0000 H   0  0  0

+    1.2231   -2.3029    0.0000 H   0  0  0

+    1.9163    2.1254    0.0000 H   0  0  0

+    1.7116   -1.2029    0.0000 H   0  0  0

+    3.4322   -0.5349    0.0000 H   0  0  0

+   -4.3774   -0.1527    0.0000 H   0  0  0

+   -5.2288   -1.2859    0.0000 H   0  0  0

+   -4.0956   -2.1373    0.0000 H   0  0  0

+    2.4734   -2.2477    0.0000 H   0  0  0

+    3.8773   -2.4432    0.0000 H   0  0  0

+    4.0728   -1.0393    0.0000 H   0  0  0

+    4.0290    0.1396    0.0000 H   0  0  0

+    3.8054    1.5392    0.0000 H   0  0  0

+    2.4058    1.3156    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+ 10 14  1  0

+ 12 15  1  0

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+  2  3  1  0

+  6  8  1  0

+  7 17  1  0

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+ 12 21  1  0

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+ 14 23  1  0

+ 14 24  1  0

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+ 15 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7779-16-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    1.7435   -0.1548    0.1317 C   0  0  0

+    0.3470    0.1904    0.4476 C   0  0  0

+    2.6982    0.8587   -0.0497 C   0  0  0

+    2.1284   -1.4938    0.0162 C   0  0  0

+   -0.6426   -0.1676   -0.3943 O   0  0  0

+    0.0870    0.7981    1.4674 O   0  0  0

+    4.0126    0.5195   -0.3469 C   0  0  0

+    2.3309    2.1924    0.0668 N   0  0  0

+    3.4360   -1.8097   -0.2790 C   0  0  0

+   -2.0194    0.1727   -0.0829 C   0  0  0

+    4.3750   -0.8065   -0.4626 C   0  0  0

+   -2.8038    0.3644   -1.3824 C   0  0  0

+   -2.6519   -0.9568    0.7327 C   0  0  0

+   -4.2545    0.7230   -1.0543 C   0  0  0

+   -4.1027   -0.5982    1.0609 C   0  0  0

+   -4.8871   -0.4065   -0.2387 C   0  0  0

+    1.4155   -2.2380    0.0000 H   0  0  0

+    4.7361    1.2534    0.0000 H   0  0  0

+    3.0545    2.9262    0.0000 H   0  0  0

+    1.3336    2.4522    0.0000 H   0  0  0

+    3.7314   -2.7970    0.0000 H   0  0  0

+   -1.7734    1.1735    0.0000 H   0  0  0

+    5.3753   -1.0543    0.0000 H   0  0  0

+   -3.5175   -0.3790    0.0000 H   0  0  0

+   -2.5160   -0.6252    0.0000 H   0  0  0

+   -2.9875   -1.9312    0.0000 H   0  0  0

+   -1.7114   -1.3780    0.0000 H   0  0  0

+   -3.9189    1.6974    0.0000 H   0  0  0

+   -5.1950    1.1443    0.0000 H   0  0  0

+   -3.3890    0.1452    0.0000 H   0  0  0

+   -4.3905    0.3914    0.0000 H   0  0  0

+   -5.8280    0.0140    0.0000 H   0  0  0

+   -5.2210   -1.3815    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  7 11  2  0

+ 10 12  1  0

+ 10 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+  9 11  1  0

+ 15 16  1  0

+  4 17  1  0

+  7 18  1  0

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+ 13 26  1  0

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+ 14 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+580-19-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.2827    0.5969   -0.0028 C   0  0  0

+   -0.4983   -0.8045   -0.0009 C   0  0  0

+    1.0329    1.0871   -0.0024 C   0  0  0

+   -1.3279    1.4311    0.0006 N   0  0  0

+    0.6007   -1.6805    0.0018 C   0  0  0

+   -1.8181   -1.2903   -0.0013 C   0  0  0

+    2.0889    0.2021   -0.0002 C   0  0  0

+   -2.5597    0.9805    0.0058 C   0  0  0

+    1.8645   -1.1806    0.0025 C   0  0  0

+   -2.8403   -0.3830   -0.0035 C   0  0  0

+    3.3958    0.6883    0.0001 N   0  0  0

+    1.2101    2.1169    0.0000 H   0  0  0

+    0.4465   -2.7140    0.0000 H   0  0  0

+   -2.0120   -2.3171    0.0000 H   0  0  0

+   -3.3511    1.6628    0.0000 H   0  0  0

+    2.6786   -1.8356    0.0000 H   0  0  0

+   -3.8319   -0.7127    0.0000 H   0  0  0

+    4.2010    0.0223    0.0000 H   0  0  0

+    3.5699    1.7186    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

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+  7  9  1  0

+  8 10  2  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2186-24-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.4571    0.5572   -0.0746 C   0  0  0

+   -0.8216    1.0130   -0.1398 O   0  0  0

+    1.5103    1.4546    0.0283 C   0  0  0

+    0.7111   -0.8061   -0.1051 C   0  0  0

+   -1.6651   -0.1362   -0.2388 C   0  0  0

+    2.8090    0.9889    0.0943 C   0  0  0

+    2.0119   -1.2669   -0.0388 C   0  0  0

+   -3.1268    0.3093   -0.3162 C   0  0  0

+    3.0599   -0.3705    0.0579 C   0  0  0

+   -4.0300   -0.9211   -0.4223 C   0  0  0

+   -3.8437   -0.2123    0.8045 O   0  0  0

+    4.4778   -0.8759    0.1296 C   0  0  0

+    1.3240    2.4745    0.0000 H   0  0  0

+   -0.0770   -1.4798    0.0000 H   0  0  0

+   -2.0767   -1.0878    0.0000 H   0  0  0

+   -0.7657   -0.6520    0.0000 H   0  0  0

+    3.5990    1.6604    0.0000 H   0  0  0

+    2.2012   -2.2863    0.0000 H   0  0  0

+   -3.2987    1.3317    0.0000 H   0  0  0

+   -5.0565   -1.0670    0.0000 H   0  0  0

+   -3.4975   -1.8107    0.0000 H   0  0  0

+    4.1297   -1.8525    0.0000 H   0  0  0

+    5.4544   -1.2240    0.0000 H   0  0  0

+    4.8259    0.1007    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

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+  8 11  1  0

+  9 12  1  0

+  7  9  2  0

+ 10 11  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+123-75-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.0780    0.7713    0.0735 C   0  0  0

+   -1.0779   -0.7713    0.0735 C   0  0  0

+    0.3860    1.1724   -0.2078 C   0  0  0

+    0.3861   -1.1724   -0.2079 C   0  0  0

+    1.1863    0.0000    0.2304 N   0  0  0

+   -1.2799    1.8917    0.0000 H   0  0  0

+   -2.2119    0.6699    0.0000 H   0  0  0

+   -2.2118   -0.6700    0.0000 H   0  0  0

+   -1.2798   -1.8917    0.0000 H   0  0  0

+    1.3913    1.7066    0.0000 H   0  0  0

+   -0.0341    2.2305    0.0000 H   0  0  0

+   -0.0340   -2.2305    0.0000 H   0  0  0

+    1.3915   -1.7066    0.0000 H   0  0  0

+    2.3248    0.0000    0.0000 H   0  0  0

+  1  2  1  0

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+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+102-82-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 39                          1 V2000

+   -0.1392   -0.2948   -0.0594 N   0  0  0

+    0.7520   -1.4129   -0.3963 C   0  0  0

+    0.4168    0.8991   -0.7100 C   0  0  0

+   -1.4266   -0.5699   -0.7113 C   0  0  0

+    2.1186   -1.1897    0.2543 C   0  0  0

+    0.4148    2.0665    0.2789 C   0  0  0

+   -2.5293   -0.6405    0.3470 C   0  0  0

+    3.0469   -2.3542   -0.0966 C   0  0  0

+    0.8767    3.3392   -0.4336 C   0  0  0

+   -3.8465   -1.0494   -0.3154 C   0  0  0

+    4.4135   -2.1310    0.5540 C   0  0  0

+    0.8746    4.5067    0.5554 C   0  0  0

+   -4.9492   -1.1200    0.7429 C   0  0  0

+   -0.1257   -1.8954    0.0000 H   0  0  0

+    1.0787   -2.3597    0.0000 H   0  0  0

+    1.1048    0.1712    0.0000 H   0  0  0

+    1.3472    1.2701    0.0000 H   0  0  0

+   -1.8266   -1.4882    0.0000 H   0  0  0

+   -0.7927   -1.3454    0.0000 H   0  0  0

+    2.9963   -0.7072    0.0000 H   0  0  0

+    1.7919   -0.2429    0.0000 H   0  0  0

+   -0.3146    2.7530    0.0000 H   0  0  0

+   -0.5043    1.6685    0.0000 H   0  0  0

+   -2.1572    0.2894    0.0000 H   0  0  0

+   -3.2088    0.0954    0.0000 H   0  0  0

+    2.1692   -2.8367    0.0000 H   0  0  0

+    3.3736   -3.3010    0.0000 H   0  0  0

+    1.6061    2.6527    0.0000 H   0  0  0

+    1.7958    3.7373    0.0000 H   0  0  0

+   -4.2186   -1.9793    0.0000 H   0  0  0

+   -3.1670   -1.7853    0.0000 H   0  0  0

+    4.5749   -3.1195    0.0000 H   0  0  0

+    5.4020   -1.9696    0.0000 H   0  0  0

+    4.2521   -1.1425    0.0000 H   0  0  0

+    1.8762    4.5085    0.0000 H   0  0  0

+    0.8728    5.5083    0.0000 H   0  0  0

+   -0.1270    4.5049    0.0000 H   0  0  0

+   -5.0132   -0.1204    0.0000 H   0  0  0

+   -5.9488   -1.1840    0.0000 H   0  0  0

+   -4.8852   -2.1196    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+  2 14  1  0

+  2 15  1  0

+  3 16  1  0

+  3 17  1  0

+  4 18  1  0

+  4 19  1  0

+  5 20  1  0

+  5 21  1  0

+  6 22  1  0

+  6 23  1  0

+  7 24  1  0

+  7 25  1  0

+  8 26  1  0

+  8 27  1  0

+  9 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 11 32  1  0

+ 11 33  1  0

+ 11 34  1  0

+ 12 35  1  0

+ 12 36  1  0

+ 12 37  1  0

+ 13 38  1  0

+ 13 39  1  0

+ 13 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+10560-74-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    1.8312    0.1433    0.1322 N   0  0  0

+    0.4528    0.3227    0.1182 C   0  0  0

+    2.8282    1.2133    0.2853 C   0  0  0

+    2.4620   -1.0324    0.0139 C   0  0  0

+   -0.8005   -0.8665   -0.0558 S   0  0  0

+   -0.2387    1.4390    0.2396 N   0  0  0

+    4.1776    0.4711    0.2314 C   0  0  0

+    2.7284    2.1767   -0.8990 C   0  0  0

+    3.7975   -0.9389    0.0579 N   0  0  0

+    1.8755   -2.0889   -0.1206 O   0  0  0

+   -2.1938    0.2479    0.0426 C   0  0  0

+   -1.5572    1.4332    0.2048 C   0  0  0

+   -3.6436   -0.0437   -0.0288 N   0  3  0

+   -4.4522    0.8629    0.0593 O   0  0  0

+   -4.0277   -1.1902   -0.1758 O   0  5  0

+    1.8738    1.5332    0.0000 H   0  0  0

+    5.1255    0.1324    0.0000 H   0  0  0

+    4.5908    1.3890    0.0000 H   0  0  0

+    3.7296    2.2804    0.0000 H   0  0  0

+    2.6247    3.1779    0.0000 H   0  0  0

+    1.7272    2.0730    0.0000 H   0  0  0

+    4.4372   -1.7161    0.0000 H   0  0  0

+   -2.0757    2.2959    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  1  0

+ 11 13  1  0

+ 13 14  2  0

+ 13 15  1  0

+  7  9  1  0

+ 11 12  2  0

+  3 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3083-25-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.5347    0.0097   -0.0995 C   0  0  0

+   -0.7428    0.1515   -0.9295 C   0  0  0

+    0.8454    1.5455    0.7925 Cl  0  0  0

+    0.3389   -1.3407    1.0789 Cl  0  0  0

+    1.9251   -0.3427   -1.1919 Cl  0  0  0

+   -1.9227    0.4505   -0.0025 C   0  0  0

+   -3.2001    0.5923   -0.8325 C   0  0  0

+   -2.8878   -0.5982   -0.1065 O   0  0  0

+   -1.4024   -0.5917    0.0000 H   0  0  0

+   -0.3861   -0.7760    0.0000 H   0  0  0

+   -1.7454    1.4283    0.0000 H   0  0  0

+   -3.2118    1.5859    0.0000 H   0  0  0

+   -4.1849    0.4594    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  6  8  1  0

+  7  8  1  0

+  2  9  1  0

+  2 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-01-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.5322    0.0001   -0.0012 C   0  0  0

+   -2.0122    0.0000   -0.0006 N   0  3  0

+    0.1575    1.1984    0.0005 C   0  0  0

+    0.1578   -1.1986    0.0024 C   0  0  0

+   -2.6212   -1.0548   -0.0020 O   0  0  0

+   -2.6213    1.0548    0.0013 O   0  5  0

+    1.5388    1.2020    0.0004 C   0  0  0

+    1.5386   -1.2022    0.0024 C   0  0  0

+    2.2348    0.0001   -0.0013 C   0  0  0

+    3.6315    0.0001   -0.0014 N   0  0  0

+   -0.3628    2.0956    0.0000 H   0  0  0

+   -0.3625   -2.0958    0.0000 H   0  0  0

+    2.0556    2.1012    0.0000 H   0  0  0

+    2.0554   -2.1014    0.0000 H   0  0  0

+    4.1501   -0.8981    0.0000 H   0  0  0

+    4.1501    0.8983    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  7  9  2  0

+  9 10  1  0

+  8  9  1  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+  8 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104789-46-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    2.9666   -0.4923   -0.0011 C   0  0  0

+    1.7366    0.1718   -0.0007 C   0  0  0

+    4.1560    0.2821   -0.0005 C   0  0  0

+    3.3518   -1.7793    0.0033 N   0  0  0

+    0.2226   -0.7296   -0.0008 S   0  0  0

+    1.7390    1.5329    0.0003 N   0  0  0

+    5.1645   -0.5871   -0.0011 N   0  0  0

+    4.0666    1.6250    0.0005 N   0  0  0

+    4.6672   -1.8164    0.0000 C   0  0  0

+   -1.3150    0.1309   -0.0003 C   0  0  0

+    2.9090    2.2209    0.0008 C   0  0  0

+   -2.4731   -0.5586   -0.0004 N   0  0  0

+   -1.3313    1.3465    0.0002 O   0  0  0

+   -3.7515    0.1568    0.0000 C   0  0  0

+   -4.9010   -0.8529   -0.0002 C   0  0  0

+   -6.4744    0.0276    0.0003 Cl  0  0  0

+    0.8558    2.0391    0.0000 H   0  0  0

+    5.2243   -2.6684    0.0000 H   0  0  0

+    2.8804    3.2385    0.0000 H   0  0  0

+   -2.4594   -1.5765    0.0000 H   0  0  0

+   -3.1571    0.9832    0.0000 H   0  0  0

+   -4.5055    0.8408    0.0000 H   0  0  0

+   -5.4954   -1.6793    0.0000 H   0  0  0

+   -4.1470   -1.5369    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  1  0

+ 10 12  1  0

+ 10 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+  7  9  1  0

+  8 11  2  0

+  6 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122587-20-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.1455    0.7898    0.0025 C   0  0  0

+   -0.8137   -0.5526    0.0014 C   0  0  0

+    0.0049    1.4980    0.0019 O   0  0  0

+   -2.4514    1.3240   -0.0013 C   0  0  0

+    0.5882   -0.6160    0.0001 C   0  0  0

+   -1.9145   -1.8950    0.0024 Cl  0  0  0

+    1.0467    0.6568    0.0005 C   0  0  0

+   -2.6546    2.8173    0.0006 C   0  0  0

+   -3.4118    0.5804   -0.0060 O   0  0  0

+    1.5539   -2.0586   -0.0016 Cl  0  0  0

+    2.4722    1.0557   -0.0001 N   0  3  0

+    2.7743    2.2356    0.0013 O   0  0  0

+    3.3429    0.2041   -0.0018 O   0  5  0

+   -1.6270    2.9571    0.0000 H   0  0  0

+   -2.7944    3.8449    0.0000 H   0  0  0

+   -3.6822    2.6775    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

+  7 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  5  7  2  0

+  8 14  1  0

+  8 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+130040-14-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    2.0261    0.1443    0.1244 C   0  0  0

+    3.2944    0.7360    0.0552 N   0  0  0

+    1.2626    0.2715    1.2777 C   0  0  0

+    1.5305   -0.5642   -0.9621 C   0  0  0

+    4.3645   -0.0032   -0.2984 C   0  0  0

+    3.4519    2.1105    0.3568 O   0  0  0

+    0.0132   -0.3107    1.3461 C   0  0  0

+    0.2808   -1.1469   -0.8945 C   0  0  0

+    5.0588   -0.8624    0.7268 C   0  0  0

+    4.7687    0.0230   -1.4417 O   0  0  0

+   -0.4810   -1.0243    0.2608 C   0  0  0

+   -2.0761   -1.7678    0.3476 S   0  0  0

+   -3.0880   -0.3570    0.0469 C   0  0  0

+   -4.2679   -0.4874   -0.6754 C   0  0  0

+   -2.7107    0.8880    0.5365 C   0  0  0

+   -5.0584    0.6206   -0.9092 C   0  0  0

+   -3.5060    1.9912    0.2989 C   0  0  0

+   -4.6771    1.8587   -0.4255 C   0  0  0

+    1.1308    1.2380    0.0000 H   0  0  0

+    2.1577   -1.3113    0.0000 H   0  0  0

+    3.5629    3.0796    0.0000 H   0  0  0

+   -0.6156    0.4350    0.0000 H   0  0  0

+    0.4153   -2.1130    0.0000 H   0  0  0

+    4.3001   -1.4755    0.0000 H   0  0  0

+    5.6719   -1.6211    0.0000 H   0  0  0

+    5.8175   -0.2493    0.0000 H   0  0  0

+   -4.6661   -1.3779    0.0000 H   0  0  0

+   -1.7485    1.0484    0.0000 H   0  0  0

+   -6.0213    0.4647    0.0000 H   0  0  0

+   -3.1111    2.8831    0.0000 H   0  0  0

+   -5.2998    2.6095    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

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+  7 11  1  0

+ 11 12  1  0

+ 12 13  1  0

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+ 13 15  1  0

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+ 15 17  2  0

+ 16 18  2  0

+  8 11  2  0

+ 17 18  1  0

+  3 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94339-55-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.5678   -0.1967   -0.0305 C   0  0  0

+   -1.9555    0.0294    0.0029 C   0  0  0

+    0.3196    0.9003    0.0172 C   0  0  0

+   -0.0748   -1.5190   -0.1172 C   0  0  0

+   -2.4481    1.3511    0.0813 C   0  0  0

+   -2.8452   -1.0675   -0.0429 C   0  0  0

+    1.7044    0.6497   -0.0150 C   0  0  0

+   -0.1988    2.2116    0.0949 C   0  0  0

+    1.3084   -1.7301   -0.1500 C   0  0  0

+   -0.9893   -2.5980   -0.1678 C   0  0  0

+   -1.5345    2.4314    0.1243 C   0  0  0

+   -3.8308    1.5547    0.1139 C   0  0  0

+   -2.3242   -2.3815   -0.1238 C   0  0  0

+   -4.2202   -0.8219   -0.0077 C   0  0  0

+    2.1779   -0.6637   -0.0964 C   0  0  0

+    2.6711    1.7609    0.0368 C   0  0  0

+   -4.6911    0.4750    0.0698 C   0  0  0

+    3.6662   -0.9041   -0.1298 C   0  0  0

+    3.9194    1.5631   -0.3722 C   0  0  0

+    4.3566    0.2228   -0.8949 C   0  0  0

+    4.1711   -0.9517    1.2062 O   0  0  0

+    0.4632    3.0324    0.0000 H   0  0  0

+    1.6874   -2.7141    0.0000 H   0  0  0

+   -0.6243   -3.5873    0.0000 H   0  0  0

+   -1.8989    3.4209    0.0000 H   0  0  0

+   -4.2179    2.5356    0.0000 H   0  0  0

+   -2.9848   -3.2034    0.0000 H   0  0  0

+   -4.8992   -1.6287    0.0000 H   0  0  0

+    2.3107    2.7519    0.0000 H   0  0  0

+   -5.7318    0.6453    0.0000 H   0  0  0

+    3.5326   -1.9501    0.0000 H   0  0  0

+    4.6038    2.3653    0.0000 H   0  0  0

+    5.1026   -0.5225    0.0000 H   0  0  0

+    5.2553    0.7745    0.0000 H   0  0  0

+    5.2209   -1.0507    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+ 12 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 18 20  1  0

+ 18 21  1  0

+  8 11  2  0

+  9 15  1  0

+ 10 13  2  0

+ 14 17  1  0

+ 19 20  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+479-92-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -0.2564   -0.2321   -0.0023 N   0  0  0

+   -1.6305    0.0276   -0.0013 C   0  0  0

+    0.7278    0.6901   -0.0001 C   0  0  0

+    0.3461   -1.4971    0.0005 N   0  0  0

+   -2.3162    0.1511   -1.2026 C   0  0  0

+   -2.3137    0.1569    1.2013 C   0  0  0

+    1.9620   -0.0008   -0.0021 C   0  0  0

+    0.5804    1.8990    0.0026 O   0  0  0

+    1.7011   -1.3238   -0.0016 C   0  0  0

+   -0.3557   -2.7831    0.0054 C   0  0  0

+   -3.6735    0.4076   -1.1982 C   0  0  0

+   -3.6705    0.4133    1.1987 C   0  0  0

+    3.3299    0.6314   -0.0016 C   0  0  0

+    2.7302   -2.4247    0.0002 C   0  0  0

+   -4.3494    0.5414    0.0005 C   0  0  0

+    3.4896    1.5026   -1.2491 C   0  0  0

+    3.4909    1.4976    1.2493 C   0  0  0

+   -2.5009   -0.8500    0.0000 H   0  0  0

+   -2.1245    1.1572    0.0000 H   0  0  0

+   -1.2493   -2.2954    0.0000 H   0  0  0

+   -0.8434   -3.6767    0.0000 H   0  0  0

+    0.5379   -3.2708    0.0000 H   0  0  0

+   -3.8669   -0.5919    0.0000 H   0  0  0

+   -3.4816    1.4137    0.0000 H   0  0  0

+    4.1336    0.0066    0.0000 H   0  0  0

+    1.9865   -3.1199    0.0000 H   0  0  0

+    3.4254   -3.1684    0.0000 H   0  0  0

+    3.4739   -1.7295    0.0000 H   0  0  0

+   -5.3489    0.7346    0.0000 H   0  0  0

+    4.4910    1.3190    0.0000 H   0  0  0

+    3.6732    2.5040    0.0000 H   0  0  0

+    2.4882    1.6862    0.0000 H   0  0  0

+    4.4918    1.3116    0.0000 H   0  0  0

+    3.6769    2.4985    0.0000 H   0  0  0

+    2.4900    1.6836    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+ 13 17  1  0

+  7  9  2  0

+ 12 15  1  0

+  5 18  1  0

+  6 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+116-54-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.8818   -0.3616    0.0982 C   0  0  0

+   -0.4798    0.0919    0.5579 C   0  0  0

+    1.9630    0.3897    0.3595 O   0  0  0

+    1.0009   -1.4039   -0.5011 O   0  0  0

+   -0.8663    1.6863   -0.1900 Cl  0  0  0

+   -1.7171   -1.1212    0.0598 Cl  0  0  0

+    3.2750   -0.0473   -0.0834 C   0  0  0

+    0.2980    0.8072    0.0000 H   0  0  0

+    2.9411   -1.0499    0.0000 H   0  0  0

+    4.2776   -0.3812    0.0000 H   0  0  0

+    3.6089    0.9553    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  2  8  1  0

+  7  9  1  0

+  7 10  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+538-74-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    2.6877   -0.0006    0.4766 C   0  0  0

+    1.3896   -0.0017    1.2422 C   0  0  0

+    3.2831    1.1972    0.1271 C   0  0  0

+    3.2859   -1.1971    0.1289 C   0  0  0

+    0.0000   -0.0002    0.0761 S   0  0  0

+    4.4736    1.1982   -0.5751 C   0  0  0

+    4.4768   -1.1961   -0.5734 C   0  0  0

+   -1.3896   -0.0018    1.2422 C   0  0  0

+    5.0690    0.0014   -0.9279 C   0  0  0

+   -2.6877   -0.0008    0.4766 C   0  0  0

+   -3.2829   -1.1973    0.1240 C   0  0  0

+   -3.2861    1.1969    0.1320 C   0  0  0

+   -4.4738   -1.1965   -0.5784 C   0  0  0

+   -4.4766    1.1978   -0.5701 C   0  0  0

+   -5.0690    0.0009   -0.9279 C   0  0  0

+    0.8882   -0.8693    0.0000 H   0  0  0

+    1.8908   -0.8695    0.0000 H   0  0  0

+    2.7549    2.0488    0.0000 H   0  0  0

+    2.7594   -2.0498    0.0000 H   0  0  0

+    5.0009    2.0503    0.0000 H   0  0  0

+    5.0059   -2.0472    0.0000 H   0  0  0

+   -1.8908   -0.8696    0.0000 H   0  0  0

+   -0.8881   -0.8694    0.0000 H   0  0  0

+    6.0711    0.0026    0.0000 H   0  0  0

+   -2.7555   -2.0494    0.0000 H   0  0  0

+   -2.7588    2.0491    0.0000 H   0  0  0

+   -5.0019   -2.0482    0.0000 H   0  0  0

+   -5.0048    2.0494    0.0000 H   0  0  0

+   -6.0711    0.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+ 11 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+  7  9  2  0

+ 14 15  1  0

+  2 16  1  0

+  2 17  1  0

+  3 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6795-23-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    1.3714    0.0562    0.1960 C   0  0  0

+    0.0089    0.2776    0.2259 C   0  0  0

+    2.5475    1.0056    0.3033 C   0  0  1

+    1.8866   -1.2285    0.0672 C   0  0  0

+   -0.8696   -0.8257    0.0868 C   0  0  0

+   -0.4753    1.5302    0.4141 O   0  0  0

+    3.7266    0.0239    0.5906 C   0  0  1

+    2.9020    1.5062   -1.0842 C   0  0  0

+    2.3797    2.0299    1.2855 O   0  0  0

+    3.2458   -1.2117    0.0401 O   0  0  0

+    1.0153   -2.3191   -0.0189 C   0  0  0

+   -2.2504   -0.5616    0.0283 C   0  0  0

+   -0.3505   -2.1281   -0.0044 C   0  0  0

+   -1.7135    1.8612   -0.0436 C   0  0  0

+    4.7490    0.5433   -0.2812 O   0  0  0

+    4.1575    1.1881   -1.3114 C   0  0  0

+   -2.7022    0.7637   -0.0261 C   0  0  0

+   -3.4207   -1.4920    0.0155 C   0  0  0

+   -1.1882   -3.1919   -0.0781 O   0  0  0

+   -1.9862    2.9793   -0.4384 O   0  0  0

+   -4.1460    0.8221   -0.0664 C   0  0  0

+   -4.6730   -0.5978   -0.0440 C   0  0  0

+   -0.3675   -4.3589   -0.1599 C   0  0  0

+   -4.8182    1.8318   -0.1104 O   0  0  0

+    4.4950   -0.6720    0.0000 H   0  0  0

+    2.5434    2.4789    0.0000 H   0  0  0

+    2.2121    3.0530    0.0000 H   0  0  0

+    1.3988   -3.2823    0.0000 H   0  0  0

+    4.6890    2.0782    0.0000 H   0  0  0

+   -4.0989   -2.2761    0.0000 H   0  0  0

+   -2.7030   -2.2401    0.0000 H   0  0  0

+   -5.6093   -0.1528    0.0000 H   0  0  0

+   -5.1987   -1.4913    0.0000 H   0  0  0

+   -1.2155   -4.9553    0.0000 H   0  0  0

+    0.2289   -5.2069    0.0000 H   0  0  0

+    0.4805   -3.7625    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  2  0

+  5 12  1  0

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+  6 14  1  0

+  7 15  1  0

+  8 16  2  0

+ 12 17  2  0

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+ 14 20  2  0

+ 17 21  1  0

+ 18 22  1  0

+ 19 23  1  0

+ 21 24  2  0

+  7 10  1  0

+ 11 13  1  0

+ 14 17  1  0

+ 15 16  1  0

+ 21 22  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 11 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+ 23 34  1  0

+ 23 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+611-13-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.4786    0.1150   -0.0012 C   0  0  0

+   -0.9746    0.2976   -0.0002 C   0  0  0

+    1.4133    1.1118   -0.0002 C   0  0  0

+    1.1294   -1.0671    0.0025 O   0  0  0

+   -1.7895   -0.7774   -0.0014 O   0  0  0

+   -1.4467    1.4185    0.0017 O   0  0  0

+    2.6694    0.4867   -0.0018 C   0  0  0

+    2.4503   -0.8471    0.0001 C   0  0  0

+   -3.2302   -0.5964   -0.0004 C   0  0  0

+    1.2339    2.1096    0.0000 H   0  0  0

+    3.5718    0.9486    0.0000 H   0  0  0

+    3.1679   -1.5631    0.0000 H   0  0  0

+   -3.1038    0.4094    0.0000 H   0  0  0

+   -4.2361   -0.4700    0.0000 H   0  0  0

+   -3.3566   -1.6022    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7  8  2  0

+  3 10  1  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+  9 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+159092-78-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.8639   -0.4520   -0.0029 C   0  0  0

+   -0.3681   -1.2459   -0.0258 C   0  0  0

+    0.7627    0.9573    0.0189 C   0  0  0

+    2.1228   -1.0556    0.0036 C   0  0  0

+   -1.6102   -0.5715   -0.0252 C   0  0  0

+   -0.3384   -2.6412   -0.0484 C   0  0  0

+   -0.5110    1.5723    0.0187 C   0  0  0

+    1.9348    1.7264    0.0409 C   0  0  0

+    3.2458   -0.2786    0.0255 C   0  0  0

+   -2.7946   -1.3209   -0.0469 C   0  0  0

+   -1.6442    0.8423   -0.0033 C   0  0  0

+   -1.5103   -3.3430   -0.0697 C   0  0  0

+   -0.6017    3.0497    0.0416 N   0  3  0

+    3.1506    1.1079    0.0410 C   0  0  0

+    4.5796   -0.9205    0.0328 N   0  3  0

+   -2.7334   -2.6837   -0.0683 C   0  0  0

+   -4.1070   -0.6361   -0.0463 N   0  3  0

+   -1.3500    3.6017    0.8283 O   0  0  0

+    0.0720    3.7132   -0.7262 O   0  5  0

+    5.5857   -0.2342    0.0524 O   0  0  0

+    4.6711   -2.1350    0.0193 O   0  5  0

+   -4.9853   -1.0036    0.7134 O   0  0  0

+   -4.3086    0.2948   -0.8054 O   0  5  0

+    2.2052   -2.0947    0.0000 H   0  0  0

+    0.5738   -3.1455    0.0000 H   0  0  0

+    1.8774    2.7671    0.0000 H   0  0  0

+   -2.5652    1.3303    0.0000 H   0  0  0

+   -1.4868   -4.3851    0.0000 H   0  0  0

+    4.0200    1.6829    0.0000 H   0  0  0

+   -3.6162   -3.2379    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 13 18  2  0

+ 13 19  1  0

+ 15 20  2  0

+ 15 21  1  0

+ 17 22  2  0

+ 17 23  1  0

+  7 11  2  0

+  9 14  1  0

+ 12 16  2  0

+  4 24  1  0

+  6 25  1  0

+  8 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1689-89-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    2.0217   -0.5279   -0.0138 C   0  0  0

+    0.6545   -0.7735    0.0037 C   0  0  0

+    2.4908    0.7673   -0.0382 C   0  0  0

+    2.9760   -1.6593    0.0001 N   0  3  0

+   -0.2462    0.2856   -0.0029 C   0  0  0

+    0.1966   -2.0514    0.0278 O   0  0  0

+    1.5893    1.8349   -0.0455 C   0  0  0

+    3.9604   -1.6170    0.7161 O   0  0  0

+    2.7768   -2.6326   -0.7046 O   0  5  0

+    0.2144    1.5837   -0.0274 C   0  0  0

+   -2.3065   -0.0930    0.0235 I   0  0  0

+    2.0727    3.1826   -0.0709 C   0  0  0

+    2.4562    4.2517   -0.0910 N   0  0  0

+    3.5164    0.9506    0.0000 H   0  0  0

+   -0.1548   -3.0322    0.0000 H   0  0  0

+   -0.4609    2.3770    0.0000 H   0  0  0

+  1  2  2  0

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+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+ 12 13  3  0

+  7 10  1  0

+  3 14  1  0

+  6 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120-14-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.7541    0.7692    0.0019 C   0  0  0

+   -1.1706   -0.5621    0.0008 C   0  0  0

+    0.5927    1.0715    0.0017 C   0  0  0

+   -1.6753    1.7696   -0.0025 O   0  0  0

+   -0.2332   -1.5874   -0.0010 C   0  0  0

+   -2.4957   -0.8566    0.0010 O   0  0  0

+    1.5383    0.0386    0.0004 C   0  0  0

+   -0.9488    3.0001    0.0000 C   0  0  0

+    1.1122   -1.2951   -0.0012 C   0  0  0

+   -2.6021   -2.2816   -0.0003 C   0  0  0

+    2.9728    0.3534    0.0006 C   0  0  0

+    3.7903   -0.5427   -0.0005 O   0  0  0

+    0.9056    2.0676    0.0000 H   0  0  0

+   -0.5498   -2.5823    0.0000 H   0  0  0

+   -0.0497    2.4693    0.0000 H   0  0  0

+   -0.4180    3.8992    0.0000 H   0  0  0

+   -1.8479    3.5309    0.0000 H   0  0  0

+    1.8145   -2.0677    0.0000 H   0  0  0

+   -3.6433   -2.2039    0.0000 H   0  0  0

+   -2.6798   -3.3228    0.0000 H   0  0  0

+   -1.5609   -2.3593    0.0000 H   0  0  0

+    3.2889    1.3485    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  7  9  1  0

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+  5 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1758-68-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.8859    0.2971    0.0813 C   0  0  0

+   -0.6323   -1.0924    0.0593 C   0  0  0

+    0.2359    1.2424    0.2202 C   0  0  0

+   -2.1963    0.7625   -0.0345 C   0  0  0

+    0.7538   -1.5819    0.1751 C   0  0  0

+   -1.6893   -1.9880   -0.0716 C   0  0  0

+    1.6192    0.7543    0.0278 C   0  0  0

+    0.0271    2.4096    0.4893 O   0  0  0

+   -3.2490   -0.1597   -0.1721 C   0  0  0

+   -2.4585    2.1238   -0.0135 N   0  0  0

+    1.8727   -0.6294    0.0052 C   0  0  0

+    0.9745   -2.7548    0.4080 O   0  0  0

+   -2.9870   -1.5204   -0.1807 C   0  0  0

+    2.6705    1.6510   -0.1317 C   0  0  0

+   -4.5579    0.2950   -0.2888 N   0  0  0

+    3.1729   -1.0896   -0.1764 C   0  0  0

+    3.9581    1.1764   -0.3103 C   0  0  0

+    4.2072   -0.1840   -0.3346 C   0  0  0

+   -1.5047   -3.0107    0.0000 H   0  0  0

+   -1.6730    2.8043    0.0000 H   0  0  0

+   -3.4405    2.4638    0.0000 H   0  0  0

+   -3.7768   -2.1959    0.0000 H   0  0  0

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+  1  2  1  0

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+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-83-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.2060    0.7841    0.0018 C   0  0  0

+   -1.7145   -0.5145    0.0004 C   0  0  0

+    0.1656    0.9876    0.0017 C   0  0  0

+   -2.0782    1.8794   -0.0025 N   0  0  0

+   -0.8461   -1.5953   -0.0011 C   0  0  0

+   -3.0993   -0.7264    0.0010 N   0  0  0

+    1.0255   -0.0963    0.0002 C   0  0  0

+    0.5205   -1.3844   -0.0012 C   0  0  0

+    2.7424    0.1605    0.0000 Cl  0  0  0

+    0.5479    1.9547    0.0000 H   0  0  0

+   -1.6976    2.8472    0.0000 H   0  0  0

+   -3.1067    1.7251    0.0000 H   0  0  0

+   -1.2226   -2.5647    0.0000 H   0  0  0

+   -3.7495    0.0852    0.0000 H   0  0  0

+   -3.4771   -1.6953    0.0000 H   0  0  0

+    1.1705   -2.1962    0.0000 H   0  0  0

+  1  2  2  0

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+  6 14  1  0

+  6 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91598-91-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.1358   -0.2883    0.1835 C   0  0  0

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+    2.3212   -1.5414    0.4327 C   0  0  0

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+   -3.9495    1.5275   -0.2033 C   0  0  0

+   -4.9418   -0.7179   -0.3178 O   0  0  0

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+    4.2786   -0.4296   -1.2472 O   0  0  0

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+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-31-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.7767   -0.2209    0.0600 C   0  0  0

+   -1.9214    0.6543    0.0239 C   0  0  0

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+    1.6441   -0.5361    0.1378 N   0  0  0

+    0.7827    1.5115    0.1121 O   0  0  0

+   -2.7532   -1.6659    0.0058 S   0  0  0

+   -4.4662    0.7224   -0.0575 N   0  3  0

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+   -5.4755    0.0414   -0.0909 O   0  0  0

+   -4.5511    1.9374   -0.0583 O   0  5  0

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+    3.1701    1.3335    0.0560 C   0  0  0

+    5.3085   -0.4159   -0.1341 C   0  0  0

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+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96918-17-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+   -1.1800   -0.3062   -0.0013 C   0  0  0

+   -2.5154    0.1368   -0.0011 C   0  0  0

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+   -4.8917   -0.3335   -0.0031 C   0  0  0

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+ 14 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94764-55-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -0.3778   -0.5476   -0.0009 C   0  0  0

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+   -2.6990   -1.6982   -0.0015 C   0  0  0

+   -1.1456    1.8556    0.0007 S   0  0  0

+    1.5892    0.8883   -0.0001 C   0  0  0

+    1.8500   -1.4881    0.0029 C   0  0  0

+   -3.8574    0.8256    0.0003 C   0  0  0

+   -4.0634   -1.5562   -0.0015 C   0  0  0

+    2.4128   -0.2205   -0.0005 C   0  0  0

+   -4.6552   -0.3019   -0.0006 C   0  0  0

+    3.8840   -0.0573   -0.0009 N   0  3  0

+    4.6056   -1.0385   -0.0012 O   0  0  0

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+    0.0925   -2.6230    0.0000 H   0  0  0

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+ 11 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10517-47-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.1206   -0.0079    0.0036 C   0  0  0

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+ 10 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78914-75-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+    2.6727    0.2822   -0.1540 C   0  0  0

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+ 21 40  1  0

+ 21 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84-11-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    0.7389   -0.8530   -0.0300 C   0  0  0

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+   -0.9208   -2.9467    0.0000 H   0  0  0

+    3.3762    1.2387    0.0000 H   0  0  0

+    3.3317   -2.9377    0.0000 H   0  0  0

+   -3.3757    1.2394    0.0000 H   0  0  0

+   -3.3326   -2.9373    0.0000 H   0  0  0

+    4.5572   -0.8645    0.0000 H   0  0  0

+   -4.5572   -0.8637    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  2  0

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+  7 10  1  0

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+ 12 16  2  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+ 16 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56856-83-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    1.1486   -0.1932    0.3103 N   0  0  0

+    0.0507    0.2338    1.1811 C   0  0  0

+    2.1188    0.6165    0.0513 N   0  0  0

+    1.1477   -1.5420   -0.2617 C   0  0  0

+   -0.9944    0.8438    0.3786 O   0  0  0

+    3.0316    0.2615   -0.6727 O   0  0  0

+   -1.9840    0.0876   -0.1218 C   0  0  0

+   -3.0686    0.7208   -0.9547 C   0  0  0

+   -2.0052   -1.1008    0.0954 O   0  0  0

+   -0.7239   -0.2641    0.0000 H   0  0  0

+    0.1428   -0.6824    0.0000 H   0  0  0

+    0.2269   -1.5414    0.0000 H   0  0  0

+    1.1471   -2.4628    0.0000 H   0  0  0

+    2.0685   -1.5426    0.0000 H   0  0  0

+   -2.6043    1.5160    0.0000 H   0  0  0

+   -3.8638    1.1851    0.0000 H   0  0  0

+   -3.5329   -0.0744    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64-17-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+   -0.0910   -0.5950    0.0000 C   0  0  0

+   -1.3411    0.2872    0.0000 C   0  0  0

+    1.0750    0.2311    0.0000 O   0  0  0

+   -0.8292   -1.4235    0.0000 H   0  0  0

+    0.6487   -1.4221    0.0000 H   0  0  0

+   -0.7013    1.1938    0.0000 H   0  0  0

+   -2.2477    0.9270    0.0000 H   0  0  0

+   -1.9809   -0.6194    0.0000 H   0  0  0

+    1.9804    0.8726    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1340-08-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 73 77                          1 V2000

+    0.8949    1.7111    0.8979 C   0  0  0

+    1.3252    1.8056   -0.3915 C   0  0  0

+    1.6928    0.9249    1.8567 C   0  0  0

+   -0.2269    2.3125    1.3293 O   0  0  0

+    0.5686    2.5590   -1.3262 C   0  0  0

+    2.4714    1.1830   -0.7797 O   0  0  0

+    2.9941    1.3221    2.1770 C   0  0  0

+    1.1478   -0.2162    2.4520 C   0  0  0

+   -1.0075    3.0532    0.5150 C   0  0  0

+   -0.6597    3.2061   -0.8385 C   0  0  0

+    0.9227    2.6657   -2.4896 O   0  0  0

+    2.0821    0.0414   -1.5460 C   0  0  2

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+    1.8951   -0.9495    3.3485 C   0  0  0

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+   -1.4675    3.9690   -1.6923 C   0  0  0

+    1.4659   -0.9184   -0.6897 O   0  0  0

+    3.3169   -0.5729   -2.2093 C   0  0  1

+    3.1893   -0.5580    3.6619 C   0  0  0

+    5.0036    0.9656    3.3905 O   0  0  0

+   -2.9498    4.4170    0.1462 C   0  0  0

+   -2.6137    4.5610   -1.1961 C   0  0  0

+   -1.1268    4.1258   -2.9966 O   0  0  0

+    0.9317   -1.9524   -1.5142 C   0  0  2

+    2.8829   -1.7738   -3.0573 C   0  0  2

+    3.9415    0.4013   -3.0477 O   0  0  0

+    3.9218   -1.2847    4.5460 O   0  0  0

+   -4.0751    5.0070    0.6243 O   0  0  0

+    0.0936   -2.9049   -0.6590 C   0  0  0

+    2.0723   -2.7299   -2.1749 C   0  0  2

+    4.0401   -2.4494   -3.5538 O   0  0  0

+   -1.0557   -2.2147   -0.1644 O   0  0  0

+    1.5301   -3.7779   -2.9811 O   0  0  0

+   -1.7356   -3.1180    0.7095 C   0  0  1

+   -2.4906   -2.3234    1.7776 C   0  0  1

+   -2.6536   -3.9080   -0.0439 O   0  0  0

+   -3.4890   -1.3856    1.0896 C   0  0  1

+   -3.1957   -3.2254    2.6327 O   0  0  0

+   -3.4731   -3.0163   -0.7974 C   0  0  2

+   -4.3703   -2.2134    0.1473 C   0  0  2

+   -4.3080   -0.7551    2.0765 O   0  0  0

+   -4.3427   -3.8191   -1.7670 C   0  0  0

+   -5.2040   -1.3390   -0.6159 O   0  0  0

+    3.2123    2.2000    0.0000 H   0  0  0

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+   -4.9563   -3.1544    0.0000 H   0  0  0

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+  1  2  2  0

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+ 42 70  1  0

+ 42 71  1  0

+ 42 72  1  0

+ 43 73  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+131432-92-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    2.4243   -0.6524   -0.0203 C   0  0  0

+    1.2567   -1.6004   -0.1156 C   0  0  0

+    2.9189   -0.2871    1.2181 C   0  0  0

+    3.0043   -0.1525   -1.1709 C   0  0  0

+    0.0064   -0.8369   -0.1140 N   0  0  0

+    3.9897    0.5824    1.3055 C   0  0  0

+    4.0755    0.7172   -1.0835 C   0  0  0

+   -1.1757   -1.4795   -0.1920 C   0  0  0

+    4.5662    1.0869    0.1546 C   0  0  0

+   -2.4619   -0.6941   -0.1904 C   0  0  1

+   -1.2044   -2.6899   -0.2635 O   0  0  0

+   -3.3150   -1.1151    1.0079 C   0  0  0

+   -2.0572    1.2257   -0.0645 Br  0  0  0

+    0.6366   -2.3965    0.0000 H   0  0  0

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+   -3.2590   -0.0754    0.0000 H   0  0  0

+   -3.7616   -0.2102    0.0000 H   0  0  0

+   -4.2199   -1.5617    0.0000 H   0  0  0

+   -2.8684   -2.0200    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122088-20-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 43                          1 V2000

+   -0.8354    0.4991   -0.1043 C   0  0  0

+   -2.1322   -0.0263   -0.1877 C   0  0  0

+   -0.6565    1.9515   -0.0122 C   0  0  0

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+   -2.3585   -1.5109   -0.2900 C   0  0  1

+    0.5665    2.4660    0.0648 N   0  0  0

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+   -3.0355    2.2250   -0.0860 C   0  0  0

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+   -3.6348   -1.8939    0.4572 C   0  0  2

+   -2.4826   -1.8801   -1.6649 O   0  0  0

+    1.6494    1.6966    0.0634 C   0  0  0

+    2.7696   -0.5300   -0.0050 C   0  0  0

+   -4.7770   -1.0129    0.0319 C   0  0  0

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+    2.7096   -1.9224   -0.0779 C   0  0  0

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+    0.2078   -1.3681    0.0000 H   0  0  0

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+ 20 35  1  0

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+ 22 37  1  0

+ 23 38  1  0

+ 24 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+135086-96-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -4.4433    0.5195    0.1174 C   0  0  0

+   -4.7727   -0.8402    0.0646 C   0  0  0

+   -3.0844    0.8923    0.0541 C   0  0  0

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+    0.0935   -0.6999   -0.2261 C   0  0  0

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+    2.4832   -1.3667   -0.4083 C   0  0  0

+    1.9258    0.9830   -0.2537 C   0  0  0

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+    3.2640    1.3004   -0.3186 C   0  0  0

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+    6.0328   -0.6324    1.2833 O   0  0  0

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+  1  2  2  0

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+ 19 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52417-22-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+   -4.2580    1.3087   -0.3477 C   0  0  0

+   -5.0419    0.4103    0.4234 C   0  0  0

+   -3.0891    0.9256   -0.8592 N   0  0  0

+   -4.7403    2.6146   -0.5690 C   0  0  0

+   -4.5740   -0.8998    0.6478 C   0  0  0

+   -6.2718    0.8381    0.9513 C   0  0  0

+   -2.6079   -0.3021   -0.6728 C   0  0  0

+   -5.9374    2.9913   -0.0461 C   0  0  0

+   -3.3324   -1.2582    0.0871 C   0  0  0

+   -5.3063   -1.8001    1.3913 N   0  0  0

+   -6.6997    2.1088    0.7185 C   0  0  0

+   -1.3667   -0.6744   -1.2287 C   0  0  0

+   -2.8031   -2.5474    0.2688 C   0  0  0

+   -0.8868   -1.9306   -1.0315 C   0  0  0

+   -1.6019   -2.8668   -0.2846 C   0  0  0

+    8.0980   -0.4815   -0.4811 O   0  0  0

+   16.6435    0.6332    0.3740 Cl  0  0  0

+   -4.0719    3.3165    0.0000 H   0  0  0

+   -6.9605    0.1562    0.0000 H   0  0  0

+   -6.2022    3.9236    0.0000 H   0  0  0

+   -6.2633   -1.6464    0.0000 H   0  0  0

+   -4.9609   -2.7057    0.0000 H   0  0  0

+   -7.6508    2.2955    0.0000 H   0  0  0

+   -0.7070    0.0357    0.0000 H   0  0  0

+   -3.4426   -3.2757    0.0000 H   0  0  0

+    0.0724   -2.0694    0.0000 H   0  0  0

+   -1.2885   -3.7839    0.0000 H   0  0  0

+    7.1288   -0.4815    0.0000 H   0  0  0

+    9.0672   -0.4815    0.0000 H   0  0  0

+   17.6127    0.6332    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+  7  9  1  0

+  8 11  2  0

+ 14 15  1  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+952-97-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.0082   -1.0864    0.0025 C   0  0  0

+   -1.6158   -1.7699   -0.0057 S   0  0  0

+    0.6146   -0.7459    1.2059 C   0  0  0

+    0.6879   -0.8918   -1.1937 C   0  0  0

+   -2.5709   -0.2892   -0.0159 C   0  0  0

+    1.8874   -0.2110    1.2085 C   0  0  0

+    1.9608   -0.3563   -1.1834 C   0  0  0

+   -3.9476   -0.3472    0.1631 C   0  0  0

+   -1.9483    0.9401   -0.1974 C   0  0  0

+    2.5590   -0.0138    0.0154 C   0  0  0

+   -4.6930    0.8153    0.1544 C   0  0  0

+   -2.6998    2.0982   -0.2049 C   0  0  0

+    3.9234    0.5604    0.0223 N   0  3  0

+   -4.0709    2.0361   -0.0321 C   0  0  0

+    4.5161    0.7346   -1.0274 O   0  0  0

+    4.4533    0.8586    1.0777 O   0  5  0

+    0.1607    0.1825    0.0000 H   0  0  0

+    1.0311   -1.8666    0.0000 H   0  0  0

+    1.5411    0.7627    0.0000 H   0  0  0

+    2.4188   -1.2827    0.0000 H   0  0  0

+   -4.4241   -1.2642    0.0000 H   0  0  0

+   -0.9163    0.9953    0.0000 H   0  0  0

+   -5.7252    0.7642    0.0000 H   0  0  0

+   -2.2272    3.0172    0.0000 H   0  0  0

+   -4.6307    2.9048    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 13 15  2  0

+ 13 16  1  0

+  7 10  2  0

+ 12 14  1  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50700-49-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.2781    0.5131    0.1729 C   0  0  0

+    0.0951   -0.9006    0.0000 C   0  0  0

+    0.7644    1.5523    0.2029 C   0  0  0

+   -1.5488    0.8497    0.2955 N   0  0  0

+    1.3873   -1.2433   -0.1304 C   0  0  0

+    2.0571    1.2113    0.0726 C   0  0  0

+   -2.5116   -0.0417    0.0026 C   0  0  0

+    2.4317   -0.2037   -0.1005 C   0  0  0

+   -3.5914    0.3133   -0.9869 C   0  0  0

+   -2.5111   -1.1322    0.5348 O   0  0  0

+    3.6012   -0.5131   -0.2180 O   0  0  0

+   -0.6143   -1.6092    0.0000 H   0  0  0

+    0.5038    2.5205    0.0000 H   0  0  0

+    1.6469   -2.2118    0.0000 H   0  0  0

+    2.7658    1.9206    0.0000 H   0  0  0

+   -3.2783    1.2658    0.0000 H   0  0  0

+   -4.5439    0.6264    0.0000 H   0  0  0

+   -3.9045   -0.6392    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

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+  8 11  2  0

+  6  8  1  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+133-06-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.4023    0.0830   -0.8929 N   0  0  0

+    1.0989   -1.0733   -0.7648 C   0  0  0

+    1.1117    1.1968   -0.5617 C   0  0  0

+   -1.1692    0.1362   -1.4125 S   0  0  0

+    2.5395   -0.7046   -0.5233 C   0  0  0

+    0.6463   -2.1959   -0.8319 O   0  0  0

+    2.3692    0.7107    0.0298 C   0  0  0

+    0.7768    2.3509   -0.7210 O   0  0  0

+   -2.0315   -0.0062    0.1770 C   0  0  0

+    3.2955   -1.5173    0.5072 C   0  0  0

+    3.6103    1.4543    0.2754 C   0  0  0

+   -3.8127    0.0255   -0.1006 Cl  0  0  0

+   -1.5747   -1.5589    0.9716 Cl  0  0  0

+   -1.5643    1.3731    1.2400 Cl  0  0  0

+    4.5652   -0.7686    0.8261 C   0  0  0

+    4.7165    0.5143    0.6844 C   0  0  0

+    3.5093   -0.2545    0.0000 H   0  0  0

+    2.2779    1.7759    0.0000 H   0  0  0

+    2.4622   -2.1872    0.0000 H   0  0  0

+    3.9035   -2.3967    0.0000 H   0  0  0

+    4.3870    2.1890    0.0000 H   0  0  0

+    2.9644    2.3063    0.0000 H   0  0  0

+    5.4608   -1.3525    0.0000 H   0  0  0

+    5.7115    0.9054    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

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+  9 12  1  0

+  9 13  1  0

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+  5  7  1  0

+ 15 16  2  0

+  5 17  1  0

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+ 10 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25155-25-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 58                          1 V2000

+    1.1970   -0.0254    0.0172 C   0  0  0

+   -0.0002    0.6659    0.0000 C   0  0  0

+    2.5019    0.7281    0.0398 C   0  0  0

+    1.1970   -1.4075    0.0193 C   0  0  0

+   -1.1970   -0.0252   -0.0208 C   0  0  0

+    3.5880   -0.2005    0.0545 O   0  0  0

+    2.6026    1.6110   -1.2057 C   0  0  0

+    2.5631    1.6045    1.2924 C   0  0  0

+   -0.0003   -2.0988    0.0043 C   0  0  0

+   -2.5020    0.7283   -0.0394 C   0  0  0

+   -1.1969   -1.4077   -0.0249 C   0  0  0

+    4.8243    0.5925    0.0762 O   0  0  0

+   -3.5880   -0.2003   -0.0591 O   0  0  0

+   -2.6028    1.6046    1.2107 C   0  0  0

+   -2.5633    1.6112   -1.2875 C   0  0  0

+    5.9096   -0.3318   -0.0228 C   0  0  0

+   -4.8244    0.5927   -0.0766 O   0  0  0

+    5.7919   -1.1185   -1.3298 C   0  0  0

+    7.2344    0.4334   -0.0058 C   0  0  0

+    5.8646   -1.2999    1.1610 C   0  0  0

+   -5.9095   -0.3319    0.0230 C   0  0  0

+   -7.2343    0.4333    0.0103 C   0  0  0

+   -5.8670   -1.2977   -1.1628 C   0  0  0

+   -5.7889   -1.1211    1.3282 C   0  0  0

+   -0.0002    1.7028    0.0000 H   0  0  0

+    2.0950   -1.9259    0.0000 H   0  0  0

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+    2.7201    2.6412    0.0000 H   0  0  0

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+    2.6353    2.6388    0.0000 H   0  0  0

+    1.5288    1.6767    0.0000 H   0  0  0

+   -0.0004   -3.1357    0.0000 H   0  0  0

+   -2.0949   -1.9261    0.0000 H   0  0  0

+   -1.5727    1.7231    0.0000 H   0  0  0

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+   -1.5289    1.6830    0.0000 H   0  0  0

+   -2.6351    2.6456    0.0000 H   0  0  0

+   -3.5977    1.5394    0.0000 H   0  0  0

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+    6.8173   -1.2719    0.0000 H   0  0  0

+    7.7530   -0.4644    0.0000 H   0  0  0

+    8.1322    0.9520    0.0000 H   0  0  0

+    6.7158    1.3312    0.0000 H   0  0  0

+    4.8289   -1.2518    0.0000 H   0  0  0

+    5.8165   -2.3356    0.0000 H   0  0  0

+    6.9003   -1.3480    0.0000 H   0  0  0

+   -6.7157    1.3311    0.0000 H   0  0  0

+   -8.1321    0.9519    0.0000 H   0  0  0

+   -7.7529   -0.4645    0.0000 H   0  0  0

+   -6.9029   -1.3433    0.0000 H   0  0  0

+   -5.8214   -2.3336    0.0000 H   0  0  0

+   -4.8311   -1.2521    0.0000 H   0  0  0

+   -6.8139   -1.2777    0.0000 H   0  0  0

+   -5.6323   -2.1461    0.0000 H   0  0  0

+   -4.7639   -0.9645    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

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+ 21 24  1  0

+  9 11  2  0

+  2 25  1  0

+  4 26  1  0

+  7 27  1  0

+  7 28  1  0

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+  8 30  1  0

+  8 31  1  0

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+ 11 34  1  0

+ 14 35  1  0

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+ 23 53  1  0

+ 23 54  1  0

+ 23 55  1  0

+ 24 56  1  0

+ 24 57  1  0

+ 24 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-09-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.1572   -0.2469    0.0033 C   0  0  0

+   -0.3552   -1.3820    0.0036 C   0  0  0

+   -0.5724    1.0134    0.0015 C   0  0  0

+   -2.9120   -0.4059   -0.0022 S   0  0  0

+    1.0195   -1.2542    0.0021 C   0  0  0

+    0.8033    1.1348    0.0000 C   0  0  0

+   -3.3869    1.3449   -0.0005 C   0  0  0

+    1.5991    0.0028    0.0003 C   0  0  0

+    3.3280    0.1594   -0.0015 Cl  0  0  0

+   -0.7910   -2.3285    0.0000 H   0  0  0

+   -1.1712    1.8662    0.0000 H   0  0  0

+    1.6213   -2.1049    0.0000 H   0  0  0

+    1.2424    2.0798    0.0000 H   0  0  0

+   -2.3812    1.6177    0.0000 H   0  0  0

+   -3.6597    2.3506    0.0000 H   0  0  0

+   -4.3926    1.0721    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  6  8  2  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6957-71-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.3826   -0.4893   -0.1836 C   0  0  0

+   -1.8529   -0.4113   -0.0005 C   0  0  0

+    0.1383    0.7972   -0.3041 C   0  0  0

+    0.4780   -1.5877   -0.2409 C   0  0  0

+   -2.2512    0.9226   -0.0065 C   0  0  0

+   -2.8128   -1.4123    0.1631 C   0  0  0

+   -1.0145    1.7656   -0.1990 C   0  0  0

+    1.4905    0.9862   -0.4830 C   0  0  0

+    1.8306   -1.3958   -0.4212 C   0  0  0

+   -3.5814    1.2513    0.1481 C   0  0  0

+   -4.1410   -1.0741    0.3166 C   0  0  0

+    2.3434   -0.1102   -0.5443 C   0  0  0

+   -4.5270    0.2545    0.3102 C   0  0  0

+    3.7165    0.0809   -0.7261 N   0  0  0

+    4.5221    0.2403    0.3426 C   0  0  0

+    4.0723    0.1267    1.4633 O   0  0  0

+    0.0901   -2.5515    0.0000 H   0  0  0

+   -2.5272   -2.4112    0.0000 H   0  0  0

+   -0.2765    2.4969    0.0000 H   0  0  0

+   -1.6755    2.5671    0.0000 H   0  0  0

+    1.8811    1.9489    0.0000 H   0  0  0

+    2.4726   -2.2126    0.0000 H   0  0  0

+   -3.8732    2.2484    0.0000 H   0  0  0

+   -4.8632   -1.8209    0.0000 H   0  0  0

+   -5.5366    0.4996    0.0000 H   0  0  0

+    3.8890   -0.9436    0.0000 H   0  0  0

+    5.5357    0.4684    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  5 10  1  0

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+  8 12  1  0

+ 10 13  2  0

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+ 15 16  2  0

+  5  7  1  0

+  9 12  2  0

+ 11 13  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

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+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+128-66-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 43                          1 V2000

+    0.6969   -0.1150    0.0023 C   0  0  0

+   -0.6969    0.1144    0.0015 C   0  0  0

+    1.5849    0.9843    0.0012 C   0  0  0

+    1.1808   -1.4424   -0.0018 C   0  0  0

+   -1.5852   -0.9851    0.0029 C   0  0  0

+   -1.1804    1.4415   -0.0002 C   0  0  0

+    3.0441    0.7635    0.0013 C   0  0  0

+    1.0800    2.2806   -0.0003 C   0  0  0

+    2.6340   -1.6940   -0.0012 C   0  0  0

+    0.2854   -2.5074   -0.0069 C   0  0  0

+   -3.0444   -0.7638    0.0014 C   0  0  0

+   -1.0801   -2.2809    0.0052 C   0  0  0

+   -2.6335    1.6936   -0.0011 C   0  0  0

+   -0.2850    2.5070   -0.0006 C   0  0  0

+    3.5597   -0.5461    0.0031 C   0  0  0

+    3.9207    1.8468   -0.0007 C   0  0  0

+    3.0630   -2.8325   -0.0044 O   0  0  0

+   -3.5595    0.5461   -0.0007 C   0  0  0

+   -3.9218   -1.8465    0.0026 C   0  0  0

+   -3.0622    2.8323   -0.0020 O   0  0  0

+    4.9393   -0.7474    0.0027 C   0  0  0

+    5.2843    1.6284   -0.0010 C   0  0  0

+   -4.9389    0.7483   -0.0021 C   0  0  0

+   -5.2852   -1.6271    0.0017 C   0  0  0

+    5.7910    0.3392    0.0007 C   0  0  0

+   -5.7913   -0.3378   -0.0013 C   0  0  0

+    1.7387    3.0921    0.0000 H   0  0  0

+    0.6474   -3.4879    0.0000 H   0  0  0

+   -1.7387   -3.0925    0.0000 H   0  0  0

+   -0.6471    3.4875    0.0000 H   0  0  0

+    3.5468    2.8228    0.0000 H   0  0  0

+   -3.5486   -2.8228    0.0000 H   0  0  0

+    5.3275   -1.7178    0.0000 H   0  0  0

+    5.9395    2.4427    0.0000 H   0  0  0

+   -5.3265    1.7190    0.0000 H   0  0  0

+   -5.9409   -2.4410    0.0000 H   0  0  0

+    6.8252    0.1880    0.0000 H   0  0  0

+   -6.8254   -0.1861    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  2  0

+  9 17  2  0

+ 11 18  1  0

+ 11 19  2  0

+ 13 20  2  0

+ 15 21  2  0

+ 16 22  1  0

+ 18 23  2  0

+ 19 24  1  0

+ 21 25  1  0

+ 23 26  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 12  1  0

+ 13 18  1  0

+ 22 25  2  0

+ 24 26  2  0

+  8 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 19 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+ 24 36  1  0

+ 25 37  1  0

+ 26 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+77-09-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -0.0159   -0.2726    0.4033 C   0  0  0

+   -0.1590   -1.4335   -0.5484 C   0  0  0

+    1.2904    0.4382    0.1591 C   0  0  0

+   -1.1660    0.6852    0.2273 C   0  0  0

+   -0.0346   -0.8355    1.7437 O   0  0  0

+   -0.2518   -2.5814    0.2433 C   0  0  0

+   -0.2077   -1.5303   -1.9196 C   0  0  0

+    1.5510    0.9972   -1.0781 C   0  0  0

+    2.2239    0.5350    1.1747 C   0  0  0

+   -2.3230    0.2658   -0.4023 C   0  0  0

+   -1.0643    1.9804    0.7010 C   0  0  0

+   -0.1707   -2.1692    1.6564 C   0  0  0

+   -0.3940   -3.8276   -0.3699 C   0  0  0

+   -0.3493   -2.7700   -2.5206 C   0  0  0

+    2.7477    1.6498   -1.3044 C   0  0  0

+    3.4217    1.1863    0.9536 C   0  0  0

+   -3.3791    1.1419   -0.5645 C   0  0  0

+   -2.1171    2.8601    0.5414 C   0  0  0

+   -0.2203   -2.9262    2.6050 O   0  0  0

+   -0.4413   -3.9131   -1.7459 C   0  0  0

+    3.6879    1.7437   -0.2889 C   0  0  0

+   -3.2776    2.4431   -0.0949 C   0  0  0

+    4.8658    2.3847   -0.5091 O   0  0  0

+   -4.3148    3.3068   -0.2536 O   0  0  0

+   -1.0940   -1.2659    0.0000 H   0  0  0

+    0.8767    1.6302    0.0000 H   0  0  0

+    2.4978   -0.3484    0.0000 H   0  0  0

+   -2.4816   -0.6454    0.0000 H   0  0  0

+   -0.2118    2.3390    0.0000 H   0  0  0

+    0.4869   -4.1093    0.0000 H   0  0  0

+   -1.2698   -2.6804    0.0000 H   0  0  0

+    2.4749    2.5335    0.0000 H   0  0  0

+    4.0926    0.5497    0.0000 H   0  0  0

+   -4.2309    0.7816    0.0000 H   0  0  0

+   -1.9556    3.7707    0.0000 H   0  0  0

+   -0.7083   -4.7986    0.0000 H   0  0  0

+    5.6782    2.8268    0.0000 H   0  0  0

+   -5.0255    3.8986    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

+  3  9  1  0

+  4 10  2  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  2  0

+  8 15  1  0

+  9 16  2  0

+ 10 17  1  0

+ 11 18  2  0

+ 12 19  2  0

+ 13 20  2  0

+ 15 21  2  0

+ 17 22  2  0

+ 21 23  1  0

+ 22 24  1  0

+  6 12  1  0

+ 14 20  1  0

+ 16 21  1  0

+ 18 22  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 20 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+623-25-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.2897    0.0024   -0.4931 C   0  0  0

+   -0.6450   -1.1957   -0.2473 C   0  0  0

+   -0.6440    1.1986   -0.2428 C   0  0  0

+   -2.6940    0.0042   -1.0397 C   0  0  0

+    0.6451   -1.1973    0.2486 C   0  0  0

+    0.6464    1.1970    0.2533 C   0  0  0

+   -3.8707   -0.0020    0.3264 Cl  0  0  0

+    1.2909   -0.0007    0.4989 C   0  0  0

+    2.6977   -0.0025    1.0392 C   0  0  0

+    3.8682   -0.0001   -0.3323 Cl  0  0  0

+   -1.1685   -2.0707    0.0000 H   0  0  0

+   -1.1659    2.0746    0.0000 H   0  0  0

+   -2.1850    0.8877    0.0000 H   0  0  0

+   -3.2066    0.8857    0.0000 H   0  0  0

+    1.1670   -2.0733    0.0000 H   0  0  0

+    1.1699    2.0720    0.0000 H   0  0  0

+    2.1877   -0.8855    0.0000 H   0  0  0

+    3.2084   -0.8851    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  9 10  1  0

+  6  8  2  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-93-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.4700    0.6035    0.0061 C   0  0  0

+   -0.4700   -0.6035   -0.0061 C   0  0  0

+    2.3351   -0.0182   -0.0002 Br  0  0  0

+   -2.3351    0.0182    0.0002 Br  0  0  0

+    1.0914    1.9406    0.0000 H   0  0  0

+   -0.7883    1.3721    0.0000 H   0  0  0

+   -1.0914   -1.9406    0.0000 H   0  0  0

+    0.7883   -1.3721    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33813-20-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 14                          1 V2000

+   -0.2336   -0.6702    0.0020 N   0  0  0

+   -1.4271    0.0019    0.0021 C   0  0  0

+    1.0268   -0.1442    0.0005 C   0  0  0

+   -0.5896   -2.1345   -0.0026 C   0  0  0

+   -1.0929    1.7707   -0.0003 S   0  0  0

+   -2.4982   -0.7474    0.0042 N   0  0  0

+    0.9907    1.5894   -0.0016 S   0  0  0

+    2.4613   -1.0786    0.0011 S   0  0  0

+   -2.1209   -2.1598   -0.0050 C   0  0  0

+   -0.6676   -3.2713    0.0000 H   0  0  0

+    0.5364   -2.3087    0.0000 H   0  0  0

+   -3.2420   -2.3633    0.0000 H   0  0  0

+   -2.0094   -3.2938    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5  7  1  0

+  6  9  1  0

+  4 10  1  0

+  4 11  1  0

+  9 12  1  0

+  9 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+513-85-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.7128   -0.2778   -0.4665 C   0  0  0

+   -0.7128    0.2778   -0.4665 C   0  0  0

+    1.7118    0.8810   -0.4665 C   0  0  0

+    0.9119   -1.0784    0.7003 O   0  0  0

+   -1.7118   -0.8810   -0.4665 C   0  0  0

+   -0.9119    1.0784    0.7003 O   0  0  0

+    1.8290   -0.5437    0.0000 H   0  0  0

+   -1.8290    0.5437    0.0000 H   0  0  0

+    2.5809    0.1318    0.0000 H   0  0  0

+    2.4611    1.7501    0.0000 H   0  0  0

+    0.8427    1.6302    0.0000 H   0  0  0

+    1.1888   -2.1920    0.0000 H   0  0  0

+   -2.5809   -0.1318    0.0000 H   0  0  0

+   -2.4611   -1.7501    0.0000 H   0  0  0

+   -0.8427   -1.6302    0.0000 H   0  0  0

+   -1.1888    2.1920    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+999-29-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    1.8712   -0.1981   -0.0009 C   0  0  0

+    0.5841    0.5858    0.0002 C   0  0  0

+    3.0491    0.4456   -0.0002 O   0  0  0

+    1.8429   -1.4060    0.0025 O   0  0  0

+   -0.5514   -0.3398   -0.0009 N   0  0  0

+    4.2892   -0.3096   -0.0013 C   0  0  0

+   -1.8112    0.1391   -0.0001 C   0  0  0

+    5.4751    0.6571   -0.0001 C   0  0  0

+   -2.8978   -0.7467   -0.0012 C   0  0  0

+   -2.0057    1.3421    0.0015 O   0  0  0

+   -4.0662   -0.3025   -0.0005 N   0  3  0

+   -5.1169    0.0969    0.0001 N   0  5  0

+    1.2041    1.3841    0.0000 H   0  0  0

+   -0.1390    1.2921    0.0000 H   0  0  0

+   -0.3900   -1.3377    0.0000 H   0  0  0

+    3.6692   -1.1080    0.0000 H   0  0  0

+    5.0123   -1.0159    0.0000 H   0  0  0

+    6.1138   -0.1264    0.0000 H   0  0  0

+    6.2586    1.2958    0.0000 H   0  0  0

+    4.8364    1.4406    0.0000 H   0  0  0

+   -2.7364   -1.7446    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  7 10  2  0

+  9 11  2  0

+ 11 12  2  0

+  2 13  1  0

+  2 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99520-64-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 41                          1 V2000

+    0.7875   -0.5811    0.1159 C   0  0  0

+   -0.5717   -0.3135    0.0650 C   0  0  0

+    1.6969    0.5657    0.0935 C   0  0  0

+    1.1926   -1.9162    0.1790 C   0  0  0

+   -1.1318    1.0234   -0.0104 C   0  0  0

+   -1.5643   -1.2918    0.0798 C   0  0  0

+    3.0785    0.3803    0.1448 C   0  0  0

+    1.1390    1.8659    0.0191 C   0  0  0

+    2.6706   -2.2129    0.2335 C   0  0  0

+    0.2314   -2.9005    0.1883 C   0  0  0

+   -2.5952    0.8206   -0.0423 C   0  0  0

+   -0.2621    2.0743   -0.0323 C   0  0  0

+   -2.8513   -0.5713    0.0133 C   0  0  0

+   -1.1327   -2.6105    0.1481 C   0  0  0

+    3.6426   -1.0179    0.2248 C   0  0  0

+    3.9006    1.4695    0.1222 C   0  0  0

+    2.0203    2.9610   -0.0026 C   0  0  0

+    3.2929   -1.7340   -0.9608 O   0  0  0

+   -3.6628    1.7107   -0.1119 C   0  0  0

+   -4.1702   -1.0199   -0.0013 C   0  0  0

+    3.3668    2.7518    0.0487 C   0  0  0

+   -4.9598    1.2419   -0.1252 C   0  0  0

+   -5.2119   -0.1192   -0.0699 C   0  0  0

+    2.9078   -3.2309    0.0000 H   0  0  0

+    0.5342   -3.9009    0.0000 H   0  0  0

+   -0.6361    3.0504    0.0000 H   0  0  0

+   -1.8313   -3.3880    0.0000 H   0  0  0

+    4.6872   -1.0549    0.0000 H   0  0  0

+    4.9376    1.3381    0.0000 H   0  0  0

+    1.6428    3.9357    0.0000 H   0  0  0

+   -3.4818    2.7402    0.0000 H   0  0  0

+   -4.3702   -2.0458    0.0000 H   0  0  0

+    4.0120    3.5742    0.0000 H   0  0  0

+   -5.7569    1.9181    0.0000 H   0  0  0

+   -6.1982   -0.4652    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  2  0

+  9 18  1  0

+ 11 19  1  0

+ 13 20  1  0

+ 16 21  2  0

+ 19 22  2  0

+ 20 23  2  0

+  8 12  1  0

+  9 15  1  0

+ 10 14  2  0

+ 11 13  2  0

+ 15 18  1  0

+ 17 21  1  0

+ 22 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141-43-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.7546   -0.6481   -0.3060 C   0  0  0

+   -0.6456   -0.6638    0.3105 C   0  0  0

+    1.4674    0.5606    0.1286 N   0  0  0

+   -1.3668    0.4938   -0.1160 O   0  0  0

+    0.5768   -1.6832    0.0000 H   0  0  0

+    1.7406   -1.0097    0.0000 H   0  0  0

+   -1.6228   -1.0486    0.0000 H   0  0  0

+   -0.4440   -1.6945    0.0000 H   0  0  0

+    2.5176    0.5509    0.0000 H   0  0  0

+    0.9507    1.4749    0.0000 H   0  0  0

+   -1.9221    1.3852    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+36164-42-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -1.3280    0.6112   -0.0596 C   0  0  0

+   -1.5828   -0.7820   -0.1168 C   0  0  0

+   -0.0122    1.0738   -0.2235 C   0  0  0

+   -2.3358    1.4641    0.1539 N   0  0  0

+   -0.5224   -1.6777   -0.3350 C   0  0  0

+   -2.9028   -1.2404    0.0481 C   0  0  0

+    1.0051    0.1701   -0.4363 C   0  0  0

+   -3.5660    1.0392    0.3132 C   0  0  0

+    0.7424   -1.2042   -0.4901 C   0  0  0

+   -3.8861   -0.3150    0.2573 C   0  0  0

+    2.3146    0.6299   -0.5995 N   0  0  0

+    3.3007    0.1470    0.1821 C   0  0  0

+    4.7314    0.5409   -0.0804 C   0  0  0

+    3.0366   -0.6046    1.0966 O   0  0  0

+    0.1886    2.0952    0.0000 H   0  0  0

+   -0.7001   -2.7033    0.0000 H   0  0  0

+   -3.1202   -2.2584    0.0000 H   0  0  0

+   -4.3381    1.7374    0.0000 H   0  0  0

+    1.5380   -1.8754    0.0000 H   0  0  0

+   -4.8830   -0.6144    0.0000 H   0  0  0

+    2.3758    1.6690    0.0000 H   0  0  0

+    5.0077   -0.4627    0.0000 H   0  0  0

+    5.7350    0.8172    0.0000 H   0  0  0

+    4.4551    1.5445    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+  7  9  1  0

+  8 10  1  0

+  3 15  1  0

+  5 16  1  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7704-40-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.1482    0.9242   -0.0024 C   0  0  0

+   -1.1494   -0.5440   -0.0013 C   0  0  0

+    0.0001    1.5918   -0.0026 N   0  0  0

+   -2.3856    1.6058    0.0026 C   0  0  0

+    0.0001   -1.2141    0.0001 N   0  0  0

+   -2.3838   -1.2214   -0.0011 C   0  0  0

+    1.1482    0.9244   -0.0017 C   0  0  0

+   -3.5417    0.8984    0.0084 C   0  0  0

+    1.1493   -0.5441    0.0004 C   0  0  0

+   -3.5455   -0.5047   -0.0021 C   0  0  0

+    2.3857    1.6059   -0.0017 C   0  0  0

+    2.3838   -1.2215    0.0012 C   0  0  0

+   -4.7628   -1.1819   -0.0019 N   0  0  0

+    3.5417    0.8984   -0.0007 C   0  0  0

+    3.5455   -0.5047    0.0010 C   0  0  0

+    4.7628   -1.1819    0.0023 N   0  0  0

+   -2.4094    2.6503    0.0000 H   0  0  0

+   -2.4104   -2.2658    0.0000 H   0  0  0

+   -4.4524    1.4104    0.0000 H   0  0  0

+    2.4096    2.6504    0.0000 H   0  0  0

+    2.4104   -2.2659    0.0000 H   0  0  0

+   -5.6591   -0.6452    0.0000 H   0  0  0

+   -4.7794   -2.2265    0.0000 H   0  0  0

+    4.4524    1.4104    0.0000 H   0  0  0

+    4.7794   -2.2265    0.0000 H   0  0  0

+    5.6591   -0.6452    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  2  0

+ 12 15  2  0

+ 15 16  1  0

+  7  9  1  0

+  8 10  1  0

+ 14 15  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1912-24-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    0.9226   -0.7265    0.0516 C   0  0  0

+   -0.2183   -1.4071    0.0184 N   0  0  0

+    0.9017    0.6039    0.0680 N   0  0  0

+    2.1275   -1.3987    0.0748 N   0  0  0

+   -1.3764   -0.7563    0.0018 C   0  0  0

+   -0.2533    1.2491    0.0514 C   0  0  0

+    3.3848   -0.6476    0.1113 C   0  0  0

+   -1.3907    0.5744    0.0183 N   0  0  0

+   -2.5634   -1.4595   -0.0322 N   0  0  0

+   -0.2763    2.9848    0.0735 Cl  0  0  0

+    4.4457   -1.4648    0.8513 C   0  0  0

+    3.8570   -0.3739   -1.3180 C   0  0  0

+   -3.8400   -0.7411   -0.0506 C   0  0  0

+   -4.9913   -1.7481   -0.0875 C   0  0  0

+    2.1423   -2.3998    0.0000 H   0  0  0

+    2.8770    0.2153    0.0000 H   0  0  0

+   -2.5523   -2.4607    0.0000 H   0  0  0

+    3.8347   -2.2580    0.0000 H   0  0  0

+    5.2389   -2.0758    0.0000 H   0  0  0

+    5.0567   -0.6716    0.0000 H   0  0  0

+    4.3591   -1.2401    0.0000 H   0  0  0

+    4.7232    0.1282    0.0000 H   0  0  0

+    3.3549    0.4923    0.0000 H   0  0  0

+   -3.2536    0.0704    0.0000 H   0  0  0

+   -4.5801   -0.0668    0.0000 H   0  0  0

+   -5.6505   -0.9945    0.0000 H   0  0  0

+   -5.7449   -2.4073    0.0000 H   0  0  0

+   -4.3321   -2.5017    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 13 14  1  0

+  6  8  2  0

+  4 15  1  0

+  7 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+157730-35-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.9180    0.5384    0.0039 C   0  0  0

+   -0.7727   -0.8719    0.0032 C   0  0  0

+    0.1952    1.3467    0.0029 C   0  0  0

+   -2.2821    0.7858    0.0000 N   0  0  0

+    0.4292   -1.4302    0.0016 N   0  0  0

+   -2.0200   -1.3926    0.0045 N   0  0  0

+    1.4563    0.7269    0.0012 C   0  0  0

+   -2.9084   -0.4279   -0.0028 C   0  0  0

+   -2.9292    2.1001   -0.0004 C   0  0  0

+    1.5379   -0.6907    0.0006 C   0  0  0

+    2.6510    1.4682   -0.0004 C   0  0  0

+   -4.2705   -0.6115   -0.0066 N   0  0  0

+    2.8153   -1.2820   -0.0016 C   0  0  0

+    3.8367    0.7973   -0.0025 C   0  0  0

+    3.8880   -0.5276   -0.0030 N   0  0  0

+    0.1071    2.3737    0.0000 H   0  0  0

+   -2.0044    2.5554    0.0000 H   0  0  0

+   -3.3845    3.0249    0.0000 H   0  0  0

+   -3.8540    1.6448    0.0000 H   0  0  0

+    2.6302    2.4988    0.0000 H   0  0  0

+   -4.9005    0.2044    0.0000 H   0  0  0

+   -4.6620   -1.5651    0.0000 H   0  0  0

+    2.9076   -2.3087    0.0000 H   0  0  0

+    4.7169    1.3337    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  1  0

+  5 10  2  0

+  7 11  1  0

+  8 12  1  0

+ 10 13  1  0

+ 11 14  2  0

+ 13 15  2  0

+  6  8  2  0

+  7 10  1  0

+ 14 15  1  0

+  3 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+205-82-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -0.5223    0.0180   -0.0053 C   0  0  0

+   -0.0478   -1.3077   -0.0041 C   0  0  0

+    0.6414    0.9196   -0.0025 C   0  0  0

+   -1.9166    0.2496   -0.0034 C   0  0  0

+    1.4275   -1.2592   -0.0015 C   0  0  0

+   -0.9560   -2.3761   -0.0047 C   0  0  0

+    1.7736    0.0959   -0.0001 C   0  0  0

+    0.8655    2.2878   -0.0025 C   0  0  0

+   -2.8078   -0.8512    0.0045 C   0  0  0

+   -2.4339    1.5538   -0.0087 C   0  0  0

+    2.4710   -2.1702   -0.0005 C   0  0  0

+   -2.2966   -2.1625   -0.0039 C   0  0  0

+    3.0877    0.5695    0.0029 C   0  0  0

+    2.1708    2.7760    0.0010 C   0  0  0

+   -4.1928   -0.6151    0.0119 C   0  0  0

+   -3.7824    1.7460   -0.0030 C   0  0  0

+    3.7885   -1.7145    0.0027 C   0  0  0

+    3.2715    1.9629    0.0040 C   0  0  0

+    4.1179   -0.3865    0.0050 C   0  0  0

+   -4.6595    0.6641    0.0081 C   0  0  0

+   -0.5920   -3.3605    0.0000 H   0  0  0

+    0.0545    2.9539    0.0000 H   0  0  0

+   -1.7843    2.3781    0.0000 H   0  0  0

+    2.2704   -3.2004    0.0000 H   0  0  0

+   -2.9553   -2.9795    0.0000 H   0  0  0

+    2.3164    3.8154    0.0000 H   0  0  0

+   -4.8648   -1.4213    0.0000 H   0  0  0

+   -4.1658    2.7230    0.0000 H   0  0  0

+    4.5632   -2.4225    0.0000 H   0  0  0

+    4.2375    2.3733    0.0000 H   0  0  0

+    5.1237   -0.0866    0.0000 H   0  0  0

+   -5.6946    0.8372    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  2  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  2  0

+ 11 17  1  0

+ 13 18  1  0

+ 13 19  1  0

+ 15 20  2  0

+  5  7  1  0

+  9 12  2  0

+ 14 18  2  0

+ 16 20  1  0

+ 17 19  2  0

+  6 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+947-72-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    1.3448   -0.4449   -0.0015 C   0  0  0

+    0.0378   -1.1081   -0.0011 C   0  0  0

+    1.3895    0.9678   -0.0011 C   0  0  0

+    2.5349   -1.1748    0.0034 C   0  0  0

+   -1.1285   -0.3101   -0.0002 C   0  0  0

+   -0.0760   -2.4997   -0.0011 C   0  0  0

+    0.1868    1.7108    0.0002 C   0  0  0

+    2.6350    1.6122   -0.0015 C   0  0  0

+    3.7321   -0.5175    0.0033 C   0  0  0

+   -1.0171    1.1005   -0.0003 C   0  0  0

+   -2.3838   -0.9343    0.0002 C   0  0  0

+   -1.3135   -3.0776   -0.0002 C   0  0  0

+    3.7804    0.8716   -0.0023 C   0  0  0

+   -2.4594    2.0666    0.0008 Cl  0  0  0

+   -2.4628   -2.2961   -0.0002 C   0  0  0

+    2.5097   -2.2217    0.0000 H   0  0  0

+    0.7837   -3.0977    0.0000 H   0  0  0

+    0.2309    2.7571    0.0000 H   0  0  0

+    2.6855    2.6582    0.0000 H   0  0  0

+    4.6239   -1.0664    0.0000 H   0  0  0

+   -3.2576   -0.3572    0.0000 H   0  0  0

+   -1.3973   -4.1214    0.0000 H   0  0  0

+    4.7087    1.3561    0.0000 H   0  0  0

+   -3.4021   -2.7590    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+ 10 14  1  0

+ 11 15  2  0

+  7 10  1  0

+  9 13  1  0

+ 12 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17722-52-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.3278    1.1079   -0.1418 N   0  0  0

+   -1.3060    0.1813   -0.1101 C   0  0  0

+    1.0136    0.7119   -0.0844 C   0  0  0

+   -2.7482    0.6107   -0.0285 C   0  0  0

+   -1.0255   -0.9981   -0.1473 O   0  0  0

+    2.0166    1.6662    0.0191 C   0  0  0

+    1.3430   -0.6367   -0.1251 C   0  0  0

+   -3.6482   -0.6264   -0.0068 C   0  0  0

+    3.3395    1.2727    0.0755 C   0  0  0

+    2.6670   -1.0248   -0.0683 C   0  0  0

+   -5.0904   -0.1971    0.0748 C   0  0  0

+    3.6654   -0.0712    0.0290 C   0  0  0

+   -5.3698    0.9778    0.1118 O   0  0  0

+   -6.0646   -1.1199    0.1063 O   0  0  0

+    5.3289   -0.5624    0.1002 Cl  0  0  0

+   -0.5699    2.1164    0.0000 H   0  0  0

+   -2.3419    1.5649    0.0000 H   0  0  0

+   -3.6504    1.1222    0.0000 H   0  0  0

+    1.7744    2.6747    0.0000 H   0  0  0

+    0.5931   -1.3532    0.0000 H   0  0  0

+   -4.0545   -1.5806    0.0000 H   0  0  0

+   -2.7460   -1.1379    0.0000 H   0  0  0

+    4.0914    1.9871    0.0000 H   0  0  0

+    2.9122   -2.0325    0.0000 H   0  0  0

+   -6.8176   -1.8331    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  2  2  0

+  6  3  2  0

+  7  3  1  0

+  8  4  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  1  0

+ 12  9  2  0

+ 13 11  2  0

+ 14 11  1  0

+ 15 12  1  0

+ 10 12  1  0

+  1 16  1  0

+  4 17  1  0

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+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13909-09-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    2.0960    0.1340   -0.2882 C   0  0  0

+    0.8168    0.8047   -0.0432 N   0  0  0

+    3.1905    1.1830   -0.4946 C   0  0  0

+    2.4504   -0.7431    0.9142 C   0  0  0

+   -0.3358    0.2158   -0.4190 C   0  0  0

+    4.5264    0.4826   -0.7505 C   0  0  0

+    3.7864   -1.4436    0.6583 C   0  0  0

+   -1.5126    0.8328   -0.1935 N   0  0  0

+   -0.3139   -0.8713   -0.9609 O   0  0  0

+    4.8809   -0.3946    0.4519 C   0  0  0

+   -2.7654    0.1926   -0.6020 C   0  0  0

+   -1.5359    1.9871    0.3819 N   0  0  0

+    6.2168   -1.0950    0.1960 C   0  0  0

+   -3.2924   -0.6740    0.5436 C   0  0  0

+   -2.5994    2.5447    0.5856 O   0  0  0

+   -4.8342   -1.4619    0.0409 Cl  0  0  0

+    1.3356   -0.5546    0.0000 H   0  0  0

+    0.8222    1.8305    0.0000 H   0  0  0

+    3.7619    2.0350    0.0000 H   0  0  0

+    2.4050    1.8429    0.0000 H   0  0  0

+    1.4292   -0.8404    0.0000 H   0  0  0

+    2.2527   -1.7497    0.0000 H   0  0  0

+    5.5476    0.5800    0.0000 H   0  0  0

+    4.7241    1.4892    0.0000 H   0  0  0

+    3.2150   -2.2956    0.0000 H   0  0  0

+    4.5719   -2.1035    0.0000 H   0  0  0

+    5.6412    0.2941    0.0000 H   0  0  0

+   -2.9013    1.2094    0.0000 H   0  0  0

+   -3.7694    0.4032    0.0000 H   0  0  0

+    5.7404   -2.0036    0.0000 H   0  0  0

+    7.1254   -1.5714    0.0000 H   0  0  0

+    6.6932   -0.1864    0.0000 H   0  0  0

+   -3.1565   -1.6908    0.0000 H   0  0  0

+   -2.2884   -0.8846    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

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+ 10 13  1  0

+ 11 14  1  0

+ 12 15  2  0

+ 14 16  1  0

+  7 10  1  0

+  1 17  1  0

+  2 18  1  0

+  3 19  1  0

+  3 20  1  0

+  4 21  1  0

+  4 22  1  0

+  6 23  1  0

+  6 24  1  0

+  7 25  1  0

+  7 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142438-62-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -0.3113    0.1751   -0.2934 C   0  0  0

+    0.6854   -0.9754   -0.0683 C   0  0  0

+    0.1889   -0.6292   -1.3630 O   0  0  0

+    0.4824    1.4449   -0.1220 C   0  0  0

+   -1.7572    0.1324    0.1292 C   0  0  0

+    2.0152   -0.2651    0.2327 C   0  0  0

+    0.3554   -2.2948    0.6327 C   0  0  0

+    1.7600    1.1729    0.1686 N   0  0  0

+    0.0249    2.5627   -0.2329 O   0  0  0

+   -2.5728   -0.8129   -0.3635 O   0  0  0

+   -2.1823    0.9492    0.9116 O   0  0  0

+    2.5039   -0.6456    1.6317 C   0  0  0

+    2.9943   -0.6328   -0.7410 O   0  0  0

+   -3.9660   -0.8540    0.0437 C   0  0  0

+   -0.5950   -2.0571    0.0000 H   0  0  0

+    0.1177   -3.2452    0.0000 H   0  0  0

+    1.3058   -2.5325    0.0000 H   0  0  0

+    2.4645    1.8537    0.0000 H   0  0  0

+    1.9020   -1.4186    0.0000 H   0  0  0

+    3.2769   -1.2475    0.0000 H   0  0  0

+    3.1058    0.1274    0.0000 H   0  0  0

+    3.9114   -0.9772    0.0000 H   0  0  0

+   -3.9949    0.1252    0.0000 H   0  0  0

+   -4.9452   -0.8829    0.0000 H   0  0  0

+   -3.9371   -1.8332    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  6 13  1  0

+ 10 14  1  0

+  2  3  1  0

+  6  8  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+133591-35-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+    0.5682    0.3618   -0.0087 C   0  0  0

+   -0.9051    0.4219   -0.0025 C   0  0  0

+    1.0204    1.6895   -0.0234 C   0  0  0

+    1.4849   -0.6869    0.0021 C   0  0  0

+   -1.2479    1.7820   -0.0138 C   0  0  0

+   -1.9041   -0.5488    0.0113 C   0  0  0

+   -0.0815    2.5258   -0.0263 N   0  0  0

+    2.3888    1.9434   -0.0317 C   0  0  0

+    2.8360   -0.4155   -0.0083 C   0  0  0

+    1.0008   -2.1138    0.0256 C   0  0  0

+   -2.5910    2.1465   -0.0115 C   0  0  0

+   -3.2286   -0.1682    0.0138 C   0  0  0

+    3.2848    0.8964   -0.0255 C   0  0  0

+    2.8910    3.3642   -0.0480 C   0  0  0

+    3.8118   -1.5284    0.0036 N   0  3  0

+   -3.5692    1.1758    0.0018 C   0  0  0

+   -4.2917   -1.1981    0.0280 N   0  3  0

+    4.5183   -1.7085    0.9793 O   0  0  0

+    3.9082   -2.2642   -0.9623 O   0  5  0

+   -5.4630   -0.8643    0.0302 O   0  0  0

+   -3.9950   -2.3794    0.0374 O   0  5  0

+   -1.6513   -1.5575    0.0000 H   0  0  0

+   -0.0391    3.5648    0.0000 H   0  0  0

+    0.0160   -1.7797    0.0000 H   0  0  0

+    0.6667   -3.0986    0.0000 H   0  0  0

+    1.9856   -2.4479    0.0000 H   0  0  0

+   -2.8566    3.1519    0.0000 H   0  0  0

+    4.3062    1.0919    0.0000 H   0  0  0

+    3.8715    3.0176    0.0000 H   0  0  0

+    3.2376    4.3447    0.0000 H   0  0  0

+    1.9105    3.7108    0.0000 H   0  0  0

+   -4.5713    1.4537    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  5  7  1  0

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+ 11 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+81340-58-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.2645   -0.0726    0.0031 C   0  0  0

+    0.5948   -1.1945   -0.0194 C   0  0  0

+    0.2568    1.2370    0.0252 C   0  0  0

+   -1.6643   -0.2701   -0.0027 C   0  0  0

+    1.9955   -1.0324   -0.0203 C   0  0  0

+    0.0395   -2.4940   -0.0418 C   0  0  0

+    1.7158    1.4407    0.0250 C   0  0  0

+   -0.6151    2.3205    0.0465 C   0  0  0

+   -2.5121    0.8427    0.0195 C   0  0  0

+   -2.1881   -1.5853   -0.0302 C   0  0  0

+    2.5721    0.3229    0.0026 C   0  0  0

+    2.8145   -2.1559   -0.0432 C   0  0  0

+   -1.3669   -2.6573   -0.0417 C   0  0  0

+    0.8936   -3.6025   -0.0641 C   0  0  0

+    2.2591    2.7252    0.0462 C   0  0  0

+   -1.9840    2.1154    0.0460 C   0  0  0

+   -3.9802    0.6526    0.0134 N   0  3  0

+    3.9540    0.5126    0.0018 C   0  0  0

+    2.2598   -3.4243   -0.0650 C   0  0  0

+    3.6266    2.8907    0.0451 C   0  0  0

+   -4.6746    1.2982   -0.7512 O   0  0  0

+   -4.4936   -0.1493    0.7728 O   0  5  0

+    4.4702    1.7895    0.0230 C   0  0  0

+   -0.2346    3.2950    0.0000 H   0  0  0

+   -3.2244   -1.7285    0.0000 H   0  0  0

+    3.8545   -2.0423    0.0000 H   0  0  0

+   -1.7750   -3.6206    0.0000 H   0  0  0

+    0.4936   -4.5692    0.0000 H   0  0  0

+    1.6297    3.5608    0.0000 H   0  0  0

+   -2.6280    2.9399    0.0000 H   0  0  0

+    4.5967   -0.3129    0.0000 H   0  0  0

+    2.8880   -4.2608    0.0000 H   0  0  0

+    4.0324    3.8549    0.0000 H   0  0  0

+    5.5069    1.9301    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+73198-02-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -1.0374   -2.8737   -0.2902 C   0  0  0

+   -2.3315   -3.4633   -0.1495 O   0  0  0

+   -1.0182   -1.5129    0.4090 C   0  0  0

+    0.3488   -0.8901    0.2603 C   0  0  0

+   -2.0138   -0.6285   -0.2131 N   0  0  0

+    0.5281    0.4264    0.0007 C   0  0  0

+    1.5639   -1.5102    0.3557 N   0  0  0

+   -1.8789    0.7009    0.3940 C   0  0  0

+    1.9510    0.6586   -0.0789 C   0  0  0

+   -0.6207    1.3918   -0.1522 C   0  0  0

+    2.5638   -0.6011    0.1543 C   0  0  0

+   -3.0921    1.5306    0.0613 C   0  0  0

+    2.7174    1.8026   -0.3218 C   0  0  0

+    3.9509   -0.7267    0.1471 C   0  0  0

+   -3.9784    1.0615   -0.6128 O   0  0  0

+   -3.1882    2.7906    0.5138 O   0  0  0

+    4.0818    1.6484   -0.3231 C   0  0  0

+    4.6841    0.4222   -0.0959 C   0  0  0

+   -0.7532   -3.8608    0.0000 H   0  0  0

+   -0.0193   -2.7374    0.0000 H   0  0  0

+   -3.2663   -3.8892    0.0000 H   0  0  0

+   -1.9581   -1.9272    0.0000 H   0  0  0

+   -2.9709   -1.0016    0.0000 H   0  0  0

+    1.7001   -2.5283    0.0000 H   0  0  0

+   -1.0224    0.1338    0.0000 H   0  0  0

+    0.1318    2.0910    0.0000 H   0  0  0

+   -1.2221    2.2246    0.0000 H   0  0  0

+    2.2855    2.7346    0.0000 H   0  0  0

+    4.4035   -1.6488    0.0000 H   0  0  0

+   -3.2663    3.8148    0.0000 H   0  0  0

+    4.6731    2.4884    0.0000 H   0  0  0

+    5.7097    0.3650    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  1  0

+  5  3  1  0

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+  7  4  1  0

+  8  5  1  0

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+ 11  7  1  0

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+  8 10  1  0

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+  8 25  1  0

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+ 10 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107-07-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    1.1492    0.4998    0.0000 C   0  0  0

+    0.1188   -0.6311    0.0000 C   0  0  0

+    2.4659   -0.0555    0.0000 O   0  0  0

+   -1.5425    0.0695    0.0000 Cl  0  0  0

+    1.7117    1.4999    0.0000 H   0  0  0

+    0.2191    1.1718    0.0000 H   0  0  0

+   -0.4437   -1.6312    0.0000 H   0  0  0

+    1.0489   -1.3031    0.0000 H   0  0  0

+    3.5232   -0.5014    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17024-18-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.4163   -0.3358    0.0010 C   0  0  0

+   -1.8812   -0.3887    0.0010 C   0  0  0

+    0.2172    0.9273    0.0001 C   0  0  0

+    0.3574   -1.4979   -0.0039 C   0  0  0

+   -2.6041    0.8255    0.0001 C   0  0  0

+   -2.5690   -1.6036    0.0013 C   0  0  0

+    1.6179    0.9895    0.0001 C   0  0  0

+   -0.5633    2.1069   -0.0011 C   0  0  0

+    1.7199   -1.4039   -0.0037 C   0  0  0

+   -1.9107    2.0582   -0.0012 C   0  0  0

+   -4.0056    0.7865    0.0001 C   0  0  0

+   -3.9348   -1.6081    0.0008 C   0  0  0

+    2.3468   -0.1634    0.0010 C   0  0  0

+   -4.6494   -0.4160    0.0008 C   0  0  0

+    3.8253   -0.0925    0.0009 N   0  3  0

+    4.4841   -1.1169    0.0017 O   0  0  0

+    4.3830    0.9903    0.0002 O   0  5  0

+   -0.1049   -2.4374    0.0000 H   0  0  0

+   -2.0402   -2.5073    0.0000 H   0  0  0

+    2.1026    1.9176    0.0000 H   0  0  0

+   -0.0844    3.0380    0.0000 H   0  0  0

+    2.2989   -2.2763    0.0000 H   0  0  0

+   -2.4555    2.9523    0.0000 H   0  0  0

+   -4.5560    1.6772    0.0000 H   0  0  0

+   -4.4494   -2.5200    0.0000 H   0  0  0

+   -5.6962   -0.4414    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  4 18  1  0

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+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+   -0.0423   -0.0053   -0.0010 C   0  0  0

+   -1.3259    0.7102    0.0008 C   0  0  0

+    1.1148    0.6863    0.0008 O   0  0  0

+   -0.0239   -1.2205    0.0008 O   0  0  0

+   -2.4682    0.0274   -0.0010 C   0  0  0

+    2.3831   -0.0206   -0.0010 C   0  0  0

+   -1.3412    1.7211    0.0000 H   0  0  0

+   -3.3513    0.5196    0.0000 H   0  0  0

+   -2.4529   -0.9835    0.0000 H   0  0  0

+    1.8909   -0.9037    0.0000 H   0  0  0

+    3.2662   -0.5128    0.0000 H   0  0  0

+    2.8753    0.8625    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  2  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  6 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3694-52-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.4550   -0.3580    0.0355 C   0  0  0

+   -0.5134    0.6289   -0.0642 C   0  0  0

+    1.8891    0.0077    0.0155 N   0  3  0

+    0.0810   -1.6838    0.1594 C   0  0  0

+   -1.8640    0.2797   -0.0445 C   0  0  0

+   -0.1372    1.9722   -0.1839 N   0  0  0

+    2.6361   -0.5014   -0.8008 O   0  0  0

+    2.3223    0.8177    0.8154 O   0  5  0

+   -1.2570   -2.0292    0.1842 C   0  0  0

+   -2.2298   -1.0520    0.0747 C   0  0  0

+   -2.8471    1.2716   -0.1443 N   0  0  0

+    0.8056   -2.4248    0.0000 H   0  0  0

+    0.8668    2.2291    0.0000 H   0  0  0

+   -0.8617    2.7132    0.0000 H   0  0  0

+   -1.5310   -3.0287    0.0000 H   0  0  0

+   -3.2320   -1.3160    0.0000 H   0  0  0

+   -2.5744    2.2715    0.0000 H   0  0  0

+   -3.8494    1.0078    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  6 13  1  0

+  6 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4251-89-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 59                          1 V2000

+   -5.4764    0.6751    0.4174 C   0  0  0

+   -6.2547    1.6178   -0.2978 C   0  0  0

+   -4.2225    1.0628    0.9232 C   0  0  0

+   -5.9511   -0.6396    0.6286 C   0  0  0

+   -7.5632    1.1995   -0.8208 C   0  0  0

+   -5.8193    2.8538   -0.4951 N   0  0  0

+   -3.7972    2.3869    0.6906 C   0  0  0

+   -3.4330    0.1747    1.6260 N   0  0  0

+   -7.1512   -1.0409    0.1616 C   0  0  0

+   -7.9986   -0.1241   -0.5933 C   0  0  0

+   -8.3769    2.0820   -1.5329 C   0  0  0

+   -4.6380    3.2691   -0.0355 C   0  0  0

+   -2.5570    2.8429    1.1665 C   0  0  0

+   -2.5755   -0.4983    0.6413 C   0  0  0

+   -9.2442   -0.5315   -1.0880 C   0  0  0

+   -9.5874    1.6560   -2.0030 C   0  0  0

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+   -2.9981    4.9974    0.2149 C   0  0  0

+   -0.7759   -2.2035    0.3307 C   0  0  0

+    0.0942   -3.1676    1.0172 N   0  0  0

+    0.9209   -3.8019   -0.0184 C   0  0  0

+    1.0050   -2.3858    1.8641 C   0  0  0

+    0.6050   -5.2978   -0.0776 C   0  0  0

+    1.1637   -3.0797    3.2184 C   0  0  0

+    1.6196   -6.0764   -1.3485 Cl  0  0  0

+   14.3154    0.4583   -0.4658 Cl  0  0  0

+   22.7621    2.3683   -0.3997 Cl  0  0  0

+   -5.2810   -1.3259    0.0000 H   0  0  0

+   -4.0902   -0.5240    0.0000 H   0  0  0

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+    0.2287   -3.2936    0.0000 H   0  0  0

+    1.3776   -4.0147    0.0000 H   0  0  0

+    2.0987   -2.8658    0.0000 H   0  0  0

+   15.2746    0.4583    0.0000 H   0  0  0

+   23.7213    2.3683    0.0000 H   0  0  0

+  1  2  2  0

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+ 27 54  1  0

+ 27 55  1  0

+ 27 56  1  0

+ 29 57  1  0

+ 30 58  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+880-93-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -2.3737   -0.0238   -0.0233 N   0  3  0

+   -3.1927   -0.5366    0.7182 O   0  5  0

+   -2.7032    0.8943   -0.7526 O   0  0  0

+   -0.9765   -0.5124   -0.0336 C   0  0  0

+    0.0910    0.3997    0.0183 C   0  0  0

+   -0.7191   -1.8481   -0.0876 C   0  0  0

+    1.4222   -0.0874    0.0079 C   0  0  0

+   -0.1349    1.7855    0.0797 C   0  0  0

+    0.5894   -2.3268   -0.0977 C   0  0  0

+    1.6484   -1.4727   -0.0539 C   0  0  0

+    2.4901    0.8249    0.0593 C   0  0  0

+    0.9240    2.6389    0.1283 C   0  0  0

+    3.0562   -2.0104   -0.0659 C   0  0  0

+    2.2329    2.1600    0.1181 C   0  0  0

+   -1.5151   -2.5257    0.0000 H   0  0  0

+   -1.1112    2.1590    0.0000 H   0  0  0

+    0.7601   -3.3581    0.0000 H   0  0  0

+    3.4767    0.4795    0.0000 H   0  0  0

+    0.7535    3.6702    0.0000 H   0  0  0

+    2.6832   -2.9869    0.0000 H   0  0  0

+    4.0327   -2.3834    0.0000 H   0  0  0

+    3.4292   -1.0339    0.0000 H   0  0  0

+    3.0289    2.8375    0.0000 H   0  0  0

+  2  1  1  0

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+ 13 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101-72-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -0.3667   -0.8111    0.1640 C   0  0  0

+   -1.6615   -1.3007    0.3736 N   0  0  0

+    0.3130   -0.1798    1.1978 C   0  0  0

+    0.2403   -0.9618   -1.0758 C   0  0  0

+   -2.7648   -0.4703    0.1628 C   0  0  0

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+    1.5177   -0.4794   -1.2824 C   0  0  0

+   -4.0352   -0.8919    0.5358 C   0  0  0

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+   -5.1234   -0.0683    0.3263 C   0  0  0

+   -3.6867    1.6000   -0.6218 C   0  0  0

+    3.4896    0.6457   -0.4600 N   0  0  0

+   -4.9502    1.1751   -0.2541 C   0  0  0

+    4.6070    0.1235    0.3305 C   0  0  0

+    5.4612   -0.7991   -0.5414 C   0  0  0

+    5.4637    1.2871    0.8334 C   0  0  0

+   -1.8031   -2.2925    0.0000 H   0  0  0

+   -0.2147    0.6718    0.0000 H   0  0  0

+    0.2992   -1.9619    0.0000 H   0  0  0

+    1.5279    1.3023    0.0000 H   0  0  0

+    2.0476   -1.3296    0.0000 H   0  0  0

+   -4.1985   -1.8803    0.0000 H   0  0  0

+   -1.6694    1.1678    0.0000 H   0  0  0

+   -6.0491   -0.4513    0.0000 H   0  0  0

+   -3.5278    2.5892    0.0000 H   0  0  0

+    3.5275    1.6468    0.0000 H   0  0  0

+   -5.7213    1.8147    0.0000 H   0  0  0

+    4.0163   -0.6857    0.0000 H   0  0  0

+    4.7261   -1.4797    0.0000 H   0  0  0

+    6.1418   -1.5342    0.0000 H   0  0  0

+    6.1963   -0.1185    0.0000 H   0  0  0

+    6.2705    0.6931    0.0000 H   0  0  0

+    6.0577    2.0939    0.0000 H   0  0  0

+    4.6569    1.8811    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93673-32-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 38                          1 V2000

+   -0.0288    0.6930   -0.1237 C   0  0  0

+   -1.3694    0.9927   -0.1622 C   0  0  0

+    0.8333    1.8552   -0.2030 C   0  0  0

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+   -0.3951   -1.7166    0.0492 C   0  0  0

+   -0.9096    3.1147    0.8563 O   0  0  0

+   -1.7721   -1.4460    0.0237 C   0  0  0

+   -3.6644    0.1450   -0.1239 C   0  0  0

+    2.7601    0.3477   -0.0700 C   0  0  0

+    2.5505   -2.0686    0.1013 C   0  0  0

+   -2.7077   -2.4988    0.0968 C   0  0  0

+   -4.5109   -0.9153   -0.0508 C   0  0  0

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+   -4.0369   -2.2216    0.0588 C   0  0  0

+    4.7159   -1.0349    0.0516 C   0  0  0

+   -2.5012    2.8357    0.0000 H   0  0  0

+    0.4233    3.9811    0.0000 H   0  0  0

+    2.7973    2.5234    0.0000 H   0  0  0

+   -0.0460   -2.7067    0.0000 H   0  0  0

+   -4.0452    1.1233    0.0000 H   0  0  0

+    1.9560   -2.9338    0.0000 H   0  0  0

+   -2.3781   -3.4955    0.0000 H   0  0  0

+   -5.5468   -0.7451    0.0000 H   0  0  0

+    4.7693    1.0563    0.0000 H   0  0  0

+    4.3733   -3.1216    0.0000 H   0  0  0

+   -4.7245   -3.0149    0.0000 H   0  0  0

+    5.7613   -1.1313    0.0000 H   0  0  0

+  1  2  2  0

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+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6691-68-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    1.9728    0.3881    0.1085 C   0  0  0

+    0.6754    0.7115    0.5854 C   0  0  0

+    2.9241    1.4198   -0.0282 C   0  0  0

+    2.2878   -0.8663   -0.2106 N   0  0  0

+   -0.2850   -0.3099    0.7268 C   0  0  0

+    0.3658    2.0436    0.9094 C   0  0  0

+    2.5884    2.6965    0.2955 C   0  0  0

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+    0.0966   -1.6215    0.3823 C   0  0  0

+   -1.5547   -0.0350    1.1870 N   0  0  0

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+    5.1061    2.0055   -0.6401 O   0  0  0

+    4.5849   -0.0315   -0.8119 O   0  5  0

+    1.7778   -3.1791   -0.4444 C   0  0  0

+   -0.8085   -2.6906    0.4971 C   0  0  0

+   -2.3743    0.2712    0.0070 C   0  0  0

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+   -6.5874   -0.0316    0.1965 C   0  0  0

+   -0.5995    2.3142    0.0000 H   0  0  0

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+   -6.4320    2.4405    0.0000 H   0  0  0

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+   -7.1566    0.5711    0.0000 H   0  0  0

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+   -6.9967   -0.9468    0.0000 H   0  0  0

+   -5.6722   -0.4409    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 23 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1163-19-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    1.0608   -0.2551   -1.1202 C   0  0  0

+    1.0085   -1.3129   -0.2236 C   0  0  0

+    2.1993    0.5359   -1.1918 C   0  0  0

+    0.0009    0.0028   -1.9312 O   0  0  0

+    2.0904   -1.5772    0.5968 C   0  0  0

+   -0.5406   -2.3929   -0.1238 Br  0  0  0

+    3.2788    0.2684   -0.3699 C   0  0  0

+    2.2743    1.9778   -2.4129 Br  0  0  0

+   -1.0603    0.2591   -1.1213 C   0  0  0

+    3.2244   -0.7871    0.5242 C   0  0  0

+    2.0198   -3.0185    1.8189 Br  0  0  0

+    4.8300    1.3454   -0.4669 Br  0  0  0

+   -1.0096    1.3157   -0.2232 C   0  0  0

+   -2.1983   -0.5323   -1.1955 C   0  0  0

+    4.7015   -1.1499    1.6478 Br  0  0  0

+   -2.0908    1.5752    0.5998 C   0  0  0

+    0.5366    2.3999   -0.1240 Br  0  0  0

+   -3.2770   -0.2696   -0.3710 C   0  0  0

+   -2.2737   -1.9682   -2.4236 Br  0  0  0

+   -3.2224    0.7817    0.5280 C   0  0  0

+   -2.0222    3.0145    1.8243 Br  0  0  0

+   -4.8276   -1.3473   -0.4715 Br  0  0  0

+   -4.6987    1.1383    1.6547 Br  0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 16 20  2  0

+ 16 21  1  0

+ 18 22  1  0

+ 20 23  1  0

+  7 10  1  0

+ 18 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-27-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    1.3759   -0.0914   -0.0747 C   0  0  0

+    0.1904    0.5288    0.0332 O   0  0  0

+    2.6509    0.6713    0.1775 C   0  0  0

+    1.4206   -1.2624   -0.3690 O   0  0  0

+   -1.0382   -0.2061   -0.2098 C   0  0  0

+    3.8489   -0.2617   -0.0104 C   0  0  0

+   -2.2361    0.7269   -0.0219 C   0  0  0

+    5.1434    0.5127    0.2456 C   0  0  0

+   -3.5306   -0.0475   -0.2779 C   0  0  0

+   -3.6318   -1.2123    0.7090 C   0  0  0

+   -4.7286    0.8855   -0.0900 C   0  0  0

+    3.4445    1.4655    0.0000 H   0  0  0

+    1.9603    1.5566    0.0000 H   0  0  0

+   -1.8319   -1.0003    0.0000 H   0  0  0

+   -0.3477   -1.0915    0.0000 H   0  0  0

+    3.0553   -1.0560    0.0000 H   0  0  0

+    4.5395   -1.1470    0.0000 H   0  0  0

+   -1.4424    1.5211    0.0000 H   0  0  0

+   -2.9267    1.6122    0.0000 H   0  0  0

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+   -4.7504   -1.1151    0.0000 H   0  0  0

+   -3.7290   -2.3309    0.0000 H   0  0  0

+   -2.5132   -1.3095    0.0000 H   0  0  0

+   -4.0387    1.7714    0.0000 H   0  0  0

+   -5.6145    1.5754    0.0000 H   0  0  0

+   -5.4185   -0.0004    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  2  0

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+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99522-79-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 59                          1 V2000

+   -2.0593    0.6132    0.5007 C   0  0  0

+   -1.3739   -0.5517   -0.1658 C   0  0  0

+   -1.1840    1.8306    0.4055 C   0  0  0

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+   -1.0466   -0.4857   -1.5070 C   0  0  0

+   -1.4549    2.8226   -0.4602 C   0  0  0

+   -0.0503    1.9348    1.2443 C   0  0  0

+   -3.5687    1.8897   -1.0034 C   0  0  0

+   -4.4655   -0.0137    0.1099 C   0  0  0

+   -0.4490   -2.7570   -0.0484 C   0  0  0

+   -0.4178   -1.5544   -2.1186 C   0  0  0

+   -2.5478    2.7576   -1.2808 N   0  0  0

+   -0.5439    4.0212   -0.5275 C   0  0  0

+    1.1620    1.5527    0.7910 O   0  0  0

+   -0.1679    2.3691    2.3750 O   0  0  0

+   -4.9143    2.0921   -1.6509 C   0  0  0

+   -4.7239   -1.0450   -0.7213 O   0  0  0

+   -5.1614    0.1654    1.0919 O   0  0  0

+   -0.1165   -2.6887   -1.3887 C   0  0  0

+   -0.1314   -3.9741    0.7318 N   0  3  0

+    2.0899    1.7758    1.8546 C   0  0  0

+   -5.8577   -1.7316   -0.1875 C   0  0  0

+    0.4226   -4.9155    0.1931 O   0  0  0

+   -0.4240   -4.0340    1.9126 O   0  5  0

+    3.4707    1.3670    1.4106 C   0  0  0

+    3.6593    0.8869    0.1894 C   0  0  0

+    5.0137    0.4859   -0.2461 C   0  0  0

+    5.2156   -0.0198   -1.5310 C   0  0  0

+    6.0967    0.6168    0.6237 C   0  0  0

+    6.4822   -0.3918   -1.9314 C   0  0  0

+    7.3587    0.2411    0.2109 C   0  0  0

+    7.5512   -0.2644   -1.0622 C   0  0  0

+   -2.5643   -0.1078    0.0000 H   0  0  0

+   -1.8906   -2.0260    0.0000 H   0  0  0

+   -0.6877    0.3180    0.0000 H   0  0  0

+    0.3944   -1.2151    0.0000 H   0  0  0

+   -2.8759    3.5744    0.0000 H   0  0  0

+    0.1569    3.4886    0.0000 H   0  0  0

+   -0.0113    4.7220    0.0000 H   0  0  0

+   -1.2447    4.5538    0.0000 H   0  0  0

+   -4.7834    2.9625    0.0000 H   0  0  0

+   -5.7847    2.2230    0.0000 H   0  0  0

+   -5.0452    1.2217    0.0000 H   0  0  0

+    0.6319   -3.1520    0.0000 H   0  0  0

+    2.6133    2.4835    0.0000 H   0  0  0

+    1.6039    2.5097    0.0000 H   0  0  0

+   -6.3137   -0.9787    0.0000 H   0  0  0

+   -6.6106   -2.1876    0.0000 H   0  0  0

+   -5.4017   -2.4845    0.0000 H   0  0  0

+    4.0656    2.0157    0.0000 H   0  0  0

+    3.0644    0.2382    0.0000 H   0  0  0

+    4.6232   -0.6708    0.0000 H   0  0  0

+    6.1710    1.4939    0.0000 H   0  0  0

+    6.4088   -1.2690    0.0000 H   0  0  0

+    7.9575    0.8863    0.0000 H   0  0  0

+    8.3043   -0.7201    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

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+ 15 22  1  0

+ 18 23  1  0

+ 21 24  2  0

+ 21 25  1  0

+ 22 26  1  0

+ 26 27  2  0

+ 27 28  1  0

+ 28 29  1  0

+ 28 30  2  0

+ 29 31  2  0

+ 30 32  1  0

+ 31 33  1  0

+  9 13  1  0

+ 12 20  2  0

+ 32 33  2  0

+  1 34  1  0

+  5 35  1  0

+  6 36  1  0

+ 12 37  1  0

+ 13 38  1  0

+ 14 39  1  0

+ 14 40  1  0

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+ 17 42  1  0

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+ 20 45  1  0

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+ 22 47  1  0

+ 23 48  1  0

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+ 27 52  1  0

+ 29 53  1  0

+ 30 54  1  0

+ 31 55  1  0

+ 32 56  1  0

+ 33 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16301-26-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.4642   -0.2073   -0.2536 N   0  3  0

+   -0.6409    0.3732   -0.5788 N   0  0  0

+    1.7460    0.4253   -0.5748 C   0  0  0

+    0.4420   -1.2789    0.3249 O   0  5  0

+   -1.9227   -0.2593   -0.2576 C   0  0  0

+    2.5267    0.6800    0.7162 C   0  0  0

+   -2.7327    0.6642    0.6545 C   0  0  0

+    1.8945    1.3421    0.0000 H   0  0  0

+    0.9991    0.9773    0.0000 H   0  0  0

+   -2.6716   -0.8086    0.0000 H   0  0  0

+   -1.4407   -1.0532    0.0000 H   0  0  0

+    2.8148   -0.2030    0.0000 H   0  0  0

+    3.4097    0.9681    0.0000 H   0  0  0

+    2.2386    1.5630    0.0000 H   0  0  0

+   -2.0345    1.2766    0.0000 H   0  0  0

+   -3.3451    1.3624    0.0000 H   0  0  0

+   -3.4309    0.0518    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

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+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+137-17-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -1.2370    0.6888    0.0017 C   0  0  0

+   -1.2179   -0.6941    0.0006 C   0  0  0

+   -0.0512    1.3997    0.0017 C   0  0  0

+   -2.5534    1.4224   -0.0034 C   0  0  0

+   -0.0135   -1.3695   -0.0005 C   0  0  0

+   -2.5129   -1.4648    0.0011 C   0  0  0

+    1.1571    0.7305    0.0006 C   0  0  0

+    1.1800   -0.6582   -0.0005 C   0  0  0

+    2.4491    1.5062    0.0001 C   0  0  0

+    2.4000   -1.3382   -0.0012 N   0  0  0

+   -0.0691    2.4414    0.0000 H   0  0  0

+   -2.0462    2.3325    0.0000 H   0  0  0

+   -3.4635    1.9296    0.0000 H   0  0  0

+   -3.0606    0.5123    0.0000 H   0  0  0

+    0.0002   -2.4113    0.0000 H   0  0  0

+   -3.0457   -0.5695    0.0000 H   0  0  0

+   -3.4082   -1.9976    0.0000 H   0  0  0

+   -1.9801   -2.3601    0.0000 H   0  0  0

+    2.9854    0.6130    0.0000 H   0  0  0

+    3.3423    2.0425    0.0000 H   0  0  0

+    1.9128    2.3994    0.0000 H   0  0  0

+    2.4157   -2.3799    0.0000 H   0  0  0

+    3.2943   -0.8037    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  7  8  2  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91828-72-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+    0.2853    0.0879   -0.1106 C   0  0  0

+   -0.2219   -1.2255    0.0033 C   0  0  0

+    1.6814    0.2768   -0.1939 C   0  0  0

+   -0.6022    1.1840   -0.1452 C   0  0  0

+   -1.6733   -1.4142    0.0869 C   0  0  0

+    0.6562   -2.3110    0.0336 C   0  0  0

+    2.5308   -0.8229   -0.1638 C   0  0  0

+    2.2570    1.6295   -0.3117 C   0  0  0

+   -1.9390    1.0118   -0.0733 C   0  0  0

+   -2.5096   -0.2757    0.0508 C   0  0  0

+   -2.2388   -2.6857    0.2001 C   0  0  0

+    2.0152   -2.1045   -0.0491 C   0  0  0

+    4.0193   -0.6066   -0.2561 C   0  0  2

+    3.5347    1.8254   -0.0100 C   0  0  0

+   -2.8255    2.1966   -0.1137 N   0  3  0

+   -3.8993   -0.4460    0.1292 C   0  0  0

+   -3.5962   -2.8182    0.2744 C   0  0  0

+    4.4002    0.6885    0.4583 C   0  0  1

+    4.4043   -0.5238   -1.6297 O   0  0  0

+   -3.7914    2.2094   -0.8556 O   0  0  0

+   -2.5891    3.1586    0.5949 O   0  5  0

+   -4.4223   -1.7009    0.2391 C   0  0  0

+    4.2419    0.5189    1.8684 O   0  0  0

+   -0.2144    2.1521    0.0000 H   0  0  0

+    0.2791   -3.2834    0.0000 H   0  0  0

+    1.6173    2.4532    0.0000 H   0  0  0

+   -1.6287   -3.5316    0.0000 H   0  0  0

+    2.6625   -2.9223    0.0000 H   0  0  0

+    4.2040   -1.6330    0.0000 H   0  0  0

+    3.9254    2.7924    0.0000 H   0  0  0

+   -4.5296    0.3849    0.0000 H   0  0  0

+   -4.0200   -3.7712    0.0000 H   0  0  0

+    5.4258    0.8776    0.0000 H   0  0  0

+    5.4239   -0.3045    0.0000 H   0  0  0

+   -5.4576   -1.8267    0.0000 H   0  0  0

+    3.5303   -0.2435    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  2  0

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+ 18 23  1  0

+  7 12  1  0

+  9 10  1  0

+ 14 18  1  0

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+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

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+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 22 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1563-66-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -0.7384    0.2860   -0.3430 C   0  0  0

+   -1.9291    0.8323    0.1127 C   0  0  0

+    0.3883    1.1072   -0.4361 C   0  0  0

+   -0.8854   -1.0329   -0.6496 O   0  0  0

+   -2.9564   -0.2833    0.1199 C   0  0  0

+   -2.0077    2.1639    0.4610 C   0  0  0

+    1.5683    0.5930   -0.8755 O   0  0  0

+    0.3061    2.4422   -0.0828 C   0  0  0

+   -2.0637   -1.5410   -0.0010 C   0  0  0

+   -0.8899    2.9729    0.3642 C   0  0  0

+    2.3367   -0.1353   -0.0435 C   0  0  0

+   -2.7418   -2.6060   -0.8652 C   0  0  0

+   -1.7224   -2.1033    1.3803 C   0  0  0

+    3.5519   -0.5578   -0.4451 N   0  0  0

+    1.9345   -0.4117    1.0694 O   0  0  0

+    4.3880   -1.3503    0.4601 C   0  0  0

+   -3.6302    0.4302    0.0000 H   0  0  0

+   -3.7151   -0.9057    0.0000 H   0  0  0

+   -2.8944    2.5843    0.0000 H   0  0  0

+    1.1120    3.0022    0.0000 H   0  0  0

+   -0.9922    3.9489    0.0000 H   0  0  0

+   -3.5696   -2.0789    0.0000 H   0  0  0

+   -3.2689   -3.4338    0.0000 H   0  0  0

+   -1.9140   -3.1331    0.0000 H   0  0  0

+   -2.5613   -2.6125    0.0000 H   0  0  0

+   -1.2132   -2.9422    0.0000 H   0  0  0

+   -0.8835   -1.5941    0.0000 H   0  0  0

+    4.0620    0.2805    0.0000 H   0  0  0

+    3.7129   -2.0625    0.0000 H   0  0  0

+    5.1002   -2.0254    0.0000 H   0  0  0

+    5.0631   -0.6381    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  1  0

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+  7 11  1  0

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+  5  9  1  0

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+  5 17  1  0

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+ 12 24  1  0

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+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-53-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.5262    0.7330    0.0018 C   0  0  0

+   -0.5691   -0.6553    0.0004 C   0  0  0

+    0.6916    1.3847    0.0017 C   0  0  0

+   -1.8069    1.5273   -0.0028 C   0  0  0

+    0.6139   -1.3837   -0.0011 C   0  0  0

+   -1.7989   -1.3175    0.0010 N   0  0  0

+    1.8671    0.6567    0.0001 C   0  0  0

+    1.8280   -0.7258   -0.0013 C   0  0  0

+    0.7244    2.4237    0.0000 H   0  0  0

+   -1.2590    2.4107    0.0000 H   0  0  0

+   -2.6903    2.0752    0.0000 H   0  0  0

+   -2.3548    0.6439    0.0000 H   0  0  0

+    0.5852   -2.4228    0.0000 H   0  0  0

+   -2.6833   -0.7713    0.0000 H   0  0  0

+   -1.8297   -2.3565    0.0000 H   0  0  0

+    2.7823    1.1496    0.0000 H   0  0  0

+    2.7135   -1.2702    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  7  8  1  0

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+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1122-58-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.3147   -0.0001    0.0032 C   0  0  0

+    0.4007   -1.1972    0.0029 C   0  0  0

+    0.4010    1.1973    0.0008 C   0  0  0

+   -1.7064    0.0000    0.0000 N   0  0  0

+    1.7792   -1.1539    0.0003 C   0  0  0

+    1.7791    1.1540   -0.0018 C   0  0  0

+   -2.4388    1.2688    0.0004 C   0  0  0

+   -2.4389   -1.2687   -0.0036 C   0  0  0

+    2.4200   -0.0001   -0.0019 N   0  0  0

+   -0.1000   -2.1130    0.0000 H   0  0  0

+   -0.0997    2.1131    0.0000 H   0  0  0

+    2.3226   -2.0450    0.0000 H   0  0  0

+    2.3226    2.0451    0.0000 H   0  0  0

+   -1.5348    1.7906    0.0000 H   0  0  0

+   -2.9606    2.1728    0.0000 H   0  0  0

+   -3.3428    0.7470    0.0000 H   0  0  0

+   -3.3428   -0.7468    0.0000 H   0  0  0

+   -2.9608   -2.1726    0.0000 H   0  0  0

+   -1.5350   -1.7906    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  6  2  0

+  4  7  1  0

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+  5 12  1  0

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+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3096-63-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.3535   -0.0001   -0.2490 C   0  0  0

+    0.3295   -1.2020   -0.1147 C   0  0  0

+    0.3296    1.2022   -0.1146 C   0  0  0

+   -1.7228   -0.0002   -0.5243 N   0  0  0

+    1.6848   -1.1984    0.1519 C   0  0  0

+   -0.4072   -2.5086   -0.2602 C   0  0  0

+    1.6845    1.1986    0.1519 C   0  0  0

+   -0.4072    2.5087   -0.2600 C   0  0  0

+   -2.4112    0.0000    0.7667 O   0  0  0

+    2.3615   -0.0001    0.2850 C   0  0  0

+   -1.7229   -1.0325    0.0000 H   0  0  0

+    2.2064   -2.0892    0.0000 H   0  0  0

+   -1.3064   -2.0016    0.0000 H   0  0  0

+   -0.9142   -3.4078    0.0000 H   0  0  0

+    0.4920   -3.0156    0.0000 H   0  0  0

+    2.2061    2.0895    0.0000 H   0  0  0

+    0.4920    3.0158    0.0000 H   0  0  0

+   -0.9143    3.4079    0.0000 H   0  0  0

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+  1  2  2  0

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+  7 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+602-87-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    1.1311    0.1097   -0.0002 C   0  0  0

+   -0.1723   -0.4176   -0.0169 C   0  0  0

+    1.3887    1.4755    0.0619 C   0  0  0

+    2.2671   -0.6919   -0.0506 C   0  0  0

+   -1.2462    0.4865    0.0320 C   0  0  0

+   -0.3143   -1.8135   -0.0819 C   0  0  0

+    0.3255    2.3242    0.1081 C   0  0  0

+    2.8876    1.6525    0.0610 C   0  0  0

+    3.4669    0.2229   -0.0131 C   0  0  0

+    2.0942   -2.0404   -0.1189 C   0  0  0

+   -0.9786    1.8234    0.0927 C   0  0  0

+   -2.6435   -0.0021    0.0176 N   0  3  0

+    0.8089   -2.5877   -0.1255 C   0  0  0

+   -3.4808    0.5674   -0.6592 O   0  0  0

+   -2.9558   -0.9736    0.6825 O   0  5  0

+   -1.2653   -2.2531    0.0000 H   0  0  0

+    0.4857    3.3596    0.0000 H   0  0  0

+    3.8898    1.9580    0.0000 H   0  0  0

+    2.6726    2.6779    0.0000 H   0  0  0

+    4.0258   -0.6633    0.0000 H   0  0  0

+    4.3992    0.7009    0.0000 H   0  0  0

+    2.9296   -2.6727    0.0000 H   0  0  0

+   -1.7794    2.4990    0.0000 H   0  0  0

+    0.7038   -3.6301    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

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+ 12 14  2  0

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+  8  9  1  0

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+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15403-45-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+    0.6667   -0.3261    0.5240 C   0  0  0

+   -0.6666    0.3251    0.5244 C   0  0  0

+    1.7865    0.3870    0.1152 C   0  0  0

+    0.7945   -1.6531    0.9400 C   0  0  0

+   -1.7862   -0.3874    0.1153 C   0  0  0

+   -0.7944    1.6521    0.9417 C   0  0  0

+    3.0391   -0.2284    0.1165 C   0  0  0

+    2.0287   -2.2650    0.9431 C   0  0  0

+   -3.0391    0.2283    0.1169 C   0  0  0

+   -2.0282    2.2640    0.9452 C   0  0  0

+    3.1571   -1.5654    0.5317 C   0  0  0

+    4.2319    0.5203   -0.3158 C   0  0  0

+   -3.1570    1.5647    0.5327 C   0  0  0

+   -4.2320   -0.5200   -0.3160 C   0  0  0

+    4.3992   -2.1849    0.5360 N   0  0  0

+    4.3098    0.9951   -1.5747 O   0  0  0

+    5.1456    0.7098    0.4626 O   0  0  0

+   -4.3989    2.1843    0.5374 N   0  0  0

+   -4.3107   -0.9923   -1.5757 O   0  0  0

+   -5.1449   -0.7114    0.4629 O   0  0  0

+    5.4854    1.7331   -2.0008 C   0  0  0

+   -5.4864   -1.7299   -2.0023 C   0  0  0

+    1.7310    1.3921    0.0000 H   0  0  0

+   -0.0345   -2.2242    0.0000 H   0  0  0

+   -1.7309   -1.3925    0.0000 H   0  0  0

+    0.0346    2.2232    0.0000 H   0  0  0

+    2.0764   -3.2705    0.0000 H   0  0  0

+   -2.0756    3.2695    0.0000 H   0  0  0

+    4.4605   -3.1897    0.0000 H   0  0  0

+    5.2387   -1.6294    0.0000 H   0  0  0

+   -4.4601    3.1891    0.0000 H   0  0  0

+   -5.2385    1.6289    0.0000 H   0  0  0

+    6.0206    0.8805    0.0000 H   0  0  0

+    6.3380    2.2683    0.0000 H   0  0  0

+    4.9502    2.5857    0.0000 H   0  0  0

+   -6.0214   -0.8772    0.0000 H   0  0  0

+   -6.3391   -2.2649    0.0000 H   0  0  0

+   -4.9514   -2.5826    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  7 12  1  0

+  9 13  2  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 12 17  2  0

+ 13 18  1  0

+ 14 19  1  0

+ 14 20  2  0

+ 16 21  1  0

+ 19 22  1  0

+  8 11  2  0

+ 10 13  1  0

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+  4 24  1  0

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+ 15 29  1  0

+ 15 30  1  0

+ 18 31  1  0

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+ 21 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 45                          1 V2000

+   -1.4456   -0.3814    0.0230 C   0  0  0

+   -2.6883    0.4753    0.2732 C   0  0  0

+   -0.1905    0.4718    0.2169 C   0  0  0

+   -3.9245   -0.3651    0.0822 C   0  0  0

+    1.0522   -0.3849   -0.0333 C   0  0  0

+   -5.1444    0.1824    0.2516 N   0  0  0

+   -3.8217   -1.5342   -0.2239 O   0  0  0

+    2.3073    0.4684    0.1607 C   0  0  0

+   -6.3462   -0.6346    0.0659 C   0  0  0

+    3.5501   -0.3883   -0.0896 C   0  0  0

+   -7.5889    0.2221    0.3161 C   0  0  0

+    4.8052    0.4649    0.1044 C   0  0  0

+   -7.6081    1.3140   -0.6055 O   0  0  0

+    6.0479   -0.3918   -0.1458 C   0  0  0

+    7.3030    0.4615    0.0481 C   0  0  0

+    8.5457   -0.3952   -0.2021 C   0  0  0

+    9.8008    0.4580   -0.0082 C   0  0  0

+   -2.1980   -1.2273    0.0000 H   0  0  0

+   -0.6988   -1.2322    0.0000 H   0  0  0

+   -1.9359    1.3212    0.0000 H   0  0  0

+   -3.4351    1.3260    0.0000 H   0  0  0

+    0.5619    1.3177    0.0000 H   0  0  0

+   -0.9373    1.3226    0.0000 H   0  0  0

+    0.2999   -1.2308    0.0000 H   0  0  0

+    1.7990   -1.2356    0.0000 H   0  0  0

+   -5.2434    1.3101    0.0000 H   0  0  0

+    3.0596    1.3143    0.0000 H   0  0  0

+    1.5604    1.3191    0.0000 H   0  0  0

+   -7.0986   -1.4805    0.0000 H   0  0  0

+   -5.5994   -1.4853    0.0000 H   0  0  0

+    2.7978   -1.2342    0.0000 H   0  0  0

+    4.2969   -1.2390    0.0000 H   0  0  0

+   -8.7007    0.4353    0.0000 H   0  0  0

+   -8.0261   -0.8221    0.0000 H   0  0  0

+    5.5576    1.3108    0.0000 H   0  0  0

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+   -7.6280    2.4459    0.0000 H   0  0  0

+    5.2956   -1.2377    0.0000 H   0  0  0

+    6.7947   -1.2425    0.0000 H   0  0  0

+    8.0553    1.3074    0.0000 H   0  0  0

+    6.5562    1.3122    0.0000 H   0  0  0

+    7.7933   -1.2411    0.0000 H   0  0  0

+    9.2925   -1.2460    0.0000 H   0  0  0

+   10.4372   -0.4782    0.0000 H   0  0  0

+   10.7370    1.0944    0.0000 H   0  0  0

+    9.1644    1.3942    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  1  0

+  8 10  1  0

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+ 10 12  1  0

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+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+  1 18  1  0

+  1 19  1  0

+  2 20  1  0

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+  3 22  1  0

+  3 23  1  0

+  5 24  1  0

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+  8 27  1  0

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+ 15 41  1  0

+ 16 42  1  0

+ 16 43  1  0

+ 17 44  1  0

+ 17 45  1  0

+ 17 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+79-41-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.8506   -0.0580   -0.0016 C   0  0  0

+   -0.6188   -0.0370   -0.0004 C   0  0  0

+    1.6226    1.2362   -0.0008 C   0  0  0

+    1.4995   -1.2199    0.0022 C   0  0  0

+   -1.2761    1.1398    0.0014 O   0  0  0

+   -1.2414   -1.0808   -0.0010 O   0  0  0

+    2.4908    0.7183    0.0000 H   0  0  0

+    2.1405    2.1044    0.0000 H   0  0  0

+    0.7544    1.7541    0.0000 H   0  0  0

+    0.9816   -2.0881    0.0000 H   0  0  0

+    2.5103   -1.2343    0.0000 H   0  0  0

+   -1.7691    2.0224    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+85-82-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 39                          1 V2000

+    2.4205   -0.4389    0.0372 C   0  0  0

+    1.3323    0.4872   -0.2760 C   0  0  0

+    3.7420    0.0617    0.1228 C   0  0  0

+    2.1802   -1.7997    0.2579 C   0  0  0

+    0.0500    0.0469   -0.3669 N   0  0  0

+    1.6407    1.8348   -0.4793 C   0  0  0

+    3.9808    1.4312   -0.0933 C   0  0  0

+    4.7919   -0.8223    0.4233 C   0  0  0

+    3.2224   -2.6300    0.5479 C   0  0  0

+   -0.8915    0.6695    0.2576 N   0  0  0

+    2.9591    2.2789   -0.3834 C   0  0  0

+    0.6518    2.7164   -0.7712 O   0  0  0

+    4.5241   -2.1422    0.6269 C   0  0  0

+   -2.1811    0.2266    0.1662 C   0  0  0

+   -3.2038    0.8985    0.8414 C   0  0  0

+   -2.4847   -0.8973   -0.6077 C   0  0  0

+   -4.5030    0.4459    0.7440 C   0  0  0

+   -3.7882   -1.3379   -0.6955 C   0  0  0

+   -4.7950   -0.6707   -0.0194 C   0  0  0

+   -5.6073    1.1689    1.4712 C   0  0  0

+   -4.1176   -2.5493   -1.5293 C   0  0  0

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+    3.0633   -3.6343    0.0000 H   0  0  0

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+   -0.1072    3.3931    0.0000 H   0  0  0

+    5.2977   -2.8021    0.0000 H   0  0  0

+   -3.0790    1.9077    0.0000 H   0  0  0

+   -1.7437   -1.5936    0.0000 H   0  0  0

+   -5.7449   -1.0336    0.0000 H   0  0  0

+   -5.0503    2.0196    0.0000 H   0  0  0

+   -6.4580    1.7259    0.0000 H   0  0  0

+   -6.1643    0.3182    0.0000 H   0  0  0

+   -5.0988   -2.2825    0.0000 H   0  0  0

+   -4.3844   -3.5305    0.0000 H   0  0  0

+   -3.1364   -2.8161    0.0000 H   0  0  0

+  1  2  1  0

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+ 20 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98911-23-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 56                          1 V2000

+   -2.6525    1.6471    0.3898 C   0  0  2

+   -2.9352    0.5618    1.2754 O   0  0  0

+   -1.2668    1.6363    0.0518 O   0  0  0

+   -3.0090    2.9692    1.0732 C   0  0  1

+   -3.2818   -0.5472    0.4660 N   0  0  0

+   -1.0637    2.6131   -0.9675 C   0  0  1

+   -2.7362    4.1230    0.1016 C   0  0  2

+   -4.3930    2.9633    1.4291 O   0  0  0

+   -2.3184   -1.5156    0.1548 C   0  0  0

+   -4.5385   -0.6711   -0.0049 C   0  0  0

+   -1.2902    4.0143   -0.3953 C   0  0  2

+    0.3666    2.5047   -1.4999 C   0  0  0

+   -2.9147    5.3685    0.7791 O   0  0  0

+   -1.6278   -1.4468   -1.0476 C   0  0  0

+   -2.0498   -2.5415    1.0515 C   0  0  0

+   -4.9733   -1.9552   -0.6631 C   0  0  0

+   -5.3195    0.2508    0.1010 O   0  0  0

+   -1.0627    4.9881   -1.4160 O   0  0  0

+    0.5752    1.1994   -2.0427 O   0  0  0

+   -0.6780   -2.4014   -1.3536 C   0  0  0

+   -1.1001   -3.4952    0.7446 C   0  0  0

+   -0.4138   -3.4290   -0.4598 C   0  0  0

+    0.5214   -4.3684   -0.7615 O   0  0  0

+    1.7225   -3.8667   -0.3710 C   0  0  0

+    2.8918   -4.5516   -0.6696 C   0  0  0

+    1.7816   -2.6661    0.3217 C   0  0  0

+    4.1115   -4.0400   -0.2717 C   0  0  0

+    3.0036   -2.1578    0.7179 C   0  0  0

+    4.1679   -2.8451    0.4242 C   0  0  0

+    5.7021   -2.2045    0.9236 Cl  0  0  0

+   14.8459    7.5598    0.1747 O   0  0  0

+   -3.6442    1.6429    0.0000 H   0  0  0

+   -2.0174    2.9847    0.0000 H   0  0  0

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+    1.3551    2.5844    0.0000 H   0  0  0

+    0.3642    3.4964    0.0000 H   0  0  0

+   -3.0554    6.3502    0.0000 H   0  0  0

+   -1.2931   -0.5133    0.0000 H   0  0  0

+   -2.9106   -3.0340    0.0000 H   0  0  0

+   -5.9126   -1.6371    0.0000 H   0  0  0

+   -5.2914   -2.8945    0.0000 H   0  0  0

+   -4.0340   -2.2733    0.0000 H   0  0  0

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+    0.1840   -1.9110    0.0000 H   0  0  0

+   -1.4361   -4.4282    0.0000 H   0  0  0

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+    4.9241   -4.6084    0.0000 H   0  0  0

+    3.0725   -1.1685    0.0000 H   0  0  0

+   13.8542    7.5598    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 11  1  0

+ 21 22  1  0

+ 28 29  2  0

+  1 32  1  0

+  4 33  1  0

+  6 34  1  0

+  7 35  1  0

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+ 25 50  1  0

+ 26 51  1  0

+ 27 52  1  0

+ 28 53  1  0

+ 31 54  1  0

+ 31 55  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35300-54-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    0.3528   -0.7087   -0.3170 C   0  0  0

+    1.1973   -1.4617    0.4775 C   0  0  0

+    0.8270    0.4257   -0.9484 C   0  0  0

+   -1.0831   -1.1282   -0.4997 C   0  0  0

+    2.5156   -1.0801    0.6404 C   0  0  0

+    2.1458    0.8074   -0.7854 C   0  0  0

+   -1.9598   -0.0742   -0.0215 O   0  0  0

+    2.9900    0.0546    0.0089 C   0  0  0

+   -3.2917   -0.2285   -0.0853 C   0  0  0

+    4.4020    0.4630    0.1829 N   0  3  0

+   -4.2016    0.8654    0.4111 C   0  0  0

+   -3.7610   -1.2446   -0.5406 O   0  0  0

+    4.8199    1.4626   -0.3735 O   0  0  0

+    5.1461   -0.2006    0.8826 O   0  5  0

+   -5.6594    0.4395    0.2256 C   0  0  0

+   -6.5832    1.5501    0.7295 C   0  0  0

+    0.9722   -2.4534    0.0000 H   0  0  0

+    0.1501    1.1846    0.0000 H   0  0  0

+   -1.9461   -1.6660    0.0000 H   0  0  0

+   -0.6677   -2.0564    0.0000 H   0  0  0

+    3.1924   -1.8390    0.0000 H   0  0  0

+    2.3709    1.7991    0.0000 H   0  0  0

+   -3.3386    1.4032    0.0000 H   0  0  0

+   -4.6170    1.7936    0.0000 H   0  0  0

+   -6.5224   -0.0983    0.0000 H   0  0  0

+   -5.2440   -0.4887    0.0000 H   0  0  0

+   -5.8014    2.2004    0.0000 H   0  0  0

+   -7.2335    2.3319    0.0000 H   0  0  0

+   -7.3650    0.8998    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  9 12  2  0

+ 10 13  2  0

+ 10 14  1  0

+ 11 15  1  0

+ 15 16  1  0

+  6  8  2  0

+  2 17  1  0

+  3 18  1  0

+  4 19  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-67-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+    1.9773    0.9251    0.4797 C   0  0  0

+    2.2698   -0.4935    0.6032 O   0  0  0

+    3.1443    1.5490   -0.3133 C   0  0  0

+    0.6740    1.1112   -0.2999 C   0  0  0

+    3.4029   -0.8186   -0.0340 C   0  0  0

+    4.2220    0.4415   -0.2379 C   0  0  0

+   -0.4688    0.4178    0.4445 C   0  0  0

+    3.7195   -1.9300   -0.3867 O   0  0  0

+   -1.7721    0.6038   -0.3351 C   0  0  0

+   -2.9149   -0.0896    0.4093 C   0  0  0

+   -4.2183    0.0964   -0.3703 C   0  0  0

+   -5.3611   -0.5970    0.3741 C   0  0  0

+   -6.6644   -0.4110   -0.4055 C   0  0  0

+    1.8049    1.9025    0.0000 H   0  0  0

+    3.9172    2.1716    0.0000 H   0  0  0

+    2.5966    2.3767    0.0000 H   0  0  0

+    1.0935    2.0107    0.0000 H   0  0  0

+   -0.0650    1.7737    0.0000 H   0  0  0

+    5.0117   -0.1596    0.0000 H   0  0  0

+    4.8800    1.1845    0.0000 H   0  0  0

+   -0.8882   -0.4817    0.0000 H   0  0  0

+    0.2702   -0.2447    0.0000 H   0  0  0

+   -1.3527    1.5033    0.0000 H   0  0  0

+   -2.5111    1.2663    0.0000 H   0  0  0

+   -3.3343   -0.9891    0.0000 H   0  0  0

+   -2.1759   -0.7521    0.0000 H   0  0  0

+   -3.7989    0.9959    0.0000 H   0  0  0

+   -4.9573    0.7589    0.0000 H   0  0  0

+   -5.7805   -1.4965    0.0000 H   0  0  0

+   -4.6221   -1.2595    0.0000 H   0  0  0

+   -6.5242    0.5715    0.0000 H   0  0  0

+   -7.6469   -0.2708    0.0000 H   0  0  0

+   -6.8046   -1.3935    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  2  0

+  7  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+  5  6  1  0

+  1 14  1  0

+  3 15  1  0

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+  4 17  1  0

+  4 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+139-13-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+   -0.0284    0.0009   -0.3427 N   0  0  0

+    0.2469   -1.3380   -0.8808 C   0  0  0

+    0.9840    0.9007   -0.9113 C   0  0  0

+   -1.3235    0.4198   -0.8953 C   0  0  0

+    1.2261   -2.0488    0.0176 C   0  0  0

+    1.2097    2.0590    0.0259 C   0  0  0

+   -2.4291   -0.0124    0.0330 C   0  0  0

+    1.7272   -3.2400   -0.3452 O   0  0  0

+    1.5600   -1.5464    1.0645 O   0  0  0

+    1.9574    3.1029   -0.3651 O   0  0  0

+    0.7175    2.0481    1.1293 O   0  0  0

+   -3.7109    0.1936   -0.3082 O   0  0  0

+   -2.1618   -0.5443    1.0845 O   0  0  0

+   -0.6858   -1.2688    0.0000 H   0  0  0

+   -0.0747   -2.2162    0.0000 H   0  0  0

+    1.3656    0.0468    0.0000 H   0  0  0

+    1.9132    1.0070    0.0000 H   0  0  0

+   -0.7893    1.1875    0.0000 H   0  0  0

+   -1.9026    1.1542    0.0000 H   0  0  0

+    2.0899   -4.1021    0.0000 H   0  0  0

+    2.5020    3.8632    0.0000 H   0  0  0

+   -4.6343    0.3420    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  6 11  2  0

+  7 12  1  0

+  7 13  2  0

+  2 14  1  0

+  2 15  1  0

+  3 16  1  0

+  3 17  1  0

+  4 18  1  0

+  4 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2978-11-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 41                          1 V2000

+    1.0096   -0.6380   -0.0311 C   0  0  0

+   -0.4708   -0.9196   -0.0381 C   0  0  0

+    1.8091   -1.1675    0.9642 C   0  0  0

+    1.5689    0.1454   -1.0236 C   0  0  0

+   -1.1903    0.3116    0.0541 O   0  0  0

+    3.1673   -0.9091    0.9706 C   0  0  0

+    2.9267    0.4037   -1.0173 C   0  0  0

+   -2.5042   -0.0022    0.0434 C   0  0  0

+    3.7256   -0.1212   -0.0184 C   0  0  0

+   -3.4484    0.9921    0.1210 N   0  0  0

+   -2.8752   -1.2464   -0.0402 N   0  0  0

+    5.1797    0.1554   -0.0116 N   0  3  0

+   -3.0311    2.3885    0.2697 C   0  0  0

+   -4.2929   -1.5789   -0.2006 C   0  0  0

+    5.6716    0.8496   -0.8831 O   0  0  0

+    5.8842   -0.3113    0.8656 O   0  5  0

+   -3.4797    3.1881   -0.9552 C   0  0  0

+   -3.6703    2.9806    1.5273 C   0  0  0

+   -4.5051   -2.2711   -1.5484 C   0  0  0

+   -4.7278   -2.5159    0.9281 C   0  0  0

+   -1.2708   -1.2723    0.0000 H   0  0  0

+   -0.2111   -1.7544    0.0000 H   0  0  0

+    1.6367   -2.0246    0.0000 H   0  0  0

+    1.0976    0.8817    0.0000 H   0  0  0

+    3.6399   -1.6446    0.0000 H   0  0  0

+    3.0975    1.2611    0.0000 H   0  0  0

+   -4.2987    0.7889    0.0000 H   0  0  0

+   -2.1622    2.4849    0.0000 H   0  0  0

+   -4.8449   -0.9009    0.0000 H   0  0  0

+   -2.7172    3.6159    0.0000 H   0  0  0

+   -3.9075    3.9506    0.0000 H   0  0  0

+   -4.2422    2.7603    0.0000 H   0  0  0

+   -3.0762    3.6220    0.0000 H   0  0  0

+   -4.3117    3.5747    0.0000 H   0  0  0

+   -4.2644    2.3392    0.0000 H   0  0  0

+   -5.3410   -2.0149    0.0000 H   0  0  0

+   -4.7613   -3.1070    0.0000 H   0  0  0

+   -3.6692   -2.5273    0.0000 H   0  0  0

+   -5.5208   -2.1478    0.0000 H   0  0  0

+   -5.0959   -3.3089    0.0000 H   0  0  0

+   -3.9348   -2.8840    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

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+ 12 16  1  0

+ 13 17  1  0

+ 13 18  1  0

+ 14 19  1  0

+ 14 20  1  0

+  7  9  1  0

+  2 21  1  0

+  2 22  1  0

+  3 23  1  0

+  4 24  1  0

+  6 25  1  0

+  7 26  1  0

+ 10 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89-57-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.3400    0.1571   -0.0003 C   0  0  0

+   -0.1369   -1.2293    0.0212 C   0  0  0

+    0.7613    1.0175   -0.0180 C   0  0  0

+   -1.7084    0.7052   -0.0104 C   0  0  0

+    1.1533   -1.7378    0.0248 C   0  0  0

+   -1.2005   -2.0725    0.0389 O   0  0  0

+    2.0428    0.4953   -0.0141 C   0  0  0

+   -1.9026    2.0344    0.0961 O   0  0  0

+   -2.6612   -0.0416   -0.1147 O   0  0  0

+    2.2361   -0.8824    0.0073 C   0  0  0

+    3.1471    1.3551   -0.0322 N   0  0  0

+    0.6181    2.0477    0.0000 H   0  0  0

+    1.3052   -2.7667    0.0000 H   0  0  0

+   -2.0155   -2.7186    0.0000 H   0  0  0

+   -2.0530    3.0636    0.0000 H   0  0  0

+    3.2015   -1.2695    0.0000 H   0  0  0

+    4.1108    0.9639    0.0000 H   0  0  0

+    3.0041    2.3853    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  2  0

+  7 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+8022-00-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 52                          1 V2000

+   -8.5654   -1.9340    0.0532 P   0  0  0

+   -9.9944   -1.2493   -0.2318 O   0  0  0

+   -8.2918   -1.9648    1.6394 O   0  0  0

+   -8.5672   -3.4384   -0.5204 O   0  0  0

+   -7.2259   -0.9496   -0.7892 S   0  0  0

+   -9.8238    0.1567   -0.0422 C   0  0  0

+   -9.4056   -2.6308    2.2378 C   0  0  0

+   -7.2172   -3.9036   -0.4638 C   0  0  0

+  -11.1524    0.8708   -0.2990 C   0  0  0

+  -10.9359    2.6557   -0.0584 S   0  0  0

+  -12.6190    3.2285   -0.4184 C   0  0  0

+  -12.6813    4.7505   -0.2748 C   0  0  0

+   10.5976   -1.4342   -0.2472 P   0  0  0

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+   11.2237   -1.2554    1.2253 O   0  0  0

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+   11.4754   -0.7750   -1.2398 O   0  0  0

+    9.1153    1.1887   -0.0384 C   0  0  0

+   10.2481   -1.7395    2.1505 C   0  0  0

+   11.8116   -3.4897   -0.7623 C   0  0  0

+    7.8473    2.0449   -0.0428 C   0  0  0

+    8.2906    3.7831    0.2274 S   0  0  0

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+    6.7687    6.0503    0.3856 C   0  0  0

+   -8.7183   -0.1196    0.0000 H   0  0  0

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+   -9.9904   -1.6528    0.0000 H   0  0  0

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+  -12.8510    2.1129    0.0000 H   0  0  0

+  -11.5427    4.7971    0.0000 H   0  0  0

+  -12.7279    5.8891    0.0000 H   0  0  0

+  -13.8199    4.7039    0.0000 H   0  0  0

+   10.1800    0.7826    0.0000 H   0  0  0

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+    7.3219    1.0337    0.0000 H   0  0  0

+    5.5259    4.7653    0.0000 H   0  0  0

+    6.2901    3.4566    0.0000 H   0  0  0

+    7.9043    5.9557    0.0000 H   0  0  0

+    6.8633    7.1859    0.0000 H   0  0  0

+    5.6331    6.1449    0.0000 H   0  0  0

+  1  2  1  0

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+  1  5  2  0

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+ 11 35  1  0

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+ 18 40  1  0

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+ 21 49  1  0

+ 23 50  1  0

+ 23 51  1  0

+ 24 52  1  0

+ 24 53  1  0

+ 24 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+218-08-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.4363    0.5582    0.0020 C   0  0  0

+   -0.3808   -0.5884    0.0008 C   0  0  0

+    1.8894    0.3807    0.0014 C   0  0  0

+   -0.1442    1.8383   -0.0021 C   0  0  0

+   -1.8329   -0.4100    0.0009 C   0  0  0

+    0.1975   -1.8699   -0.0010 C   0  0  0

+    2.4152   -0.9323   -0.0001 C   0  0  0

+    2.7596    1.4745    0.0019 C   0  0  0

+   -1.4864    2.0067   -0.0075 C   0  0  0

+   -2.3635    0.9005    0.0025 C   0  0  0

+   -2.7062   -1.5042   -0.0008 C   0  0  0

+    1.5395   -2.0391   -0.0018 C   0  0  0

+    3.8071   -1.1119   -0.0007 C   0  0  0

+    4.1082    1.2653    0.0009 C   0  0  0

+   -3.6876    1.0764    0.0026 N   0  0  0

+   -4.0531   -1.2561   -0.0010 C   0  0  0

+    4.6289   -0.0245    0.0002 C   0  0  0

+   -4.5129    0.0563    0.0014 C   0  0  0

+    0.4786    2.6837    0.0000 H   0  0  0

+   -0.4263   -2.7145    0.0000 H   0  0  0

+    2.3775    2.4525    0.0000 H   0  0  0

+   -1.8834    2.9787    0.0000 H   0  0  0

+   -2.3388   -2.4878    0.0000 H   0  0  0

+    1.9368   -3.0110    0.0000 H   0  0  0

+    4.2137   -2.0800    0.0000 H   0  0  0

+    4.7606    2.0880    0.0000 H   0  0  0

+   -4.7359   -2.0537    0.0000 H   0  0  0

+    5.6698   -0.1624    0.0000 H   0  0  0

+   -5.5475    0.2356    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14097-03-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 53                          1 V2000

+    3.6162    0.0859    0.0703 C   0  0  0

+    4.4310   -1.0418    0.2183 C   0  0  0

+    4.1577    1.2678   -0.4423 C   0  0  0

+    2.2965    0.0302    0.4198 N   0  0  0

+    5.7619   -0.9787   -0.1425 C   0  0  0

+    3.7703   -2.5158    0.8545 Cl  0  0  0

+    5.4892    1.3149   -0.7983 C   0  0  0

+    1.5482    1.0719    0.2819 N   0  0  0

+    6.2896    0.1957   -0.6492 C   0  0  0

+    0.2279    1.0162    0.6316 C   0  0  0

+    7.7178    0.2555   -1.0334 N   0  3  0

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+   -0.3162   -0.1695    1.1334 C   0  0  0

+    8.1857    1.2877   -1.4798 O   0  0  0

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+  -10.4952   -1.6705    0.0000 H   0  0  0

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+   -8.6883    1.3578    0.0000 H   0  0  0

+   -9.8789    0.5966    0.0000 H   0  0  0

+   -9.5725   -2.2553    0.0000 H   0  0  0

+   -8.2906   -2.8500    0.0000 H   0  0  0

+   -7.6959   -1.5681    0.0000 H   0  0  0

+  1  2  1  0

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+ 27 50  1  0

+ 27 51  1  0

+ 27 52  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5522-43-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -0.2981   -0.4222   -0.0123 C   0  0  0

+   -1.4770    0.1367    0.0115 C   0  0  0

+    0.9192    0.4107    0.0053 C   0  0  0

+   -0.1645   -1.8896   -0.0508 C   0  0  0

+   -1.6018    1.6058    0.0562 C   0  0  0

+   -2.6984   -0.6882   -0.0053 C   0  0  0

+    2.2201   -0.2806   -0.0225 C   0  0  0

+    0.8134    1.7176    0.0440 C   0  0  0

+   -1.3804   -2.7202   -0.0633 C   0  0  0

+    1.0358   -2.4199   -0.0735 C   0  0  0

+   -0.5222    2.3507    0.0719 C   0  0  0

+   -2.9605    2.1752    0.0821 C   0  0  0

+   -2.5727   -2.1547   -0.0506 C   0  0  0

+   -3.8687   -0.0948    0.0200 C   0  0  0

+    2.2510   -1.5956   -0.0615 C   0  0  0

+    3.3732    0.4307   -0.0085 N   0  3  0

+   -3.9990    1.3672    0.0646 C   0  0  0

+    3.5277    1.3557   -0.7857 O   0  0  0

+    4.2554    0.1451    0.7813 O   0  5  0

+    1.6843    2.3192    0.0000 H   0  0  0

+   -1.2977   -3.7755    0.0000 H   0  0  0

+    1.1309   -3.4741    0.0000 H   0  0  0

+   -0.6075    3.4057    0.0000 H   0  0  0

+   -3.1000    3.2245    0.0000 H   0  0  0

+   -3.4423   -2.7582    0.0000 H   0  0  0

+   -4.7452   -0.6883    0.0000 H   0  0  0

+    3.1920   -2.0803    0.0000 H   0  0  0

+   -4.9696    1.7895    0.0000 H   0  0  0

+  1  2  2  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77-81-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.1990    0.0255   -0.1148 P   0  0  0

+   -1.1240    0.7158    0.4896 O   0  0  0

+    1.5571    0.6270    0.6766 N   0  0  0

+    0.1065   -1.7704    0.1230 C   0  0  0

+    0.2964    0.3274   -1.5604 O   0  0  0

+   -2.2368    0.1669   -0.2192 C   0  0  0

+    2.7226   -0.0397    0.0809 C   0  0  0

+    1.6571    2.0490    0.3219 C   0  0  0

+    0.0486   -2.8951    0.2719 N   0  0  0

+   -3.5330    0.7843    0.3095 C   0  0  0

+   -2.8984   -0.6730    0.0000 H   0  0  0

+   -1.5638   -0.6638    0.0000 H   0  0  0

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+    0.5906    2.1240    0.0000 H   0  0  0

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+   -3.9928   -0.1809    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2950-01-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 77                          1 V2000

+   -5.0836   -2.2972   -0.0057 C   0  0  0

+   -4.2940   -3.6077   -0.0151 C   0  0  0

+   -5.9708   -2.2274   -1.2502 C   0  0  0

+   -5.9583   -2.2379    1.2482 C   0  0  0

+   -4.1259   -1.1337   -0.0056 C   0  0  0

+   -4.6143    0.1663    0.0004 C   0  0  0

+   -2.7666   -1.3614   -0.0056 C   0  0  0

+   -5.9551    0.3858    0.0065 O   0  0  0

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+   -1.8794   -0.2815   -0.0055 C   0  0  0

+   -4.2731    2.6511    0.0069 C   0  0  0

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+    5.1287   -2.8646    1.2591 C   0  0  0

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+    5.3809   -1.8540    0.0000 H   0  0  0

+  2  1  1  0

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+ 31 73  1  0

+ 32 74  1  0

+ 32 75  1  0

+ 32 76  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+634-93-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.1849   -0.0001    0.0011 C   0  0  0

+   -0.4889   -1.2024    0.0008 C   0  0  0

+   -0.4886    1.2026    0.0008 C   0  0  0

+   -2.5839    0.0000   -0.0042 N   0  0  0

+    0.8936   -1.1991    0.0003 C   0  0  0

+   -1.3543   -2.7073    0.0006 Cl  0  0  0

+    0.8934    1.1992    0.0003 C   0  0  0

+   -1.3539    2.7076    0.0006 Cl  0  0  0

+    1.5839   -0.0002    0.0000 C   0  0  0

+    3.3199   -0.0002   -0.0007 Cl  0  0  0

+   -3.1049    0.9025    0.0000 H   0  0  0

+   -3.1050   -0.9025    0.0000 H   0  0  0

+    1.4163   -2.1007    0.0000 H   0  0  0

+    1.4161    2.1007    0.0000 H   0  0  0

+  1  2  2  0

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+  7  9  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+367-51-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  8                          1 V2000

+   -1.9991   -0.9937    0.0132 C   0  0  0

+   -2.9521    0.0758   -0.4549 C   0  0  0

+   -0.9756   -0.6835    0.6073 O   0  0  0

+   -2.2515   -2.1723   -0.1964 O   0  0  0

+   -2.3067    1.7062    0.0096 S   0  0  0

+    8.0492    0.0877   -0.0686 Na  0  3  0

+   -3.8044    0.5778    0.0000 H   0  0  0

+   -3.5799   -0.6886    0.0000 H   0  0  0

+   -1.9426    2.6259    0.0000 H   0  0  0

+   -2.4586   -3.1396    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  7  1  0

+  2  8  1  0

+  5  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-63-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    1.3093   -0.1171    0.0123 C   0  0  0

+    0.0546    0.3238    0.2321 O   0  0  0

+    2.4514    0.7845    0.2177 C   0  0  0

+    1.4963   -1.2617   -0.3510 O   0  0  0

+   -1.0740   -0.5670    0.0291 C   0  0  0

+    3.6902    0.3492    0.0007 C   0  0  0

+   -2.3735    0.1758    0.3459 C   0  0  0

+   -2.5070    1.3870   -0.5794 C   0  0  0

+   -3.5626   -0.7629    0.1320 C   0  0  0

+    2.2807    1.8083    0.0000 H   0  0  0

+   -1.6997   -1.3951    0.0000 H   0  0  0

+   -0.3324   -1.2931    0.0000 H   0  0  0

+    3.8818   -0.6708    0.0000 H   0  0  0

+    4.4778    1.0252    0.0000 H   0  0  0

+   -1.5057    0.7452    0.0000 H   0  0  0

+   -1.4754    1.5007    0.0000 H   0  0  0

+   -2.6207    2.4186    0.0000 H   0  0  0

+   -3.5386    1.2733    0.0000 H   0  0  0

+   -4.2057    0.0517    0.0000 H   0  0  0

+   -4.3772   -1.4060    0.0000 H   0  0  0

+   -2.9195   -1.5775    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  7  8  1  0

+  7  9  1  0

+  3 10  1  0

+  5 11  1  0

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+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5493-45-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 42                          1 V2000

+    0.6933   -1.3361   -0.3234 C   0  0  0

+   -0.6933   -1.3361    0.3234 C   0  0  0

+    1.4488   -0.1057    0.1082 C   0  0  0

+    1.4604   -2.5854    0.1147 C   0  0  0

+   -1.4488   -0.1057   -0.1082 C   0  0  0

+   -1.4604   -2.5854   -0.1147 C   0  0  0

+    2.6967    0.1067   -0.3385 O   0  0  0

+    0.9313    0.6896    0.8562 O   0  0  0

+    0.6933   -3.8346   -0.3234 C   0  0  0

+   -2.6967    0.1067    0.3385 O   0  0  0

+   -0.9313    0.6896   -0.8562 O   0  0  0

+   -0.6933   -3.8346    0.3234 C   0  0  0

+    3.4246    1.2923    0.0773 C   0  0  0

+   -3.4246    1.2923   -0.0773 C   0  0  0

+    4.8112    1.2923   -0.5694 C   0  0  0

+   -4.8112    1.2923    0.5694 C   0  0  0

+    5.5783    2.5415   -0.1313 C   0  0  0

+    5.8122    1.2571    0.4498 O   0  0  0

+   -5.5783    2.5415    0.1313 C   0  0  0

+   -5.8122    1.2571   -0.4498 O   0  0  0

+    0.1856   -0.4285    0.0000 H   0  0  0

+   -0.1856   -0.4285    0.0000 H   0  0  0

+    2.2510   -3.2610    0.0000 H   0  0  0

+    2.2510   -1.9098    0.0000 H   0  0  0

+   -2.2510   -1.9098    0.0000 H   0  0  0

+   -2.2510   -3.2610    0.0000 H   0  0  0

+    0.5035   -4.8571    0.0000 H   0  0  0

+    1.6639   -4.2079    0.0000 H   0  0  0

+   -1.6639   -4.2079    0.0000 H   0  0  0

+   -0.5035   -4.8571    0.0000 H   0  0  0

+    3.6144    2.3148    0.0000 H   0  0  0

+    2.4539    1.6655    0.0000 H   0  0  0

+   -2.4539    1.6655    0.0000 H   0  0  0

+   -3.6144    2.3148    0.0000 H   0  0  0

+    4.7929    0.2525    0.0000 H   0  0  0

+   -4.7929    0.2525    0.0000 H   0  0  0

+    6.5101    3.0033    0.0000 H   0  0  0

+    4.8770    3.3094    0.0000 H   0  0  0

+   -4.8770    3.3094    0.0000 H   0  0  0

+   -6.5101    3.0033    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  5 10  1  0

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+ 10 14  1  0

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+  9 12  1  0

+ 17 18  1  0

+ 19 20  1  0

+  1 21  1  0

+  2 22  1  0

+  4 23  1  0

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+ 15 35  1  0

+ 16 36  1  0

+ 17 37  1  0

+ 17 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+159092-84-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.4492   -0.2000    0.0006 C   0  0  0

+   -0.8843    0.4087   -0.0084 C   0  0  0

+    1.5813    0.6457   -0.0015 C   0  0  0

+    0.6205   -1.5855    0.0168 C   0  0  0

+   -0.9868    1.8184   -0.0188 C   0  0  0

+   -2.0431   -0.3692   -0.0074 C   0  0  0

+    1.4118    2.0499   -0.0116 C   0  0  0

+    2.8615    0.0740    0.0070 C   0  0  0

+    1.8808   -2.1116    0.0251 C   0  0  0

+    0.1854    2.6099   -0.0208 C   0  0  0

+   -2.2570    2.4111   -0.0274 C   0  0  0

+   -3.2666    0.2387   -0.0164 C   0  0  0

+    2.6068    2.9235   -0.0132 N   0  3  0

+    2.9968   -1.2832    0.0171 C   0  0  0

+    2.0602   -3.5809    0.0423 N   0  3  0

+   -3.3715    1.6241   -0.0257 C   0  0  0

+   -4.4944   -0.5881   -0.0153 N   0  3  0

+    2.6793    3.8576    0.7650 O   0  0  0

+    3.5175    2.7081   -0.7927 O   0  5  0

+    3.1811   -4.0575    0.0499 O   0  0  0

+    1.0870   -4.3132    0.0489 O   0  5  0

+   -5.5887   -0.0534   -0.0233 O   0  0  0

+   -4.4103   -1.8032   -0.0064 O   0  5  0

+   -0.2098   -2.2157    0.0000 H   0  0  0

+   -1.9754   -1.4094    0.0000 H   0  0  0

+    3.7068    0.6840    0.0000 H   0  0  0

+    0.0992    3.6487    0.0000 H   0  0  0

+   -2.3498    3.4494    0.0000 H   0  0  0

+    3.9501   -1.7049    0.0000 H   0  0  0

+   -4.3145    2.0683    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  5 10  1  0

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+  7 10  2  0

+  9 14  1  0

+ 12 16  2  0

+  4 24  1  0

+  6 25  1  0

+  8 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2855-13-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    0.9997   -0.4378   -0.0583 C   0  0  0

+   -0.1579   -1.3109    0.3833 C   0  0  0

+    0.7805    1.0237    0.3408 C   0  0  0

+    2.2786   -0.9300    0.6494 C   0  0  0

+    1.2359   -0.5304   -1.5663 C   0  0  0

+   -1.5462   -0.7754    0.0961 C   0  0  0

+   -0.5559    1.5016   -0.2337 C   0  0  0

+    3.4173   -0.0983    0.2373 N   0  0  0

+   -1.6769    0.7073    0.4367 C   0  0  0

+   -1.9438   -1.0057   -1.3644 C   0  0  0

+   -2.5520   -1.5479    0.9767 C   0  0  0

+   -0.7273    2.9319    0.0539 N   0  0  0

+   -0.7158   -2.2134    0.0000 H   0  0  0

+    0.6263   -2.0256    0.0000 H   0  0  0

+    1.8414    1.0075    0.0000 H   0  0  0

+    0.9698    2.0677    0.0000 H   0  0  0

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+   -2.1291    1.6671    0.0000 H   0  0  0

+   -2.7011    0.4303    0.0000 H   0  0  0

+   -2.4756   -0.0876    0.0000 H   0  0  0

+   -2.8619   -1.5375    0.0000 H   0  0  0

+   -1.4120   -1.9238    0.0000 H   0  0  0

+   -3.1983   -0.7064    0.0000 H   0  0  0

+   -3.3935   -2.1942    0.0000 H   0  0  0

+   -1.9057   -2.3894    0.0000 H   0  0  0

+    0.1219    3.5680    0.0000 H   0  0  0

+   -1.7028    3.3493    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+ 11 32  1  0

+ 12 33  1  0

+ 12 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+43192-03-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.7746   -0.0781   -0.0036 C   0  0  0

+   -0.3610   -0.8621    0.0554 C   0  0  0

+    0.6633    1.2974   -0.0898 C   0  0  0

+    2.1122   -0.7107    0.0316 N   0  3  0

+   -1.6158   -0.2672    0.0281 C   0  0  0

+   -0.5846    1.8929   -0.1177 C   0  0  0

+    1.9046    2.1495   -0.1541 C   0  0  0

+    2.4854   -1.3983   -0.9019 O   0  0  0

+    2.8397   -0.5437    0.9941 O   0  5  0

+   -1.7240    1.1151   -0.0586 C   0  0  0

+   -2.7663   -1.0571    0.0872 N   0  0  0

+   -4.0447   -0.4490    0.0592 O   0  0  0

+   -0.2772   -1.8972    0.0000 H   0  0  0

+   -0.6643    2.9283    0.0000 H   0  0  0

+    2.4923    1.2933    0.0000 H   0  0  0

+    2.7608    2.7372    0.0000 H   0  0  0

+    1.3169    3.0057    0.0000 H   0  0  0

+   -2.6605    1.5638    0.0000 H   0  0  0

+   -2.6845   -2.0923    0.0000 H   0  0  0

+   -4.9825   -0.0029    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

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+  6 10  2  0

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+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+29082-74-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.3619    0.0011   -0.2888 C   0  0  0

+    0.3343   -1.2069   -0.2151 C   0  0  0

+    0.3358    1.2085   -0.2119 C   0  0  0

+   -1.8304    0.0021   -0.4535 C   0  0  0

+    1.7083   -1.2015   -0.0668 C   0  0  0

+   -0.5244   -2.7128   -0.3091 Cl  0  0  0

+    1.7094    1.2012   -0.0637 C   0  0  0

+   -0.5212    2.7155   -0.3031 Cl  0  0  0

+   -2.6197   -0.0017    0.6171 C   0  0  0

+   -2.5254    0.0082   -2.0443 Cl  0  0  0

+    2.3947   -0.0008    0.0088 C   0  0  0

+    2.5756   -2.7024    0.0256 Cl  0  0  0

+    2.5783    2.7010    0.0320 Cl  0  0  0

+   -4.3449   -0.0005    0.4236 Cl  0  0  0

+   -1.9247   -0.0078    2.2079 Cl  0  0  0

+    4.1206   -0.0019    0.1957 Cl  0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

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+  4 10  1  0

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+  5 12  1  0

+  7 13  1  0

+  9 14  1  0

+  9 15  1  0

+ 11 16  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3025-52-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 41                          1 V2000

+   -4.1144   -0.0613    0.0342 C   0  0  0

+   -3.5587   -1.2272    0.5527 C   0  0  0

+   -3.2904    0.9633   -0.4232 C   0  0  0

+   -5.4982    0.0784   -0.0325 N   0  0  0

+   -2.1912   -1.3714    0.6151 C   0  0  0

+   -1.9223    0.8268   -0.3642 C   0  0  0

+   -6.1893   -0.0786   -1.3147 C   0  0  0

+   -6.2631    0.3822    1.1795 C   0  0  0

+   -1.3597   -0.3440    0.1565 C   0  0  0

+   -6.3509   -1.5674   -1.6280 C   0  0  0

+   -6.1500    1.8755    1.4930 C   0  0  0

+   -0.0038   -0.4831    0.2167 N   0  0  0

+    0.7613    0.4653   -0.2067 N   0  0  0

+    2.1200    0.3258   -0.1464 C   0  0  0

+    2.9522    1.3512   -0.6042 C   0  0  0

+    2.6835   -0.8401    0.3784 C   0  0  0

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+    4.0551   -0.9737    0.4360 C   0  0  0

+    4.8726    0.0433   -0.0243 C   0  0  0

+    6.3437   -0.1078    0.0405 N   0  3  0

+    6.8317   -1.1275    0.4939 O   0  0  0

+    7.0661    0.7874   -0.3597 O   0  5  0

+   -4.1306   -2.0359    0.0000 H   0  0  0

+   -3.6734    1.8767    0.0000 H   0  0  0

+   -1.8122   -2.2865    0.0000 H   0  0  0

+   -1.3540    1.6380    0.0000 H   0  0  0

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+   -7.1798   -0.0810    0.0000 H   0  0  0

+   -7.2382    0.5560    0.0000 H   0  0  0

+   -6.5342   -0.5704    0.0000 H   0  0  0

+   -7.3356   -1.4605    0.0000 H   0  0  0

+   -6.4578   -2.5521    0.0000 H   0  0  0

+   -5.3662   -1.6743    0.0000 H   0  0  0

+   -5.1624    1.8007    0.0000 H   0  0  0

+   -6.0752    2.8631    0.0000 H   0  0  0

+   -7.1376    1.9503    0.0000 H   0  0  0

+    2.5749    2.2670    0.0000 H   0  0  0

+    2.1170   -1.6526    0.0000 H   0  0  0

+    4.8950    2.0111    0.0000 H   0  0  0

+    4.4393   -1.8866    0.0000 H   0  0  0

+  1  2  2  0

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+  6  9  1  0

+ 18 19  2  0

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+ 10 33  1  0

+ 11 34  1  0

+ 11 35  1  0

+ 11 36  1  0

+ 15 37  1  0

+ 16 38  1  0

+ 17 39  1  0

+ 18 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120812-48-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.1170   -0.9188   -0.0168 C   0  0  0

+   -0.9372    0.0223    0.0011 C   0  0  0

+    1.4624   -0.4976   -0.0119 C   0  0  0

+   -0.1853   -2.2997   -0.0340 C   0  0  0

+   -0.6701    1.4066    0.0234 C   0  0  0

+   -2.2750   -0.4335   -0.0038 C   0  0  0

+    1.7753    0.9417    0.0121 C   0  0  0

+    2.4774   -1.4484   -0.0294 C   0  0  0

+   -1.5364   -2.7231   -0.0326 C   0  0  0

+    0.8608   -3.2287   -0.0516 C   0  0  0

+    0.7249    1.8796    0.0290 C   0  0  0

+   -1.7290    2.3078    0.0403 C   0  0  0

+   -3.3163    0.5014    0.0141 C   0  0  0

+   -2.5436   -1.8235   -0.0272 C   0  0  0

+    3.0972    1.3867    0.0178 C   0  0  0

+    2.1699   -2.7978   -0.0515 C   0  0  0

+    3.8929   -1.0153   -0.0249 N   0  3  0

+    1.0180    3.2431    0.0513 C   0  0  0

+   -3.0358    1.8502    0.0353 C   0  0  0

+   -4.7229    0.0399    0.0087 N   0  3  0

+    3.3652    2.7377    0.0409 C   0  0  0

+    4.4728   -0.8180   -1.0778 O   0  0  0

+    4.4778   -0.8561    1.0315 O   0  5  0

+    2.3304    3.6617    0.0567 C   0  0  0

+   -5.5248    0.5394   -0.7601 O   0  0  0

+   -5.0783   -0.8392    0.7731 O   0  5  0

+   -1.7572   -3.7456    0.0000 H   0  0  0

+    0.6488   -4.2530    0.0000 H   0  0  0

+   -1.5375    3.3362    0.0000 H   0  0  0

+   -3.5347   -2.1579    0.0000 H   0  0  0

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+    2.9435   -3.5019    0.0000 H   0  0  0

+    0.2433    3.9460    0.0000 H   0  0  0

+   -3.8226    2.5396    0.0000 H   0  0  0

+    4.3571    3.0698    0.0000 H   0  0  0

+    2.5485    4.6847    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 33  1  0

+ 19 34  1  0

+ 21 35  1  0

+ 24 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+627-72-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    1.1552    0.0068    0.1005 C   0  0  0

+   -0.1204    1.2793    0.3109 S   0  0  0

+    2.5389    0.6419    0.2517 C   0  0  0

+   -1.5687    0.2996    0.0933 C   0  0  0

+    3.5986   -0.4152    0.0769 C   0  0  0

+    2.7136    1.6838   -0.7689 N   0  0  0

+   -2.7646    0.8603    0.1715 C   0  0  0

+   -1.4266   -1.4013   -0.2237 Cl  0  0  0

+    4.0469   -0.6454   -1.0212 O   0  0  0

+    4.0444   -1.1011    1.1412 O   0  0  0

+   -4.1915   -0.1049   -0.0429 Cl  0  0  0

+    0.2662   -0.6944    0.0000 H   0  0  0

+    1.7461   -0.9590    0.0000 H   0  0  0

+    3.6171    0.9876    0.0000 H   0  0  0

+    3.7743    2.0800    0.0000 H   0  0  0

+    1.8402    2.4043    0.0000 H   0  0  0

+   -2.8530    1.9891    0.0000 H   0  0  0

+    4.6614   -2.0504    0.0000 H   0  0  0

+  2  1  1  0

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+  1 13  1  0

+  3 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92118-27-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+    2.4445    0.1650    0.2176 P   0  0  0

+    1.5591   -0.8769    1.4234 C   0  0  0

+    2.8168   -0.7133   -1.0794 O   0  0  0

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+    0.3308   -1.3928    0.8140 N   0  0  0

+    2.4526   -2.0472    1.8392 C   0  0  0

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+   -3.1943   -0.4078    0.4644 C   0  0  0

+   -1.9299   -2.2916   -0.2790 N   0  0  0

+   -3.3131    0.5516   -0.7214 C   0  0  0

+   -2.9511   -2.7206   -0.7856 O   0  0  0

+   -4.8484    1.4872   -0.5861 Cl  0  0  0

+    0.9924   -0.1030    0.0000 H   0  0  0

+    0.2591   -2.3493    0.0000 H   0  0  0

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+    2.8737    0.8757    0.0000 H   0  0  0

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+   -3.4995   -1.3172    0.0000 H   0  0  0

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+ 15 35  1  0

+ 15 36  1  0

+ 17 37  1  0

+ 17 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+481-72-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.8302    0.7753    0.2414 C   0  0  0

+   -0.5943   -0.6130    0.2048 C   0  0  0

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+    1.9079   -0.1860    0.0013 C   0  0  0

+    1.0093   -2.2971    0.4558 O   0  0  0

+   -2.9733   -0.9938    0.1072 C   0  0  0

+   -1.4596   -2.8341    0.1021 O   0  0  0

+    2.7274    2.0840   -0.1858 C   0  0  0

+   -4.6080    0.8935    0.0943 C   0  0  0

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+   -5.2418    0.4674   -1.1135 O   0  0  0

+    4.2330    0.2352   -0.4786 C   0  0  0

+    3.4293   -2.0001   -0.2958 O   0  0  0

+   -2.3109    2.2762    0.0000 H   0  0  0

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+    3.6092   -3.0209    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112309-61-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.4405   -0.9854   -0.2453 C   0  0  0

+   -0.5270   -0.0888   -0.0654 C   0  0  0

+    1.7328   -0.2157   -0.3871 C   0  0  0

+    0.2784   -2.4829   -0.2921 C   0  0  0

+    0.0475    1.2603   -0.0780 C   0  0  0

+   -2.2091   -0.4596    0.1508 Cl  0  0  0

+    1.3784    1.1906   -0.2673 O   0  0  0

+    2.6203   -0.5754    0.6736 O   0  0  0

+   -0.5844    2.2890    0.0611 O   0  0  0

+    1.8154   -1.3003    0.0000 H   0  0  0

+   -0.8030   -2.3658    0.0000 H   0  0  0

+    0.1613   -3.5643    0.0000 H   0  0  0

+    1.3598   -2.6000    0.0000 H   0  0  0

+    3.6284   -0.9840    0.0000 H   0  0  0

+  1  2  2  0

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+  3 10  1  0

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+  4 12  1  0

+  4 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+216-48-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+    0.6679    0.3459   -0.0092 C   0  0  0

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+  1  2  2  0

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+ 17 29  1  0

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+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+136112-70-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+   -0.7319    1.8937    0.0276 C   0  0  0

+   -2.1048    1.8239    0.0342 N   0  0  0

+   -0.4139    3.2633    0.0394 C   0  0  0

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+   -3.5747    3.3673    0.0000 H   0  0  0

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+ 17 36  1  0

+ 18 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1943-79-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.6587   -0.0548    0.4745 C   0  0  0

+   -0.6242   -0.1243    0.9188 O   0  0  0

+    1.2715    1.1791    0.3111 C   0  0  0

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+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+8003-22-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    0.6978    0.0666   -1.1384 C   0  0  0

+   -0.6106    0.0103   -0.3927 C   0  0  0

+    1.5041    1.2471   -0.6518 C   0  0  0

+    1.5199   -1.1557   -0.8053 C   0  0  0

+   -1.7328    0.0915   -1.0659 N   0  0  0

+   -0.5957   -0.1322    0.9928 C   0  0  0

+    2.7456    0.7166   -0.0605 C   0  0  0

+    1.1887    2.4149   -0.7326 O   0  0  0

+    2.7548   -0.6884   -0.1503 C   0  0  0

+    1.2196   -2.3077   -1.0340 O   0  0  0

+   -2.9177    0.0459   -0.4493 C   0  0  0

+   -1.7720   -0.1855    1.6853 C   0  0  0

+    3.8270    1.3748    0.5303 C   0  0  0

+    3.8456   -1.4022    0.3522 C   0  0  0

+   -2.9744   -0.0927    0.9599 C   0  0  0

+   -4.1180    0.1339   -1.1762 C   0  0  0

+    4.8953    0.6495    1.0216 C   0  0  0

+    4.9051   -0.7314    0.9319 C   0  0  0

+   -4.2219   -0.1396    1.6029 C   0  0  0

+   -5.3094    0.0850   -0.5206 C   0  0  0

+   -5.3627   -0.0514    0.8653 C   0  0  0

+    0.2500    0.8723    0.0000 H   0  0  0

+    0.1029   -0.7335    0.0000 H   0  0  0

+   -1.7866   -1.1071    0.0000 H   0  0  0

+    3.8499    2.2963    0.0000 H   0  0  0

+    3.8387   -2.3239    0.0000 H   0  0  0

+   -4.1032    1.0555    0.0000 H   0  0  0

+    5.7083    1.0839    0.0000 H   0  0  0

+    5.7142   -1.1730    0.0000 H   0  0  0

+   -4.2401   -1.0612    0.0000 H   0  0  0

+   -5.8447    0.8354    0.0000 H   0  0  0

+   -6.1434   -0.5415    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  6 12  1  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 11 16  1  0

+ 13 17  2  0

+ 14 18  2  0

+ 15 19  1  0

+ 16 20  2  0

+ 19 21  2  0

+  7  9  2  0

+ 12 15  2  0

+ 17 18  1  0

+ 20 21  1  0

+  1 22  1  0

+  6 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+524-42-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.4548    0.4466   -0.0023 C   0  0  0

+   -0.7986   -0.9205   -0.0012 C   0  0  0

+    0.9735    0.8248   -0.0015 C   0  0  0

+   -1.4515    1.4155    0.0016 C   0  0  0

+    0.2525   -1.9448    0.0011 C   0  0  0

+   -2.1443   -1.2864   -0.0019 C   0  0  0

+    1.9916   -0.2738    0.0005 C   0  0  0

+    1.3115    1.9900   -0.0020 O   0  0  0

+   -2.7834    1.0313    0.0066 C   0  0  0

+    1.5591   -1.6213    0.0024 C   0  0  0

+   -3.1248   -0.3083   -0.0037 C   0  0  0

+    3.1778   -0.0106    0.0008 O   0  0  0

+   -1.1984    2.4268    0.0000 H   0  0  0

+   -0.0204   -2.9510    0.0000 H   0  0  0

+   -2.4117   -2.2941    0.0000 H   0  0  0

+   -3.5320    1.7568    0.0000 H   0  0  0

+    2.2708   -2.3831    0.0000 H   0  0  0

+   -4.1300   -0.5849    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  2  0

+  7 10  1  0

+  9 11  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+540-80-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.3882   -0.4994    0.0000 O   0  0  0

+   -0.9763   -0.0030    0.0000 C   0  0  0

+    1.3211    0.2837    0.0000 N   0  0  0

+   -1.2090    0.8492   -1.2493 C   0  0  0

+   -1.9488   -1.1842    0.0000 C   0  0  0

+   -1.2090    0.8492    1.2492 C   0  0  0

+    2.4657   -0.1328    0.0000 O   0  0  0

+   -0.3278    1.0898    0.0000 H   0  0  0

+   -1.4496    1.7304    0.0000 H   0  0  0

+   -2.0902    0.6086    0.0000 H   0  0  0

+   -2.6540   -0.6036    0.0000 H   0  0  0

+   -2.5294   -1.8894    0.0000 H   0  0  0

+   -1.2436   -1.7648    0.0000 H   0  0  0

+   -0.3278    1.0898    0.0000 H   0  0  0

+   -1.4496    1.7304    0.0000 H   0  0  0

+   -2.0902    0.6086    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2393-18-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.4830   -0.3477    0.0041 C   0  0  0

+    1.4086   -1.3988    0.0030 C   0  0  0

+    0.9348    0.9779    0.0024 C   0  0  0

+   -0.9575   -0.6348    0.0010 C   0  0  0

+    2.7474   -1.1303    0.0002 C   0  0  0

+    2.2859    1.2395   -0.0004 C   0  0  0

+   -1.8490    0.3810    0.0021 C   0  0  0

+    3.1981    0.1873   -0.0015 C   0  0  0

+   -3.2388    0.1040   -0.0009 C   0  0  0

+    4.5634    0.4532   -0.0039 N   0  0  0

+   -4.1289    1.1181    0.0002 O   0  0  0

+   -3.6294   -1.0482   -0.0044 O   0  0  0

+    1.0749   -2.3878    0.0000 H   0  0  0

+    0.2491    1.7649    0.0000 H   0  0  0

+   -1.2927   -1.6233    0.0000 H   0  0  0

+    3.4353   -1.9153    0.0000 H   0  0  0

+    2.6268    2.2261    0.0000 H   0  0  0

+   -1.5138    1.3695    0.0000 H   0  0  0

+    5.2485   -0.3343    0.0000 H   0  0  0

+    4.9029    1.4403    0.0000 H   0  0  0

+   -4.8175    1.9026    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  9 12  2  0

+  6  8  2  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93-27-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -1.0512    0.0531    0.4202 C   0  0  0

+   -0.2562   -1.0566    0.1429 C   0  0  0

+   -0.4702    1.3081    0.5289 C   0  0  0

+   -2.4348   -0.0971    0.5831 N   0  0  0

+    1.1106   -0.9013   -0.0229 C   0  0  0

+   -0.8201   -2.2893    0.0356 O   0  0  0

+    0.8938    1.4545    0.3622 C   0  0  0

+   -3.2847    0.6360   -0.1630 C   0  0  0

+    1.6824    0.3525    0.0869 C   0  0  0

+    0.2396   -3.2048   -0.2492 C   0  0  0

+   -4.7670    0.5718    0.1012 C   0  0  0

+   -2.8565    1.3475   -1.0472 O   0  0  0

+    3.1429    0.5157   -0.0902 N   0  3  0

+    3.6484    1.6197    0.0062 O   0  0  0

+    3.8391   -0.4539   -0.3323 O   0  5  0

+   -1.0697    2.1442    0.0000 H   0  0  0

+   -2.7406   -1.0795    0.0000 H   0  0  0

+    1.7151   -1.7339    0.0000 H   0  0  0

+    1.3146    2.3934    0.0000 H   0  0  0

+   -0.4330   -3.9834    0.0000 H   0  0  0

+    1.0182   -3.8774    0.0000 H   0  0  0

+    0.9122   -2.4262    0.0000 H   0  0  0

+   -4.8115    1.5997    0.0000 H   0  0  0

+   -5.7949    0.5273    0.0000 H   0  0  0

+   -4.7225   -0.4561    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  8 11  1  0

+  8 12  2  0

+  9 13  1  0

+ 13 14  2  0

+ 13 15  1  0

+  7  9  1  0

+  3 16  1  0

+  4 17  1  0

+  5 18  1  0

+  7 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+485-47-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -1.5490    0.0000    0.0001 C   0  0  0

+   -0.6372   -1.2039   -0.0001 C   0  0  0

+   -0.6372    1.2039    0.0000 C   0  0  0

+   -2.3664    0.0001   -1.1720 O   0  0  0

+   -2.3660   -0.0001    1.1725 O   0  0  0

+    0.7494   -0.7040   -0.0003 C   0  0  0

+   -0.9818   -2.3662   -0.0001 O   0  0  0

+    0.7494    0.7039   -0.0002 C   0  0  0

+   -0.9818    2.3662   -0.0002 O   0  0  0

+    1.9656   -1.3914   -0.0001 C   0  0  0

+    1.9656    1.3914    0.0001 C   0  0  0

+    3.1570   -0.6919    0.0002 C   0  0  0

+    3.1570    0.6920    0.0003 C   0  0  0

+   -3.4092    0.0002    0.0000 H   0  0  0

+   -3.4088   -0.0002    0.0000 H   0  0  0

+    1.9742   -2.4342    0.0000 H   0  0  0

+    1.9741    2.4342    0.0000 H   0  0  0

+    4.0620   -1.2100    0.0000 H   0  0  0

+    4.0620    1.2102    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  3  9  2  0

+  6 10  1  0

+  8 11  1  0

+ 10 12  2  0

+ 11 13  2  0

+  6  8  2  0

+ 12 13  1  0

+  4 14  1  0

+  5 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+135561-93-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+   -1.7904   -0.2237    0.0857 C   0  0  0

+   -2.8315    0.7090   -0.0459 C   0  0  0

+   -0.5995    0.2161    0.6788 C   0  0  0

+   -2.2119   -1.4243   -0.4372 N   0  0  0

+   -3.9475    0.0023   -0.6892 C   0  0  0

+   -2.6182    2.0121    0.4216 C   0  0  0

+    0.4765   -0.6656    0.8385 N   0  0  0

+   -0.4994    1.4683    1.0857 N   0  0  0

+   -3.5066   -1.3122   -0.9127 C   0  0  0

+   -5.2311    0.3812   -1.0783 C   0  0  0

+   -1.4513    2.3194    0.9679 N   0  0  0

+   -3.6184    2.9708    0.3131 N   0  0  0

+    1.5104   -0.8231   -0.0189 C   0  0  0

+    0.6757   -1.5363    1.9176 N   0  0  0

+   -4.3637   -2.2244   -1.5206 C   0  0  0

+   -6.0660   -0.5382   -1.6746 C   0  0  0

+   -3.4014    4.2391    0.7717 N   0  0  0

+    2.3334   -1.7652    0.4973 C   0  0  0

+    1.7099   -0.0829   -1.3163 C   0  0  0

+    1.7873   -2.1959    1.7114 C   0  0  0

+   -5.6292   -1.8348   -1.9015 C   0  0  0

+    2.3791   -3.2371    2.6261 C   0  0  0

+   13.0650    0.7853   -1.0940 Cl  0  0  0

+   -1.6924   -2.2288    0.0000 H   0  0  0

+   -5.4895    1.3033    0.0000 H   0  0  0

+   -4.5279    2.6709    0.0000 H   0  0  0

+   -4.1185   -3.1502    0.0000 H   0  0  0

+   -7.0034   -0.3422    0.0000 H   0  0  0

+   -2.5032    4.5712    0.0000 H   0  0  0

+   -4.1381    4.8510    0.0000 H   0  0  0

+    3.2870   -1.8536    0.0000 H   0  0  0

+    2.6346   -0.3321    0.0000 H   0  0  0

+    1.9591    0.8418    0.0000 H   0  0  0

+    0.7852    0.1663    0.0000 H   0  0  0

+   -6.2974   -2.5208    0.0000 H   0  0  0

+    1.5465   -3.7103    0.0000 H   0  0  0

+    2.8523   -4.0697    0.0000 H   0  0  0

+    3.2117   -2.7639    0.0000 H   0  0  0

+   14.0227    0.7853    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  9 15  1  0

+ 10 16  2  0

+ 12 17  1  0

+ 13 18  2  0

+ 13 19  1  0

+ 14 20  2  0

+ 15 21  2  0

+ 20 22  1  0

+  5  9  2  0

+  8 11  1  0

+ 16 21  1  0

+ 18 20  1  0

+  4 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 23 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91254-92-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -0.4655   -0.5901   -0.0022 C   0  0  0

+   -1.5763    0.0947   -0.0016 C   0  0  0

+    0.8387    0.0967   -0.0012 C   0  0  0

+   -0.5019   -2.0647    0.0024 C   0  0  0

+   -1.5485    1.5684    0.0005 C   0  0  0

+   -2.8774   -0.6002   -0.0027 C   0  0  0

+    1.9372   -0.6213   -0.0017 C   0  0  0

+    0.8741    1.5689    0.0008 C   0  0  0

+    0.7865   -2.7794    0.0017 C   0  0  0

+   -1.6565   -2.6872    0.0074 C   0  0  0

+   -0.2492    2.2613    0.0019 C   0  0  0

+   -2.6835    2.2273    0.0015 C   0  0  0

+   -2.9150   -1.9114   -0.0043 C   0  0  0

+   -4.0947    0.2298   -0.0014 C   0  0  0

+    1.9071   -2.0894   -0.0027 C   0  0  0

+    3.1355    0.0112   -0.0007 N   0  3  0

+    2.0712    2.2184    0.0020 O   0  0  0

+   -3.9816    1.5408    0.0006 C   0  0  0

+    3.6742    0.2968   -1.0551 O   0  0  0

+    3.6740    0.2942    1.0545 O   0  5  0

+    0.8097   -3.8006    0.0000 H   0  0  0

+   -1.6861   -3.7082    0.0000 H   0  0  0

+   -0.2173    3.2823    0.0000 H   0  0  0

+   -2.6633    3.2486    0.0000 H   0  0  0

+   -3.8139   -2.3965    0.0000 H   0  0  0

+   -5.0175   -0.2082    0.0000 H   0  0  0

+    2.7937   -2.5967    0.0000 H   0  0  0

+    2.9690    2.7055    0.0000 H   0  0  0

+   -4.8331    2.1050    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  2  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+ 12 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  8 11  2  0

+  9 15  2  0

+ 10 13  1  0

+ 14 18  2  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+828-00-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.2252   -0.5258    0.1085 C   0  0  0

+    0.7195   -1.5711   -0.4939 C   0  0  0

+    0.1689    0.7731   -0.3387 O   0  0  0

+   -1.5846   -0.7951   -0.3249 O   0  0  0

+    2.1627   -1.1924   -0.1452 C   0  0  0

+    1.5004    0.9912    0.1237 C   0  0  0

+   -2.5883   -0.0022    0.0821 C   0  0  0

+    2.4117    0.1470   -0.5769 O   0  0  0

+    2.3628   -1.2857    1.3688 C   0  0  0

+    1.8850    2.4548   -0.1014 C   0  0  0

+   -3.9991   -0.2817   -0.3678 C   0  0  0

+   -2.3605    0.9356    0.8091 O   0  0  0

+    0.7701   -0.3031    0.0000 H   0  0  0

+   -0.1361   -2.1262    0.0000 H   0  0  0

+    1.1317   -2.5040    0.0000 H   0  0  0

+    2.0712   -2.2082    0.0000 H   0  0  0

+    1.2064    0.0146    0.0000 H   0  0  0

+    1.9318   -2.2101    0.0000 H   0  0  0

+    3.2872   -1.7167    0.0000 H   0  0  0

+    2.7938   -0.3613    0.0000 H   0  0  0

+    2.8714    2.1956    0.0000 H   0  0  0

+    2.1442    3.4412    0.0000 H   0  0  0

+    0.8986    2.7140    0.0000 H   0  0  0

+   -4.1973    0.7188    0.0000 H   0  0  0

+   -4.9996   -0.4799    0.0000 H   0  0  0

+   -3.8009   -1.2822    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+  7 12  2  0

+  6  8  1  0

+  1 13  1  0

+  2 14  1  0

+  2 15  1  0

+  5 16  1  0

+  6 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4947-27-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+   -0.1933   -0.7876   -0.3461 C   0  0  0

+   -1.1684   -1.6599    0.1744 C   0  0  0

+    1.0976   -1.2675   -0.6022 C   0  0  0

+   -0.5320    0.6178   -0.6243 C   0  0  0

+   -2.5331   -1.1639    0.4477 C   0  0  0

+   -0.8410   -2.9870    0.4287 C   0  0  0

+    2.0676   -0.4195   -1.1142 N   0  0  0

+    1.4023   -2.6034   -0.3389 C   0  0  0

+   -1.8984    1.1144   -0.3568 C   0  0  0

+    0.3114    1.3693   -1.0741 O   0  0  0

+   -2.8710    0.2483    0.1735 C   0  0  0

+   -3.3758   -1.9156    0.8965 O   0  0  0

+    0.4407   -3.4494    0.1706 C   0  0  0

+    2.7312    0.4735   -0.2694 C   0  0  0

+    2.7896   -3.1241   -0.6134 C   0  0  0

+   -2.2262    2.4418   -0.6172 C   0  0  0

+   -4.1541    0.7254    0.4275 C   0  0  0

+    3.6635    1.3627   -0.7901 C   0  0  0

+    2.4563    0.4786    1.0923 C   0  0  0

+   -3.5076    2.8982   -0.3639 C   0  0  0

+   -4.4615    2.0490    0.1677 C   0  0  0

+    4.3172    2.2443    0.0478 C   0  0  0

+    3.1139    1.3632    1.9246 C   0  0  0

+    4.0449    2.2430    1.4039 C   0  0  0

+   -1.5701   -3.6437    0.0000 H   0  0  0

+    2.7884   -1.0853    0.0000 H   0  0  0

+    0.6238   -4.4134    0.0000 H   0  0  0

+    2.4448   -4.0428    0.0000 H   0  0  0

+    3.7083   -3.4689    0.0000 H   0  0  0

+    3.1344   -2.2054    0.0000 H   0  0  0

+   -1.4985    3.1001    0.0000 H   0  0  0

+   -4.8908    0.0773    0.0000 H   0  0  0

+    4.3989    0.7131    0.0000 H   0  0  0

+    1.5755    0.0461    0.0000 H   0  0  0

+   -3.6954    3.8613    0.0000 H   0  0  0

+   -5.3967    2.3461    0.0000 H   0  0  0

+    5.1926    2.6876    0.0000 H   0  0  0

+    2.3804    2.0150    0.0000 H   0  0  0

+    3.6801    3.1539    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  2  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 14 18  1  0

+ 14 19  2  0

+ 16 20  2  0

+ 17 21  2  0

+ 18 22  2  0

+ 19 23  1  0

+ 22 24  1  0

+  8 13  1  0

+  9 11  2  0

+ 20 21  1  0

+ 23 24  2  0

+  6 25  1  0

+  7 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+ 24 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+158366-46-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.7176   -0.4612   -0.0058 C   0  0  0

+   -0.6591   -0.3865   -0.0005 N   0  0  0

+    1.2022    0.8355   -0.0173 C   0  0  0

+    1.4916   -1.6439    0.0047 C   0  0  0

+   -1.0218    0.9125   -0.0084 C   0  0  0

+   -1.5360   -1.4791    0.0111 N   0  3  0

+    0.0938    1.6839   -0.0187 C   0  0  0

+    2.6248    1.2444   -0.0255 N   0  3  0

+    1.7710   -2.3731   -1.2842 C   0  0  0

+    1.9316   -2.0724    1.0524 O   0  0  0

+   -2.4140    1.4155   -0.0061 N   0  3  0

+   -1.9127   -1.9464    1.0710 O   0  0  0

+   -1.9216   -1.9617   -1.0386 O   0  5  0

+    2.9198    2.4240    0.0451 O   0  0  0

+    3.5004    0.4012   -0.1030 O   0  5  0

+   -2.6283    2.6145   -0.0139 O   0  0  0

+   -3.3452    0.6305    0.0035 O   0  5  0

+    0.1182    2.6951    0.0000 H   0  0  0

+    0.8264   -2.7350    0.0000 H   0  0  0

+    2.1329   -3.3177    0.0000 H   0  0  0

+    2.7156   -2.0112    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

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+  6 13  1  0

+  8 14  2  0

+  8 15  1  0

+ 11 16  2  0

+ 11 17  1  0

+  5  7  2  0

+  7 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.0000   -1.4102   -0.0008 C   0  0  0

+   -1.2793   -0.6716   -0.0003 C   0  0  0

+    1.2793   -0.6716   -0.0009 C   0  0  0

+    0.0000   -2.6248    0.0038 O   0  0  0

+   -1.2793    0.6716    0.0002 C   0  0  0

+   -2.7827   -1.5397   -0.0008 Cl  0  0  0

+    1.2793    0.6716   -0.0005 C   0  0  0

+    2.7827   -1.5396   -0.0010 Cl  0  0  0

+    0.0000    1.4102    0.0001 C   0  0  0

+   -2.7827    1.5396    0.0003 Cl  0  0  0

+    2.7827    1.5396    0.0006 Cl  0  0  0

+    0.0000    2.6248   -0.0003 O   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+  9 12  2  0

+  7  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-78-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.6490   -1.1602   -0.0020 C   0  0  0

+   -0.6804   -1.1421   -0.0015 N   0  0  0

+    1.3292   -0.0182   -0.0012 N   0  0  0

+    1.3227   -2.3646    0.0024 N   0  0  0

+   -1.3292    0.0180   -0.0002 C   0  0  0

+    0.6802    1.1421    0.0001 C   0  0  0

+   -0.6489    1.1602    0.0007 N   0  0  0

+   -2.7092    0.0368    0.0008 N   0  0  0

+    1.3865    2.3279    0.0005 N   0  0  0

+    0.8125   -3.2213    0.0000 H   0  0  0

+    2.3197   -2.3782    0.0000 H   0  0  0

+   -3.1959    0.9070    0.0000 H   0  0  0

+   -3.2195   -0.8198    0.0000 H   0  0  0

+    2.3835    2.3143    0.0000 H   0  0  0

+    0.8997    3.1981    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  5  8  1  0

+  6  9  1  0

+  6  7  2  0

+  4 10  1  0

+  4 11  1  0

+  8 12  1  0

+  8 13  1  0

+  9 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51787-75-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.6965   -0.1394   -0.0009 C   0  0  0

+   -0.7865   -0.1296   -0.0006 C   0  0  0

+    1.4079    1.0665   -0.0007 C   0  0  0

+    1.3881   -1.3479    0.0045 C   0  0  0

+   -1.4856   -0.1209    1.2049 C   0  0  0

+   -1.4863   -0.1233   -1.2062 C   0  0  0

+    2.7952    1.0467   -0.0005 C   0  0  0

+    0.7250    2.2825   -0.0012 N   0  0  0

+    2.7686   -1.3520    0.0047 C   0  0  0

+   -2.8659   -0.1118    1.1990 C   0  0  0

+   -2.8661   -0.1142   -1.1999 C   0  0  0

+    3.4698   -0.1592   -0.0005 C   0  0  0

+   -3.5550   -0.1113   -0.0001 C   0  0  0

+    4.9500   -0.1750   -0.0007 N   0  3  0

+   -5.0352   -0.1016    0.0001 N   0  3  0

+    5.5477   -1.2362   -0.0007 O   0  0  0

+    5.5702    0.8733   -0.0009 O   0  5  0

+   -5.6444   -0.1012   -1.0546 O   0  0  0

+   -5.6440   -0.0940    1.0551 O   0  5  0

+    0.8674   -2.2427    0.0000 H   0  0  0

+   -1.4757    0.9144    0.0000 H   0  0  0

+   -1.4782    0.9120    0.0000 H   0  0  0

+    3.3253    1.9360    0.0000 H   0  0  0

+    1.2533    3.1729    0.0000 H   0  0  0

+   -0.3102    2.2948    0.0000 H   0  0  0

+    3.2814   -2.2514    0.0000 H   0  0  0

+   -2.8621    0.9235    0.0000 H   0  0  0

+   -2.8605    0.9211    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+ 10 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 14 17  1  0

+ 15 18  2  0

+ 15 19  1  0

+  9 12  2  0

+ 11 13  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+488-23-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+    0.6913   -0.6966   -0.0014 C   0  0  0

+   -0.6913   -0.6966   -0.0010 C   0  0  0

+    1.3824    0.5003   -0.0005 C   0  0  0

+    1.4448   -2.0017    0.0035 C   0  0  0

+   -1.3823    0.5003    0.0003 C   0  0  0

+   -1.4448   -2.0017   -0.0016 C   0  0  0

+    0.6911    1.6977    0.0008 C   0  0  0

+    2.8894    0.5003   -0.0014 C   0  0  0

+   -0.6911    1.6977    0.0008 C   0  0  0

+   -2.8893    0.5004    0.0007 C   0  0  0

+    0.5468   -2.5202    0.0000 H   0  0  0

+    1.9633   -2.8997    0.0000 H   0  0  0

+    2.3428   -1.4832    0.0000 H   0  0  0

+   -2.3428   -1.4832    0.0000 H   0  0  0

+   -1.9633   -2.8997    0.0000 H   0  0  0

+   -0.5468   -2.5202    0.0000 H   0  0  0

+    1.2096    2.5957    0.0000 H   0  0  0

+    2.8894   -0.5367    0.0000 H   0  0  0

+    3.9264    0.5003    0.0000 H   0  0  0

+    2.8894    1.5373    0.0000 H   0  0  0

+   -1.2096    2.5957    0.0000 H   0  0  0

+   -2.8892    1.5374    0.0000 H   0  0  0

+   -3.9263    0.5005    0.0000 H   0  0  0

+   -2.8894   -0.5366    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7  9  2  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

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+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+138835-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+    0.4092   -0.4071   -0.0062 C   0  0  0

+   -0.9610   -0.7129   -0.0166 C   0  0  0

+    0.8276    0.9376    0.0160 C   0  0  0

+    1.4041   -1.4795   -0.0123 C   0  0  0

+   -1.9061    0.3389   -0.0046 C   0  0  0

+   -1.3835   -2.0607   -0.0385 C   0  0  0

+    2.2682    1.1836    0.0259 C   0  0  0

+   -0.1279    1.9660    0.0281 C   0  0  0

+    2.6935   -1.1843   -0.0020 N   0  3  0

+    0.9322   -2.8644   -0.0294 C   0  0  0

+   -3.2694    0.0201   -0.0151 C   0  0  0

+   -1.4556    1.6779    0.0173 C   0  0  0

+   -0.3924   -3.1329   -0.0498 C   0  0  0

+   -2.7527   -2.3352   -0.0485 C   0  0  0

+    3.1507    0.0728    0.0126 C   0  0  0

+    2.7835    2.4831    0.0474 C   0  0  0

+    3.6309   -2.2455   -0.0083 O   0  5  0

+   -3.6700   -1.2998   -0.0365 C   0  0  0

+   -4.2823    1.1009   -0.0029 N   0  3  0

+    4.5389    0.3149    0.0222 C   0  0  0

+    4.1334    2.6769    0.0556 C   0  0  0

+   -5.2302    1.0386    0.7593 O   0  0  0

+   -4.1672    2.0520   -0.7551 O   0  5  0

+    5.0064    1.5921    0.0436 C   0  0  0

+    0.1871    2.9692    0.0000 H   0  0  0

+    1.6264   -3.6541    0.0000 H   0  0  0

+   -2.1567    2.4614    0.0000 H   0  0  0

+   -0.7155   -4.1335    0.0000 H   0  0  0

+   -3.0874   -3.3319    0.0000 H   0  0  0

+    2.1323    3.3086    0.0000 H   0  0  0

+   -4.6972   -1.5243    0.0000 H   0  0  0

+    5.2133   -0.4918    0.0000 H   0  0  0

+    4.5188    3.6552    0.0000 H   0  0  0

+    6.0438    1.7631    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

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+ 15 20  1  0

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+  8 12  2  0

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+ 10 13  2  0

+ 14 18  2  0

+ 21 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 24 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6633-40-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.0467   -0.5377   -0.0009 C   0  0  0

+   -1.5298   -0.4953   -0.0007 C   0  0  0

+    0.4546    0.7610    0.0001 C   0  0  0

+    0.8416   -1.6151    0.0035 C   0  0  0

+   -1.9556    0.8309    0.0003 C   0  0  0

+   -2.4772   -1.5211   -0.0014 C   0  0  0

+   -0.7241    1.7033    0.0009 C   0  0  0

+    1.8160    0.9803    0.0001 C   0  0  0

+    2.2016   -1.3861    0.0022 C   0  0  0

+   -3.3003    1.1296    0.0007 C   0  0  0

+   -3.8219   -1.2181   -0.0011 C   0  0  0

+    2.6904   -0.0919   -0.0008 C   0  0  0

+   -4.2391    0.1059    0.0000 C   0  0  0

+    4.1513    0.1462   -0.0007 N   0  3  0

+   -5.5655    0.4003   -0.0001 O   0  0  0

+    4.9220   -0.7970   -0.0015 O   0  0  0

+    4.5828    1.2852    0.0001 O   0  5  0

+    0.4775   -2.5905    0.0000 H   0  0  0

+   -2.1678   -2.5152    0.0000 H   0  0  0

+   -0.0010    2.4524    0.0000 H   0  0  0

+   -1.4025    2.4931    0.0000 H   0  0  0

+    2.1861    1.9534    0.0000 H   0  0  0

+    2.8629   -2.1902    0.0000 H   0  0  0

+   -3.6130    2.1227    0.0000 H   0  0  0

+   -4.5267   -1.9844    0.0000 H   0  0  0

+   -6.5819    0.6259    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+ 10 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 14 17  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  2  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3102-87-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -1.4440   -2.5076    0.0029 C   0  0  0

+   -0.6904   -1.2026    0.0029 C   0  0  0

+    0.6903   -1.2026   -0.0001 C   0  0  0

+   -1.3848    0.0002    0.0001 C   0  0  0

+    1.4437   -2.5078   -0.0034 C   0  0  0

+    1.3848    0.0001    0.0003 C   0  0  0

+   -2.7848    0.0002   -0.0022 N   0  0  0

+   -0.6905    1.2025    0.0001 C   0  0  0

+    2.7848    0.0000   -0.0022 N   0  0  0

+    0.6906    1.2025    0.0029 C   0  0  0

+   -1.4440    2.5077   -0.0034 C   0  0  0

+    1.4442    2.5075    0.0029 C   0  0  0

+   -2.3497   -1.9846    0.0000 H   0  0  0

+   -1.9670   -3.4133    0.0000 H   0  0  0

+   -0.5383   -3.0306    0.0000 H   0  0  0

+    0.5379   -3.0306    0.0000 H   0  0  0

+    1.9665   -3.4136    0.0000 H   0  0  0

+    2.3495   -1.9850    0.0000 H   0  0  0

+   -3.3077    0.9059    0.0000 H   0  0  0

+   -3.3077   -0.9055    0.0000 H   0  0  0

+    3.3076   -0.9057    0.0000 H   0  0  0

+    3.3078    0.9057    0.0000 H   0  0  0

+   -0.5383    3.0306    0.0000 H   0  0  0

+   -1.9669    3.4134    0.0000 H   0  0  0

+   -2.3497    1.9848    0.0000 H   0  0  0

+    2.3499    1.9845    0.0000 H   0  0  0

+    1.9672    3.4132    0.0000 H   0  0  0

+    0.5385    3.0305    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  1  0

+  8  4  2  0

+  9  6  1  0

+ 10  6  2  0

+ 11  8  1  0

+ 12 10  1  0

+  8 10  1  0

+  1 13  1  0

+  1 14  1  0

+  1 15  1  0

+  5 16  1  0

+  5 17  1  0

+  5 18  1  0

+  7 19  1  0

+  7 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7779-77-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    1.1947   -0.0570    0.2766 C   0  0  0

+   -0.1566    0.4368    0.5918 C   0  0  0

+    2.0838    0.7400   -0.4621 C   0  0  0

+    1.6025   -1.3200    0.7161 C   0  0  0

+   -1.2390   -0.2256    0.1379 O   0  0  0

+   -0.2956    1.4415    1.2611 O   0  0  0

+    3.3561    0.2624   -0.7523 C   0  0  0

+    1.6937    1.9981   -0.9006 N   0  0  0

+    2.8676   -1.7756    0.4183 C   0  0  0

+   -2.5712    0.2612    0.4486 C   0  0  0

+    3.7411   -0.9883   -0.3158 C   0  0  0

+   -3.6127   -0.6657   -0.1814 C   0  0  0

+   -5.0164   -0.1527    0.1460 C   0  0  0

+   -3.4204   -0.6919   -1.6991 C   0  0  0

+    0.8897   -2.0094    0.0000 H   0  0  0

+    4.0782    0.9421    0.0000 H   0  0  0

+    2.3671    2.7260    0.0000 H   0  0  0

+    0.7266    2.2173    0.0000 H   0  0  0

+    3.0587   -2.7487    0.0000 H   0  0  0

+   -2.0830    1.1244    0.0000 H   0  0  0

+   -3.3428    0.8841    0.0000 H   0  0  0

+    4.6970   -1.2521    0.0000 H   0  0  0

+   -3.8512   -1.6282    0.0000 H   0  0  0

+   -4.6760    0.7787    0.0000 H   0  0  0

+   -5.9478    0.1877    0.0000 H   0  0  0

+   -5.3568   -1.0841    0.0000 H   0  0  0

+   -3.5543   -1.6745    0.0000 H   0  0  0

+   -2.4378   -0.8258    0.0000 H   0  0  0

+   -3.2865    0.2907    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  7 11  2  0

+ 10 12  1  0

+ 12 13  1  0

+ 12 14  1  0

+  9 11  1  0

+  4 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14953-63-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.1965   -0.8523   -0.0981 C   0  0  0

+   -1.2644   -0.0193    0.0098 C   0  0  0

+    1.2320   -0.4528   -0.0656 C   0  0  0

+   -0.6684   -2.1083   -0.2342 N   0  0  0

+   -2.3823   -0.8017   -0.0700 N   0  0  0

+   -1.2248    1.4508    0.1811 N   0  3  0

+    2.1634   -1.2403    0.6089 C   0  0  0

+    1.6483    0.7080   -0.7142 C   0  0  0

+   -1.9715   -2.0808   -0.2144 C   0  0  0

+   -3.7708   -0.3395   -0.0016 C   0  0  0

+   -1.1981    1.9331    1.2992 O   0  0  0

+   -1.2190    2.1778   -0.7961 O   0  5  0

+    3.4908   -0.8642    0.6354 C   0  0  0

+    2.9787    1.0746   -0.6811 C   0  0  0

+    3.8977    0.2922   -0.0058 C   0  0  0

+    1.9506   -2.2245    0.0000 H   0  0  0

+    0.9637    1.4464    0.0000 H   0  0  0

+   -2.5733   -2.8881    0.0000 H   0  0  0

+   -3.4528    0.6159    0.0000 H   0  0  0

+   -4.7262   -0.0215    0.0000 H   0  0  0

+   -4.0888   -1.2949    0.0000 H   0  0  0

+    4.1803   -1.5980    0.0000 H   0  0  0

+    3.1967    2.0577    0.0000 H   0  0  0

+    4.8699    0.5546    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  7 13  2  0

+  8 14  1  0

+ 13 15  1  0

+  5  9  1  0

+ 14 15  2  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35604-67-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+   -3.1274   -0.4135   -0.2337 C   0  0  0

+   -4.1560    0.5222   -0.2856 C   0  0  0

+   -1.9476   -0.0969    0.3640 O   0  0  0

+   -3.3099   -1.6706   -0.7873 C   0  0  0

+   -5.3564    0.1946   -0.8953 C   0  0  0

+   -3.9837    1.7554    0.2613 O   0  0  0

+   -1.1080   -1.2481    0.2564 C   0  0  0

+   -4.5118   -1.9928   -1.3895 C   0  0  0

+   -5.5301   -1.0595   -1.4504 C   0  0  0

+   -5.2003    2.4746    0.0498 C   0  0  0

+    0.2430   -0.9573    0.9130 C   0  0  0

+   -5.0728    3.8784    0.6448 C   0  0  0

+    1.1415   -2.1893    0.7978 C   0  0  0

+    0.8602    0.1520    0.2604 O   0  0  0

+    2.4118   -1.9372    1.4910 N   0  0  0

+    2.0744    0.4292    0.9579 C   0  0  0

+    3.0200   -0.7673    0.8438 C   0  0  0

+   11.8020    0.8968   -0.7930 Cl  0  0  0

+   -2.5773   -2.3217    0.0000 H   0  0  0

+   -6.0926    0.8416    0.0000 H   0  0  0

+   -1.9724   -1.7100    0.0000 H   0  0  0

+   -0.7706   -2.1683    0.0000 H   0  0  0

+   -4.7448   -2.9448    0.0000 H   0  0  0

+   -6.4522   -1.3916    0.0000 H   0  0  0

+   -6.1527    2.7060    0.0000 H   0  0  0

+   -5.5694    1.5666    0.0000 H   0  0  0

+   -0.3404   -0.1697    0.0000 H   0  0  0

+   -4.0967    3.7897    0.0000 H   0  0  0

+   -4.9841    4.8545    0.0000 H   0  0  0

+   -6.0489    3.9671    0.0000 H   0  0  0

+    0.2746   -2.6466    0.0000 H   0  0  0

+    1.4690   -3.1131    0.0000 H   0  0  0

+    3.0000   -2.7212    0.0000 H   0  0  0

+    2.9246    0.9168    0.0000 H   0  0  0

+    1.7176    1.3421    0.0000 H   0  0  0

+    3.8175   -1.3370    0.0000 H   0  0  0

+    3.6960   -0.0576    0.0000 H   0  0  0

+   12.7821    0.8968    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 11 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+  8  9  1  0

+ 16 17  1  0

+  4 19  1  0

+  5 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

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+ 10 25  1  0

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+ 11 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+622-51-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.1319    0.4246   -0.2890 C   0  0  0

+    0.3633   -0.8285   -0.6261 C   0  0  0

+    0.7245    1.3929    0.2179 C   0  0  0

+   -1.4900    0.7126   -0.4654 N   0  0  0

+    1.7050   -1.1076   -0.4562 C   0  0  0

+    2.0656    1.1073    0.3855 C   0  0  0

+   -2.4251   -0.0779    0.0977 C   0  0  0

+    2.5554   -0.1410    0.0491 C   0  0  0

+   -3.7303    0.1276   -0.1685 N   0  0  0

+   -2.0913   -0.9763    0.8459 O   0  0  0

+    4.0189   -0.4493    0.2337 C   0  0  0

+   -0.2844   -1.5979    0.0000 H   0  0  0

+    0.4097    2.3481    0.0000 H   0  0  0

+   -1.7353    1.6879    0.0000 H   0  0  0

+    2.0234   -2.0616    0.0000 H   0  0  0

+    2.7161    1.8743    0.0000 H   0  0  0

+   -4.0916    1.0662    0.0000 H   0  0  0

+   -4.3625   -0.6546    0.0000 H   0  0  0

+    3.8116   -1.4334    0.0000 H   0  0  0

+    5.0030   -0.6566    0.0000 H   0  0  0

+    4.2262    0.5348    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  7 10  2  0

+  8 11  1  0

+  6  8  2  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+55984-51-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.7109   -0.4655    0.1855 N   0  0  0

+   -0.6021   -0.6524    0.8078 C   0  0  0

+    1.4560    0.5271    0.5371 N   0  0  0

+    1.1804   -1.4094   -0.8318 C   0  0  0

+   -1.6456    0.0868    0.0105 C   0  0  0

+    2.5476    0.6825    0.0197 O   0  0  0

+   -3.0885    0.0535    0.4440 C   0  0  0

+   -1.3256    0.7059   -0.9757 O   0  0  0

+   -1.3239   -1.2402    0.0000 H   0  0  0

+   -0.2290   -1.5052    0.0000 H   0  0  0

+    0.3470   -1.8240    0.0000 H   0  0  0

+    1.5950   -2.2428    0.0000 H   0  0  0

+    2.0138   -0.9948    0.0000 H   0  0  0

+   -3.1100    0.9841    0.0000 H   0  0  0

+   -4.0191    0.0320    0.0000 H   0  0  0

+   -3.0670   -0.8771    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  5  8  2  0

+  2  9  1  0

+  2 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+81593-15-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+   -1.2372    0.7724    0.7121 C   0  0  0

+   -1.2421   -0.7637    0.7127 C   0  0  0

+    0.0485    1.4758    0.3474 C   0  0  0

+   -1.7164    0.0055   -0.4455 N   0  0  0

+    0.0387   -1.4758    0.3479 C   0  0  0

+    1.1819    0.7378    0.0253 C   0  0  0

+    0.0904    2.8556    0.3368 C   0  0  0

+   -3.4245    0.0111   -0.3657 Cl  0  0  0

+    1.1767   -0.7455    0.0245 C   0  0  0

+    0.0712   -2.8559    0.3376 C   0  0  0

+    2.3616    1.4085   -0.3091 C   0  0  0

+    1.2615    3.5121    0.0049 C   0  0  0

+    2.3516   -1.4242   -0.3105 C   0  0  0

+    1.2377   -3.5203    0.0052 C   0  0  0

+    2.3945    2.7867   -0.3176 C   0  0  0

+    2.3754   -2.8026   -0.3181 C   0  0  0

+   -1.9357    1.5126    0.0000 H   0  0  0

+   -1.9454   -1.4994    0.0000 H   0  0  0

+   -0.7799    3.3833    0.0000 H   0  0  0

+   -0.8026   -3.3777    0.0000 H   0  0  0

+    3.2352    0.8862    0.0000 H   0  0  0

+    1.2913    4.5294    0.0000 H   0  0  0

+    3.2287   -0.9078    0.0000 H   0  0  0

+    1.2606   -4.5378    0.0000 H   0  0  0

+    3.2931    3.2645    0.0000 H   0  0  0

+    3.2708   -3.2864    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  7 12  2  0

+  9 13  1  0

+ 10 14  2  0

+ 11 15  2  0

+ 13 16  2  0

+  2  4  1  0

+  6  9  1  0

+ 12 15  1  0

+ 14 16  1  0

+  1 17  1  0

+  2 18  1  0

+  7 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+139883-82-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 23                          1 V2000

+   -2.0176   -0.8679   -0.6135 C   0  0  1

+   -2.9535    0.0808    0.1382 C   0  0  0

+   -0.8516   -1.2281    0.2707 C   0  0  0

+   -2.7488   -2.0879   -0.9809 N   0  0  0

+   -4.1373    0.4465   -0.7595 C   0  0  0

+    0.2610   -0.4774    0.2533 O   0  0  0

+   -0.9182   -2.1927    0.9952 O   0  0  0

+   -5.0592    1.3809   -0.0191 C   0  0  0

+   -6.1724    1.8370   -0.6147 O   0  0  0

+   -4.7964    1.7195    1.1105 O   0  0  0

+    8.8912    0.2105    0.0368 N   0  0  0

+   17.5213    0.8985   -0.1797 O   0  0  0

+   -1.5351   -0.0737    0.0000 H   0  0  0

+   -2.1047    0.4590    0.0000 H   0  0  0

+   -3.0090    1.0084    0.0000 H   0  0  0

+   -3.6779   -2.0727    0.0000 H   0  0  0

+   -2.2974   -2.9001    0.0000 H   0  0  0

+   -4.9861    0.0682    0.0000 H   0  0  0

+   -4.0818   -0.4811    0.0000 H   0  0  0

+    1.0313    0.0423    0.0000 H   0  0  0

+   -7.0323    2.1893    0.0000 H   0  0  0

+    8.4266    1.0153    0.0000 H   0  0  0

+    8.4266   -0.5943    0.0000 H   0  0  0

+    9.8204    0.2105    0.0000 H   0  0  0

+   16.5921    0.8985    0.0000 H   0  0  0

+   18.4505    0.8985    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  8  9  1  0

+  8 10  2  0

+  1 13  1  0

+  2 14  1  0

+  2 15  1  0

+  4 16  1  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  6 20  1  0

+  9 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6112-76-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.3771   -0.3926   -0.0460 C   0  0  0

+   -2.3391    0.5722   -0.3854 C   0  0  0

+   -0.1531    0.0364    0.4731 C   0  0  0

+   -1.9397   -1.6153   -0.3445 N   0  0  0

+   -2.0464    1.8636   -0.1975 N   0  0  0

+   -3.4105   -0.0936   -0.8559 N   0  0  0

+    0.0497    1.3433    0.6242 N   0  0  0

+    1.0942   -1.1261    0.9173 S   0  0  0

+   -3.1761   -1.3763   -0.8367 C   0  0  0

+   -0.8811    2.2205    0.2951 C   0  0  0

+   10.1904    0.1489   -0.7853 O   0  0  0

+   -1.4931   -2.4853    0.0000 H   0  0  0

+    1.8096   -1.7929    0.0000 H   0  0  0

+   -3.8711   -2.0643    0.0000 H   0  0  0

+   -0.6588    3.1729    0.0000 H   0  0  0

+    9.2124    0.1489    0.0000 H   0  0  0

+   11.1684    0.1489    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6  9  2  0

+  7 10  1  0

+  4 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+79-11-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    1.0171    0.0005   -0.0012 C   0  0  0

+   -0.1564    0.9459    0.0016 C   0  0  0

+    2.2691    0.4846   -0.0004 O   0  0  0

+    0.8311   -1.1934    0.0008 O   0  0  0

+   -1.6908   -0.0008   -0.0003 Cl  0  0  0

+    0.6037    1.6969    0.0000 H   0  0  0

+   -0.8166    1.7860    0.0000 H   0  0  0

+    3.2657    0.8699    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80830-42-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    1.0519    1.1629   -0.9490 C   0  0  1

+    1.0817   -0.2859   -0.6718 N   0  0  0

+   -0.0842    1.7967   -0.1883 C   0  0  0

+    2.6566    1.7533   -0.2613 S   0  0  0

+    2.3271   -0.8072   -0.1157 C   0  0  1

+    0.0216   -1.0812   -0.9170 C   0  0  0

+   -1.3606    1.8104   -0.7310 C   0  0  0

+    0.1437    2.3595    1.0528 C   0  0  0

+    3.0292    0.2641    0.7699 C   0  0  0

+    2.0335   -2.0306    0.7138 C   0  0  0

+   -1.1002   -1.1719    0.0853 C   0  0  0

+   -0.0296   -1.7239   -1.9442 O   0  0  0

+   -2.4045    2.3948   -0.0281 C   0  0  0

+   -1.5883    1.2530   -1.9493 O   0  0  0

+   -0.8981    2.9410    1.7511 C   0  0  0

+    2.3136   -3.2515    0.2315 O   0  0  0

+    1.5459   -1.9125    1.8130 O   0  0  0

+   -2.2685   -1.9480   -0.5259 C   0  0  0

+   -2.1704    2.9611    1.2097 C   0  0  0

+   -3.6188   -2.0572    0.6806 S   0  0  0

+    1.1264    2.1143    0.0000 H   0  0  0

+    3.2032   -1.1857    0.0000 H   0  0  0

+    1.0439    2.6764    0.0000 H   0  0  0

+    3.6742   -0.4393    0.0000 H   0  0  0

+    3.8696    0.7163    0.0000 H   0  0  0

+   -0.8416   -0.2532    0.0000 H   0  0  0

+   -1.8717   -0.6101    0.0000 H   0  0  0

+   -3.3060    2.0817    0.0000 H   0  0  0

+   -1.9492    0.3695    0.0000 H   0  0  0

+   -0.6505    3.8627    0.0000 H   0  0  0

+    2.5270   -4.1817    0.0000 H   0  0  0

+   -2.5271   -2.8667    0.0000 H   0  0  0

+   -1.4970   -2.5098    0.0000 H   0  0  0

+   -2.6946    3.7586    0.0000 H   0  0  0

+   -4.5700   -2.1341    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

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+  6 12  2  0

+  7 13  1  0

+  7 14  1  0

+  8 15  2  0

+ 10 16  1  0

+ 10 17  2  0

+ 11 18  1  0

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+ 18 20  1  0

+  5  9  1  0

+ 15 19  1  0

+  1 21  1  0

+  5 22  1  0

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+  9 24  1  0

+  9 25  1  0

+ 11 26  1  0

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+ 13 28  1  0

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+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75-55-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    0.2589   -0.0093   -0.5818 C   0  0  0

+   -0.8388   -0.7850    0.1492 C   0  0  0

+   -0.8157    0.6838    0.1412 N   0  0  0

+    1.5314   -0.0034    0.2678 C   0  0  0

+    0.5346    0.9348    0.0000 H   0  0  0

+   -1.8038   -0.9752    0.0000 H   0  0  0

+   -0.4514   -1.6890    0.0000 H   0  0  0

+   -1.2796    1.5511    0.0000 H   0  0  0

+    1.5360   -0.9870    0.0000 H   0  0  0

+    2.5150    0.0012    0.0000 H   0  0  0

+    1.5268    0.9802    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  3  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98046-73-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -0.1157   -0.4258   -0.0004 C   0  0  0

+   -1.4970   -0.4537   -0.0004 N   0  0  0

+    0.2483    0.9345    0.0005 C   0  0  0

+    0.8130   -1.3689    0.0038 N   0  0  0

+   -1.9324    0.8480    0.0005 C   0  0  0

+   -2.3933   -1.4833   -0.0015 C   0  0  0

+   -0.8851    1.6598    0.0010 N   0  0  0

+    1.6085    1.2733    0.0003 C   0  0  0

+    2.0960   -1.0771    0.0026 C   0  0  0

+   -3.3189    1.1155    0.0003 C   0  0  0

+   -3.7208   -1.2412   -0.0017 C   0  0  0

+    2.5379    0.2449   -0.0008 C   0  0  0

+   -4.1993    0.0797   -0.0008 C   0  0  0

+    3.9071    0.5312   -0.0011 N   0  0  0

+    4.8511   -0.5242   -0.0022 O   0  0  0

+   -2.0506   -2.4612    0.0000 H   0  0  0

+    1.9107    2.2645    0.0000 H   0  0  0

+    2.7916   -1.8451    0.0000 H   0  0  0

+   -3.6624    2.0931    0.0000 H   0  0  0

+   -4.3898   -2.0325    0.0000 H   0  0  0

+   -5.2190    0.2636    0.0000 H   0  0  0

+    4.2306    1.5156    0.0000 H   0  0  0

+    5.5419   -1.2965    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  8 12  2  0

+ 10 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+  5  7  2  0

+  9 12  1  0

+ 11 13  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+27602-80-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.7672    0.4697    0.5137 C   0  0  0

+    0.1230   -0.7454    0.3697 C   0  0  0

+    2.2420    0.5070    0.8214 C   0  0  0

+    0.0627    1.6501    0.3703 C   0  0  0

+   -1.2326   -0.7814    0.0868 C   0  0  0

+    3.0354    0.5308   -0.4865 C   0  0  0

+   -1.2895    1.6213    0.0822 C   0  0  0

+   -1.9433    0.4074   -0.0519 C   0  0  0

+   -1.8675   -1.9756   -0.0555 O   0  0  0

+    4.5327    0.5687   -0.1741 C   0  0  0

+    3.8625   -0.6320   -0.5631 O   0  0  0

+   -3.2742    0.3772   -0.3296 O   0  0  0

+   -0.8833   -2.9927    0.1413 C   0  0  0

+   -3.7103    1.7357   -0.4098 C   0  0  0

+    0.6665   -1.6221    0.0000 H   0  0  0

+    1.7504   -0.3998    0.0000 H   0  0  0

+    2.7829   -0.3713    0.0000 H   0  0  0

+    0.5624    2.5525    0.0000 H   0  0  0

+    3.0069    1.5619    0.0000 H   0  0  0

+   -1.8278    2.5012    0.0000 H   0  0  0

+    5.5082    0.2335    0.0000 H   0  0  0

+    4.6897    1.5882    0.0000 H   0  0  0

+   -1.6246   -3.7100    0.0000 H   0  0  0

+   -0.1660   -3.7340    0.0000 H   0  0  0

+   -0.1420   -2.2754    0.0000 H   0  0  0

+   -2.7282    2.0510    0.0000 H   0  0  0

+   -4.0256    2.7178    0.0000 H   0  0  0

+   -4.6924    1.4204    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+  7  8  2  0

+ 10 11  1  0

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+ 10 21  1  0

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+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.3551    0.7482   -0.0027 C   0  0  0

+   -0.4727   -0.6604   -0.0009 C   0  0  0

+    0.9151    1.2035   -0.0022 N   0  0  0

+   -1.5633    1.4800    0.0007 C   0  0  0

+    1.2259   -1.1755    0.0014 S   0  0  0

+   -1.6895   -1.2982   -0.0011 C   0  0  0

+    1.9450    0.4049   -0.0002 C   0  0  0

+   -2.7634    0.8392    0.0055 C   0  0  0

+   -2.8491   -0.5462   -0.0032 C   0  0  0

+    3.4081    0.7662    0.0007 C   0  0  0

+   -1.5351    2.5207    0.0000 H   0  0  0

+   -1.7376   -2.3381    0.0000 H   0  0  0

+   -3.6392    1.4019    0.0000 H   0  0  0

+   -3.7787   -1.0147    0.0000 H   0  0  0

+    3.6577   -0.2445    0.0000 H   0  0  0

+    4.4188    1.0158    0.0000 H   0  0  0

+    3.1585    1.7769    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  6  9  2  0

+  7 10  1  0

+  5  7  1  0

+  8  9  1  0

+  4 11  1  0

+  6 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+196-77-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 39                          1 V2000

+   -0.5714   -0.0308    0.0074 C   0  0  0

+    0.0620   -1.3033    0.0076 C   0  0  0

+    0.1636    1.1785    0.0067 C   0  0  0

+   -1.9798    0.0320    0.0020 C   0  0  0

+    1.4689   -1.3826   -0.0002 C   0  0  0

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+   -2.7391   -1.1600    0.0006 C   0  0  0

+   -2.6305    1.2860   -0.0026 C   0  0  0

+    2.1875   -0.1809   -0.0004 C   0  0  0

+    2.4678   -2.4462   -0.0101 C   0  0  0

+   -2.0759   -2.4108    0.0168 C   0  0  0

+    2.4950    2.1884    0.0060 C   0  0  0

+   -1.8621    2.4712    0.0040 C   0  0  0

+   -4.1341   -1.0783   -0.0092 C   0  0  0

+   -4.0311    1.3273   -0.0131 C   0  0  0

+    3.5681   -0.4305   -0.0071 C   0  0  0

+    3.7098   -1.8851   -0.0146 C   0  0  0

+    3.8591    1.9576    0.0008 C   0  0  0

+   -4.7588    0.1555   -0.0158 C   0  0  0

+    4.4069    0.6807   -0.0055 C   0  0  0

+   -0.2515   -3.4148    0.0000 H   0  0  0

+    0.0520    3.3032    0.0000 H   0  0  0

+    2.2627   -3.4780    0.0000 H   0  0  0

+   -2.6395   -3.2991    0.0000 H   0  0  0

+    2.1193    3.1710    0.0000 H   0  0  0

+   -2.3439    3.4064    0.0000 H   0  0  0

+   -4.7109   -1.9581    0.0000 H   0  0  0

+   -4.5288    2.2541    0.0000 H   0  0  0

+    4.6203   -2.4121    0.0000 H   0  0  0

+    4.5096    2.7844    0.0000 H   0  0  0

+   -5.8098    0.2013    0.0000 H   0  0  0

+    5.4513    0.5541    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+38915-38-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 61 60                          1 V2000

+   -4.9972   -1.6267   -0.5960 C   0  0  0

+   -5.6864   -2.0100    0.5741 C   0  0  0

+   -3.9119   -2.4194   -1.0068 C   0  0  0

+   -5.3801   -0.5128   -1.3169 N   0  0  0

+   -5.2724   -3.1614    1.2881 C   0  0  0

+   -6.7277   -1.2877    1.0082 N   0  0  0

+   -3.5490   -3.5946   -0.2109 C   0  0  0

+   -3.1670   -2.1156   -2.1591 C   0  0  0

+   -4.8063    0.6522   -0.6302 C   0  0  0

+   -4.2408   -3.8997    0.8828 N   0  0  0

+   -5.9820   -3.5232    2.4592 C   0  0  0

+   -7.3869   -1.6214    2.0937 C   0  0  0

+   -2.4591   -4.3814   -0.6330 C   0  0  0

+   -2.1260   -2.9159   -2.5131 C   0  0  0

+   -5.1937    1.9282   -1.3802 C   0  0  0

+   -7.0307   -2.7492    2.8478 C   0  0  0

+   -8.4344   -0.8589    2.4946 O   0  0  0

+   -1.7766   -4.0351   -1.7576 C   0  0  0

+   -4.5960    3.1415   -0.6651 C   0  0  0

+   -8.5588    0.2033    1.5469 C   0  0  0

+   -0.4353   -5.0127   -2.2664 Cl  0  0  0

+   -4.9680    4.3667   -1.3852 N   0  0  0

+   -9.7291    1.1058    1.9429 C   0  0  0

+   -4.3659    5.4874   -0.6507 C   0  0  0

+   -9.8622    2.2431    0.9282 C   0  0  0

+   -4.7156    6.8023   -1.3504 C   0  0  0

+  -11.0325    3.1455    1.3242 C   0  0  0

+   -3.9767    8.1778   -0.4489 Cl  0  0  0

+   12.2823   -0.3299    0.9639 O   0  0  0

+   20.9169    0.2561    0.6489 Cl  0  0  0

+   29.5516    0.8420    0.3339 Cl  0  0  0

+   -6.3310   -0.4525    0.0000 H   0  0  0

+   -3.0396   -1.1714    0.0000 H   0  0  0

+   -4.0966    0.0165    0.0000 H   0  0  0

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+   -6.0602   -4.4728    0.0000 H   0  0  0

+   -2.5332   -5.3313    0.0000 H   0  0  0

+   -1.3445   -2.3709    0.0000 H   0  0  0

+   -5.9034    2.5639    0.0000 H   0  0  0

+   -5.9971    1.4160    0.0000 H   0  0  0

+   -7.8059   -3.3032    0.0000 H   0  0  0

+   -3.8863    2.5058    0.0000 H   0  0  0

+   -3.7926    3.6537    0.0000 H   0  0  0

+   -7.6155    0.0692    0.0000 H   0  0  0

+   -8.1886    1.0812    0.0000 H   0  0  0

+   -5.9161    4.4610    0.0000 H   0  0  0

+  -10.6724    1.2400    0.0000 H   0  0  0

+  -10.0994    0.2279    0.0000 H   0  0  0

+   -3.6790    4.8271    0.0000 H   0  0  0

+   -3.5451    5.9712    0.0000 H   0  0  0

+   -8.9189    2.1089    0.0000 H   0  0  0

+   -9.4920    3.1210    0.0000 H   0  0  0

+   -5.4025    7.4625    0.0000 H   0  0  0

+   -5.5364    6.3185    0.0000 H   0  0  0

+  -10.4507    3.9000    0.0000 H   0  0  0

+  -11.7870    3.7273    0.0000 H   0  0  0

+  -11.6143    2.3910    0.0000 H   0  0  0

+   11.3295   -0.3299    0.0000 H   0  0  0

+   13.2351   -0.3299    0.0000 H   0  0  0

+   21.8697    0.2561    0.0000 H   0  0  0

+   30.5044    0.8420    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  8 14  2  0

+  9 15  1  0

+ 11 16  2  0

+ 12 17  1  0

+ 13 18  2  0

+ 15 19  1  0

+ 17 20  1  0

+ 18 21  1  0

+ 19 22  1  0

+ 20 23  1  0

+ 22 24  1  0

+ 23 25  1  0

+ 24 26  1  0

+ 25 27  1  0

+ 26 28  1  0

+  7 10  2  0

+ 12 16  1  0

+ 14 18  1  0

+  4 32  1  0

+  8 33  1  0

+  9 34  1  0

+  9 35  1  0

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+ 27 56  1  0

+ 27 57  1  0

+ 29 58  1  0

+ 29 59  1  0

+ 30 60  1  0

+ 31 61  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77094-11-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.2735   -0.6424   -0.0014 C   0  0  0

+   -1.1841   -0.5641   -0.0006 C   0  0  0

+    1.0073    0.5477   -0.0010 C   0  0  0

+    1.1544   -1.6612    0.0028 N   0  0  0

+   -1.8034    0.7092    0.0006 C   0  0  0

+   -1.9835   -1.7144   -0.0014 C   0  0  0

+    0.3522    1.7803    0.0006 C   0  0  0

+    2.3415    0.1750   -0.0020 N   0  0  0

+    2.3777   -1.1882   -0.0005 C   0  0  0

+   -1.0024    1.8670    0.0010 C   0  0  0

+   -3.1374    0.7959    0.0010 N   0  0  0

+   -3.3432   -1.5564   -0.0010 C   0  0  0

+    1.1693    3.0465    0.0010 C   0  0  0

+    3.4965    1.0761   -0.0020 C   0  0  0

+    3.5258   -1.9530    0.0022 N   0  0  0

+   -3.8912   -0.2777    0.0002 C   0  0  0

+   -1.5553   -2.6634    0.0000 H   0  0  0

+   -1.4561    2.8041    0.0000 H   0  0  0

+   -3.9656   -2.3910    0.0000 H   0  0  0

+    2.0441    2.4820    0.0000 H   0  0  0

+    1.7338    3.9213    0.0000 H   0  0  0

+    0.2945    3.6110    0.0000 H   0  0  0

+    4.1369    0.2552    0.0000 H   0  0  0

+    4.3174    1.7165    0.0000 H   0  0  0

+    2.8561    1.8970    0.0000 H   0  0  0

+    3.4592   -2.9920    0.0000 H   0  0  0

+    4.4589   -1.4912    0.0000 H   0  0  0

+   -4.9268   -0.1700    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

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+  7 13  1  0

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+  7 10  2  0

+  8  9  1  0

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+ 10 18  1  0

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+ 14 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1028-11-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.3043   -1.0222   -0.1279 C   0  0  0

+   -1.2884   -1.7690   -0.2288 S   0  0  0

+    1.1964   -1.4259    0.8476 C   0  0  0

+    0.6638   -0.0363   -1.0280 C   0  0  0

+   -2.3123   -0.8822    0.7239 N   0  0  0

+   -1.7277   -1.5626   -1.5643 O   0  0  0

+   -1.1636   -3.0322    0.4100 O   0  0  0

+    2.4461   -0.8399    0.9268 C   0  0  0

+    1.9131    0.5495   -0.9489 C   0  0  0

+   -2.5213    0.4651    0.4532 C   0  0  0

+    2.8033    0.1497    0.0305 C   0  0  0

+   -3.3827    1.2042    1.2573 C   0  0  0

+   -1.8946    1.0348   -0.5648 N   0  0  0

+    4.1413    0.7771    0.1153 N   0  3  0

+   -3.5815    2.5441    0.9765 C   0  0  0

+   -2.0650    2.3104   -0.8558 C   0  0  0

+    4.4561    1.6492   -0.6746 O   0  0  0

+    4.9274    0.4213    0.9749 O   0  5  0

+   -2.9098    3.1017   -0.1030 C   0  0  0

+    1.2022   -2.2856    0.0000 H   0  0  0

+    0.0295    0.5440    0.0000 H   0  0  0

+   -3.0645   -1.2985    0.0000 H   0  0  0

+    3.0813   -1.4192    0.0000 H   0  0  0

+    1.9061    1.4092    0.0000 H   0  0  0

+   -4.1353    0.7887    0.0000 H   0  0  0

+   -4.3845    2.8512    0.0000 H   0  0  0

+   -1.3006    2.7039    0.0000 H   0  0  0

+   -2.8841    3.9610    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  2  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+ 10 12  2  0

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+  9 11  1  0

+ 16 19  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 12 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 19 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2564-83-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    0.0034   -0.6508   -0.4562 N   0  0  0

+   -1.2355   -0.0085   -0.0779 C   0  0  0

+    1.2341    0.0066   -0.0780 C   0  0  0

+    0.0114   -1.9899    0.1331 O   0  0  0

+   -1.2406    1.4901   -0.3896 C   0  0  0

+   -2.3758   -0.6485   -0.9030 C   0  0  0

+   -1.5731   -0.2227    1.3994 C   0  0  0

+    1.2265    1.5129   -0.3265 C   0  0  0

+    1.6027   -0.2666    1.3843 C   0  0  0

+    2.3705   -0.5895   -0.9439 C   0  0  0

+   -0.0279    2.1364    0.2900 C   0  0  0

+    0.0176   -3.0205    0.0000 H   0  0  0

+   -1.5722    2.4659    0.0000 H   0  0  0

+   -2.2571    1.3203    0.0000 H   0  0  0

+   -2.8802    0.2502    0.0000 H   0  0  0

+   -3.2745   -1.1529    0.0000 H   0  0  0

+   -1.8714   -1.5472    0.0000 H   0  0  0

+   -2.1253    0.6475    0.0000 H   0  0  0

+   -2.4433   -0.7749    0.0000 H   0  0  0

+   -1.0209   -1.0929    0.0000 H   0  0  0

+    2.2455    1.3585    0.0000 H   0  0  0

+    1.5368    2.4957    0.0000 H   0  0  0

+    0.9890   -1.0946    0.0000 H   0  0  0

+    2.4307   -0.8803    0.0000 H   0  0  0

+    2.2164    0.5614    0.0000 H   0  0  0

+    1.8918   -1.5022    0.0000 H   0  0  0

+    3.2832   -1.0682    0.0000 H   0  0  0

+    2.8492    0.3232    0.0000 H   0  0  0

+    0.6104    2.9456    0.0000 H   0  0  0

+   -0.6889    2.9271    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  8 11  1  0

+  4 12  1  0

+  5 13  1  0

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+  8 22  1  0

+  9 23  1  0

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+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 11 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25081-31-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -0.0573   -0.3936    0.1520 N   0  0  0

+   -1.0790    0.4263    0.8079 C   0  0  0

+    0.8703    0.2175   -0.8031 C   0  0  0

+    0.0290   -1.6526    0.4196 N   0  0  0

+   -2.3343    0.4265   -0.0259 C   0  0  0

+    2.0934    0.7079   -0.0720 C   0  0  0

+    0.8784   -2.3342   -0.1257 O   0  0  0

+   -3.4109    1.1166    0.3821 O   0  0  0

+   -2.3717   -0.1945   -1.0617 O   0  0  0

+    3.0852    1.3069   -0.7496 O   0  0  0

+    2.1812    0.5620    1.1242 O   0  0  0

+   -0.3300    0.9347    0.0000 H   0  0  0

+   -1.3448    1.2916    0.0000 H   0  0  0

+    0.9383    1.1202    0.0000 H   0  0  0

+    0.0901    0.6765    0.0000 H   0  0  0

+   -4.1730    1.6051    0.0000 H   0  0  0

+    3.8601    1.7749    0.0000 H   0  0  0

+  1  2  1  0

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+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  3 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3420-97-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.0193   -0.4418    0.0026 C   0  0  0

+   -0.2284   -1.5913    0.0010 C   0  0  0

+   -0.4281    0.8226    0.0027 C   0  0  0

+   -2.3688   -0.5536   -0.0016 O   0  0  0

+    1.1297   -1.4887   -0.0004 C   0  0  0

+    0.9280    0.9448    0.0013 C   0  0  0

+   -2.8934    0.7756    0.0014 C   0  0  0

+    1.7371   -0.2134   -0.0003 C   0  0  0

+   -4.4224    0.7205   -0.0032 C   0  0  0

+    3.0655   -0.1034   -0.0013 N   0  0  0

+    3.5853    0.9981   -0.0012 O   0  0  0

+   -0.6802   -2.5352    0.0000 H   0  0  0

+   -1.0290    1.6794    0.0000 H   0  0  0

+    1.7213   -2.3519    0.0000 H   0  0  0

+    1.3695    1.8936    0.0000 H   0  0  0

+   -1.8828    1.0473    0.0000 H   0  0  0

+   -3.0491    1.8104    0.0000 H   0  0  0

+   -4.4601    1.7663    0.0000 H   0  0  0

+   -5.4682    0.6828    0.0000 H   0  0  0

+   -4.3847   -0.3253    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

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+  6  8  1  0

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+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118517-20-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 95101                          1 V2000

+    1.5933   -0.2108    0.5509 C   0  0  1

+    1.8158    0.8109   -0.4869 N   0  0  0

+    1.1575    1.2192    0.7620 C   0  0  1

+    0.5499   -1.2869    0.2525 C   0  0  1

+    2.8450   -0.7274    1.2730 C   0  0  0

+    3.1227    1.1952   -0.3855 N   0  0  0

+   -0.2946    1.5737    0.5924 C   0  0  0

+   -0.5883   -0.6586   -0.5589 C   0  0  2

+    1.2096   -2.4084   -0.5524 C   0  0  0

+   -0.0031   -1.8434    1.5661 C   0  0  0

+    3.4449   -1.8697    0.4463 C   0  0  2

+    4.1433    0.5997   -1.0286 C   0  0  0

+    3.5579    2.2226    0.3659 C   0  0  0

+   -1.2415    0.4294    0.2996 C   0  0  2

+   -1.5731   -1.7619   -0.9398 C   0  0  0

+    2.3969   -2.9631    0.2384 C   0  0  0

+    4.5902   -2.4238    1.1459 O   0  0  0

+    5.3968    1.2954   -0.6687 C   0  0  0

+    4.0503   -0.3508   -1.7788 O   0  0  0

+    5.0249    2.3266    0.2173 C   0  0  0

+    2.8620    2.9442    1.0514 O   0  0  0

+   -2.4547    0.9483   -0.4544 C   0  0  1

+   -2.8504   -1.2020   -1.5818 C   0  0  0

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+  -12.1147    0.7882    0.3215 C   0  0  0

+    1.5436    2.1394    0.0000 H   0  0  0

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+   -1.8524    1.7440    0.0000 H   0  0  0

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+ 43 95  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68041-18-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 44                          1 V2000

+   -2.4480    0.0831   -0.4130 C   0  0  0

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+ 26 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+61421-82-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    0.8545    0.0017   -0.7730 C   0  0  0

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+ 23 37  1  0

+ 23 38  1  0

+ 23 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75605-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -2.3115    1.0417   -0.2479 C   0  0  0

+   -3.1274    0.0276    0.3112 C   0  0  0

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+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108529-37-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.3095    0.0541   -0.0030 C   0  0  0

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+    1.2269    1.6601   -0.0027 N   0  0  0

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+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117-10-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.2733    0.3243    0.0463 C   0  0  0

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+   -3.6616   -1.0670   -0.2643 C   0  0  0

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+    2.4734   -1.7698   -0.1355 C   0  0  0

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+   -4.5613   -1.5818    0.0000 H   0  0  0

+    2.4809   -2.8064    0.0000 H   0  0  0

+    4.5686    0.8230    0.0000 H   0  0  0

+    2.4953    3.4117    0.0000 H   0  0  0

+    4.5606   -1.5823    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23445-00-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 54                          1 V2000

+   -0.8700   -0.9941   -0.7578 C   0  0  0

+   -2.0523   -1.5209   -0.2141 C   0  0  0

+    0.2908   -1.7694   -0.8596 C   0  0  0

+   -0.8776    0.4156   -1.1985 C   0  0  0

+   -3.2063   -0.8473   -0.1626 O   0  0  0

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+   -2.0334    1.1933   -0.7006 C   0  0  0

+   -0.0109    0.8943   -1.9078 O   0  0  0

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+    2.1487   -0.6145   -0.3923 C   0  0  2

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+   -0.8590   -4.8458    0.6950 O   0  0  0

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+    3.5060   -0.1630   -0.9362 C   0  0  1

+   -3.1058    3.2950   -0.2367 C   0  0  0

+   -0.9569    3.2536   -1.2533 O   0  0  0

+   -4.1891    2.6083    0.2855 C   0  0  0

+   -5.2907    0.5804    0.8271 O   0  0  0

+   -0.4874   -4.7512    2.0715 C   0  0  0

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+    4.3058    0.4899    0.1969 C   0  0  2

+    4.2212   -1.2962   -1.4324 O   0  0  0

+    3.4525    1.5982    0.8241 C   0  0  2

+    1.2522    2.1028    1.8954 C   0  0  0

+    5.5068    1.0554   -0.3323 O   0  0  0

+    4.1176    2.1159    1.9781 O   0  0  0

+    0.0486    1.5262    2.4062 O   0  0  0

+   -2.8782   -3.3017    0.0000 H   0  0  0

+    1.1130   -3.5968    0.0000 H   0  0  0

+    2.6333   -1.4665    0.0000 H   0  0  0

+    3.0336    0.6958    0.0000 H   0  0  0

+   -3.1002    4.2751    0.0000 H   0  0  0

+   -0.1245    3.7711    0.0000 H   0  0  0

+   -5.0441    3.0876    0.0000 H   0  0  0

+   -6.1312    0.0761    0.0000 H   0  0  0

+   -0.2456   -5.7011    0.0000 H   0  0  0

+    0.4625   -4.5094    0.0000 H   0  0  0

+   -0.7292   -3.8013    0.0000 H   0  0  0

+    2.5866    0.1629    0.0000 H   0  0  0

+    4.8284   -0.3393    0.0000 H   0  0  0

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+    2.9530    2.4416    0.0000 H   0  0  0

+    2.0669    2.6477    0.0000 H   0  0  0

+    0.7668    2.9543    0.0000 H   0  0  0

+    6.3936    1.4729    0.0000 H   0  0  0

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+   -0.8354    1.1027    0.0000 H   0  0  0

+  1  2  2  0

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+ 28 47  1  0

+ 28 48  1  0

+ 29 49  1  0

+ 30 50  1  0

+ 31 51  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25377-73-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 45                          1 V2000

+    4.1855    0.1540    0.6905 C   0  0  0

+    4.4661   -1.3623    0.6530 C   0  0  0

+    5.3594    0.7490   -0.0564 C   0  0  0

+    2.9119    0.4478   -0.0595 C   0  0  0

+    5.7685   -1.4615   -0.1111 C   0  0  0

+    6.1715   -0.2346   -0.4545 O   0  0  0

+    5.5345    1.9268   -0.2608 O   0  0  0

+    1.9163    1.0439    0.5485 C   0  0  0

+    6.3519   -2.4875   -0.3693 O   0  0  0

+    0.6427    1.3378   -0.2015 C   0  0  0

+   -0.5265    0.6235    0.4795 C   0  0  0

+   -1.8196    0.9219   -0.2820 C   0  0  0

+   -2.9888    0.2077    0.3990 C   0  0  0

+   -4.2819    0.5060   -0.3625 C   0  0  0

+   -5.4511   -0.2082    0.3185 C   0  0  0

+   -6.7442    0.0901   -0.4430 C   0  0  0

+   -7.9134   -0.6241    0.2380 C   0  0  0

+   -9.2065   -0.3258   -0.5235 C   0  0  0

+  -10.3757   -1.0400    0.1575 C   0  0  0

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+   -2.5429    1.6056    0.0000 H   0  0  0

+   -3.4589   -0.6696    0.0000 H   0  0  0

+   -2.2655   -0.4760    0.0000 H   0  0  0

+   -3.8118    1.3833    0.0000 H   0  0  0

+   -5.0052    1.1897    0.0000 H   0  0  0

+   -5.9212   -1.0855    0.0000 H   0  0  0

+   -4.7278   -0.8919    0.0000 H   0  0  0

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+   -7.4675    0.7738    0.0000 H   0  0  0

+   -8.3835   -1.5014    0.0000 H   0  0  0

+   -7.1901   -1.3078    0.0000 H   0  0  0

+   -8.7364    0.5515    0.0000 H   0  0  0

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+  -10.8945   -0.1906    0.0000 H   0  0  0

+  -11.2251   -1.5588    0.0000 H   0  0  0

+   -9.8569   -1.8894    0.0000 H   0  0  0

+  1  2  1  0

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+  5  6  1  0

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+ 18 41  1  0

+ 18 42  1  0

+ 19 43  1  0

+ 19 44  1  0

+ 19 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98931-06-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 48                          1 V2000

+    0.9470    0.3711    0.3487 C   0  0  0

+   -0.0861    1.3135    0.3678 C   0  0  0

+    2.3175    0.6544    0.3390 C   0  0  0

+    0.7789   -1.0823    0.3259 C   0  0  0

+   -1.4770    0.7619    0.3931 C   0  0  2

+    0.3119    2.6119    0.3663 C   0  0  0

+    2.9404   -0.5570    0.3298 N   0  0  0

+    2.6928    1.9968    0.3400 C   0  0  0

+   -0.6196   -1.6497    0.3044 C   0  0  0

+    2.0051   -1.5811    0.3198 C   0  0  0

+   -1.5349   -0.5902   -0.3225 C   0  0  1

+   -2.4566    1.7285   -0.2717 C   0  0  0

+    1.6684    2.9339    0.3524 C   0  0  0

+    4.3926   -0.7507    0.3293 C   0  0  0

+   -2.9225   -1.0666   -0.3225 N   0  0  0

+   -3.8789    1.1752   -0.1461 C   0  0  2

+    4.8991   -0.8065   -1.1134 C   0  0  0

+   -3.9667   -0.1791   -0.8558 C   0  0  0

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+   -4.4579   -1.0973    0.0000 H   0  0  0

+   -4.1318    2.8921    0.0000 H   0  0  0

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+   -5.5980    1.4131    0.0000 H   0  0  0

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+  1  2  2  0

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+ 21 44  1  0

+ 21 45  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13177-28-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.9457   -0.6440   -0.0096 C   0  0  0

+   -0.2813   -0.2359   -0.0070 C   0  0  0

+    1.8763    0.4835    0.0161 C   0  0  0

+    1.3917   -2.0320   -0.0290 C   0  0  0

+   -0.2582    1.2351    0.0214 C   0  0  0

+   -1.3179   -1.2854   -0.0315 C   0  0  0

+    0.9987    1.6637    0.0347 C   0  0  0

+    3.1556    0.2027    0.0168 C   0  0  0

+    0.4711   -2.9658   -0.0457 C   0  0  0

+    2.8488   -2.2467   -0.0272 C   0  0  0

+   -1.3551    2.2209    0.0362 C   0  0  0

+   -0.9500   -2.5540   -0.0545 C   0  0  0

+   -2.6312   -0.9522   -0.0300 N   0  3  0

+    1.2842    3.1065    0.0628 C   0  0  0

+    3.6382   -1.1877   -0.0074 C   0  0  0

+   -1.0953    3.5086    0.0620 C   0  0  0

+   -3.4004   -1.5106    0.7317 O   0  0  0

+   -3.0427   -0.0942   -0.7903 O   0  5  0

+    0.3004    3.9793    0.0751 C   0  0  0

+    3.8562    0.9912    0.0000 H   0  0  0

+    0.7374   -3.9864    0.0000 H   0  0  0

+    3.2517   -3.2215    0.0000 H   0  0  0

+   -2.3564    1.8893    0.0000 H   0  0  0

+   -1.6958   -3.2999    0.0000 H   0  0  0

+    2.2838    3.4432    0.0000 H   0  0  0

+    4.6806   -1.3487    0.0000 H   0  0  0

+   -1.8867    4.2059    0.0000 H   0  0  0

+    0.5102    5.0130    0.0000 H   0  0  0

+  1  2  2  0

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+ 12 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 19 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102408-25-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.5107   -0.0726   -0.0023 C   0  0  0

+   -0.8774   -0.3084   -0.0012 C   0  0  0

+    0.9870    1.2396   -0.0011 C   0  0  0

+    1.6223   -0.8909    0.0010 N   0  0  0

+   -1.7716    0.7904    0.0012 C   0  0  0

+   -1.3998   -1.6125   -0.0029 C   0  0  0

+    0.0811    2.3171    0.0013 C   0  0  0

+    2.3445    1.1723   -0.0022 N   0  0  0

+    2.7210   -0.0822   -0.0020 C   0  0  0

+    1.6223   -2.3559    0.0066 C   0  0  0

+   -1.2573    2.1025    0.0029 C   0  0  0

+   -3.0899    0.5726    0.0015 N   0  0  0

+   -2.7586   -1.7651   -0.0021 C   0  0  0

+    4.0303   -0.5195   -0.0002 N   0  0  0

+   -3.5820   -0.6432   -0.0005 C   0  0  0

+   -0.7726   -2.4362    0.0000 H   0  0  0

+    0.4423    3.2874    0.0000 H   0  0  0

+    0.5870   -2.3559    0.0000 H   0  0  0

+    1.6223   -3.3912    0.0000 H   0  0  0

+    2.6576   -2.3559    0.0000 H   0  0  0

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+   -3.1740   -2.7134    0.0000 H   0  0  0

+    4.2373   -1.5339    0.0000 H   0  0  0

+    4.8053    0.1669    0.0000 H   0  0  0

+   -4.6093   -0.7715    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5598-15-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -2.0321    0.0918    0.3358 P   0  0  0

+   -1.1379   -1.2388    0.1875 O   0  0  0

+   -1.7687    1.0586   -0.9244 O   0  0  0

+   -3.5899   -0.3114    0.3866 O   0  0  0

+   -1.6640    0.7969    1.5839 O   0  0  0

+    0.1583   -0.8382    0.1502 C   0  0  0

+   -1.9853    0.2742   -2.0991 C   0  0  0

+   -4.3142    0.8781    0.7070 C   0  0  0

+    1.1674   -1.7850    0.0251 C   0  0  0

+    0.4480    0.4500    0.2278 N   0  0  0

+   -1.7501    1.1382   -3.3397 C   0  0  0

+   -5.8099    0.5627    0.7712 C   0  0  0

+    2.4867   -1.3638   -0.0122 C   0  0  0

+    0.7802   -3.4739   -0.0823 Cl  0  0  0

+    1.6948    0.8831    0.1949 C   0  0  0

+    2.7502   -0.0039    0.0773 C   0  0  0

+    2.0139    2.5862    0.3002 Cl  0  0  0

+    4.3852    0.5780    0.0362 Cl  0  0  0

+   -2.9895    0.0107    0.0000 H   0  0  0

+   -1.2559   -0.4646    0.0000 H   0  0  0

+   -3.3722    1.3146    0.0000 H   0  0  0

+   -4.6416    1.8633    0.0000 H   0  0  0

+   -0.7483    0.8655    0.0000 H   0  0  0

+   -1.4774    2.1400    0.0000 H   0  0  0

+   -2.7519    1.4109    0.0000 H   0  0  0

+   -6.0241    1.5786    0.0000 H   0  0  0

+   -6.8258    0.3485    0.0000 H   0  0  0

+   -5.5957   -0.4532    0.0000 H   0  0  0

+    3.2627   -2.0535    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  2  0

+  6 10  1  0

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+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57-57-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  9                          1 V2000

+    0.5080   -0.0387    0.0404 C   0  0  0

+   -0.5778   -1.0861    0.1899 C   0  0  0

+   -0.4864    0.8712    0.1745 O   0  0  0

+    1.7056   -0.0229   -0.1190 O   0  0  0

+   -1.5545   -0.0054   -0.3041 C   0  0  0

+   -1.3391   -1.7893    0.0000 H   0  0  0

+    0.1336   -1.8397    0.0000 H   0  0  0

+   -2.2246    0.7851    0.0000 H   0  0  0

+   -2.3343   -0.6880    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  5  1  0

+  2  6  1  0

+  2  7  1  0

+  5  8  1  0

+  5  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50-21-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.7478    0.2953   -0.3962 C   0  0  0

+   -0.6650   -0.1054   -0.0582 C   0  0  0

+    1.1662    1.4773    0.4805 C   0  0  0

+    1.6253   -0.8074   -0.1595 O   0  0  0

+   -1.6661    0.7769   -0.2041 O   0  0  0

+   -0.8968   -1.2209    0.3440 O   0  0  0

+    0.0631    1.0252    0.0000 H   0  0  0

+    2.1096    1.1433    0.0000 H   0  0  0

+    1.5002    2.4207    0.0000 H   0  0  0

+    0.2228    1.8113    0.0000 H   0  0  0

+    2.2485   -1.5905    0.0000 H   0  0  0

+   -2.4169    1.4386    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  1  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+76547-98-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 61                          1 V2000

+   -1.5238   -2.2191   -1.0219 N   0  0  0

+   -2.4999   -2.4472    0.0537 C   0  0  1

+   -0.8638   -1.0669   -1.2523 C   0  0  0

+   -1.3820   -3.4615   -1.8028 C   0  0  0

+   -3.0099   -3.8966   -0.0902 C   0  0  0

+   -1.8224   -2.2834    1.3898 C   0  0  0

+   -1.2240    0.1754   -0.4790 C   0  0  1

+    0.0201   -1.0298   -2.0819 O   0  0  0

+   -2.7087   -4.2276   -1.5736 C   0  0  0

+   -2.5240   -2.4464    2.5225 O   0  0  0

+   -0.6477   -2.0054    1.4415 O   0  0  0

+   -0.0274    1.0104   -0.3088 N   0  0  0

+   -2.2898    0.9618   -1.2450 C   0  0  0

+    0.6091    0.5853    0.9450 C   0  0  1

+   -2.6555    2.2231   -0.4599 C   0  0  0

+    2.1206    0.8018    0.8486 C   0  0  0

+    0.0574    1.3969    2.0887 C   0  0  0

+   -3.7213    3.0094   -1.2259 C   0  0  0

+    2.6807   -0.0220   -0.3126 C   0  0  0

+   -0.0141    0.8623    3.3179 O   0  0  0

+   -0.3206    2.5287    1.8993 O   0  0  0

+   -4.0870    4.2707   -0.4408 C   0  0  0

+    4.1695    0.1912   -0.4076 C   0  0  0

+   -5.1103    5.0257   -1.1762 N   0  0  0

+    5.0320   -0.6339    0.2902 C   0  0  0

+    4.6730    1.2081   -1.1968 C   0  0  0

+    6.3974   -0.4383    0.2031 C   0  0  0

+    6.0389    1.4037   -1.2840 C   0  0  0

+    6.9009    0.5825   -0.5818 C   0  0  0

+   -3.1178   -1.7634    0.0000 H   0  0  0

+   -1.0342   -4.3149    0.0000 H   0  0  0

+   -0.4891   -3.2332    0.0000 H   0  0  0

+   -3.8173   -3.4523    0.0000 H   0  0  0

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+    2.9523    1.1989    0.0000 H   0  0  0

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+   -4.6426    3.0313    0.0000 H   0  0  0

+   -4.0197    2.1374    0.0000 H   0  0  0

+    1.8490   -0.4191    0.0000 H   0  0  0

+    2.9476   -0.9041    0.0000 H   0  0  0

+   -0.1363   -0.0512    0.0000 H   0  0  0

+   -3.1657    4.2488    0.0000 H   0  0  0

+   -3.7886    5.1427    0.0000 H   0  0  0

+   -5.0072    5.9415    0.0000 H   0  0  0

+   -5.9550    4.6570    0.0000 H   0  0  0

+    4.7504   -1.5114    0.0000 H   0  0  0

+    4.1325    1.9546    0.0000 H   0  0  0

+    6.9384   -1.1844    0.0000 H   0  0  0

+    6.3196    2.2815    0.0000 H   0  0  0

+    7.8083    0.7436    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 25 27  2  0

+ 26 28  1  0

+ 27 29  1  0

+  5  9  1  0

+ 28 29  2  0

+  2 30  1  0

+  4 31  1  0

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+  5 33  1  0

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+  7 35  1  0

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+ 10 38  1  0

+ 12 39  1  0

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+ 25 56  1  0

+ 26 57  1  0

+ 27 58  1  0

+ 28 59  1  0

+ 29 60  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81-11-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+    3.0830   -0.0557   -0.0050 C   0  0  0

+    1.7997   -0.6100   -0.0023 C   0  0  0

+    3.2880    1.6943   -0.0088 S   0  0  0

+    4.1872   -0.8795    0.0010 C   0  0  0

+    0.6163    0.2673   -0.0030 C   0  0  0

+    1.6423   -1.9994    0.0006 C   0  0  0

+    4.7757    1.9785    0.1420 O   0  0  0

+    2.9445    2.1205   -1.3201 O   0  0  0

+    2.6832    2.1565    1.1912 O   0  0  0

+    4.0265   -2.2608    0.0097 C   0  0  0

+   -0.6161   -0.2672   -0.0004 C   0  0  0

+    2.7511   -2.8163    0.0008 C   0  0  0

+    5.1474   -3.0918    0.0153 N   0  0  0

+   -1.7995    0.6102   -0.0010 C   0  0  0

+   -3.0832    0.0557    0.0017 C   0  0  0

+   -1.6421    1.9992    0.0014 C   0  0  0

+   -3.2882   -1.6943    0.0066 S   0  0  0

+   -4.1871    0.8793    0.0010 C   0  0  0

+   -2.7513    2.8163    0.0007 C   0  0  0

+   -4.7749   -1.9787   -0.1521 O   0  0  0

+   -2.6766   -2.1581   -1.1893 O   0  0  0

+   -2.9520   -2.1188    1.3204 O   0  0  0

+   -4.0263    2.2610   -0.0024 C   0  0  0

+   -5.1472    3.0920   -0.0036 N   0  0  0

+    5.1453   -0.4665    0.0000 H   0  0  0

+    0.7354    1.3038    0.0000 H   0  0  0

+    0.6861   -2.4167    0.0000 H   0  0  0

+    5.8005    2.1743    0.0000 H   0  0  0

+   -0.7352   -1.3037    0.0000 H   0  0  0

+    2.6344   -3.8531    0.0000 H   0  0  0

+    5.0283   -4.1283    0.0000 H   0  0  0

+    6.1046   -2.6766    0.0000 H   0  0  0

+   -0.6859    2.4165    0.0000 H   0  0  0

+   -5.1452    0.4663    0.0000 H   0  0  0

+   -2.6346    3.8531    0.0000 H   0  0  0

+   -5.7997   -2.1747    0.0000 H   0  0  0

+   -5.0281    4.1285    0.0000 H   0  0  0

+   -6.1044    2.6768    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+ 10 12  1  0

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+  7 28  1  0

+ 11 29  1  0

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+ 13 31  1  0

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+ 16 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 24 37  1  0

+ 24 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+102-77-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.4104   -0.6601    0.0644 C   0  0  0

+   -1.5416   -1.2766   -0.1964 N   0  0  0

+   -0.9547    1.0087    0.4005 S   0  0  0

+    1.2255   -1.3143    0.0850 S   0  0  0

+   -2.7349   -0.6438   -0.1702 C   0  0  0

+   -2.6925    0.7305    0.1569 C   0  0  0

+    2.5793   -0.2733    0.4671 N   0  0  0

+   -4.0155   -1.1851   -0.4282 C   0  0  0

+   -3.8192    1.5107    0.2250 C   0  0  0

+    2.5897    0.7934   -0.5427 C   0  0  0

+    3.7962   -1.0678    0.2532 C   0  0  0

+   -5.1355   -0.3982   -0.3579 C   0  0  0

+   -5.0561    0.9483   -0.0336 C   0  0  0

+    3.8492    1.6444   -0.3745 C   0  0  0

+    5.0254   -0.1702    0.4015 C   0  0  0

+    5.0071    0.8421   -0.6047 O   0  0  0

+   -4.1255   -2.2162    0.0000 H   0  0  0

+   -3.7266    2.5435    0.0000 H   0  0  0

+    2.1927    1.7514    0.0000 H   0  0  0

+    1.5717    0.5960    0.0000 H   0  0  0

+    3.1290   -1.8616    0.0000 H   0  0  0

+    4.5040   -1.8256    0.0000 H   0  0  0

+   -6.0694   -0.8490    0.0000 H   0  0  0

+   -5.9111    1.5351    0.0000 H   0  0  0

+    4.5403    2.4175    0.0000 H   0  0  0

+    3.1672    2.4255    0.0000 H   0  0  0

+    5.4544   -1.1143    0.0000 H   0  0  0

+    6.0369    0.0584    0.0000 H   0  0  0

+  1  2  2  0

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+  1  4  1  0

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+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1929-73-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+   -2.2426   -0.2854   -0.0197 C   0  0  0

+   -3.5530   -0.6382    0.2743 C   0  0  0

+   -1.9410    1.0212   -0.3723 C   0  0  0

+   -1.2559   -1.2184    0.0436 O   0  0  0

+   -4.5534    0.3136    0.2148 C   0  0  0

+   -3.9342   -2.2730    0.7167 Cl  0  0  0

+   -2.9443    1.9697   -0.4305 C   0  0  0

+   -0.0390   -0.5572   -0.3086 C   0  0  0

+   -4.2494    1.6169   -0.1374 C   0  0  0

+    1.1006   -1.5420   -0.2577 C   0  0  0

+   -5.5076    2.8107   -0.2115 Cl  0  0  0

+    2.3473   -1.1415   -0.5527 O   0  0  0

+    0.8921   -2.6920    0.0488 O   0  0  0

+    3.4454   -2.0903   -0.5036 C   0  0  0

+    4.7483   -1.3824   -0.8807 C   0  0  0

+    4.9963   -0.3186    0.0407 O   0  0  0

+    6.2196    0.3002   -0.3624 C   0  0  0

+    6.5449    1.4541    0.5881 C   0  0  0

+    7.8547    2.1166    0.1565 C   0  0  0

+    8.1800    3.2705    1.1071 C   0  0  0

+   -0.9614    1.3171    0.0000 H   0  0  0

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+    2.6884   -2.7788    0.0000 H   0  0  0

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+    5.0069   -2.3725    0.0000 H   0  0  0

+    5.7715   -1.3689    0.0000 H   0  0  0

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+  1  2  1  0

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+  7  9  2  0

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+ 18 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+87679-37-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 65 67                          1 V2000

+    2.5399   -0.5191    0.7488 N   0  0  0

+    3.3084   -1.6937    0.3698 C   0  0  2

+    3.3230    0.6677    0.3303 C   0  0  1

+    1.3388   -0.5110    1.3603 C   0  0  0

+    4.0831   -1.2449   -0.8992 C   0  0  1

+    2.5403   -2.9486    0.0124 C   0  0  0

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+    2.4867    1.5452   -0.5651 C   0  0  0

+    0.5986    0.7879    1.5501 C   0  0  1

+    0.8537   -1.5491    1.7578 O   0  0  0

+    5.1863   -2.2661   -1.1178 C   0  0  0

+    3.5729   -4.0418   -0.3096 C   0  0  0

+    2.6228    2.8796   -0.5141 O   0  0  0

+    1.6936    1.0475   -1.3288 O   0  0  0

+   -0.8479    0.5318    1.5496 N   0  0  0

+    1.0049    1.4161    2.8847 C   0  0  0

+    4.5087   -3.6090   -1.4343 C   0  0  0

+   -1.3632    1.0234    0.2648 C   0  0  1

+   -2.7676    0.4633    0.0307 C   0  0  0

+   -1.4206    2.5291    0.2897 C   0  0  0

+   -2.7093   -1.0654    0.0055 C   0  0  0

+   -1.1557    3.2293   -0.8244 O   0  0  0

+   -1.7051    3.1060    1.3125 O   0  0  0

+   -4.0926   -1.6171   -0.2251 C   0  0  0

+   -1.2110    4.6801   -0.8004 C   0  0  0

+   -4.5407   -1.8435   -1.5133 C   0  0  0

+   -4.9113   -1.9020    0.8514 C   0  0  0

+   -0.8699    5.2264   -2.1883 C   0  0  0

+   -5.8093   -2.3494   -1.7248 C   0  0  0

+   -6.1804   -2.4081    0.6398 C   0  0  0

+   -6.6304   -2.6291   -0.6482 C   0  0  0

+    4.0126   -2.4152    0.0000 H   0  0  0

+    3.8962    1.4971    0.0000 H   0  0  0

+    3.3046   -0.6042    0.0000 H   0  0  0

+    1.7301   -2.3486    0.0000 H   0  0  0

+    1.8712   -3.7028    0.0000 H   0  0  0

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+    0.0411    1.6279    0.0000 H   0  0  0

+    6.0402   -2.8020    0.0000 H   0  0  0

+    5.7994   -1.4657    0.0000 H   0  0  0

+    2.7697   -4.6511    0.0000 H   0  0  0

+    4.0922   -4.9060    0.0000 H   0  0  0

+    2.7251    3.8826    0.0000 H   0  0  0

+   -1.1394   -0.4333    0.0000 H   0  0  0

+    1.8515    0.8686    0.0000 H   0  0  0

+    1.5524    2.2627    0.0000 H   0  0  0

+    0.1583    1.9636    0.0000 H   0  0  0

+    4.6424   -4.6083    0.0000 H   0  0  0

+    5.5028   -3.7767    0.0000 H   0  0  0

+   -0.4441    1.4377    0.0000 H   0  0  0

+   -3.0323    1.4361    0.0000 H   0  0  0

+   -3.7642    0.3107    0.0000 H   0  0  0

+   -2.4446   -2.0382    0.0000 H   0  0  0

+   -1.7127   -0.9128    0.0000 H   0  0  0

+   -1.8510    5.4591    0.0000 H   0  0  0

+   -2.1535    4.3222    0.0000 H   0  0  0

+   -4.1262   -2.7626    0.0000 H   0  0  0

+   -5.2638   -0.9574    0.0000 H   0  0  0

+   -0.0147    4.6924    0.0000 H   0  0  0

+   -0.3359    6.0816    0.0000 H   0  0  0

+   -1.7251    5.7604    0.0000 H   0  0  0

+   -5.4599   -3.2951    0.0000 H   0  0  0

+   -6.5896   -1.4867    0.0000 H   0  0  0

+   -7.5620   -3.0147    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  4 10  2  0

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+ 20 22  1  0

+ 20 23  2  0

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+ 22 25  1  0

+ 24 26  1  0

+ 24 27  2  0

+ 25 28  1  0

+ 26 29  2  0

+ 27 30  1  0

+ 29 31  1  0

+  5  7  1  0

+ 12 17  1  0

+ 30 31  2  0

+  2 32  1  0

+  3 33  1  0

+  5 34  1  0

+  6 35  1  0

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+  7 37  1  0

+  7 38  1  0

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+ 11 40  1  0

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+ 25 56  1  0

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+ 28 60  1  0

+ 28 61  1  0

+ 28 62  1  0

+ 29 63  1  0

+ 30 64  1  0

+ 31 65  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90-02-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.4637    0.0794    0.0021 C   0  0  0

+    0.5062   -0.9364    0.0004 C   0  0  0

+   -0.0597    1.4200    0.0020 C   0  0  0

+   -1.8912   -0.2622   -0.0021 C   0  0  0

+    1.8519   -0.6004   -0.0014 C   0  0  0

+    0.1290   -2.2388    0.0009 O   0  0  0

+    1.2811    1.7324    0.0002 C   0  0  0

+   -2.7255    0.6183   -0.0007 O   0  0  0

+    2.2345    0.7260   -0.0014 C   0  0  0

+   -0.7711    2.1783    0.0000 H   0  0  0

+   -2.1872   -1.2589    0.0000 H   0  0  0

+    2.5737   -1.3488    0.0000 H   0  0  0

+   -0.1602   -3.2375    0.0000 H   0  0  0

+    1.5802    2.7282    0.0000 H   0  0  0

+    3.2447    0.9719    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  7  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2642-98-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    0.2431    0.7822    0.0020 C   0  0  0

+   -0.5103   -0.4072    0.0011 C   0  0  0

+    1.7056    0.6989    0.0014 C   0  0  0

+   -0.4057    2.0298   -0.0022 C   0  0  0

+   -1.9725   -0.3072    0.0012 C   0  0  0

+    0.1234   -1.6600   -0.0004 C   0  0  0

+    2.3176   -0.5752    0.0001 C   0  0  0

+    2.5022    1.8472    0.0016 C   0  0  0

+   -1.7549    2.1269   -0.0077 C   0  0  0

+   -2.5692    0.9748    0.0024 C   0  0  0

+   -2.7810   -1.4471   -0.0004 C   0  0  0

+    1.4801   -1.7718   -0.0009 C   0  0  0

+    3.7150   -0.6661   -0.0002 C   0  0  0

+    3.8621    1.7257    0.0005 C   0  0  0

+   -3.9690    1.0781    0.0024 C   0  0  0

+   -4.1392   -1.3121   -0.0008 C   0  0  0

+    2.0719   -3.0324   -0.0019 N   0  0  0

+    4.4657    0.4733    0.0007 C   0  0  0

+   -4.7299   -0.0528    0.0012 C   0  0  0

+    0.1707    2.9065    0.0000 H   0  0  0

+   -0.4624   -2.5305    0.0000 H   0  0  0

+    2.0576    2.7976    0.0000 H   0  0  0

+   -2.2035    3.0754    0.0000 H   0  0  0

+   -2.3461   -2.4019    0.0000 H   0  0  0

+    4.1823   -1.6055    0.0000 H   0  0  0

+    4.4592    2.5884    0.0000 H   0  0  0

+   -4.4277    2.0217    0.0000 H   0  0  0

+   -4.7451   -2.1687    0.0000 H   0  0  0

+    1.4723   -3.8934    0.0000 H   0  0  0

+    3.1174   -3.1211    0.0000 H   0  0  0

+    5.5126    0.4033    0.0000 H   0  0  0

+   -5.7760    0.0277    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  8 14  1  0

+ 10 15  1  0

+ 11 16  2  0

+ 12 17  1  0

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+ 15 19  2  0

+  7 12  1  0

+  9 10  2  0

+ 14 18  2  0

+ 16 19  1  0

+  4 20  1  0

+  6 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 13 25  1  0

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+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16110-09-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -1.3756   -0.0260    0.0032 C   0  0  0

+   -0.7074   -1.2428    0.0021 C   0  0  0

+   -0.6417    1.1458    0.0026 C   0  0  0

+   -3.1109    0.0237   -0.0020 Cl  0  0  0

+    0.6781   -1.2344    0.0005 C   0  0  0

+    0.6770    1.1159    0.0011 N   0  0  0

+    1.3451   -0.0218    0.0001 C   0  0  0

+    3.0810    0.0025   -0.0013 Cl  0  0  0

+   -1.2336   -2.1382    0.0000 H   0  0  0

+   -1.1344    2.0600    0.0000 H   0  0  0

+    1.2094   -2.1268    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  6  7  2  0

+  2  9  1  0

+  3 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+709-98-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.8715    0.8052   -0.4450 C   0  0  0

+   -0.2159   -0.4183   -0.4671 C   0  0  0

+   -0.1617    1.9660   -0.1661 C   0  0  0

+   -2.2446    0.8695   -0.7091 N   0  0  0

+    1.1414   -0.4782   -0.2116 C   0  0  0

+    1.1940    1.9012    0.0885 C   0  0  0

+   -3.1046    0.1199    0.0085 C   0  0  0

+    1.8462    0.6810    0.0662 C   0  0  0

+    1.9625   -2.0075   -0.2383 Cl  0  0  0

+   -4.5661    0.0910   -0.3581 C   0  0  0

+   -2.7024   -0.5313    0.9493 O   0  0  0

+    3.5505    0.6031    0.3873 Cl  0  0  0

+   -5.3159   -0.8292    0.6072 C   0  0  0

+   -0.7592   -1.2821    0.0000 H   0  0  0

+   -0.6394    2.8678    0.0000 H   0  0  0

+   -2.5802    1.8332    0.0000 H   0  0  0

+    1.7394    2.7637    0.0000 H   0  0  0

+   -4.3487    1.0880    0.0000 H   0  0  0

+   -5.4853    0.5341    0.0000 H   0  0  0

+   -6.1070   -0.1846    0.0000 H   0  0  0

+   -5.9605   -1.6203    0.0000 H   0  0  0

+   -4.5248   -1.4738    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  7 10  1  0

+  7 11  2  0

+  8 12  1  0

+ 10 13  1  0

+  6  8  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1152-48-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+   -1.0814   -0.8151   -0.0048 C   0  0  0

+   -2.1951   -1.6568   -0.0050 C   0  0  0

+   -1.2607    0.5697   -0.0021 C   0  0  0

+    0.2824   -1.3875   -0.0013 C   0  0  0

+   -3.4644   -1.1163   -0.0025 C   0  0  0

+   -2.5351    1.0969    0.0003 C   0  0  0

+    1.4466   -0.5029   -0.0011 C   0  0  0

+    0.4356   -2.5951    0.0015 O   0  0  0

+   -3.6349    0.2567    0.0001 C   0  0  0

+    2.6921   -1.0258    0.0021 C   0  0  0

+   -4.9998    0.8296    0.0022 N   0  3  0

+    3.8633   -0.1358    0.0023 C   0  0  0

+   -5.1530    2.0379    0.0046 O   0  0  0

+   -5.9696    0.0927    0.0017 O   0  5  0

+    5.1548   -0.6732    0.0057 C   0  0  0

+    3.6915    1.2528   -0.0067 C   0  0  0

+    6.2475    0.1678    0.0053 C   0  0  0

+    4.7942    2.0800   -0.0070 C   0  0  0

+    6.0691    1.5402    0.0017 C   0  0  0

+   -2.0685   -2.6870    0.0000 H   0  0  0

+   -0.4367    1.2009    0.0000 H   0  0  0

+   -4.2933   -1.7411    0.0000 H   0  0  0

+   -2.6697    2.1261    0.0000 H   0  0  0

+    1.3160    0.5268    0.0000 H   0  0  0

+    2.8227   -2.0555    0.0000 H   0  0  0

+    5.2902   -1.7023    0.0000 H   0  0  0

+    2.7363    1.6590    0.0000 H   0  0  0

+    7.2064   -0.2295    0.0000 H   0  0  0

+    4.6684    3.1103    0.0000 H   0  0  0

+    6.8956    2.1682    0.0000 H   0  0  0

+  1  2  2  0

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+  1  4  1  0

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+  6  9  1  0

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+ 10 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86674-51-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 30                          1 V2000

+    0.0824   -0.2851   -0.0018 C   0  0  0

+   -1.3183    0.1688   -0.0012 C   0  0  0

+    1.0613    0.5883   -0.0005 C   0  0  0

+    0.3513   -1.7344    0.0024 C   0  0  0

+   -1.5988    1.4504    0.0006 C   0  0  0

+   -2.3862   -0.8472   -0.0021 C   0  0  0

+    2.4549    0.1119   -0.0010 C   0  0  0

+    0.7515    2.0281    0.0009 C   0  0  0

+   -0.7771   -2.6773    0.0063 C   0  0  0

+    1.5968   -2.1568    0.0020 C   0  0  0

+   -0.5034    2.4348    0.0022 C   0  0  0

+   -3.0069    1.8819    0.0013 C   0  0  0

+   -2.0253   -2.2728   -0.0042 C   0  0  0

+   -3.6427   -0.4588   -0.0015 C   0  0  0

+    2.7025   -1.1821   -0.0027 C   0  0  0

+    3.4778    1.0005   -0.0001 N   0  0  0

+   -3.9664    0.9792    0.0001 C   0  0  0

+    4.6293    0.6036   -0.0005 O   0  0  0

+    1.5699    2.7674    0.0000 H   0  0  0

+   -0.5674   -3.7600    0.0000 H   0  0  0

+    1.8135   -3.2382    0.0000 H   0  0  0

+   -0.7326    3.5136    0.0000 H   0  0  0

+   -3.2570    2.9560    0.0000 H   0  0  0

+   -2.8302   -3.0267    0.0000 H   0  0  0

+   -4.4525   -1.2075    0.0000 H   0  0  0

+    3.7460   -1.5391    0.0000 H   0  0  0

+   -5.0209    1.3022    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

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+ 12 17  2  0

+ 16 18  2  0

+  8 11  2  0

+  9 13  2  0

+ 10 15  1  0

+ 14 17  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+448-97-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.7303   -0.1295    0.1438 C   0  0  0

+   -0.7303    0.1294    0.1438 C   0  0  0

+    1.6158    0.8667   -0.2664 C   0  0  0

+    1.2196   -1.3664    0.5591 C   0  0  0

+   -1.6159   -0.8668   -0.2663 C   0  0  0

+   -1.2196    1.3664    0.5592 C   0  0  0

+    2.9743    0.6234   -0.2651 C   0  0  0

+    2.5782   -1.6058    0.5590 C   0  0  0

+   -2.9743   -0.6235   -0.2648 C   0  0  0

+   -2.5782    1.6057    0.5592 C   0  0  0

+    3.4595   -0.6151    0.1459 C   0  0  0

+    3.8334    1.5874   -0.6622 F   0  0  0

+   -3.4594    0.6152    0.1457 C   0  0  0

+   -3.8335   -1.5874   -0.6623 F   0  0  0

+    4.8356   -0.8602    0.1468 N   0  0  0

+   -4.8356    0.8603    0.1467 N   0  0  0

+    1.2886    1.8113    0.0000 H   0  0  0

+    0.5877   -2.1410    0.0000 H   0  0  0

+   -1.2887   -1.8114    0.0000 H   0  0  0

+   -0.5877    2.1410    0.0000 H   0  0  0

+    2.9065   -2.5500    0.0000 H   0  0  0

+   -2.9066    2.5499    0.0000 H   0  0  0

+    5.1759   -1.8002    0.0000 H   0  0  0

+    5.4795   -0.0955    0.0000 H   0  0  0

+   -5.1759    1.8002    0.0000 H   0  0  0

+   -5.4795    0.0956    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  9 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 13 16  1  0

+  8 11  2  0

+ 10 13  2  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-94-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.0000   -0.7679    0.0000 N   0  0  0

+   -1.1786    0.1090    0.0000 C   0  0  0

+    1.1786    0.1090    0.0000 C   0  0  0

+   -2.4488   -0.7440    0.0000 C   0  0  0

+    2.4488   -0.7440    0.0000 C   0  0  0

+   -3.6298    0.1347    0.0000 C   0  0  0

+    3.6298    0.1347    0.0000 C   0  0  0

+   -4.5412    0.8128    0.0000 N   0  0  0

+    4.5412    0.8128    0.0000 N   0  0  0

+    0.0000   -1.8708    0.0000 H   0  0  0

+   -0.4245    0.9138    0.0000 H   0  0  0

+   -1.8930    0.9492    0.0000 H   0  0  0

+    1.8930    0.9492    0.0000 H   0  0  0

+    0.4245    0.9138    0.0000 H   0  0  0

+   -3.2029   -1.5488    0.0000 H   0  0  0

+   -1.7344   -1.5842    0.0000 H   0  0  0

+    1.7344   -1.5842    0.0000 H   0  0  0

+    3.2029   -1.5488    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  1  0

+  6  4  1  0

+  7  5  1  0

+  8  6  3  0

+  9  7  3  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+66931-57-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    1.7417   -0.2733   -0.0146 C   0  0  0

+    0.4649    0.3110   -0.0713 C   0  0  0

+    2.8856    0.5612    0.0448 C   0  0  0

+    1.9062   -1.6690   -0.0097 C   0  0  0

+    0.3439    1.6666   -0.0685 C   0  0  0

+   -0.7640   -0.5589   -0.1355 C   0  0  0

+    2.7210    1.9569    0.0454 C   0  0  0

+    4.1625   -0.0230    0.1025 C   0  0  0

+    3.1583   -2.1993    0.0465 C   0  0  0

+    1.4689    2.4873   -0.0100 C   0  0  0

+   -1.9296    0.2663   -0.1853 O   0  0  0

+    4.2835   -1.3786    0.1006 C   0  0  0

+   -3.0552   -0.6121   -0.2447 C   0  0  0

+   -4.3430    0.2122   -0.3003 C   0  0  0

+   -5.5482   -0.7282   -0.3638 C   0  0  0

+   -5.1459   -0.0807    0.8449 O   0  0  0

+    1.0639   -2.3011    0.0000 H   0  0  0

+   -0.6152    2.1016    0.0000 H   0  0  0

+   -1.4655   -1.3444    0.0000 H   0  0  0

+   -0.0626   -1.3444    0.0000 H   0  0  0

+    3.5633    2.5890    0.0000 H   0  0  0

+    5.0224    0.5849    0.0000 H   0  0  0

+    3.2789   -3.2455    0.0000 H   0  0  0

+    1.3483    3.5335    0.0000 H   0  0  0

+    5.2426   -1.8136    0.0000 H   0  0  0

+   -3.7193   -1.4295    0.0000 H   0  0  0

+   -2.3179   -1.3640    0.0000 H   0  0  0

+   -4.2276    1.2590    0.0000 H   0  0  0

+   -6.5895   -0.5711    0.0000 H   0  0  0

+   -5.2811   -1.7469    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  1  0

+  8 12  2  0

+ 11 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+  7 10  2  0

+  9 12  1  0

+ 15 16  1  0

+  4 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+70-34-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.9404   -0.1468   -0.0031 C   0  0  0

+   -0.3451   -0.6548   -0.0026 C   0  0  0

+    1.1429    1.2226   -0.0010 C   0  0  0

+    2.1000   -1.0667    0.0003 N   0  3  0

+   -1.4281    0.2039   -0.0001 C   0  0  0

+    0.0570    2.0820    0.0016 C   0  0  0

+    2.3989    1.7203   -0.0010 F   0  0  0

+    1.9216   -2.2716    0.0035 O   0  0  0

+    3.2327   -0.6188   -0.0001 O   0  5  0

+   -1.2271    1.5719    0.0020 C   0  0  0

+   -2.8042   -0.3413   -0.0001 N   0  3  0

+   -3.7590    0.4150    0.0022 O   0  0  0

+   -2.9819   -1.5463   -0.0024 O   0  5  0

+   -0.4970   -1.6802    0.0000 H   0  0  0

+    0.2075    3.1076    0.0000 H   0  0  0

+   -2.0401    2.2150    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  6 10  2  0

+  2 14  1  0

+  6 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21340-68-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 39                          1 V2000

+   -1.0381   -0.2937   -0.3185 C   0  0  0

+   -2.5027   -0.1201   -0.1580 C   0  0  0

+   -0.3427    0.4705   -1.2537 C   0  0  0

+   -0.3538   -1.2175    0.4700 C   0  0  0

+   -3.3204   -1.2305    0.0446 C   0  0  0

+   -3.0647    1.1542   -0.2037 C   0  0  0

+    1.0189    0.3068   -1.4006 C   0  0  0

+    1.0074   -1.3767    0.3186 C   0  0  0

+   -4.6818   -1.0637    0.1937 C   0  0  0

+   -4.4277    1.3105   -0.0535 C   0  0  0

+    1.6966   -0.6180   -0.6181 C   0  0  0

+   -5.2361    0.2041    0.1423 C   0  0  0

+    3.0380   -0.7774   -0.7654 O   0  0  0

+   -6.9499    0.4073    0.3301 Cl  0  0  0

+    3.6562   -0.1182    0.3416 C   0  0  0

+    5.0895    0.1989    0.0007 C   0  0  0

+    2.9054    1.1796    0.6465 C   0  0  0

+    3.6138   -1.0321    1.5679 C   0  0  0

+    5.8704    0.8224    0.8969 O   0  0  0

+    5.5358   -0.1081   -1.0793 O   0  0  0

+    7.2514    1.1279    0.5685 C   0  0  0

+   -0.7015    1.4341    0.0000 H   0  0  0

+   -0.8690   -2.1073    0.0000 H   0  0  0

+   -2.9133   -2.1747    0.0000 H   0  0  0

+   -2.4550    1.9821    0.0000 H   0  0  0

+    1.5378    1.1945    0.0000 H   0  0  0

+    1.3681   -2.3395    0.0000 H   0  0  0

+   -5.2961   -1.8883    0.0000 H   0  0  0

+   -4.8402    2.2523    0.0000 H   0  0  0

+    3.7954    1.6945    0.0000 H   0  0  0

+    2.3905    2.0696    0.0000 H   0  0  0

+    2.0154    0.6647    0.0000 H   0  0  0

+    2.5867   -0.9844    0.0000 H   0  0  0

+    3.5661   -2.0592    0.0000 H   0  0  0

+    4.6409   -1.0798    0.0000 H   0  0  0

+    7.4735    0.1240    0.0000 H   0  0  0

+    8.2553    1.3500    0.0000 H   0  0  0

+    7.0293    2.1318    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  1  0

+  7 11  2  0

+  9 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 15 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+ 16 19  1  0

+ 16 20  2  0

+ 19 21  1  0

+  8 11  1  0

+ 10 12  2  0

+  3 22  1  0

+  4 23  1  0

+  5 24  1  0

+  6 25  1  0

+  7 26  1  0

+  8 27  1  0

+  9 28  1  0

+ 10 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+142-84-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    0.0000   -0.5130    0.0000 N   0  0  0

+   -1.1786    0.3639    0.0000 C   0  0  0

+    1.1786    0.3639    0.0000 C   0  0  0

+   -2.4488   -0.4890    0.0000 C   0  0  0

+    2.4488   -0.4890    0.0000 C   0  0  0

+   -3.6763    0.4243    0.0000 C   0  0  0

+    3.6763    0.4243    0.0000 C   0  0  0

+    0.0000   -1.6605    0.0000 H   0  0  0

+   -0.3940    1.2012    0.0000 H   0  0  0

+   -1.9219    1.2381    0.0000 H   0  0  0

+    1.9219    1.2381    0.0000 H   0  0  0

+    0.3940    1.2012    0.0000 H   0  0  0

+   -3.2334   -1.3263    0.0000 H   0  0  0

+   -1.7055   -1.3632    0.0000 H   0  0  0

+    1.7055   -1.3632    0.0000 H   0  0  0

+    3.2334   -1.3263    0.0000 H   0  0  0

+   -2.9913    1.3449    0.0000 H   0  0  0

+   -4.5969    1.1093    0.0000 H   0  0  0

+   -4.3613   -0.4963    0.0000 H   0  0  0

+    4.3613   -0.4963    0.0000 H   0  0  0

+    4.5969    1.1093    0.0000 H   0  0  0

+    2.9913    1.3449    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  7 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+481-42-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    0.1396    0.9366   -0.0019 C   0  0  0

+   -0.6503   -0.2285   -0.0009 C   0  0  0

+    1.6127    0.8123   -0.0013 C   0  0  0

+   -0.4702    2.1844    0.0023 C   0  0  0

+    0.0071   -1.5481    0.0007 C   0  0  0

+   -2.0425   -0.1204   -0.0020 C   0  0  0

+    2.2333   -0.5253    0.0004 C   0  0  0

+    2.3090    1.8080   -0.0026 O   0  0  0

+   -1.8555    2.2788    0.0074 C   0  0  0

+    1.4798   -1.6332    0.0014 C   0  0  0

+   -0.6623   -2.5627    0.0020 O   0  0  0

+   -2.6356    1.1426   -0.0040 C   0  0  0

+   -2.8129   -1.2354   -0.0015 O   0  0  0

+    3.7353   -0.6478    0.0006 C   0  0  0

+    0.1139    3.0527    0.0000 H   0  0  0

+   -2.3112    3.2209    0.0000 H   0  0  0

+    1.9424   -2.5719    0.0000 H   0  0  0

+   -3.6786    1.2276    0.0000 H   0  0  0

+   -3.4078   -2.0964    0.0000 H   0  0  0

+    3.6502   -1.6908    0.0000 H   0  0  0

+    4.7783   -0.7329    0.0000 H   0  0  0

+    3.8204    0.3952    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  2  0

+  6 13  1  0

+  7 14  1  0

+  7 10  2  0

+  9 12  1  0

+  4 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+ 14 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24370-25-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -1.4541    0.8120   -0.0024 C   0  0  0

+   -1.1193   -0.5522   -0.0015 C   0  0  0

+   -0.2542    1.5026   -0.0018 N   0  0  0

+   -2.7863    1.1979    0.0014 C   0  0  0

+    0.2371   -0.6305   -0.0004 N   0  0  0

+   -2.1365   -1.5100   -0.0015 C   0  0  0

+    0.7469    0.5748   -0.0006 C   0  0  0

+   -3.7786    0.2398    0.0060 C   0  0  0

+   -3.4534   -1.1088   -0.0023 C   0  0  0

+    2.1003    0.8655   -0.0005 N   0  0  0

+    3.0043   -0.1342    0.0007 C   0  0  0

+    4.3220    0.1489    0.0008 N   0  0  0

+    2.6311   -1.2912    0.0019 O   0  0  0

+   -0.1381    2.5296    0.0000 H   0  0  0

+   -3.0349    2.2011    0.0000 H   0  0  0

+   -1.9011   -2.5163    0.0000 H   0  0  0

+   -4.7709    0.5285    0.0000 H   0  0  0

+   -4.2055   -1.8177    0.0000 H   0  0  0

+    2.4176    1.8491    0.0000 H   0  0  0

+    5.0152   -0.6176    0.0000 H   0  0  0

+    4.6392    1.1325    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

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+  5  7  2  0

+  8  9  1  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64099-25-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.2753   -0.0409   -0.0020 C   0  0  0

+   -0.8700    0.7884   -0.0011 C   0  0  0

+    1.5522    0.4794   -0.0009 C   0  0  0

+   -0.4192   -1.6712    0.0025 S   0  0  0

+   -2.1124    0.0331   -0.0026 C   0  0  0

+   -0.6479    2.1833    0.0015 C   0  0  0

+    1.7269    1.8380    0.0012 C   0  0  0

+    2.7254   -0.4233   -0.0014 N   0  3  0

+   -2.0789   -1.2669    0.0053 N   0  0  0

+   -3.3052    0.6838   -0.0019 O   0  0  0

+    0.6193    2.6774    0.0030 C   0  0  0

+    3.8513    0.0412   -0.0004 O   0  0  0

+    2.5647   -1.6307   -0.0028 O   0  5  0

+   -4.3229   -0.3193   -0.0037 C   0  0  0

+   -1.4594    2.8374    0.0000 H   0  0  0

+    2.6881    2.2412    0.0000 H   0  0  0

+    0.7631    3.7097    0.0000 H   0  0  0

+   -5.0546    0.4230    0.0000 H   0  0  0

+   -5.0652   -1.0510    0.0000 H   0  0  0

+   -3.5912   -1.0616    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+  8 13  1  0

+ 10 14  1  0

+  5  9  2  0

+  7 11  1  0

+  6 15  1  0

+  7 16  1  0

+ 11 17  1  0

+ 14 18  1  0

+ 14 19  1  0

+ 14 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+140-03-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 63 62                          1 V2000

+    3.9626   -0.1100   -0.4170 C   0  0  0

+    2.5369    0.4231   -0.5716 C   0  0  0

+    4.8943    1.0348   -0.0143 C   0  0  0

+    3.9866   -1.1372    0.6090 O   0  0  0

+    1.6192   -0.7046   -0.9682 C   0  0  0

+    6.3478    0.6115   -0.2360 C   0  0  0

+    4.2852   -2.4046    0.2830 C   0  0  0

+    0.6074   -1.0264   -0.2008 C   0  0  0

+    7.2795    1.7564    0.1667 C   0  0  0

+    4.1970   -3.4911    1.3236 C   0  0  0

+    4.6247   -2.6743   -0.8448 O   0  0  0

+   -0.4756   -0.0171    0.0809 C   0  0  0

+    8.7329    1.3330   -0.0550 C   0  0  0

+   -1.8448   -0.6630   -0.1403 C   0  0  0

+    9.6646    2.4779    0.3477 C   0  0  0

+   -2.9443    0.3617    0.1457 C   0  0  0

+   11.1181    2.0545    0.1260 C   0  0  0

+   -4.3135   -0.2842   -0.0755 C   0  0  0

+   -5.4130    0.7405    0.2106 C   0  0  0

+   -6.7822    0.0945   -0.0107 C   0  0  0

+   -7.8818    1.1193    0.2754 C   0  0  0

+   -9.2304    0.4830    0.0575 C   0  0  0

+  -10.3493    1.1990    0.2504 O   0  0  0

+   -9.3045   -0.6716   -0.2908 O   0  0  0

+  -11.6487    0.5859    0.0405 C   0  0  0

+    5.0115   -0.4691    0.0000 H   0  0  0

+    3.0353    1.4134    0.0000 H   0  0  0

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+   -2.6970   -1.3721    0.0000 H   0  0  0

+   -1.2490   -1.5980    0.0000 H   0  0  0

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+   -2.0921    1.0708    0.0000 H   0  0  0

+   -3.5401    1.2967    0.0000 H   0  0  0

+   10.8080    0.9901    0.0000 H   0  0  0

+   12.1825    1.7444    0.0000 H   0  0  0

+   11.4282    3.1189    0.0000 H   0  0  0

+   -5.1657   -0.9933    0.0000 H   0  0  0

+   -3.7177   -1.2192    0.0000 H   0  0  0

+   -4.5608    1.4496    0.0000 H   0  0  0

+   -6.0089    1.6754    0.0000 H   0  0  0

+   -7.6344   -0.6146    0.0000 H   0  0  0

+   -6.1863   -0.8404    0.0000 H   0  0  0

+   -7.0296    1.8284    0.0000 H   0  0  0

+   -8.4777    2.0542    0.0000 H   0  0  0

+  -12.1218    1.5886    0.0000 H   0  0  0

+  -12.6514    0.1128    0.0000 H   0  0  0

+  -11.1756   -0.4168    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

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+ 20 21  1  0

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+ 22 23  1  0

+ 22 24  2  0

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+  1 26  1  0

+  2 27  1  0

+  2 28  1  0

+  3 29  1  0

+  3 30  1  0

+  5 31  1  0

+  6 32  1  0

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+ 20 58  1  0

+ 21 59  1  0

+ 21 60  1  0

+ 25 61  1  0

+ 25 62  1  0

+ 25 63  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+393-75-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.5580    1.1979    0.0031 C   0  0  0

+   -1.2499    0.0001    0.0020 C   0  0  0

+    0.8244    1.1973    0.0026 C   0  0  0

+   -1.2976    2.4800   -0.0014 N   0  3  0

+   -0.5578   -1.1981    0.0004 C   0  0  0

+   -2.9859    0.0001    0.0032 Cl  0  0  0

+    1.5152    0.0001    0.0010 C   0  0  0

+   -0.6883    3.5347   -0.0004 O   0  0  0

+   -2.5156    2.4805   -0.0060 O   0  5  0

+    0.8241   -1.1975   -0.0001 C   0  0  0

+   -1.2974   -2.4802   -0.0013 N   0  3  0

+    3.0222    0.0001    0.0000 C   0  0  0

+   -0.6880   -3.5348   -0.0026 O   0  0  0

+   -2.5154   -2.4807   -0.0012 O   0  5  0

+    3.4885   -1.3189   -0.0015 F   0  0  0

+    3.4877    0.6607   -1.1420 F   0  0  0

+    3.4893    0.6585    1.1426 F   0  0  0

+    1.3431    2.0950    0.0000 H   0  0  0

+    1.3428   -2.0952    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

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+  5 10  2  0

+  5 11  1  0

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+ 11 13  2  0

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+ 12 15  1  0

+ 12 16  1  0

+ 12 17  1  0

+  7 10  1  0

+  3 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75-91-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.5102    0.0277    0.0000 C   0  0  0

+   -0.6386   -0.8222    0.0005 O   0  0  0

+    0.4912    0.9116    1.2487 C   0  0  0

+    1.7781   -0.8286    0.0005 C   0  0  0

+    0.4912    0.9102   -1.2498 C   0  0  0

+   -1.8164    0.0559    0.0000 O   0  0  0

+    1.5627    0.9346    0.0000 H   0  0  0

+    0.4682    1.9831    0.0000 H   0  0  0

+   -0.5803    0.8886    0.0000 H   0  0  0

+    1.1783   -1.7168    0.0000 H   0  0  0

+    2.6663   -1.4284    0.0000 H   0  0  0

+    2.3779    0.0596    0.0000 H   0  0  0

+    1.5627    0.9333    0.0000 H   0  0  0

+    0.4681    1.9817    0.0000 H   0  0  0

+   -0.5803    0.8871    0.0000 H   0  0  0

+   -2.6756    0.6965    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  3  7  1  0

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+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+103088-83-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    1.3389    0.1294   -0.0032 C   0  0  0

+   -0.0202   -0.2456   -0.0026 C   0  0  0

+    1.6906    1.4902   -0.0016 C   0  0  0

+    2.4036   -0.8859    0.0007 C   0  0  0

+   -1.0133    0.7659   -0.0003 C   0  0  0

+   -0.4007   -1.6024   -0.0047 C   0  0  0

+    0.6890    2.4684    0.0001 C   0  0  0

+    3.1055    1.8839   -0.0013 C   0  0  0

+    3.8253   -0.4168    0.0004 C   0  0  0

+    2.1369   -2.0704    0.0045 O   0  0  0

+   -2.4241    0.3649    0.0006 C   0  0  0

+   -0.6422    2.1104    0.0016 C   0  0  0

+   -1.7000   -1.9720   -0.0045 C   0  0  0

+    4.0961    0.9736   -0.0024 C   0  0  0

+    4.7371   -1.2200    0.0039 O   0  0  0

+   -2.7395   -1.0126   -0.0011 C   0  0  0

+   -3.4503    1.3111    0.0025 C   0  0  0

+   -4.0844   -1.4071   -0.0003 C   0  0  0

+   -4.7616    0.8914    0.0028 C   0  0  0

+   -5.0703   -0.4633    0.0021 C   0  0  0

+    0.3440   -2.3443    0.0000 H   0  0  0

+    0.9546    3.4855    0.0000 H   0  0  0

+    3.3512    2.9060    0.0000 H   0  0  0

+   -1.3830    2.8561    0.0000 H   0  0  0

+   -1.9438   -2.9945    0.0000 H   0  0  0

+    5.0947    1.3019    0.0000 H   0  0  0

+   -3.2234    2.3375    0.0000 H   0  0  0

+   -4.3334   -2.4284    0.0000 H   0  0  0

+   -5.5361    1.6022    0.0000 H   0  0  0

+   -6.0771   -0.7655    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 13 25  1  0

+ 14 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90147-31-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -1.0574    0.0124   -0.0036 C   0  0  0

+   -2.2340   -0.6481   -0.0027 O   0  0  0

+   -1.3328    1.3641   -0.0012 C   0  0  0

+    0.2303   -0.5768   -0.0012 C   0  0  0

+   -3.2416    0.2355    0.0002 C   0  0  0

+   -2.7305    1.4867    0.0012 C   0  0  0

+    1.3357    0.2091   -0.0024 C   0  0  0

+   -4.6825   -0.1041    0.0012 N   0  3  0

+    2.6228   -0.3799    0.0000 C   0  0  0

+   -5.5173    0.7828    0.0038 O   0  0  0

+   -5.0332   -1.2705   -0.0007 O   0  5  0

+    3.7213    0.4011   -0.0012 N   0  0  0

+    2.7377   -1.5922    0.0032 O   0  0  0

+    5.0534   -0.2085    0.0013 C   0  0  0

+    6.1174    0.8910   -0.0008 C   0  0  0

+    7.5086    0.2544    0.0018 C   0  0  0

+   -0.6497    2.1295    0.0000 H   0  0  0

+    0.3271   -1.5981    0.0000 H   0  0  0

+   -3.2648    2.3625    0.0000 H   0  0  0

+    1.2390    1.2304    0.0000 H   0  0  0

+    3.6246    1.4224    0.0000 H   0  0  0

+    4.5238   -1.0871    0.0000 H   0  0  0

+    5.8665   -0.8340    0.0000 H   0  0  0

+    6.6470    1.7697    0.0000 H   0  0  0

+    5.3042    1.5165    0.0000 H   0  0  0

+    7.0817   -0.6785    0.0000 H   0  0  0

+    8.4415   -0.1725    0.0000 H   0  0  0

+    7.9355    1.1873    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 12 21  1  0

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+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-34-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.6422   -1.2597   -0.0036 C   0  0  0

+   -0.7526   -1.1919   -0.0028 C   0  0  0

+    1.3920   -0.0821   -0.0026 C   0  0  0

+    1.3212   -2.5717    0.0005 C   0  0  0

+   -1.3801    0.0363   -0.0009 C   0  0  0

+    0.7514    1.1398   -0.0007 C   0  0  0

+    2.6669   -2.6337   -0.0003 O   0  0  0

+    0.6661   -3.5946    0.0046 O   0  0  0

+   -0.6307    1.1997    0.0006 C   0  0  0

+   -2.8585    0.1102    0.0000 N   0  3  0

+    1.5447    2.3894    0.0005 N   0  3  0

+   -3.4140    1.1941    0.0016 O   0  0  0

+   -3.5194   -0.9129   -0.0010 O   0  5  0

+    0.9806    3.4689    0.0021 O   0  0  0

+    2.7617    2.3382   -0.0003 O   0  5  0

+   -1.3140   -2.0611    0.0000 H   0  0  0

+    2.4258   -0.1256    0.0000 H   0  0  0

+    3.7005   -2.6813    0.0000 H   0  0  0

+   -1.1063    2.1186    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 15  1  0

+  6  9  2  0

+  2 16  1  0

+  3 17  1  0

+  7 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4584-57-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+   -4.8305   -0.0242    0.0028 C   0  0  0

+   -4.2854   -1.3041    0.0009 C   0  0  0

+   -3.9982    1.0900    0.0041 C   0  0  0

+   -6.2154    0.1421   -0.0023 N   0  0  0

+   -2.9186   -1.4724    0.0002 C   0  0  0

+   -2.6299    0.9299    0.0034 C   0  0  0

+   -6.7914    1.4891   -0.0003 C   0  0  0

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+   -0.6158   -0.5302    0.0002 C   0  0  0

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+    2.2059   -0.9147    0.0036 C   0  0  0

+    3.8624    1.3123    0.0006 C   0  0  0

+    3.5760   -1.0713    0.0028 C   0  0  0

+    4.4028    0.0386   -0.0013 C   0  0  0

+    5.8727   -0.1379   -0.0020 N   0  3  0

+    6.3516   -1.2578   -0.0037 O   0  0  0

+    6.6031    0.8368   -0.0010 O   0  5  0

+   -4.9130   -2.1376    0.0000 H   0  0  0

+   -4.4106    2.0484    0.0000 H   0  0  0

+   -2.5105   -2.4326    0.0000 H   0  0  0

+   -2.0061    1.7662    0.0000 H   0  0  0

+   -5.8321    1.8993    0.0000 H   0  0  0

+   -7.2016    2.4484    0.0000 H   0  0  0

+   -7.7507    1.0789    0.0000 H   0  0  0

+   -7.9288   -0.4045    0.0000 H   0  0  0

+   -7.7196   -1.8651    0.0000 H   0  0  0

+   -6.2590   -1.6559    0.0000 H   0  0  0

+   -0.2056   -1.4895    0.0000 H   0  0  0

+   -0.2206    1.5038    0.0000 H   0  0  0

+    2.0876    2.4457    0.0000 H   0  0  0

+    1.5838   -1.7523    0.0000 H   0  0  0

+    4.4917    2.1445    0.0000 H   0  0  0

+    3.9903   -2.0289    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

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+  6  9  2  0

+ 16 17  1  0

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+  8 28  1  0

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+ 10 31  1  0

+ 11 32  1  0

+ 13 33  1  0

+ 14 34  1  0

+ 15 35  1  0

+ 16 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3344-12-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+    0.5858   -0.7506    0.0589 C   0  0  0

+    0.1444    0.7172    1.0291 S   0  0  0

+    2.0595   -1.0907    0.2905 C   0  0  0

+   -0.2715   -1.9132    0.4884 C   0  0  0

+   -1.7768    1.1227    0.2297 P   0  0  0

+    2.9168    0.0718   -0.1390 C   0  0  0

+   -0.5909   -2.8734   -0.3934 O   0  0  0

+   -0.6714   -1.9809    1.6266 O   0  0  0

+   -2.3556    2.4753    0.8836 O   0  0  0

+   -1.6320    1.3597   -1.8720 S   0  0  0

+   -2.6870   -0.0029    0.5377 O   0  0  0

+    4.2524   -0.0015   -0.0265 O   0  0  0

+    2.4020    1.0700   -0.5846 O   0  0  0

+   -1.4170   -3.9935    0.0204 C   0  0  0

+   -2.4325    2.2526    2.2931 C   0  0  0

+   -3.3547    1.7731   -2.2618 C   0  0  0

+    5.0784    1.1186   -0.4403 C   0  0  0

+   -1.6297   -4.9360   -1.1659 C   0  0  0

+    6.5520    0.7785   -0.2087 C   0  0  0

+   -0.4622   -0.5689    0.0000 H   0  0  0

+    1.6818   -2.0850    0.0000 H   0  0  0

+    2.9933   -1.5999    0.0000 H   0  0  0

+   -1.9725   -3.0865    0.0000 H   0  0  0

+   -2.4663   -4.1669    0.0000 H   0  0  0

+   -3.4378    2.5997    0.0000 H   0  0  0

+   -2.7796    1.2473    0.0000 H   0  0  0

+   -1.4272    1.9055    0.0000 H   0  0  0

+   -3.1065    2.8073    0.0000 H   0  0  0

+   -4.3889    2.0213    0.0000 H   0  0  0

+   -3.6029    0.7389    0.0000 H   0  0  0

+    5.4561    2.1129    0.0000 H   0  0  0

+    4.1446    1.6278    0.0000 H   0  0  0

+   -2.6672   -4.7019    0.0000 H   0  0  0

+   -1.8638   -5.9735    0.0000 H   0  0  0

+   -0.5922   -5.1701    0.0000 H   0  0  0

+    6.3128   -0.2578    0.0000 H   0  0  0

+    7.5883    0.5393    0.0000 H   0  0  0

+    6.7912    1.8148    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 18 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6146-52-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -1.2146    0.6395   -0.0026 C   0  0  0

+   -1.6564   -0.6960   -0.0017 C   0  0  0

+    0.1530    0.9209   -0.0020 C   0  0  0

+   -2.4241    1.4659    0.0016 C   0  0  0

+   -0.7190   -1.7240    0.0003 C   0  0  0

+   -3.0330   -0.6685   -0.0026 N   0  0  0

+    1.0564   -0.1041   -0.0004 C   0  0  0

+   -3.4724    0.6273    0.0048 C   0  0  0

+    0.6254   -1.4239    0.0013 C   0  0  0

+    2.5060    0.1949    0.0003 N   0  3  0

+    3.3155   -0.7152    0.0016 O   0  0  0

+    2.8894    1.3509   -0.0006 O   0  5  0

+    0.4807    1.9007    0.0000 H   0  0  0

+   -2.4630    2.4983    0.0000 H   0  0  0

+   -1.0301   -2.7091    0.0000 H   0  0  0

+   -3.6433   -1.5021    0.0000 H   0  0  0

+   -4.4640    0.9173    0.0000 H   0  0  0

+    1.3200   -2.1886    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  8  1  0

+  7  9  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-78-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.7162    0.7434    0.0020 C   0  0  0

+   -1.0981   -0.5919    0.0007 C   0  0  0

+    0.6325    1.0769    0.0017 C   0  0  0

+   -1.6858    1.7488   -0.0023 N   0  0  0

+   -0.1367   -1.5836   -0.0008 C   0  0  0

+   -2.5599   -0.9584    0.0004 C   0  0  0

+    1.5885    0.0805    0.0002 C   0  0  0

+    1.2047   -1.2482   -0.0010 C   0  0  0

+    3.0517    0.4413   -0.0005 C   0  0  0

+    0.9222    2.0774    0.0000 H   0  0  0

+   -1.3980    2.7499    0.0000 H   0  0  0

+   -2.6967    1.4975    0.0000 H   0  0  0

+   -0.4225   -2.5853    0.0000 H   0  0  0

+   -2.8132    0.0520    0.0000 H   0  0  0

+   -3.5703   -1.2117    0.0000 H   0  0  0

+   -2.3066   -1.9688    0.0000 H   0  0  0

+    1.9278   -1.9979    0.0000 H   0  0  0

+    3.3011   -0.5700    0.0000 H   0  0  0

+    4.0630    0.6907    0.0000 H   0  0  0

+    2.8023    1.4526    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104671-59-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    1.2656   -0.1082   -0.0610 C   0  0  0

+    0.0300    0.3430   -0.3351 O   0  0  0

+    2.3148    0.7370   -0.0958 N   0  0  0

+    1.4363   -1.2777    0.2232 O   0  0  0

+   -0.9182   -0.4208   -0.3037 N   0  0  0

+    3.6619    0.2450    0.2031 C   0  0  0

+   -2.1389    0.0363    0.0244 C   0  0  0

+   -3.3121   -0.9088    0.0633 C   0  0  0

+   -2.2963    1.2101    0.2894 O   0  0  0

+    2.1545    1.7059    0.0000 H   0  0  0

+   -0.7618   -1.3904    0.0000 H   0  0  0

+    3.3250   -0.6775    0.0000 H   0  0  0

+    4.5844   -0.0919    0.0000 H   0  0  0

+    3.9988    1.1675    0.0000 H   0  0  0

+   -3.9282   -0.1440    0.0000 H   0  0  0

+   -4.0769   -1.5249    0.0000 H   0  0  0

+   -2.6960   -1.6736    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  7  9  2  0

+  3 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-26-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -1.3685   -0.3841    0.0611 C   0  0  0

+   -2.4011    0.6213    0.0362 C   0  0  0

+    0.0562   -0.0210    0.1255 C   0  0  0

+   -1.7754   -1.7019    0.0276 C   0  0  0

+   -3.6761    0.1895   -0.0233 C   0  0  0

+    0.9972   -0.9857    0.1473 N   0  0  0

+    0.3847    1.1498    0.1591 O   0  0  0

+   -3.5017   -1.5830   -0.0355 S   0  0  0

+   -4.9192    0.9924   -0.0602 N   0  3  0

+    2.3533   -0.6431    0.0753 C   0  0  0

+   -6.0017    0.4368   -0.1140 O   0  0  0

+   -4.8594    2.2087   -0.0368 O   0  5  0

+    3.3158   -1.6372   -0.0378 C   0  0  0

+    2.7354    0.6916    0.1112 C   0  0  0

+    4.6528   -1.2985   -0.1092 C   0  0  0

+    4.0724    1.0287    0.0397 C   0  0  0

+    5.0341    0.0344   -0.0680 C   0  0  0

+    6.3506    0.3672   -0.1383 O   0  0  0

+    6.4204    1.7929   -0.0719 C   0  0  0

+   -2.1719    1.6333    0.0000 H   0  0  0

+   -1.1884   -2.5575    0.0000 H   0  0  0

+    0.7152   -1.9843    0.0000 H   0  0  0

+    3.0323   -2.6353    0.0000 H   0  0  0

+    2.0135    1.4369    0.0000 H   0  0  0

+    5.3752   -2.0433    0.0000 H   0  0  0

+    4.3567    2.0266    0.0000 H   0  0  0

+    7.4568    1.7422    0.0000 H   0  0  0

+    6.4711    2.8293    0.0000 H   0  0  0

+    5.3840    1.8436    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 10 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+ 17 18  1  0

+ 18 19  1  0

+  5  8  1  0

+ 16 17  1  0

+  2 20  1  0

+  4 21  1  0

+  6 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 19 27  1  0

+ 19 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60883-97-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 46                          1 V2000

+   -1.7252   -1.7516   -0.7719 C   0  0  0

+   -1.7257   -1.7549    0.7642 C   0  0  0

+   -0.4844   -1.8801   -0.0039 N   0  0  0

+   -1.7403   -0.4161   -1.4768 C   0  0  0

+   -1.7401   -0.4224    1.4748 C   0  0  0

+    1.1630   -2.0487   -0.0038 S   0  0  0

+   -1.7537    0.7629   -0.7401 C   0  0  0

+   -1.7409   -0.3745   -2.8567 C   0  0  0

+   -1.7526    0.7598    0.7432 C   0  0  0

+   -1.7405   -0.3867    2.8549 C   0  0  0

+    1.8582   -0.4297   -0.0008 C   0  0  0

+    1.4933   -2.6131    1.2577 O   0  0  0

+    1.4938   -2.6086   -1.2673 O   0  0  0

+   -1.7677    1.9882   -1.4122 C   0  0  0

+   -1.7548    0.8419   -3.5145 C   0  0  0

+   -1.7655    1.9822    1.4205 C   0  0  0

+   -1.7534    0.8268    3.5179 C   0  0  0

+    2.1307    0.2031    1.1974 C   0  0  0

+    2.1365    0.2054   -1.1969 C   0  0  0

+   -1.7683    2.0206   -2.7904 C   0  0  0

+   -1.7663    2.0087    2.7989 C   0  0  0

+    2.6762    1.4735    1.1998 C   0  0  0

+    2.6819    1.4753   -1.1945 C   0  0  0

+    2.9491    2.1107    0.0040 C   0  0  0

+    3.5437    3.4954    0.0066 C   0  0  0

+   -2.6095   -1.6900    0.0000 H   0  0  0

+   -2.3800   -2.3530    0.0000 H   0  0  0

+   -2.6273   -0.3860    0.0000 H   0  0  0

+   -2.6269   -0.3964    0.0000 H   0  0  0

+   -0.8813    2.0015    0.0000 H   0  0  0

+   -0.8684    0.8520    0.0000 H   0  0  0

+   -0.8792    2.0003    0.0000 H   0  0  0

+   -0.8670    0.8363    0.0000 H   0  0  0

+    2.9451   -0.1471    0.0000 H   0  0  0

+    2.9497   -0.1474    0.0000 H   0  0  0

+   -1.7816    2.9070    0.0000 H   0  0  0

+   -1.7845    2.8950    0.0000 H   0  0  0

+    3.4909    1.1241    0.0000 H   0  0  0

+    3.4978    1.1286    0.0000 H   0  0  0

+    4.3583    3.1456    0.0000 H   0  0  0

+    3.8935    4.3100    0.0000 H   0  0  0

+    2.7291    3.8452    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

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+ 10 17  2  0

+ 11 18  2  0

+ 11 19  1  0

+ 14 20  2  0

+ 16 21  2  0

+ 18 22  1  0

+ 19 23  2  0

+ 22 24  2  0

+ 24 25  1  0

+  2  3  1  0

+  7  9  1  0

+ 15 20  1  0

+ 17 21  1  0

+ 23 24  1  0

+  1 26  1  0

+  2 27  1  0

+  8 28  1  0

+ 10 29  1  0

+ 14 30  1  0

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+ 16 32  1  0

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+ 19 35  1  0

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+ 21 37  1  0

+ 22 38  1  0

+ 23 39  1  0

+ 25 40  1  0

+ 25 41  1  0

+ 25 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+31698-14-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.4349    0.0224   -1.0805 C   0  0  2

+   -0.7391   -1.3468   -0.4056 C   0  0  1

+    0.9736    0.2497   -0.7029 N   0  0  0

+   -1.2571    0.9701   -0.3697 O   0  0  0

+    0.2293   -1.3779    0.6556 O   0  0  0

+   -2.1369   -1.1481    0.2197 C   0  0  1

+    1.2923   -0.6179    0.2946 C   0  0  0

+    1.8870    1.1416   -1.1992 C   0  0  0

+   -2.5180    0.3008   -0.1545 C   0  0  1

+   -3.0619   -2.0549   -0.3836 O   0  0  0

+    2.5126   -0.6423    0.7990 N   0  0  0

+    3.1406    1.1528   -0.7080 C   0  0  0

+   -3.2490    0.9553    1.0195 C   0  0  0

+    3.4708    0.1926    0.3538 C   0  0  0

+   -3.5225    2.3228    0.7076 O   0  0  0

+    4.6872    0.1496    0.8640 N   0  0  0

+   -1.3610   -0.2121    0.0000 H   0  0  0

+   -0.8218   -2.2985    0.0000 H   0  0  0

+   -1.8390   -2.0558    0.0000 H   0  0  0

+    1.5227    2.0247    0.0000 H   0  0  0

+   -3.3330   -0.1976    0.0000 H   0  0  0

+   -3.7441   -2.7237    0.0000 H   0  0  0

+    3.6920    1.9329    0.0000 H   0  0  0

+   -4.1984    1.0619    0.0000 H   0  0  0

+   -3.6394    0.0834    0.0000 H   0  0  0

+   -3.7099    3.2596    0.0000 H   0  0  0

+    5.6419    0.1159    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

+  3  8  1  0

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+  6 10  1  0

+  7 11  2  0

+  8 12  2  0

+  9 13  1  0

+ 11 14  1  0

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+  5  7  1  0

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+ 12 14  1  0

+  1 17  1  0

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+  6 19  1  0

+  8 20  1  0

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+ 10 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+982-57-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+   -2.1116   -0.9573    0.2445 C   0  0  0

+   -2.5774   -2.3915   -0.0143 C   0  0  0

+   -0.9000   -0.6893   -0.5342 N   0  0  0

+   -3.2126    0.0197   -0.1730 C   0  0  0

+   -1.3886   -3.3174    0.0078 C   0  0  0

+   -3.5041   -2.7818    1.0009 O   0  0  0

+    0.2372   -0.3270    0.0920 C   0  0  0

+   -2.8322    1.3686    0.2065 O   0  0  0

+   -0.7125   -3.5462    1.1919 C   0  0  0

+   -0.9776   -3.9423   -1.1544 C   0  0  0

+    1.4567    0.0404   -0.7135 C   0  0  0

+    0.2790   -0.2968    1.3037 O   0  0  0

+   -3.6513    2.3976   -0.0619 C   0  0  0

+    0.3778   -4.3953    1.2123 C   0  0  0

+    0.1131   -4.7917   -1.1341 C   0  0  0

+    1.0753    1.4486   -1.7729 Cl  0  0  0

+    2.8050    0.4752    0.4018 Cl  0  0  0

+   -3.2564    3.7976    0.3320 C   0  0  0

+   -4.7051    2.2013   -0.6194 O   0  0  0

+    0.7924   -5.0160    0.0485 C   0  0  0

+   -4.3574    4.7745   -0.0855 C   0  0  0

+    1.9601   -5.9254    0.0703 N   0  3  0

+   -3.9626    6.1745    0.3084 C   0  0  0

+    2.3253   -6.4722   -0.9550 O   0  0  0

+    2.5556   -6.1270    1.1134 O   0  5  0

+   -2.8955    6.3732    0.8728 O   0  0  0

+   -4.7092    7.1124    0.0637 O   0  0  0

+   14.8922    6.1030    0.2659 Na  0  3  0

+   -1.8715   -0.0327    0.0000 H   0  0  0

+   -3.2808   -1.7452    0.0000 H   0  0  0

+   -0.6516   -1.6117    0.0000 H   0  0  0

+   -4.0828    0.4137    0.0000 H   0  0  0

+   -3.7325   -0.7817    0.0000 H   0  0  0

+   -4.3844   -3.1526    0.0000 H   0  0  0

+   -0.2596   -2.7052    0.0000 H   0  0  0

+   -1.6795   -4.5902    0.0000 H   0  0  0

+    1.7411   -0.8715    0.0000 H   0  0  0

+    1.0774   -3.7449    0.0000 H   0  0  0

+   -0.3367   -5.6344    0.0000 H   0  0  0

+   -2.3862    3.4036    0.0000 H   0  0  0

+   -2.7365    4.5990    0.0000 H   0  0  0

+   -5.2276    5.1685    0.0000 H   0  0  0

+   -4.8772    3.9731    0.0000 H   0  0  0

+   -5.3041    7.8598    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 20  2  0

+  1 29  1  0

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+ 15 39  1  0

+ 18 40  1  0

+ 18 41  1  0

+ 21 42  1  0

+ 21 43  1  0

+ 27 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+620-25-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.6726   -0.2355   -0.0024 C   0  0  0

+   -0.4887   -0.9974   -0.0016 C   0  0  0

+    0.5899    1.1514   -0.0014 C   0  0  0

+    1.9209   -0.8622    0.0016 N   0  0  0

+   -1.7215   -0.3744    0.0003 C   0  0  0

+   -0.6458    1.7677    0.0004 C   0  0  0

+    3.1038   -0.0839    0.0007 O   0  0  0

+   -1.8002    1.0060    0.0013 C   0  0  0

+   -2.9821   -1.2002    0.0007 C   0  0  0

+   -0.4300   -2.0374    0.0000 H   0  0  0

+    1.4590    1.7256    0.0000 H   0  0  0

+    1.9816   -1.9021    0.0000 H   0  0  0

+   -0.7086    2.8075    0.0000 H   0  0  0

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+   -2.7311    1.4734    0.0000 H   0  0  0

+   -3.5529   -0.3288    0.0000 H   0  0  0

+   -3.8535   -1.7710    0.0000 H   0  0  0

+   -2.4113   -2.0716    0.0000 H   0  0  0

+  1  2  2  0

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+  5  9  1  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+610-28-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.4557    0.5154   -0.0139 C   0  0  0

+   -0.8858   -0.8109    0.0579 C   0  0  0

+    0.9114    0.7992   -0.0368 C   0  0  0

+   -1.4425    1.6133   -0.0715 C   0  0  0

+    0.0411   -1.8317    0.1058 C   0  0  0

+   -2.3329   -1.1211    0.0832 N   0  3  0

+    1.8272   -0.2310    0.0115 C   0  0  0

+   -2.0803    1.8857   -1.2263 O   0  0  0

+   -1.6787    2.2703    0.9225 O   0  0  0

+    1.3940   -1.5434    0.0827 C   0  0  0

+   -2.7620   -2.0762   -0.5390 O   0  0  0

+   -3.0946   -0.4213    0.7263 O   0  5  0

+    3.2767    0.0678   -0.0132 N   0  3  0

+    4.0866   -0.8409    0.0295 O   0  0  0

+    3.6595    1.2224   -0.0762 O   0  5  0

+    1.2364    1.7809    0.0000 H   0  0  0

+   -0.2761   -2.8160    0.0000 H   0  0  0

+   -3.0313    2.2919    0.0000 H   0  0  0

+    2.0844   -2.3133    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 15  1  0

+  7 10  1  0

+  3 16  1  0

+  5 17  1  0

+  8 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146-59-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 56                          1 V2000

+   -5.5570    0.5346    1.0201 C   0  0  0

+   -4.8673    0.5562   -0.2093 C   0  0  0

+   -5.8539    1.7507    1.6880 C   0  0  0

+   -5.9598   -0.6872    1.5889 C   0  0  0

+   -4.4964    1.8095   -0.7296 C   0  0  0

+   -4.5667   -0.6115   -0.8792 N   0  0  0

+   -5.4927    2.9280    1.1765 N   0  0  0

+   -6.5457    1.7027    2.9171 C   0  0  0

+   -6.6269   -0.6922    2.7789 C   0  0  0

+   -4.8400    3.0195    0.0211 C   0  0  0

+   -3.8074    1.9311   -1.9473 C   0  0  0

+   -3.2428   -1.0397   -0.4081 C   0  0  0

+   -6.9158    0.5059    3.4414 C   0  0  0

+   -7.0153   -1.8742    3.3270 O   0  0  0

+   -4.4635    4.2685   -0.5098 C   0  0  0

+   -3.4724    3.1674   -2.4064 C   0  0  0

+   -2.8451   -2.3371   -1.1148 C   0  0  0

+   -7.6806   -1.5624    4.5527 C   0  0  0

+   -3.7966    4.3215   -1.6948 C   0  0  0

+   -1.4662   -2.7831   -0.6242 C   0  0  0

+   -3.3389    5.8674   -2.3383 Cl  0  0  0

+   -1.0844   -4.0288   -1.3027 N   0  0  0

+    0.2410   -4.3999   -0.7894 C   0  0  0

+   -2.0201   -5.0637   -0.8431 C   0  0  0

+    1.2576   -4.3692   -1.9324 C   0  0  0

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+    2.8843   -4.8247   -1.3024 Cl  0  0  0

+   14.2897    0.2583    0.1369 Cl  0  0  0

+   22.6651    2.0194    1.4605 Cl  0  0  0

+   -5.4067   -1.4459    0.0000 H   0  0  0

+   -5.2505   -1.2549    0.0000 H   0  0  0

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+   -0.5315   -2.6950    0.0000 H   0  0  0

+   -1.3637   -1.8499    0.0000 H   0  0  0

+   -0.3606   -5.1207    0.0000 H   0  0  0

+    0.6517   -5.2442    0.0000 H   0  0  0

+   -2.3945   -4.2027    0.0000 H   0  0  0

+   -2.9589   -5.0493    0.0000 H   0  0  0

+    1.8592   -3.6484    0.0000 H   0  0  0

+    0.8469   -3.5249    0.0000 H   0  0  0

+   -3.2825   -5.5392    0.0000 H   0  0  0

+   -2.8340   -6.7889    0.0000 H   0  0  0

+   -1.5843   -6.3404    0.0000 H   0  0  0

+   15.2286    0.2583    0.0000 H   0  0  0

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+  7 10  1  0

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+ 16 19  2  0

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+ 26 52  1  0

+ 26 53  1  0

+ 26 54  1  0

+ 28 55  1  0

+ 29 56  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86607-81-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    0.3977    1.1144   -0.0020 C   0  0  0

+   -0.4756    0.0181   -0.0006 C   0  0  0

+    1.7575    0.5420   -0.0013 C   0  0  0

+   -0.1047    2.4114    0.0013 C   0  0  0

+    0.2592   -1.1158    0.0009 O   0  0  0

+   -1.8469    0.2447   -0.0013 C   0  0  0

+    1.5838   -0.8488    0.0005 C   0  0  0

+    3.0362    1.0892   -0.0020 C   0  0  0

+   -1.4684    2.6165    0.0060 C   0  0  0

+   -2.3345    1.5345   -0.0034 C   0  0  0

+   -2.7852   -0.9001   -0.0003 N   0  3  0

+    2.7044   -1.6712    0.0016 C   0  0  0

+    4.1360    0.2573   -0.0009 C   0  0  0

+   -3.9871   -0.7024   -0.0009 O   0  0  0

+   -2.3554   -2.0397    0.0011 O   0  5  0

+    3.9676   -1.1184    0.0009 C   0  0  0

+    0.5451    3.2228    0.0000 H   0  0  0

+    3.1623    2.1210    0.0000 H   0  0  0

+   -1.8474    3.5844    0.0000 H   0  0  0

+   -3.3612    1.6968    0.0000 H   0  0  0

+    2.5900   -2.7044    0.0000 H   0  0  0

+    5.0931    0.6628    0.0000 H   0  0  0

+    4.8013   -1.7392    0.0000 H   0  0  0

+  1  2  2  0

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+  3  7  2  0

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+  5  7  1  0

+  9 10  1  0

+ 13 16  1  0

+  4 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 16 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+145439-00-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 40                          1 V2000

+   -1.4800   -0.6730    0.3308 C   0  0  0

+   -0.5801   -1.2807   -0.5360 C   0  0  0

+   -1.3964    0.6323    0.8683 C   0  0  0

+   -2.4807   -1.6077    0.5563 N   0  0  0

+    0.5843   -0.7151   -1.0438 N   0  0  0

+   -1.0407   -2.5099   -0.7919 N   0  0  0

+   -1.8642    1.6821    0.1643 N   0  0  0

+   -0.9021    0.8077    1.9666 O   0  0  0

+   -2.1651   -2.7054   -0.1535 C   0  0  0

+   -3.6596   -1.4316    1.4081 C   0  0  0

+    1.6109   -0.4307   -0.2181 C   0  0  0

+    0.6953   -0.4285   -2.4762 C   0  0  0

+   -2.4937    1.4862   -0.9444 N   0  0  0

+   -1.6577    3.0458    0.6583 C   0  0  0

+    2.7384    0.1169   -0.7098 O   0  0  0

+    1.5189   -0.6684    0.9698 O   0  0  0

+   -3.0163    2.4227   -1.5217 O   0  0  0

+    3.8737    0.3498    0.1650 C   0  0  0

+    4.3166   -0.9749    0.7894 C   0  0  0

+    5.0282    0.9431   -0.6449 C   0  0  0

+    3.4725    1.3266    1.2721 C   0  0  0

+   -2.6225   -3.4360    0.0000 H   0  0  0

+   -3.5323   -0.5791    0.0000 H   0  0  0

+   -4.5121   -1.3043    0.0000 H   0  0  0

+   -3.7869   -2.2841    0.0000 H   0  0  0

+    1.4991   -0.7398    0.0000 H   0  0  0

+    1.0066    0.3753    0.0000 H   0  0  0

+   -0.1085   -0.1172    0.0000 H   0  0  0

+   -0.8054    2.9167    0.0000 H   0  0  0

+   -1.5286    3.8981    0.0000 H   0  0  0

+   -2.5100    3.1749    0.0000 H   0  0  0

+    3.4991   -1.2482    0.0000 H   0  0  0

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+    5.1341   -0.7016    0.0000 H   0  0  0

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+    4.6342    1.7098    0.0000 H   0  0  0

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+    3.1450    2.1239    0.0000 H   0  0  0

+    2.6752    0.9991    0.0000 H   0  0  0

+  1  2  2  0

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+  6  9  2  0

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+ 20 35  1  0

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+ 20 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+ 21 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+591-27-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.0147   -0.9834    0.0000 C   0  0  0

+   -1.2344   -0.3210    0.0002 C   0  0  0

+    1.1656   -0.2567   -0.0002 C   0  0  0

+   -1.2683    1.0683    0.0001 C   0  0  0

+   -2.4259   -1.0496   -0.0001 N   0  0  0

+    1.1255    1.1305   -0.0002 C   0  0  0

+    2.3615   -0.9022    0.0001 O   0  0  0

+   -0.0899    1.7886    0.0000 C   0  0  0

+    0.0136   -2.0232    0.0000 H   0  0  0

+   -2.1817    1.5660    0.0000 H   0  0  0

+   -3.3396   -0.5524    0.0000 H   0  0  0

+   -2.3997   -2.0895    0.0000 H   0  0  0

+    2.0114    1.6757    0.0000 H   0  0  0

+    3.2769   -1.3963    0.0000 H   0  0  0

+   -0.1171    2.8284    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+59485-08-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -1.0111    0.5539    0.1107 C   0  0  0

+   -2.3449    0.8096    0.1587 O   0  0  0

+   -0.1084    1.5970   -0.0386 C   0  0  0

+   -0.5494   -0.7499    0.2166 C   0  0  0

+   -3.0016   -0.4498    0.3154 C   0  0  0

+    1.2468    1.3344   -0.0872 C   0  0  0

+    0.8072   -1.0073    0.1675 C   0  0  0

+   -4.5147   -0.2319    0.3768 C   0  0  0

+   -3.8545   -0.6852   -0.8067 O   0  0  0

+    1.7042    0.0332    0.0129 C   0  0  0

+    3.1568   -0.2454   -0.0399 N   0  3  0

+    3.5608   -1.3910    0.0481 O   0  0  0

+    3.9483    0.6711   -0.1714 O   0  5  0

+   -0.4466    2.5747    0.0000 H   0  0  0

+   -1.2229   -1.5351    0.0000 H   0  0  0

+   -2.3513   -1.2544    0.0000 H   0  0  0

+    1.9228    2.1175    0.0000 H   0  0  0

+    1.1482   -1.9840    0.0000 H   0  0  0

+   -4.7482    0.7759    0.0000 H   0  0  0

+   -5.3695   -0.8147    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89-63-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.7838    0.0744   -0.0019 C   0  0  0

+   -0.8646   -1.3090   -0.0935 C   0  0  0

+    0.4512    0.6907    0.0528 C   0  0  0

+   -2.0197    0.8880    0.0311 N   0  3  0

+    0.2976   -2.0691   -0.1300 C   0  0  0

+   -2.1126   -1.9352   -0.1485 N   0  0  0

+    1.6071   -0.0689    0.0162 C   0  0  0

+   -2.1852    1.7776   -0.7842 O   0  0  0

+   -2.8714    0.6679    0.8736 O   0  5  0

+    1.5295   -1.4477   -0.0751 C   0  0  0

+    3.1575    0.7091    0.0845 Cl  0  0  0

+    0.5126    1.7262    0.0000 H   0  0  0

+    0.2395   -3.1048    0.0000 H   0  0  0

+   -2.9791   -1.3648    0.0000 H   0  0  0

+   -2.1733   -2.9708    0.0000 H   0  0  0

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+  1  2  2  0

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+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60259-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    1.9918   -0.8526    0.0086 C   0  0  0

+    2.6473   -0.6208    1.2036 C   0  0  0

+    2.6486   -0.6496   -1.1905 C   0  0  0

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+    3.9593   -0.1861    1.1992 C   0  0  0

+    3.9610   -0.2148   -1.1949 C   0  0  0

+   -0.3395   -0.1787    0.0024 N   0  0  0

+    4.6163    0.0169   -0.0003 C   0  0  0

+   -1.7267   -0.3747    0.0046 N   0  0  0

+    6.0215    0.4819   -0.0050 N   0  3  0

+   -2.5216    0.6412   -0.0052 N   0  0  0

+    6.6002    0.6607   -1.0617 O   0  0  0

+    6.5991    0.6857    1.0478 O   0  5  0

+   -3.8802    0.4493   -0.0031 C   0  0  0

+   -4.7426    1.5459   -0.0136 C   0  0  0

+   -4.4052   -0.8437    0.0037 C   0  0  0

+   -6.1080    1.3461   -0.0119 C   0  0  0

+   -5.7721   -1.0299    0.0053 C   0  0  0

+   -6.6221    0.0620    0.0002 C   0  0  0

+   -8.1142   -0.1488    0.0024 C   0  0  0

+    2.3115    0.3599    0.0000 H   0  0  0

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+   -0.3201   -1.8749    0.0000 H   0  0  0

+    1.0024   -2.2715    0.0000 H   0  0  0

+    3.6433    0.8012    0.0000 H   0  0  0

+    4.2968   -1.1955    0.0000 H   0  0  0

+    0.0481    0.7827    0.0000 H   0  0  0

+   -4.3585    2.5087    0.0000 H   0  0  0

+   -3.7694   -1.6625    0.0000 H   0  0  0

+   -6.7498    2.1601    0.0000 H   0  0  0

+   -6.1633   -1.9899    0.0000 H   0  0  0

+   -8.2592    0.8776    0.0000 H   0  0  0

+   -9.1406   -0.2938    0.0000 H   0  0  0

+   -7.9692   -1.1752    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

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+  9 11  2  0

+ 10 12  2  0

+ 10 13  1  0

+ 11 14  1  0

+ 14 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 16 18  2  0

+ 17 19  2  0

+ 19 20  1  0

+  6  8  2  0

+ 18 19  1  0

+  2 21  1  0

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+  4 23  1  0

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+  5 25  1  0

+  6 26  1  0

+  7 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3585-32-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.0607   -0.2525    0.0000 N   0  0  0

+   -1.1683    0.4199    0.0000 N   0  0  0

+    1.1201    0.3920    0.0000 N   0  0  0

+   -2.4199   -0.3415    0.0000 C   0  0  0

+    2.4053   -0.3111    0.0000 C   0  0  0

+   -1.1930    1.4943    0.0000 H   0  0  0

+   -2.9784    0.5767    0.0000 H   0  0  0

+   -3.3381   -0.9000    0.0000 H   0  0  0

+   -1.8613   -1.2597    0.0000 H   0  0  0

+    1.8895   -1.2539    0.0000 H   0  0  0

+    3.3481   -0.8269    0.0000 H   0  0  0

+    2.9211    0.6317    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  3  5  1  0

+  2  6  1  0

+  4  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83-26-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -0.5626    0.0003    0.6287 C   0  0  0

+    0.3285   -1.2038    0.4366 C   0  0  0

+    0.3291    1.2040    0.4372 C   0  0  0

+   -1.6402    0.0008   -0.4248 C   0  0  0

+    1.6842   -0.7041    0.1452 C   0  0  0

+   -0.0087   -2.3660    0.5088 O   0  0  0

+    1.6845    0.7038    0.1455 C   0  0  0

+   -0.0076    2.3664    0.5097 O   0  0  0

+   -3.0914   -0.0004   -0.0183 C   0  0  0

+   -1.3409    0.0022   -1.5947 O   0  0  0

+    2.8731   -1.3917   -0.1104 C   0  0  0

+    2.8738    1.3910   -0.1097 C   0  0  0

+   -3.3892    1.2491    0.8129 C   0  0  0

+   -3.9715   -0.0021   -1.2697 C   0  0  0

+   -3.3866   -1.2493    0.8147 C   0  0  0

+    4.0381   -0.6925   -0.3604 C   0  0  0

+    4.0384    0.6914   -0.3600 C   0  0  0

+   -1.0239   -0.9145    0.0000 H   0  0  0

+    2.8814   -2.4162    0.0000 H   0  0  0

+    2.8825    2.4155    0.0000 H   0  0  0

+   -2.3926    1.4866    0.0000 H   0  0  0

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+   -3.9695   -1.0266    0.0000 H   0  0  0

+   -4.3837   -1.0136    0.0000 H   0  0  0

+   -3.6223   -2.2464    0.0000 H   0  0  0

+   -2.3895   -1.4850    0.0000 H   0  0  0

+    4.9296   -1.1973    0.0000 H   0  0  0

+    4.9302    1.1959    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

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+  9 13  1  0

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+ 11 16  2  0

+ 12 17  2  0

+  5  7  2  0

+ 16 17  1  0

+  1 18  1  0

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+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56980-96-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 48                          1 V2000

+   -0.8127   -0.3313   -0.2680 C   0  0  0

+   -2.0100   -1.0647   -0.2818 C   0  0  0

+   -0.8511    1.0524   -0.3533 C   0  0  0

+    0.3777   -0.9740   -0.1661 O   0  0  0

+   -3.2330   -0.3909   -0.3816 C   0  0  0

+   -1.9793   -2.5296   -0.1926 C   0  0  0

+   -2.0612    1.7082   -0.4513 C   0  0  0

+    1.3926    0.0320   -0.1791 C   0  0  0

+   -3.2526    0.9891   -0.4657 C   0  0  0

+   -3.2669   -3.3125   -0.2077 C   0  0  0

+   -0.9176   -3.1099   -0.1066 O   0  0  0

+    2.7677   -0.6294   -0.0666 C   0  0  0

+   -4.4761    1.6658   -0.5661 N   0  0  0

+    3.8543    0.4476   -0.0806 C   0  0  0

+    2.8431   -1.3663    1.1555 O   0  0  0

+   -5.4363    1.4627    0.3576 C   0  0  0

+    5.1745   -0.1874    0.0275 N   0  0  0

+   -6.6533    2.0193    0.1981 N   0  0  0

+   -5.2045    0.7774    1.3349 O   0  0  0

+    6.1667    0.8957    0.0084 C   0  0  0

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+    6.0440    1.6767   -1.3016 C   0  0  0

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+    0.5784    0.6850    0.0000 H   0  0  0

+   -3.8091   -2.4207    0.0000 H   0  0  0

+   -4.1587   -3.8547    0.0000 H   0  0  0

+   -2.7247   -4.2043    0.0000 H   0  0  0

+    3.7503   -0.9813    0.0000 H   0  0  0

+   -4.3218    2.6980    0.0000 H   0  0  0

+    4.4106    1.3307    0.0000 H   0  0  0

+    3.0401    1.1006    0.0000 H   0  0  0

+    2.9493   -2.4046    0.0000 H   0  0  0

+    5.3720   -1.2122    0.0000 H   0  0  0

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+    5.8820    2.7078    0.0000 H   0  0  0

+    5.0129    1.5147    0.0000 H   0  0  0

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+    5.6498    2.8458    0.0000 H   0  0  0

+    4.9083    1.5695    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  4  8  1  0

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+  7  9  1  0

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+ 22 44  1  0

+ 22 45  1  0

+ 23 46  1  0

+ 23 47  1  0

+ 23 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+144-80-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+    0.5127   -0.4691   -0.0709 C   0  0  0

+   -1.1628   -1.0050   -0.1719 S   0  0  0

+    1.3232   -0.9274    0.9517 C   0  0  0

+    1.0157    0.4043   -1.0175 C   0  0  0

+   -2.0783    0.0652    0.6994 N   0  0  0

+   -1.5448   -0.8246   -1.5286 O   0  0  0

+   -1.2194   -2.2322    0.5423 O   0  0  0

+    2.6367   -0.5095    1.0337 C   0  0  0

+    2.3287    0.8264   -0.9413 C   0  0  0

+   -2.1006    1.3683    0.3561 C   0  0  0

+    3.1438    0.3725    0.0876 C   0  0  0

+   -2.9337    2.3422    1.1490 C   0  0  0

+   -1.4503    1.7572   -0.5908 O   0  0  0

+    4.4718    0.7976    0.1679 N   0  0  0

+    1.2261   -1.8637    0.0000 H   0  0  0

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+   -2.9585   -0.2685    0.0000 H   0  0  0

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+   -2.2184    2.9541    0.0000 H   0  0  0

+   -3.5456    3.0575    0.0000 H   0  0  0

+   -3.6490    1.7303    0.0000 H   0  0  0

+    5.1686    0.1647    0.0000 H   0  0  0

+    4.6715    1.7175    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  2  0

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+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+70458-92-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    0.6139   -0.3586    0.0908 C   0  0  0

+    1.2508    0.8911   -0.0167 C   0  0  0

+    1.3606   -1.5136    0.1915 N   0  0  0

+   -0.7751   -0.4147    0.0885 C   0  0  0

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+    0.4947    2.0617   -0.1191 C   0  0  0

+    2.7001   -1.5131    0.1932 C   0  0  0

+    0.6593   -2.7951    0.3017 C   0  0  0

+   -1.5114    0.7537   -0.0190 C   0  0  0

+    3.4345   -0.3493    0.0926 C   0  0  0

+    3.3262    1.9896   -0.1102 O   0  0  0

+   -0.8693    1.9915   -0.1148 C   0  0  0

+    0.4287   -3.3722   -1.0964 C   0  0  0

+   -2.9029    0.6955   -0.0217 N   0  0  0

+    4.9034   -0.3905    0.0979 C   0  0  0

+   -1.6011    3.1228   -0.2133 F   0  0  0

+   -3.2999    0.0355    1.2281 C   0  0  0

+   -3.2855   -0.2026   -1.1181 C   0  0  0

+    5.6101    0.7534    0.0000 O   0  0  0

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+   -4.8145   -0.1745    1.2402 C   0  0  0

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+   -3.3293   -1.2356    0.0000 H   0  0  0

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+  1  2  2  0

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+ 22 40  1  0

+ 22 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68-89-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 39                          1 V2000

+   -2.3792   -0.1097   -0.3888 N   0  0  0

+   -3.3185    0.9176   -0.2555 C   0  0  0

+   -1.3834   -0.3929    0.4752 C   0  0  0

+   -2.3084   -1.0324   -1.4407 N   0  0  0

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+   -4.5216    0.6803    0.3963 C   0  0  0

+   -0.6692   -1.5057   -0.0388 C   0  0  0

+   -1.1408    0.2000    1.5110 O   0  0  0

+   -1.2495   -1.8746   -1.2004 C   0  0  0

+   -3.2074   -1.0898   -2.5959 C   0  0  0

+   -3.9822    3.1885   -0.6466 C   0  0  0

+   -5.4472    1.6973    0.5262 C   0  0  0

+    0.4499   -2.1212    0.5608 N   0  0  0

+   -0.8130   -3.0168   -2.0813 C   0  0  0

+   -5.1771    2.9504    0.0081 C   0  0  0

+    1.8035   -1.7143    0.1757 C   0  0  0

+    0.2582   -3.1672    1.5685 C   0  0  0

+    2.1735   -0.0897    0.8928 S   0  0  0

+    1.8886   -0.0544    2.2845 O   0  0  0

+    3.3661    0.4621    0.3520 O   0  0  0

+    1.0911    0.8038    0.3040 O   0  0  0

+   11.9980    1.7326   -1.2460 Na  0  3  0

+   -2.1270    2.4297    0.0000 H   0  0  0

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+   -3.2685   -0.1321    0.0000 H   0  0  0

+   -4.1651   -1.1509    0.0000 H   0  0  0

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+    1.2021   -3.3402    0.0000 H   0  0  0

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+  7  9  2  0

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+ 16 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 17 38  1  0

+ 21 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+72869-86-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+   -0.1624    0.6814   -1.0716 N   0  0  0

+    0.1625   -0.6814   -1.0716 N   0  0  0

+    0.6645    1.5713   -0.4880 C   0  0  0

+   -0.6645   -1.5713   -0.4880 C   0  0  0

+    1.8029    1.1507    0.0950 O   0  0  0

+    0.3828    2.7533   -0.4880 O   0  0  0

+   -1.8029   -1.1507    0.0950 O   0  0  0

+   -0.3828   -2.7533   -0.4881 O   0  0  0

+    2.6939    2.1094    0.7238 C   0  0  0

+   -2.6939   -2.1094    0.7237 C   0  0  0

+    3.9041    1.3758    1.3052 C   0  0  0

+   -3.9041   -1.3758    1.3051 C   0  0  0

+    4.6094    0.6858    0.2400 O   0  0  0

+   -4.6094   -0.6858    0.2399 O   0  0  0

+    5.7158   -0.0320    0.5188 C   0  0  0

+   -5.7158    0.0320    0.5188 C   0  0  0

+    6.4297   -0.7303   -0.5592 C   0  0  0

+    6.1229   -0.1018    1.6619 O   0  0  0

+   -6.4297    0.7304   -0.5592 C   0  0  0

+   -6.1229    0.1017    1.6619 O   0  0  0

+    5.9249   -0.6439   -1.9766 C   0  0  0

+    7.5219   -1.4391   -0.2839 C   0  0  0

+   -5.9249    0.6440   -1.9765 C   0  0  0

+   -7.5219    1.4391   -0.2839 C   0  0  0

+   -1.0435    0.9133    0.0000 H   0  0  0

+    1.0436   -0.9133    0.0000 H   0  0  0

+    3.2180    2.8547    0.0000 H   0  0  0

+    1.9859    2.6829    0.0000 H   0  0  0

+   -3.2180   -2.8547    0.0000 H   0  0  0

+   -1.9859   -2.6829    0.0000 H   0  0  0

+    4.7602    1.6876    0.0000 H   0  0  0

+    3.9931    2.2826    0.0000 H   0  0  0

+   -4.7602   -1.6876    0.0000 H   0  0  0

+   -3.9931   -2.2826    0.0000 H   0  0  0

+    6.0786    0.2542    0.0000 H   0  0  0

+    5.0268   -0.4902    0.0000 H   0  0  0

+    5.7712   -1.5420    0.0000 H   0  0  0

+    7.4745   -2.3490    0.0000 H   0  0  0

+    8.3336   -1.0252    0.0000 H   0  0  0

+   -6.0786   -0.2541    0.0000 H   0  0  0

+   -5.0268    0.4903    0.0000 H   0  0  0

+   -5.7712    1.5421    0.0000 H   0  0  0

+   -7.4746    2.3490    0.0000 H   0  0  0

+   -8.3336    1.0251    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  7 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+ 15 18  2  0

+ 16 19  1  0

+ 16 20  2  0

+ 17 21  1  0

+ 17 22  2  0

+ 19 23  1  0

+ 19 24  2  0

+  1 25  1  0

+  2 26  1  0

+  9 27  1  0

+  9 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+ 11 31  1  0

+ 11 32  1  0

+ 12 33  1  0

+ 12 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1649-18-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 48                          1 V2000

+   -4.2000   -0.3885   -0.6537 N   0  0  0

+   -5.4900    0.0345   -0.3553 C   0  0  0

+   -3.8836   -1.4721    0.2848 C   0  0  0

+   -3.3044    0.7293   -0.3317 C   0  0  0

+   -6.0652    1.0650   -1.0915 C   0  0  0

+   -6.1625   -0.5509    0.6239 N   0  0  0

+   -2.4298   -1.9073    0.0965 C   0  0  0

+   -1.8507    0.2942   -0.5200 C   0  0  0

+   -7.3498    1.4759   -0.7838 C   0  0  0

+   -7.3888   -0.1798    0.9392 C   0  0  0

+   -1.5343   -0.7895    0.4185 N   0  0  0

+   -8.0183    0.8400    0.2537 C   0  0  0

+   -0.1709   -1.2365    0.1031 C   0  0  0

+    0.8194   -0.1132    0.4169 C   0  0  0

+    2.2394   -0.5788    0.0884 C   0  0  0

+    3.2148    0.5276    0.3975 C   0  0  0

+    4.6526    0.3259    0.1659 C   0  0  0

+    2.8138    1.5843    0.8371 O   0  0  0

+    5.5612    1.3513    0.4519 C   0  0  0

+    5.1191   -0.8941   -0.3358 C   0  0  0

+    6.9068    1.1557    0.2332 C   0  0  0

+    6.4677   -1.0767   -0.5500 C   0  0  0

+    7.3623   -0.0546   -0.2695 C   0  0  0

+    8.6835   -0.2401   -0.4818 F   0  0  0

+   -4.8977   -1.5661    0.0000 H   0  0  0

+   -3.9845   -2.4856    0.0000 H   0  0  0

+   -2.8900    1.6596    0.0000 H   0  0  0

+   -4.1741    1.2593    0.0000 H   0  0  0

+   -5.4203    1.8533    0.0000 H   0  0  0

+   -2.8442   -2.8376    0.0000 H   0  0  0

+   -1.5601   -2.4372    0.0000 H   0  0  0

+   -0.8366    0.3882    0.0000 H   0  0  0

+   -1.7498    1.3077    0.0000 H   0  0  0

+   -7.5774    2.4686    0.0000 H   0  0  0

+   -8.0099   -0.9870    0.0000 H   0  0  0

+   -9.0283    0.9707    0.0000 H   0  0  0

+   -0.6158   -2.1527    0.0000 H   0  0  0

+    0.6769   -1.8009    0.0000 H   0  0  0

+    1.2643    0.8029    0.0000 H   0  0  0

+   -0.0284    0.4512    0.0000 H   0  0  0

+    1.7945   -1.4949    0.0000 H   0  0  0

+    3.0872   -1.1432    0.0000 H   0  0  0

+    5.2113    2.3078    0.0000 H   0  0  0

+    4.4866   -1.6923    0.0000 H   0  0  0

+    7.5453    1.9492    0.0000 H   0  0  0

+    6.8252   -2.0304    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  9 12  2  0

+ 11 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 16 18  2  0

+ 17 19  1  0

+ 17 20  2  0

+ 19 21  2  0

+ 20 22  1  0

+ 21 23  1  0

+ 23 24  1  0

+  8 11  1  0

+ 10 12  1  0

+ 22 23  2  0

+  3 25  1  0

+  3 26  1  0

+  4 27  1  0

+  4 28  1  0

+  5 29  1  0

+  7 30  1  0

+  7 31  1  0

+  8 32  1  0

+  8 33  1  0

+  9 34  1  0

+ 10 35  1  0

+ 12 36  1  0

+ 13 37  1  0

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+ 14 39  1  0

+ 14 40  1  0

+ 15 41  1  0

+ 15 42  1  0

+ 19 43  1  0

+ 20 44  1  0

+ 21 45  1  0

+ 22 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107-68-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.4619   -0.8157   -0.0090 C   0  0  0

+   -1.1129    0.0844    0.0010 S   0  0  0

+    1.6205    0.1834    0.0019 C   0  0  0

+   -1.3461    0.7179    1.2515 O   0  0  0

+   -1.3462    0.7451   -1.2353 O   0  0  0

+   -2.1494   -1.0300   -0.0111 O   0  0  0

+    2.8959   -0.5455   -0.0062 N   0  0  0

+    3.9606    0.4665    0.0048 C   0  0  0

+   -0.1895   -1.7043    0.0000 H   0  0  0

+    1.2711   -1.5634    0.0000 H   0  0  0

+    2.2718    1.0720    0.0000 H   0  0  0

+    0.8113    0.9310    0.0000 H   0  0  0

+   -2.8997   -1.8367    0.0000 H   0  0  0

+    3.0282   -1.6393    0.0000 H   0  0  0

+    4.7196   -0.3321    0.0000 H   0  0  0

+    4.7592    1.2255    0.0000 H   0  0  0

+    3.2016    1.2651    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  2  0

+  5  2  2  0

+  6  2  1  0

+  7  3  1  0

+  8  7  1  0

+  1  9  1  0

+  1 10  1  0

+  3 11  1  0

+  3 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+579-66-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+    1.2024    0.1841   -0.2330 C   0  0  0

+    0.0001   -0.5021   -0.3456 C   0  0  0

+    1.1994    1.5468   -0.0068 C   0  0  0

+    2.5086   -0.5580   -0.3513 C   0  0  0

+   -1.2018    0.1850   -0.2302 C   0  0  0

+   -0.0005   -1.8800   -0.5747 N   0  0  0

+    0.0014    2.2275    0.1075 C   0  0  0

+    3.0055   -0.9413    1.0441 C   0  0  0

+   -1.1976    1.5472   -0.0040 C   0  0  0

+   -2.5088   -0.5554   -0.3521 C   0  0  0

+   -3.0085   -0.9407    1.0417 C   0  0  0

+    2.0920    2.0676    0.0000 H   0  0  0

+    3.4449   -0.1207    0.0000 H   0  0  0

+    2.5498    0.4746    0.0000 H   0  0  0

+   -0.8957   -2.3963    0.0000 H   0  0  0

+    0.8942   -2.3971    0.0000 H   0  0  0

+    0.0017    3.2609    0.0000 H   0  0  0

+    2.3743   -1.7596    0.0000 H   0  0  0

+    3.8238   -1.5725    0.0000 H   0  0  0

+    3.6367   -0.1230    0.0000 H   0  0  0

+   -2.0898    2.0686    0.0000 H   0  0  0

+   -2.5491    0.4772    0.0000 H   0  0  0

+   -3.4449   -0.1176    0.0000 H   0  0  0

+   -3.6395   -0.1223    0.0000 H   0  0  0

+   -3.8269   -1.5717    0.0000 H   0  0  0

+   -2.3775   -1.7591    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+ 10 11  1  0

+  7  9  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+612-24-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.4325    0.8414    0.0027 C   0  0  0

+    0.1368   -0.5231    0.0003 C   0  0  0

+    1.7646    1.2606    0.0027 C   0  0  0

+   -0.6253    1.8066   -0.0009 C   0  0  0

+    1.1608   -1.4476   -0.0020 C   0  0  0

+   -1.2721   -0.9767    0.0007 N   0  3  0

+    2.7785    0.3255    0.0004 C   0  0  0

+   -1.4644    2.5723   -0.0037 N   0  0  0

+    2.4782   -1.0253   -0.0019 C   0  0  0

+   -1.5285   -2.1674   -0.0014 O   0  0  0

+   -2.1750   -0.1593    0.0031 O   0  5  0

+    1.9911    2.2732    0.0000 H   0  0  0

+    0.9424   -2.4619    0.0000 H   0  0  0

+    3.7686    0.6356    0.0000 H   0  0  0

+    3.2446   -1.7247    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  3  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7  9  1  0

+  3 12  1  0

+  5 13  1  0

+  7 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4539-51-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    0.3298   -0.5343   -0.0011 C   0  0  0

+   -1.1441   -0.4856   -0.0006 C   0  0  0

+    0.7720    0.7974   -0.0004 C   0  0  0

+    1.2530   -1.5784    0.0029 C   0  0  0

+   -1.4976    0.8718    0.0004 C   0  0  0

+   -2.1352   -1.4643   -0.0014 C   0  0  0

+   -0.3366    1.6253    0.0005 N   0  0  0

+    2.1368    1.0635   -0.0003 C   0  0  0

+    2.6015   -1.3018    0.0011 C   0  0  0

+   -2.8433    1.2256    0.0010 C   0  0  0

+   -3.4629   -1.0942   -0.0011 C   0  0  0

+    3.0456    0.0187   -0.0009 C   0  0  0

+   -3.8140    0.2470    0.0007 C   0  0  0

+    4.4156    0.2903   -0.0007 N   0  0  0

+    0.9226   -2.5679    0.0000 H   0  0  0

+   -1.8734   -2.4742    0.0000 H   0  0  0

+   -0.3023    2.6680    0.0000 H   0  0  0

+    2.4760    2.0500    0.0000 H   0  0  0

+    3.2928   -2.0831    0.0000 H   0  0  0

+   -3.1177    2.2321    0.0000 H   0  0  0

+   -4.2064   -1.8260    0.0000 H   0  0  0

+   -4.8214    0.5179    0.0000 H   0  0  0

+    5.1029   -0.4945    0.0000 H   0  0  0

+    4.7516    1.2779    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+ 10 13  2  0

+ 12 14  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4403-61-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+   -0.0999    0.1863    0.0016 C   0  0  0

+   -0.9855   -0.8067   -0.0010 C   0  0  0

+    1.3022   -0.1048    0.0004 C   0  0  0

+   -0.5724    1.6173   -0.0007 C   0  0  0

+   -2.4610   -0.5004    0.0002 C   0  0  0

+    2.4145   -0.3357   -0.0005 N   0  0  0

+   -0.6488   -1.8265    0.0000 H   0  0  0

+    0.4474    1.9540    0.0000 H   0  0  0

+   -0.9091    2.6371    0.0000 H   0  0  0

+   -1.5922    1.2806    0.0000 H   0  0  0

+   -2.2427    0.5512    0.0000 H   0  0  0

+   -3.5126   -0.2821    0.0000 H   0  0  0

+   -2.6793   -1.5520    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  3  0

+  2  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110021-94-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 48                          1 V2000

+    1.7645    0.9274   -0.7272 C   0  0  0

+    2.3731   -0.2787   -0.2992 C   0  0  0

+    2.3398    2.1425   -0.2908 C   0  0  0

+    0.6604    0.9161   -1.5401 N   0  0  0

+    3.5568   -0.2073    0.5657 C   0  0  0

+    1.8671   -1.5148   -0.6858 C   0  0  0

+    3.4850    2.1210    0.5448 C   0  0  0

+    1.7848    3.3723   -0.6788 C   0  0  0

+   -0.6195    0.8941   -0.9799 C   0  0  0

+    4.0399    0.9697    0.9337 N   0  0  0

+    4.1761   -1.4067    1.0016 C   0  0  0

+    2.5045   -2.6933   -0.2370 C   0  0  0

+    4.0397    3.3446    0.9667 C   0  0  0

+    2.3509    4.5360   -0.2493 C   0  0  0

+   -1.7389    0.8827   -1.8040 C   0  0  0

+   -0.7735    0.8780    0.4011 C   0  0  0

+    3.6836   -2.6047    0.6259 C   0  0  0

+    2.0341   -3.8794   -0.5969 N   0  0  0

+    3.4754    4.5196    0.5713 C   0  0  0

+   -3.0027    0.8610   -1.2506 C   0  0  0

+   -2.0379    0.8563    0.9542 C   0  0  0

+    2.5411   -4.8169   -0.2400 N   0  3  0

+   -3.1565    0.8507    0.1305 C   0  0  0

+    3.0481   -5.7545    0.1170 N   0  5  0

+   -4.4372    0.8287    0.6911 N   0  0  0

+   -5.4595   -0.4343    0.3713 S   0  0  0

+   -4.6682   -1.8306    1.2166 C   0  0  0

+   -6.6598   -0.0405    1.0219 O   0  0  0

+   -5.3726   -0.5600   -1.0415 O   0  0  0

+    0.6473    1.8716    0.0000 H   0  0  0

+    0.9129   -1.5660    0.0000 H   0  0  0

+    0.8293    3.3861    0.0000 H   0  0  0

+    5.1308   -1.3653    0.0000 H   0  0  0

+    4.9952    3.3552    0.0000 H   0  0  0

+    1.8500    5.3498    0.0000 H   0  0  0

+   -1.7520    1.8382    0.0000 H   0  0  0

+   -0.7156   -0.0758    0.0000 H   0  0  0

+    4.2449   -3.3780    0.0000 H   0  0  0

+    3.9901    5.3247    0.0000 H   0  0  0

+   -3.0428    1.8158    0.0000 H   0  0  0

+   -2.0273   -0.0992    0.0000 H   0  0  0

+   -4.8561    1.6876    0.0000 H   0  0  0

+   -5.4996   -2.3018    0.0000 H   0  0  0

+   -4.1970   -2.6620    0.0000 H   0  0  0

+   -3.8368   -1.3594    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+  9 16  2  0

+ 11 17  2  0

+ 12 18  1  0

+ 13 19  2  0

+ 15 20  2  0

+ 16 21  1  0

+ 18 22  2  0

+ 20 23  1  0

+ 22 24  2  0

+ 23 25  1  0

+ 25 26  1  0

+ 26 27  1  0

+ 26 28  2  0

+ 26 29  2  0

+  7 10  2  0

+ 12 17  1  0

+ 14 19  1  0

+ 21 23  2  0

+  4 30  1  0

+  6 31  1  0

+  8 32  1  0

+ 11 33  1  0

+ 13 34  1  0

+ 14 35  1  0

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+ 20 40  1  0

+ 21 41  1  0

+ 25 42  1  0

+ 27 43  1  0

+ 27 44  1  0

+ 27 45  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85-22-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.0004   -1.7564    0.0936 C   0  0  0

+   -1.1980   -1.0653    0.0709 C   0  0  0

+    1.1978   -1.0656    0.0701 C   0  0  0

+   -0.0008   -3.2623    0.1502 C   0  0  0

+   -1.1981    0.3182    0.0242 C   0  0  0

+   -2.8356   -2.0103    0.1030 Br  0  0  0

+    1.1985    0.3174    0.0244 C   0  0  0

+    2.8350   -2.0114    0.1011 Br  0  0  0

+   -0.0048   -3.8261   -1.2721 C   0  0  0

+    0.0002    1.0095    0.0008 C   0  0  0

+   -2.8358    1.2631   -0.0081 Br  0  0  0

+    2.8366    1.2617   -0.0065 Br  0  0  0

+    0.0006    2.8994   -0.0636 Br  0  0  0

+    0.8955   -3.7856    0.0000 H   0  0  0

+    0.8993   -2.7457    0.0000 H   0  0  0

+   -1.0426   -3.8187    0.0000 H   0  0  0

+   -0.0122   -4.8639    0.0000 H   0  0  0

+    1.0330   -3.8335    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

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+  3  8  1  0

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+  5 11  1  0

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+ 10 13  1  0

+  7 10  1  0

+  4 14  1  0

+  4 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+599-79-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+   -2.7934    1.2323    0.3225 C   0  0  0

+   -4.5228    1.1936    0.6573 S   0  0  0

+   -2.2788    2.1909   -0.5330 C   0  0  0

+   -1.9555    0.3077    0.9207 C   0  0  0

+   -5.2238    0.2061   -0.4723 N   0  0  0

+   -4.6606    0.5177    1.8997 O   0  0  0

+   -5.0000    2.5021    0.3755 O   0  0  0

+   -0.9264    2.2277   -0.7994 C   0  0  0

+   -0.6005    0.3322    0.6637 C   0  0  0

+   -4.8385   -1.1262   -0.5655 C   0  0  0

+   -0.0746    1.2937   -0.2030 C   0  0  0

+   -5.4313   -1.9502   -1.5166 C   0  0  0

+   -3.9066   -1.5984    0.2482 N   0  0  0

+    1.2674    1.3240   -0.4625 N   0  0  0

+   -5.0384   -3.2741   -1.5984 C   0  0  0

+   -3.5123   -2.8563    0.1927 C   0  0  0

+    2.0507    0.4605    0.0896 N   0  0  0

+   -4.0623   -3.7310   -0.7231 C   0  0  0

+    3.3912    0.4908   -0.1695 C   0  0  0

+    4.2382   -0.4426    0.4272 C   0  0  0

+    3.9150    1.4557   -1.0391 C   0  0  0

+    5.6051   -0.4064    0.1588 C   0  0  0

+    5.2656    1.4906   -1.3036 C   0  0  0

+    6.1192    0.5694   -0.7102 C   0  0  0

+    6.5083   -1.3894    0.7847 C   0  0  0

+    7.4479    0.6089   -0.9746 O   0  0  0

+    6.0364   -2.2397    1.7174 O   0  0  0

+    7.6782   -1.4329    0.4594 O   0  0  0

+   -2.7742    2.9940    0.0000 H   0  0  0

+   -2.3301   -0.5584    0.0000 H   0  0  0

+   -6.1541    0.3638    0.0000 H   0  0  0

+   -0.5571    3.0961    0.0000 H   0  0  0

+   -0.1120   -0.4751    0.0000 H   0  0  0

+   -6.3617   -1.7928    0.0000 H   0  0  0

+   -5.7535   -3.8897    0.0000 H   0  0  0

+   -2.5765   -2.9775    0.0000 H   0  0  0

+   -3.7962   -4.6363    0.0000 H   0  0  0

+    3.8675   -1.3104    0.0000 H   0  0  0

+    3.4221    2.2603    0.0000 H   0  0  0

+    5.6320    2.3602    0.0000 H   0  0  0

+    8.3911    0.6369    0.0000 H   0  0  0

+    5.5785   -3.0648    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 18  1  0

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+ 18 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 23 40  1  0

+ 26 41  1  0

+ 27 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+116-85-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.9310    0.7465    0.0468 C   0  0  0

+   -0.9597   -0.6649    0.0469 C   0  0  0

+    0.3545    1.4504    0.1907 C   0  0  0

+   -2.1229    1.4624   -0.0957 C   0  0  0

+    0.2980   -1.4204    0.1905 C   0  0  0

+   -2.1775   -1.3313   -0.0899 C   0  0  0

+    1.6147    0.6931    0.0264 C   0  0  0

+    0.3799    2.6401    0.4413 O   0  0  0

+   -3.3320    0.7749   -0.2368 C   0  0  0

+   -2.1061    2.8489   -0.0975 N   0  0  0

+    1.5870   -0.7135    0.0263 C   0  0  0

+    0.2761   -2.6099    0.4413 O   0  0  0

+   -3.3584   -0.5997   -0.2265 C   0  0  0

+   -2.2140   -2.6868   -0.0906 O   0  0  0

+    2.8260    1.3592   -0.1286 C   0  0  0

+    2.7713   -1.4269   -0.1285 C   0  0  0

+    3.9948    0.6345   -0.2812 C   0  0  0

+    3.9675   -0.7486   -0.2818 C   0  0  0

+   -4.2264    1.3068    0.0000 H   0  0  0

+   -1.1987    3.3582    0.0000 H   0  0  0

+   -3.0009    3.3801    0.0000 H   0  0  0

+   -4.2723   -1.0972    0.0000 H   0  0  0

+   -2.2420   -3.7270    0.0000 H   0  0  0

+    2.8532    2.3994    0.0000 H   0  0  0

+    2.7576   -2.4674    0.0000 H   0  0  0

+    4.9090    1.1316    0.0000 H   0  0  0

+    4.8614   -1.2812    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-88-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.1859   -0.0636   -0.5307 C   0  0  0

+   -1.4839   -0.6779   -0.0027 C   0  0  0

+   -1.1675    0.7053    0.1674 O   0  0  0

+    0.9636   -0.4062    0.4191 C   0  0  0

+    2.2616    0.2081   -0.1088 C   0  0  0

+    0.3028    0.8818    0.0000 H   0  0  0

+   -2.5481   -0.6752    0.0000 H   0  0  0

+   -1.2519   -1.7165    0.0000 H   0  0  0

+    0.3899   -1.3025    0.0000 H   0  0  0

+    1.6667   -1.2050    0.0000 H   0  0  0

+    2.7168   -0.7538    0.0000 H   0  0  0

+    3.2235    0.6633    0.0000 H   0  0  0

+    1.8064    1.1700    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

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+  1  6  1  0

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+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5857-92-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    1.8019    0.6002   -0.0068 C   0  0  0

+    0.4295    0.8186   -0.1217 N   0  0  0

+    2.4153   -0.3874   -0.7674 C   0  0  0

+    2.5596    1.3745    0.8651 C   0  0  0

+   -0.4025   -0.0862    0.2695 N   0  3  0

+    3.7809   -0.6010   -0.6496 C   0  0  0

+    3.9192    1.1584    0.9793 C   0  0  0

+   -1.7266    0.0813    0.0665 C   0  0  0

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+    4.4015   -1.5932   -1.4121 N   0  0  0

+   -2.6342   -0.8997    0.4902 C   0  0  0

+   -2.2024    1.2411   -0.5647 C   0  0  0

+    6.0145   -0.0587    0.3566 C   0  0  0

+   -3.9903   -0.7177    0.2769 C   0  0  0

+   -3.5548    1.4068   -0.7693 C   0  0  0

+   -4.4480    0.4343   -0.3548 C   0  0  0

+   -4.8997   -1.6917    0.6968 N   0  0  0

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+   -1.5990    2.0321    0.0000 H   0  0  0

+    5.8610   -1.0417    0.0000 H   0  0  0

+    6.9975   -0.2122    0.0000 H   0  0  0

+    6.1680    0.9243    0.0000 H   0  0  0

+   -3.8987    2.3403    0.0000 H   0  0  0

+   -5.8689   -1.4673    0.0000 H   0  0  0

+   -4.6094   -2.6433    0.0000 H   0  0  0

+   -5.7964    1.6134    0.0000 H   0  0  0

+   -6.9115    0.7555    0.0000 H   0  0  0

+   -6.0536   -0.3596    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99520-59-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 40                          1 V2000

+    0.0422   -0.3491   -0.0012 C   0  0  0

+   -1.2921   -0.7131   -0.0011 C   0  0  0

+    0.4983    1.0301   -0.0007 C   0  0  0

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+    5.9635   -0.1740    0.0017 O   0  0  0

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+    1.5007   -3.3361    0.0000 H   0  0  0

+   -0.8050   -4.0316    0.0000 H   0  0  0

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+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4559-64-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.2728    0.6619   -0.0048 C   0  0  0

+   -1.4507   -0.7968   -0.0015 C   0  0  0

+   -0.0519    1.1861   -0.0052 N   0  0  0

+   -2.4159    1.4877   -0.0017 C   0  0  0

+   -0.3917   -1.5991    0.0012 N   0  0  0

+   -2.7589   -1.3238   -0.0006 C   0  0  0

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+   -4.7794    1.7467    0.0078 N   0  0  0

+    1.9761   -1.8969    0.0031 C   0  0  0

+   -5.1155   -1.0071   -0.0021 N   0  0  0

+    3.3793    0.0563    0.0009 C   0  0  0

+    3.2096   -1.3297    0.0022 C   0  0  0

+    4.9867    0.7119    0.0010 Cl  0  0  0

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+ 13 23  1  0

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+ 14 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141-38-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 79 79                          1 V2000

+   -4.4892   -0.2001    0.7539 C   0  0  0

+   -5.7577   -0.7189    0.0738 C   0  0  0

+   -5.2094   -1.3341    1.2413 O   0  0  0

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+ 29 78  1  0

+ 29 79  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+505-60-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.0000   -0.9740    0.0000 S   0  0  0

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+  5 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3025-77-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    2.8745   -0.4033   -0.1616 C   0  0  0

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+ 15 31  1  0

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+ 17 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146177-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+    0.5072   -0.7146   -0.0015 C   0  0  0

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+ 17 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68-04-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 20                          1 V2000

+   -5.5736    0.2857    0.2135 C   0  0  0

+   -6.4732    1.2579    0.9793 C   0  0  0

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+   -7.7193    1.2309   -1.0352 O   0  0  0

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+   -3.7969   -1.4106   -0.7979 O   0  0  0

+    6.7666   -0.2748    0.2486 Na  0  3  0

+   15.4161    0.0963    0.0305 Na  0  3  0

+   24.0657    0.4674   -0.1875 Na  0  3  0

+   -5.6913    1.5724    0.0000 H   0  0  0

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+  9 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60504-57-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 80                          1 V2000

+   -0.4957    1.6694   -0.3017 C   0  0  0

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+ 41 75  1  0

+ 41 76  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+119-61-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.0375   -1.0844   -0.0527 C   0  0  0

+   -0.0791   -2.2975   -0.1165 O   0  0  0

+    1.2664   -0.3899   -0.0352 C   0  0  0

+   -1.2909   -0.3040    0.0011 C   0  0  0

+    2.0392   -0.3777    1.1281 C   0  0  0

+    1.7347    0.2528   -1.1838 C   0  0  0

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+   -1.2503    1.0744    0.2248 C   0  0  0

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+    2.9526    0.8991   -1.1603 C   0  0  0

+   -3.6884   -0.2071   -0.1137 C   0  0  0

+   -2.4241    1.7964    0.2743 C   0  0  0

+    3.7106    0.9120   -0.0022 C   0  0  0

+   -3.6405    1.1586    0.1030 C   0  0  0

+    2.2983   -1.3783    0.0000 H   0  0  0

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+   -4.6019   -0.6906    0.0000 H   0  0  0

+   -2.3887    2.8293    0.0000 H   0  0  0

+    4.6251    1.3935    0.0000 H   0  0  0

+   -4.5154    1.7089    0.0000 H   0  0  0

+  2  1  2  0

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+ 13 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7390-93-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 47                          1 V2000

+    0.7503    0.7476    0.1897 C   0  0  0

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+   -1.6102   -2.1325    0.3386 C   0  0  0

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+    4.1352    2.3583    0.2870 C   0  0  0

+   -3.4218    0.0667   -0.0893 C   0  0  0

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+ 24 42  1  0

+ 25 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-64-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.0000    0.0971    0.0000 C   0  0  0

+   -1.2492    0.9804    0.0000 C   0  0  0

+    1.2492    0.9804    0.0000 C   0  0  0

+   -2.8545   -0.1547    0.0000 Br  0  0  0

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+   -0.8731   -0.8809    0.0000 H   0  0  0

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+   -0.3761    1.9584    0.0000 H   0  0  0

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+  1  2  1  0

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+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14882-94-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 52                          1 V2000

+   -1.0634    0.9607    0.0075 C   0  0  0

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+    0.1068    1.6756   -0.2257 C   0  0  0

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+ 25 48  1  0

+ 26 49  1  0

+ 26 50  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+79660-72-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    0.7020    0.0285    0.1291 C   0  0  0

+    1.3622   -1.1987   -0.0630 C   0  0  0

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+   -1.4033   -1.1172   -0.0476 C   0  0  0

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+   -2.7976   -1.0872   -0.0411 N   0  0  0

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+ 24 41  1  0

+ 26 42  1  0

+ 26 43  1  0

+ 26 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88598-57-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+    0.5450   -0.0156   -0.0001 C   0  0  0

+   -0.7500    0.5316    0.0114 C   0  0  0

+    1.6673    0.8375    0.0074 C   0  0  0

+    0.7139   -1.4180   -0.0250 C   0  0  0

+   -1.8726   -0.3264    0.0030 C   0  0  0

+   -0.9154    1.9346    0.0307 C   0  0  0

+    2.9564    0.2807   -0.0053 C   0  0  0

+    1.4741    2.2412    0.0272 C   0  0  0

+    2.0085   -1.9325   -0.0353 C   0  0  0

+   -0.4291   -2.2546   -0.0381 C   0  0  0

+   -3.1504    0.2379    0.0143 C   0  0  0

+   -1.6750   -1.7287   -0.0169 C   0  0  0

+    0.2288    2.7691    0.0383 C   0  0  0

+   -2.2104    2.4592    0.0413 C   0  0  0

+    3.1128   -1.0874   -0.0207 C   0  0  0

+    4.1241    1.2328   -0.0094 C   0  0  0

+   -3.3012    1.6114    0.0326 C   0  0  0

+   -4.3449   -0.6369    0.0061 N   0  3  0

+    4.4718   -1.7418   -0.0242 C   0  0  0

+    5.4067    0.5157    0.4056 C   0  0  0

+   -5.2659   -0.4028   -0.7558 O   0  0  0

+   -4.4066   -1.5905    0.7613 O   0  5  0

+    5.5491   -0.7481   -0.4511 C   0  0  0

+    2.3114    2.8821    0.0000 H   0  0  0

+    2.1530   -2.9770    0.0000 H   0  0  0

+   -0.3068   -3.3019    0.0000 H   0  0  0

+   -2.5107   -2.3716    0.0000 H   0  0  0

+    0.1082    3.8166    0.0000 H   0  0  0

+   -2.3553    3.5036    0.0000 H   0  0  0

+    4.7499    2.0814    0.0000 H   0  0  0

+    3.3606    1.9600    0.0000 H   0  0  0

+   -4.2722    2.0224    0.0000 H   0  0  0

+    3.8989   -2.6270    0.0000 H   0  0  0

+    5.2782   -2.4211    0.0000 H   0  0  0

+    6.4563    0.4155    0.0000 H   0  0  0

+    5.7208    1.5222    0.0000 H   0  0  0

+    6.0859   -1.6556    0.0000 H   0  0  0

+    6.5489   -0.4133    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+ 19 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 23 37  1  0

+ 23 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142438-57-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.3296    0.1607   -0.2974 C   0  0  0

+    0.6600   -0.9959   -0.0684 C   0  0  0

+    0.1639   -0.6519   -1.3638 O   0  0  0

+    0.4787    1.4223   -0.1282 C   0  0  0

+   -1.7754    0.1379    0.1271 C   0  0  0

+    1.9924   -0.2889    0.2298 C   0  0  0

+    0.3237   -2.3101    0.6393 C   0  0  0

+    1.7475    1.1369    0.1616 O   0  0  0

+    0.0357    2.5409   -0.2400 O   0  0  0

+   -2.6025   -0.8015   -0.3578 O   0  0  0

+   -2.1901    0.9652    0.9039 O   0  0  0

+    2.4800   -0.6668    1.6299 C   0  0  0

+    2.9699   -0.6642   -0.7427 O   0  0  0

+   -3.9955   -0.8236    0.0512 C   0  0  0

+   -0.6212   -2.0683    0.0000 H   0  0  0

+    0.0819   -3.2550    0.0000 H   0  0  0

+    1.2686   -2.5519    0.0000 H   0  0  0

+    1.8825   -1.4377    0.0000 H   0  0  0

+    3.2509   -1.2643    0.0000 H   0  0  0

+    3.0775    0.1041    0.0000 H   0  0  0

+    3.8805   -1.0138    0.0000 H   0  0  0

+   -4.0110    0.1517    0.0000 H   0  0  0

+   -4.9708   -0.8391    0.0000 H   0  0  0

+   -3.9800   -1.7989    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  2  7  1  0

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+ 12 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105467-67-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.8494    0.1390   -0.0036 C   0  0  0

+   -2.1391   -0.5601   -0.0031 C   0  0  0

+   -0.8368    1.5571    0.0002 C   0  0  0

+    0.3536   -0.5617   -0.0019 C   0  0  0

+   -3.3252    0.2066    0.0011 C   0  0  0

+   -2.2119   -1.9534   -0.0063 C   0  0  0

+    0.3159    2.2183    0.0003 N   0  0  0

+   -2.0659    2.2627    0.0044 C   0  0  0

+    1.5387    0.1720   -0.0020 C   0  0  0

+   -3.2493    1.6186    0.0053 C   0  0  0

+   -4.5679   -0.4508    0.0016 C   0  0  0

+   -3.4400   -2.5757   -0.0053 C   0  0  0

+    1.4877    1.5885   -0.0035 C   0  0  0

+    2.8416   -0.5016    0.0004 C   0  0  0

+   -4.6111   -1.8304   -0.0021 C   0  0  0

+   -5.7201    0.2678    0.0061 O   0  0  0

+    2.6906    2.3387   -0.0033 C   0  0  0

+    4.0138    0.2869    0.0008 C   0  0  0

+    2.9454   -1.8932    0.0027 C   0  0  0

+    3.8984    1.7411   -0.0071 C   0  0  0

+    5.2643   -0.3431    0.0030 C   0  0  0

+    4.1798   -2.4794    0.0053 C   0  0  0

+    5.3343   -1.7065    0.0048 C   0  0  0

+    0.3677   -1.6080    0.0000 H   0  0  0

+   -1.3349   -2.5242    0.0000 H   0  0  0

+   -2.0540    3.3090    0.0000 H   0  0  0

+   -4.1342    2.1771    0.0000 H   0  0  0

+   -3.4911   -3.6209    0.0000 H   0  0  0

+   -5.5362   -2.3195    0.0000 H   0  0  0

+   -6.6080    0.8215    0.0000 H   0  0  0

+    2.6393    3.3838    0.0000 H   0  0  0

+    2.0823   -2.4849    0.0000 H   0  0  0

+    4.7648    2.3278    0.0000 H   0  0  0

+    6.1409    0.2283    0.0000 H   0  0  0

+    4.2564   -3.5230    0.0000 H   0  0  0

+    6.2697   -2.1755    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57-27-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 44                          1 V2000

+    0.4986    0.7556   -0.7284 C   0  0  2

+   -0.1998   -0.4052   -0.0647 C   0  0  0

+    1.5459    1.2744    0.2293 C   0  0  2

+   -0.6911    1.6558   -1.0332 C   0  0  1

+    1.2077    0.2294   -1.9800 C   0  0  0

+   -1.5055   -0.4150   -0.5400 C   0  0  0

+    0.3193   -1.2475    0.8882 C   0  0  0

+    2.4276    0.1075    0.6472 C   0  0  1

+    0.9698    2.0526    1.3532 C   0  0  0

+   -1.7014    0.6353   -1.3702 O   0  0  0

+   -1.2468    2.2766    0.2536 C   0  0  2

+    2.1461   -0.8946   -1.5131 C   0  0  0

+   -2.3541   -1.4265   -0.0806 C   0  0  0

+    1.7118   -1.0145    1.3779 C   0  0  0

+   -0.5299   -2.2459    1.3314 C   0  0  0

+    3.1227   -0.4048   -0.5416 N   0  0  0

+   -0.2442    2.5043    1.3247 C   0  0  0

+   -2.3054    1.4599    0.7579 O   0  0  0

+   -1.8250   -2.3245    0.8449 C   0  0  0

+   -3.6382   -1.5294   -0.5167 O   0  0  0

+    3.9040   -1.5696   -0.1045 C   0  0  0

+    2.3252    1.8572    0.0000 H   0  0  0

+   -0.0319    2.3716    0.0000 H   0  0  0

+    2.1503    0.4711    0.0000 H   0  0  0

+    1.3950    1.1843    0.0000 H   0  0  0

+    3.1116    0.7997    0.0000 H   0  0  0

+    1.5547    2.8303    0.0000 H   0  0  0

+   -1.6615    3.1569    0.0000 H   0  0  0

+    1.3534   -1.4590    0.0000 H   0  0  0

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+    1.6352   -1.9846    0.0000 H   0  0  0

+    2.6345   -1.3237    0.0000 H   0  0  0

+   -0.0950   -3.1164    0.0000 H   0  0  0

+   -0.1796    3.4753    0.0000 H   0  0  0

+   -3.0759    0.8655    0.0000 H   0  0  0

+   -2.2820   -3.1836    0.0000 H   0  0  0

+   -4.6082   -1.6071    0.0000 H   0  0  0

+    3.0959   -2.1117    0.0000 H   0  0  0

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+    4.7121   -1.0275    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+ 21 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88-17-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.3143   -0.1833   -0.0004 C   0  0  0

+   -1.8159   -1.4892   -0.0019 F   0  0  0

+   -1.7635    0.4902   -1.1414 F   0  0  0

+   -1.7619    0.4869    1.1431 F   0  0  0

+    0.1922   -0.2238   -0.0015 C   0  0  0

+    0.9195    0.9594   -0.0003 C   0  0  0

+    0.8512   -1.4377    0.0021 C   0  0  0

+    0.2564    2.1887    0.0019 N   0  0  0

+    2.3082    0.9175   -0.0008 C   0  0  0

+    2.2333   -1.4758    0.0016 C   0  0  0

+    2.9607   -0.2994   -0.0025 C   0  0  0

+    0.3086   -2.3218    0.0000 H   0  0  0

+    0.8008    3.0717    0.0000 H   0  0  0

+   -0.7805    2.2187    0.0000 H   0  0  0

+    2.8543    1.7995    0.0000 H   0  0  0

+    2.7258   -2.3888    0.0000 H   0  0  0

+    3.9976   -0.3313    0.0000 H   0  0  0

+  2  1  1  0

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+  7 12  1  0

+  8 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+148-65-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 38                          1 V2000

+   -1.1976    0.1614    0.4582 N   0  0  0

+   -1.3862   -1.1793    0.1431 C   0  0  0

+   -0.2455    0.5409    1.5050 C   0  0  0

+   -1.9463    1.1952   -0.2608 C   0  0  0

+   -0.6433   -1.7578   -0.8807 C   0  0  0

+   -2.2677   -1.8956    0.8239 N   0  0  0

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+   -3.3563    1.3029    0.3234 C   0  0  0

+   -0.8412   -3.0931   -1.1837 C   0  0  0

+   -2.4771   -3.1707    0.5568 C   0  0  0

+    1.6557    1.8891    0.3887 C   0  0  0

+    2.4358   -0.4234    0.6529 S   0  0  0

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+    2.9377    1.8498   -0.1279 C   0  0  0

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+   -4.2859    1.8524   -1.7718 C   0  0  0

+   -5.4440    2.3914    0.2092 C   0  0  0

+    5.2208    0.3324   -0.6803 Cl  0  0  0

+    0.0341    1.4651    0.0000 H   0  0  0

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+   -2.0983    2.1487    0.0000 H   0  0  0

+    0.2530   -1.3987    0.0000 H   0  0  0

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+   -3.2043    0.3494    0.0000 H   0  0  0

+   -0.0098   -3.5841    0.0000 H   0  0  0

+   -3.3891   -3.4876    0.0000 H   0  0  0

+    1.1527    2.7133    0.0000 H   0  0  0

+   -1.8214   -4.7718    0.0000 H   0  0  0

+    3.4329    2.6787    0.0000 H   0  0  0

+   -5.1923    2.1851    0.0000 H   0  0  0

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+   -3.3795    1.5197    0.0000 H   0  0  0

+   -5.4065    3.3562    0.0000 H   0  0  0

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+  1  2  1  0

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+ 17 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99601-31-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.2959   -0.4403   -0.0700 C   0  0  0

+   -1.1325   -0.1385   -0.0169 C   0  0  0

+    1.2024    0.6181   -0.1730 C   0  0  0

+    1.0122   -1.5873   -0.0468 N   0  0  0

+   -1.5445    1.2164   -0.0718 C   0  0  0

+   -2.0443   -1.1046    0.0817 N   0  0  0

+    2.4612    0.0431   -0.2027 N   0  0  0

+    0.7462    1.9375   -0.2242 C   0  0  0

+    2.2914   -1.3075   -0.1219 C   0  0  0

+   -2.8485    1.5080   -0.0242 N   0  0  0

+   -0.5771    2.2340   -0.1751 C   0  0  0

+   -3.3219   -0.7933    0.1274 C   0  0  0

+    3.7385    0.7534   -0.3044 C   0  0  0

+    3.3098   -2.2382   -0.1240 N   0  0  0

+   -3.7306    0.5382    0.0727 C   0  0  0

+   -4.3530   -1.8867    0.2384 C   0  0  0

+    4.1801    1.2104    1.0873 C   0  0  0

+    1.4356    2.7091    0.0000 H   0  0  0

+   -0.8781    3.2240    0.0000 H   0  0  0

+    3.8235   -0.2778    0.0000 H   0  0  0

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+   -5.1058   -1.1768    0.0000 H   0  0  0

+   -5.0629   -2.6395    0.0000 H   0  0  0

+   -3.6002   -2.5966    0.0000 H   0  0  0

+    4.9242    0.4914    0.0000 H   0  0  0

+    4.8991    1.9545    0.0000 H   0  0  0

+    3.4360    1.9294    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 10 15  2  0

+ 12 16  1  0

+ 13 17  1  0

+  7  9  1  0

+  8 11  2  0

+ 12 15  1  0

+  8 18  1  0

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+ 13 20  1  0

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+ 14 22  1  0

+ 14 23  1  0

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+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14098-44-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+    2.2386    0.6301   -0.3786 C   0  0  0

+    2.1300   -0.5805    0.2999 C   0  0  0

+    3.4895    1.1693   -0.6307 C   0  0  0

+    1.1192    1.2849   -0.7879 O   0  0  0

+    3.2731   -1.2400    0.7208 C   0  0  0

+    0.9043   -1.1147    0.5486 O   0  0  0

+    4.6267    0.5055   -0.2081 C   0  0  0

+    0.5591    1.9093    0.3689 C   0  0  0

+    4.5187   -0.6961    0.4662 C   0  0  0

+    0.7647   -2.2476   -0.3110 C   0  0  0

+   -0.6169    2.7948   -0.0480 C   0  0  0

+   -0.6740   -2.3229   -0.8262 C   0  0  0

+   -1.7848    2.4100    0.6802 O   0  0  0

+   -1.5801   -2.1327    0.2623 O   0  0  0

+   -2.7605    2.0121   -0.2850 C   0  0  0

+   -2.8997   -2.2628   -0.2703 C   0  0  0

+   -3.7759    1.0751    0.3720 C   0  0  0

+   -3.8189   -1.2318    0.3877 C   0  0  0

+   -3.9540   -0.0830   -0.4460 O   0  0  0

+    3.5489    2.1476    0.0000 H   0  0  0

+    3.2184   -2.2186    0.0000 H   0  0  0

+    5.4977    0.9550    0.0000 H   0  0  0

+    1.5031    2.1729    0.0000 H   0  0  0

+    0.7409    2.8724    0.0000 H   0  0  0

+    5.3139   -1.2691    0.0000 H   0  0  0

+    0.7588   -3.2277    0.0000 H   0  0  0

+    1.7428   -2.3106    0.0000 H   0  0  0

+    0.1180    3.4433    0.0000 H   0  0  0

+   -1.1044    3.6450    0.0000 H   0  0  0

+   -1.2625   -3.1066    0.0000 H   0  0  0

+   -0.2132   -3.1879    0.0000 H   0  0  0

+   -2.7438    2.9921    0.0000 H   0  0  0

+   -3.6549    2.4129    0.0000 H   0  0  0

+   -3.7511   -2.7482    0.0000 H   0  0  0

+   -2.6024   -3.1967    0.0000 H   0  0  0

+   -4.1987    1.9593    0.0000 H   0  0  0

+   -4.7455    0.9318    0.0000 H   0  0  0

+   -4.7789   -1.0344    0.0000 H   0  0  0

+   -4.3082   -2.0810    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  7  9  2  0

+ 18 19  1  0

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+ 15 32  1  0

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+ 16 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 18 38  1  0

+ 18 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2876-22-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -1.0190    0.4028   -0.0030 C   0  0  0

+   -0.8428   -1.0543   -0.0014 C   0  0  0

+    0.0379    1.2042   -0.0029 N   0  0  0

+   -2.3373    0.9282    0.0012 C   0  0  0

+    0.3782   -1.5803    0.0002 N   0  0  0

+   -1.9892   -1.8759   -0.0011 C   0  0  0

+    1.2589    0.6797   -0.0012 C   0  0  0

+   -3.4001    0.0716    0.0066 C   0  0  0

+   -2.5447    2.3043    0.0002 N   0  0  0

+    1.4370   -0.7771    0.0004 C   0  0  0

+   -3.2246   -1.3101   -0.0024 C   0  0  0

+    2.4057    1.5025   -0.0006 C   0  0  0

+    2.7481   -1.2996    0.0016 C   0  0  0

+    3.6384    0.9342    0.0016 C   0  0  0

+    3.8077   -0.4513    0.0013 C   0  0  0

+   -1.8890   -2.9148    0.0000 H   0  0  0

+   -4.3682    0.4617    0.0000 H   0  0  0

+   -1.7287    2.9550    0.0000 H   0  0  0

+   -3.5163    2.6856    0.0000 H   0  0  0

+   -4.0656   -1.9282    0.0000 H   0  0  0

+    2.3065    2.5415    0.0000 H   0  0  0

+    2.9019   -2.3319    0.0000 H   0  0  0

+    4.4816    1.5493    0.0000 H   0  0  0

+    4.7742   -0.8453    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

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+ 14 15  1  0

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+  9 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+612-60-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.2418    0.5991   -0.0028 C   0  0  0

+   -0.4537   -0.8021   -0.0009 C   0  0  0

+    1.0753    1.0912   -0.0024 C   0  0  0

+   -1.2887    1.4300    0.0006 N   0  0  0

+    0.6498   -1.6707    0.0018 C   0  0  0

+   -1.7727   -1.2927   -0.0012 C   0  0  0

+    2.1212    0.2208   -0.0002 C   0  0  0

+   -2.5188    0.9764    0.0058 C   0  0  0

+    1.9105   -1.1568    0.0025 C   0  0  0

+   -2.7967   -0.3885   -0.0034 C   0  0  0

+    3.5303    0.7552    0.0002 C   0  0  0

+    1.2503    2.1214    0.0000 H   0  0  0

+    0.5041   -2.7054    0.0000 H   0  0  0

+   -1.9635   -2.3201    0.0000 H   0  0  0

+   -3.3118    1.6569    0.0000 H   0  0  0

+    2.7310   -1.8039    0.0000 H   0  0  0

+   -3.7875   -0.7205    0.0000 H   0  0  0

+    3.9008   -0.2218    0.0000 H   0  0  0

+    4.5073    1.1257    0.0000 H   0  0  0

+    3.1598    1.7322    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  3  7  2  0

+  4  8  1  0

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+  7  9  1  0

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+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1072-43-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -0.7077   -0.1410    0.5888 C   0  0  0

+    0.0135   -1.2296   -0.2085 C   0  0  0

+    0.9300    0.3263   -0.0359 S   0  0  0

+   -1.7884    0.4995   -0.2846 C   0  0  0

+   -1.4853   -0.9586    0.0000 H   0  0  0

+   -0.8226   -1.9873    0.0000 H   0  0  0

+    0.8884   -1.9421    0.0000 H   0  0  0

+   -1.2131    1.4702    0.0000 H   0  0  0

+   -2.7591    1.0748    0.0000 H   0  0  0

+   -2.3637   -0.4712    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  3  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4560-58-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 66 69                          1 V2000

+    0.1907   -2.8923   -0.0550 C   0  0  0

+   -0.8320   -1.7653    0.1029 C   0  0  0

+   -0.6136   -0.6863   -0.9942 C   0  0  0

+   -2.2315   -2.2817   -0.2025 C   0  0  0

+   -0.6141   -1.0503    1.4024 C   0  0  0

+    0.8509   -0.2987   -0.9598 C   0  0  0

+   -1.1072   -1.4168   -2.2436 C   0  0  0

+   -3.2646   -1.4083    0.5121 C   0  0  0

+   -2.3951   -2.1255   -1.7366 C   0  0  0

+   -1.4672   -0.9762    2.2538 O   0  0  0

+    0.7616   -0.4254    1.5671 C   0  0  0

+    1.1199    0.4307    0.3599 C   0  0  0

+    1.1620    0.5925   -2.1619 C   0  0  0

+   -3.2347    0.0031   -0.0779 C   0  0  0

+   -4.6587   -2.0101    0.3241 C   0  0  0

+    2.5933    0.8010    0.4739 C   0  0  0

+    2.4424    1.3963   -1.9313 C   0  0  0

+   -4.2678    0.8766    0.6367 C   0  0  0

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+   -3.4697    2.5316   -0.8383 O   0  0  0

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+    5.4702    0.4064    0.2524 C   0  0  0

+    5.5594   -0.9511   -0.1850 O   0  0  0

+   -0.5607   -3.5741    0.0000 H   0  0  0

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+ 26 64  1  0

+ 27 65  1  0

+ 28 66  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71839-05-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 44                          1 V2000

+   -1.7412   -0.0833   -0.0892 C   0  0  0

+   -2.8495    0.7783   -0.0078 C   0  0  0

+   -0.4098    0.4685   -0.3443 C   0  0  0

+   -1.9184   -1.4680    0.0806 C   0  0  0

+   -2.6785    2.1711   -0.1711 C   0  0  0

+   -4.1329    0.2384    0.2388 C   0  0  0

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+   -1.3488    2.7193   -0.4257 C   0  0  0

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+    2.6837    0.5034    0.5545 O   0  0  0

+    0.2428   -4.5118    0.0644 C   0  0  0

+    1.4951   -3.9594   -0.1934 C   0  0  0

+    4.0546    1.0731    0.2191 S   0  0  0

+    3.8976    2.5798    0.0718 O   0  0  0

+    4.8482    0.8795    1.3818 O   0  0  0

+    4.3668    0.5887   -1.0798 O   0  0  0

+    0.6897    2.3385    0.0000 H   0  0  0

+   -3.3474   -3.0172    0.0000 H   0  0  0

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+  8 11  2  0

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+ 17 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+ 24 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+824-69-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -3.0741   -0.5437   -0.0014 Cl  0  0  0

+   -1.3645   -0.2426   -0.0019 C   0  0  0

+   -0.8896    1.0613    0.0010 C   0  0  0

+   -0.4759   -1.3020    0.0006 C   0  0  0

+   -1.7636    2.1033    0.0033 O   0  0  0

+    0.4762    1.3018    0.0011 C   0  0  0

+    0.8894   -1.0616    0.0007 C   0  0  0

+    1.3645    0.2428   -0.0017 C   0  0  0

+    1.7634   -2.1036    0.0036 O   0  0  0

+    3.0742    0.5439   -0.0016 Cl  0  0  0

+   -0.8318   -2.2791    0.0000 H   0  0  0

+   -2.4319    2.9001    0.0000 H   0  0  0

+    0.8321    2.2789    0.0000 H   0  0  0

+    2.4317   -2.9004    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

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+ 10  8  1  0

+  7  8  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97461-41-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    5.5435    0.3954   -0.0010 C   0  0  0

+    4.4183   -0.6414    0.0009 C   0  0  0

+    5.4298    1.2736    1.2467 C   0  0  0

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+    5.4298    1.2691   -1.2518 C   0  0  0

+    3.1233    0.0434   -0.0004 N   0  0  0

+    1.9819   -0.6734    0.0009 C   0  0  0

+    0.7306   -0.0117   -0.0003 C   0  0  0

+    2.0272   -1.8903    0.0031 O   0  0  0

+   -0.4179   -0.7330    0.0010 C   0  0  0

+   -1.6698   -0.0711   -0.0002 C   0  0  0

+   -2.8823   -0.6632    0.0009 O   0  0  0

+   -1.8673    1.2942    0.0034 C   0  0  0

+   -3.8377    0.2768   -0.0008 C   0  0  0

+   -3.2558    1.4966    0.0005 C   0  0  0

+   -5.2957    0.0201   -0.0011 N   0  3  0

+   -6.0783    0.9534   -0.0027 O   0  0  0

+   -5.7126   -1.1243    0.0003 O   0  5  0

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+    0.6929    1.0030    0.0000 H   0  0  0

+   -0.3801   -1.7477    0.0000 H   0  0  0

+   -1.1489    2.0118    0.0000 H   0  0  0

+   -3.7341    2.3923    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 32  1  0

+ 13 33  1  0

+ 15 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112653-29-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 39                          1 V2000

+   -0.2591    0.4020   -0.0683 C   0  0  2

+    0.6022   -0.6457    0.6399 C   0  0  0

+    0.4676    1.7484   -0.0619 C   0  0  2

+   -1.5431    0.5354    0.6328 N   0  0  0

+    1.9396   -0.7845   -0.0903 C   0  0  1

+    1.8050    1.6096   -0.7921 C   0  0  1

+    0.7018    2.1570    1.2872 O   0  0  0

+   -2.4625   -0.4309    0.0172 C   0  0  0

+    2.6663    0.5619   -0.0840 C   0  0  1

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+    2.9002    0.9705    1.2652 O   0  0  0

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+   -4.0915   -0.7049   -1.7467 O   0  0  0

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+ 14 35  1  0

+ 15 36  1  0

+ 16 37  1  0

+ 17 38  1  0

+ 18 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+765-87-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.5657    0.7502    0.0174 C   0  0  0

+   -0.5669   -0.7494   -0.0155 C   0  0  0

+    0.6985    1.4178    0.5223 C   0  0  0

+   -1.5217    1.3936   -0.3447 O   0  0  0

+    0.6958   -1.4189   -0.5218 C   0  0  0

+   -1.5251   -1.3912    0.3434 O   0  0  0

+    1.8992    0.7475   -0.1532 C   0  0  0

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+    1.3770    2.2216    0.0000 H   0  0  0

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+    0.0348   -2.2371    0.0000 H   0  0  0

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+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6473-13-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+106113                          1 V2000

+   -8.0883   -0.2491    0.2523 C   0  0  0

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+ 71106  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3989-90-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+   -0.7399    0.6064    0.0022 C   0  0  0

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+    2.6575   -1.0089   -0.0004 C   0  0  0

+    2.9196    1.3732    0.0010 C   0  0  0

+   -4.9356    1.0633    0.0021 C   0  0  0

+   -5.1983   -1.3187   -0.0012 C   0  0  0

+    3.4613    0.0919    0.0004 C   0  0  0

+   -5.7397   -0.0373    0.0008 C   0  0  0

+    4.9317   -0.0784   -0.0003 N   0  3  0

+    5.6580    0.8993    0.0004 O   0  0  0

+    5.4152   -1.1964   -0.0015 O   0  5  0

+   -0.7276    2.7334    0.0000 H   0  0  0

+   -1.5505   -2.6795    0.0000 H   0  0  0

+    1.1694    2.5322    0.0000 H   0  0  0

+   -3.0955    2.9928    0.0000 H   0  0  0

+   -3.4484   -2.4781    0.0000 H   0  0  0

+    0.8174   -2.9388    0.0000 H   0  0  0

+    3.0802   -1.9706    0.0000 H   0  0  0

+    3.5588    2.2068    0.0000 H   0  0  0

+   -5.3580    2.0251    0.0000 H   0  0  0

+   -5.8377   -2.1522    0.0000 H   0  0  0

+   -6.7831    0.0839    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

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+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111070-57-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 47                          1 V2000

+   -1.4027    0.7306    0.2096 C   0  0  0

+   -0.6715   -0.3730    0.5549 N   0  0  0

+   -0.7351    2.0439    0.0944 C   0  0  0

+   -2.7422    0.6294   -0.0350 C   0  0  0

+   -1.2514   -1.5821    0.6677 C   0  0  0

+    0.7027   -0.2423    0.7944 N   0  0  0

+   -0.5025    2.6042   -1.1628 C   0  0  0

+   -0.3392    2.7324    1.2428 C   0  0  0

+   -3.3764   -0.6231    0.0692 C   0  0  0

+   -2.6220   -1.7327    0.4325 C   0  0  0

+   -0.5775   -2.5528    0.9773 O   0  0  0

+    1.5614   -0.7137   -0.0646 C   0  0  0

+    0.1213    3.8307   -1.2632 C   0  0  0

+    0.2835    3.9578    1.1282 C   0  0  0

+   -4.8293   -0.7545   -0.1923 C   0  0  0

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+   -5.3509   -0.4042   -1.4369 C   0  0  0

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+    4.9614   -0.0723    1.0991 C   0  0  0

+   -7.5437   -0.9989   -0.6804 C   0  0  0

+    6.4993   -1.0350   -0.6487 N   0  3  0

+    7.5157   -0.7120   -0.0602 O   0  0  0

+    6.5725   -1.6199   -1.7145 O   0  5  0

+   -3.2729    1.4241    0.0000 H   0  0  0

+   -1.3703    3.0043    0.0000 H   0  0  0

+    0.5013    2.2776    0.0000 H   0  0  0

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+   -5.4024   -2.1375    0.0000 H   0  0  0

+   -5.1145    0.5217    0.0000 H   0  0  0

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+   -7.2710   -2.2685    0.0000 H   0  0  0

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+   -8.4985   -0.9600    0.0000 H   0  0  0

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+ 21 40  1  0

+ 22 41  1  0

+ 23 42  1  0

+ 25 43  1  0

+ 26 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-61-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -1.0302    0.1050    0.0585 C   0  0  0

+   -0.2342   -0.9235    0.5291 C   0  0  0

+   -0.4663    1.3226   -0.2745 C   0  0  0

+   -2.7656   -0.1395   -0.1238 S   0  0  0

+    1.1270   -0.7369    0.6678 C   0  0  0

+    0.8946    1.5156   -0.1382 C   0  0  0

+   -3.4796    0.2943    1.3060 N   0  0  0

+   -3.1932    0.8239   -1.0768 O   0  0  0

+   -2.9479   -1.5443   -0.2358 O   0  0  0

+    1.6966    0.4851    0.3340 C   0  0  0

+    3.0755    0.6773    0.4733 N   0  0  0

+    3.9377   -0.1651   -0.1296 C   0  0  0

+    5.4178   -0.0365    0.1229 C   0  0  0

+    3.5223   -1.0266   -0.8755 O   0  0  0

+   -0.6158   -1.8573    0.0000 H   0  0  0

+   -1.0679    2.1323    0.0000 H   0  0  0

+    1.7257   -1.5488    0.0000 H   0  0  0

+    1.2728    2.4508    0.0000 H   0  0  0

+   -3.4570    1.3028    0.0000 H   0  0  0

+   -4.3643   -0.1904    0.0000 H   0  0  0

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+    5.5051   -1.0415    0.0000 H   0  0  0

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+    5.3305    0.9685    0.0000 H   0  0  0

+  1  2  1  0

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+  7 19  1  0

+  7 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+111-64-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+   -0.0010   -0.3376    0.0000 C   0  0  0

+   -1.2727    0.5132    0.0000 C   0  0  0

+    1.2250    0.5777    0.0000 C   0  0  0

+   -2.4986   -0.4022    0.0000 C   0  0  0

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+    4.0349    0.5066    0.0000 Cl  0  0  0

+   -4.9963   -0.4667    0.0000 C   0  0  0

+   -6.2679    0.3841    0.0000 C   0  0  0

+   -0.7428   -1.2131    0.0000 H   0  0  0

+    0.7850   -1.1736    0.0000 H   0  0  0

+   -0.5309    1.3887    0.0000 H   0  0  0

+   -2.0588    1.3492    0.0000 H   0  0  0

+    1.9668    1.4532    0.0000 H   0  0  0

+    0.4390    1.4137    0.0000 H   0  0  0

+   -3.2404   -1.2777    0.0000 H   0  0  0

+   -1.7125   -1.2382    0.0000 H   0  0  0

+   -3.0285    1.3241    0.0000 H   0  0  0

+   -4.5563    1.2846    0.0000 H   0  0  0

+   -5.7381   -1.3422    0.0000 H   0  0  0

+   -4.2103   -1.3027    0.0000 H   0  0  0

+   -5.6298    1.3378    0.0000 H   0  0  0

+   -7.2216    1.0222    0.0000 H   0  0  0

+   -6.9060   -0.5696    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 24  1  0

+ 10 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101-67-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 72 73                          1 V2000

+   -0.0919   -2.4364   -0.9452 N   0  0  0

+   -1.1560   -1.6404   -0.5137 C   0  0  0

+    1.2004   -2.1896   -0.4752 C   0  0  0

+   -1.4648   -0.4659   -1.1880 C   0  0  0

+   -1.9114   -2.0249    0.5873 C   0  0  0

+    2.2813   -2.8710   -1.0201 C   0  0  0

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+   -2.5177    0.3184   -0.7590 C   0  0  0

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+  2  1  1  0

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+ 28 69  1  0

+ 29 70  1  0

+ 29 71  1  0

+ 29 72  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+62783-49-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.4290    0.6942   -0.4772 C   0  0  0

+   -0.8471   -0.6229   -0.4520 C   0  0  0

+    0.9431    1.0395   -0.9962 C   0  0  0

+   -1.2717    1.6957   -0.0316 C   0  0  0

+   -2.1058   -0.9396    0.0241 C   0  0  0

+    1.9588    0.4335   -0.1317 N   0  0  0

+   -2.5322    1.3796    0.4390 C   0  0  0

+   -2.9461    0.0609    0.4749 C   0  0  0

+   -2.5619   -2.3757    0.0511 C   0  0  0

+    2.3047   -0.7967   -0.3075 N   0  0  0

+    2.5817    1.2247    0.9323 C   0  0  0

+    3.1492   -1.3005    0.4112 O   0  0  0

+   -0.1774   -1.3347    0.0000 H   0  0  0

+    1.6442    1.7203    0.0000 H   0  0  0

+    0.4672    1.8931    0.0000 H   0  0  0

+   -0.9710    2.6256    0.0000 H   0  0  0

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+    3.1862    1.9926    0.0000 H   0  0  0

+    1.8138    1.8292    0.0000 H   0  0  0

+  1  2  2  0

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+  9 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1222-98-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    3.7239    0.0813   -0.0007 C   0  0  0

+    2.5794    1.0183   -0.0002 C   0  0  0

+    5.0310    0.5713   -0.0007 C   0  0  0

+    3.5016   -1.2972    0.0046 C   0  0  0

+    1.2116    0.5016   -0.0001 C   0  0  0

+    2.7762    2.2195    0.0003 O   0  0  0

+    6.0940   -0.3081   -0.0013 C   0  0  0

+    4.5733   -2.1653    0.0040 C   0  0  0

+    0.1663    1.3573    0.0004 C   0  0  0

+    5.8667   -1.6729   -0.0019 C   0  0  0

+   -1.2098    0.8374    0.0004 C   0  0  0

+   -2.2949    1.7202    0.0009 C   0  0  0

+   -1.4403   -0.5427   -0.0059 C   0  0  0

+   -3.5818    1.2249    0.0010 C   0  0  0

+   -2.7328   -1.0218   -0.0058 C   0  0  0

+   -3.8013   -0.1415    0.0005 C   0  0  0

+   -5.1860   -0.6646    0.0010 N   0  3  0

+   -5.3829   -1.8666    0.0006 O   0  0  0

+   -6.1284    0.1069    0.0019 O   0  5  0

+    5.2028    1.5949    0.0000 H   0  0  0

+    2.5320   -1.6677    0.0000 H   0  0  0

+    1.0438   -0.5227    0.0000 H   0  0  0

+    7.0664    0.0549    0.0000 H   0  0  0

+    4.4094   -3.1902    0.0000 H   0  0  0

+    0.3341    2.3816    0.0000 H   0  0  0

+    6.6698   -2.3304    0.0000 H   0  0  0

+   -2.1318    2.7453    0.0000 H   0  0  0

+   -0.6402   -1.2039    0.0000 H   0  0  0

+   -4.3880    1.8786    0.0000 H   0  0  0

+   -2.9054   -2.0453    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  7 10  2  0

+  9 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+ 16 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+  8 10  1  0

+ 15 16  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6629-29-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.5472    0.2339   -0.0063 C   0  0  0

+    0.0449   -1.0129    0.0478 C   0  0  0

+    0.2348    1.3718   -0.0601 C   0  0  0

+   -2.0226    0.3510   -0.0128 N   0  3  0

+    1.4301   -1.1267    0.0482 C   0  0  0

+   -0.8121   -2.2511    0.1069 C   0  0  0

+    1.6202    1.2652   -0.0600 C   0  0  0

+   -2.6609   -0.0461   -0.9712 O   0  0  0

+   -2.5986    0.8445    0.9402 O   0  5  0

+    2.2184    0.0139   -0.0058 C   0  0  0

+    2.0280   -2.3878    0.1024 N   0  0  0

+    2.4100    2.4158   -0.1149 N   0  0  0

+   -0.2143    2.3111    0.0000 H   0  0  0

+   -1.6682   -1.6586    0.0000 H   0  0  0

+   -1.4046   -3.1072    0.0000 H   0  0  0

+    0.0440   -2.8436    0.0000 H   0  0  0

+    3.2563   -0.0687    0.0000 H   0  0  0

+    1.4363   -3.2445    0.0000 H   0  0  0

+    3.0658   -2.4719    0.0000 H   0  0  0

+    3.4480    2.3347    0.0000 H   0  0  0

+    1.9612    3.3553    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+  7 10  1  0

+  3 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105427-01-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    2.5160    0.1384   -0.2198 C   0  0  0

+    1.0619   -0.2342   -0.0855 C   0  0  0

+    3.1589    0.9250    0.9243 C   0  0  0

+    3.4425   -0.4561    0.6913 O   0  0  0

+    2.9988    0.4265   -1.6427 C   0  0  0

+    0.1289    0.7293    0.0471 N   0  0  0

+    0.7314   -1.4011   -0.0968 O   0  0  0

+   -1.2295    0.3936    0.0392 C   0  0  0

+   -2.1935    1.3935    0.0402 C   0  0  0

+   -1.6165   -0.9398    0.0246 C   0  0  0

+   -3.5332    1.0588    0.0324 C   0  0  0

+   -2.9583   -1.2679    0.0169 C   0  0  0

+   -3.9155   -0.2703    0.0237 C   0  0  0

+    4.1009    1.3573    0.0000 H   0  0  0

+    2.5252    1.7451    0.0000 H   0  0  0

+    3.5299   -0.4635    0.0000 H   0  0  0

+    3.8888    0.9576    0.0000 H   0  0  0

+    2.4677    1.3165    0.0000 H   0  0  0

+    0.4149    1.7255    0.0000 H   0  0  0

+   -1.9076    2.3898    0.0000 H   0  0  0

+   -0.8994   -1.6881    0.0000 H   0  0  0

+   -4.2531    1.8045    0.0000 H   0  0  0

+   -3.2478   -2.2631    0.0000 H   0  0  0

+   -4.9217   -0.5190    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  6  8  1  0

+  8  9  1  0

+  8 10  2  0

+  9 11  2  0

+ 10 12  1  0

+ 11 13  1  0

+  3  4  1  0

+ 12 13  2  0

+  3 14  1  0

+  3 15  1  0

+  5 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80556-89-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.2611   -0.0600    0.1230 N   0  0  0

+   -0.9063    0.5487    0.7657 C   0  0  0

+    0.9582    0.6496   -0.9525 C   0  0  0

+    0.6782   -1.2185    0.5076 N   0  0  0

+   -2.1556    0.1402    0.0284 C   0  0  0

+    2.0629    1.5232   -0.3546 C   0  0  0

+    1.6487   -1.7246   -0.0267 O   0  0  0

+   -3.3537    0.5820    0.4421 O   0  0  0

+   -2.0787   -0.5849   -0.9350 O   0  0  0

+    2.9917    0.6989    0.3525 O   0  0  0

+   -0.2792    1.2373    0.0000 H   0  0  0

+   -1.4121    1.3308    0.0000 H   0  0  0

+    0.7848    1.5647    0.0000 H   0  0  0

+    0.0670    0.9201    0.0000 H   0  0  0

+    2.7209    2.1824    0.0000 H   0  0  0

+    1.4434    2.2187    0.0000 H   0  0  0

+   -4.2276    0.9042    0.0000 H   0  0  0

+    3.6883    0.0807    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  2 11  1  0

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+  3 13  1  0

+  3 14  1  0

+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7085-85-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.1094   -0.7118   -0.0013 C   0  0  0

+   -1.3315   -0.3910   -0.0009 C   0  0  0

+    1.0204    0.2808   -0.0006 O   0  0  0

+    0.4737   -1.8707    0.0028 O   0  0  0

+   -1.7610    0.9751    0.0003 C   0  0  0

+   -2.2426   -1.3836   -0.0016 C   0  0  0

+    2.4378   -0.0347   -0.0010 C   0  0  0

+   -2.1016    2.0588    0.0012 N   0  0  0

+    3.2490    1.2626    0.0001 C   0  0  0

+   -3.2600   -1.1571    0.0000 H   0  0  0

+   -1.9300   -2.3779    0.0000 H   0  0  0

+    2.0978   -1.0200    0.0000 H   0  0  0

+    3.3783   -0.4839    0.0000 H   0  0  0

+    4.1327    0.7100    0.0000 H   0  0  0

+    3.8016    2.1463    0.0000 H   0  0  0

+    2.3653    1.8152    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  5  8  3  0

+  7  9  1  0

+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+  9 14  1  0

+  9 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86-57-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.3727   -0.1528   -0.0123 C   0  0  0

+   -1.5052    0.6993    0.0081 C   0  0  0

+    0.9138    0.4098    0.0372 C   0  0  0

+   -0.5585   -1.5440   -0.0875 C   0  0  0

+   -1.3193    2.0903    0.0769 C   0  0  0

+   -2.7920    0.1363   -0.0414 C   0  0  0

+    1.0554    1.7620    0.1039 C   0  0  0

+    2.1089   -0.4633    0.0164 N   0  3  0

+   -1.8195   -2.0530   -0.1396 C   0  0  0

+   -0.0578    2.5998    0.1229 C   0  0  0

+   -2.9333   -1.2156   -0.1081 C   0  0  0

+    2.1608   -1.4421    0.7395 O   0  0  0

+    3.0405   -0.2030   -0.7238 O   0  5  0

+    0.2671   -2.1847    0.0000 H   0  0  0

+   -2.1449    2.7309    0.0000 H   0  0  0

+   -3.6356    0.7530    0.0000 H   0  0  0

+    2.0135    2.1792    0.0000 H   0  0  0

+   -1.9555   -3.0891    0.0000 H   0  0  0

+    0.0784    3.6359    0.0000 H   0  0  0

+   -3.8913   -1.6331    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  8 13  1  0

+  7 10  2  0

+  9 11  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5460-35-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -1.3602   -2.2342    0.0034 O   0  0  0

+   -1.0017   -1.0751    0.0031 C   0  0  0

+    0.4349   -0.7270    0.0010 C   0  0  0

+   -2.0030    0.0363   -0.0015 C   0  0  0

+    0.8094    0.6302    0.0007 C   0  0  0

+    1.4102   -1.7176   -0.0002 C   0  0  0

+   -3.1942   -0.2142   -0.0046 O   0  0  0

+   -1.5644    1.3648   -0.0018 C   0  0  0

+   -0.2261    1.6803    0.0029 C   0  0  0

+    2.1593    0.9673   -0.0013 C   0  0  0

+    2.7499   -1.3629   -0.0017 C   0  0  0

+    0.1534    2.9978    0.0026 N   0  0  0

+    3.1201   -0.0314   -0.0029 C   0  0  0

+    1.1354   -2.7217    0.0000 H   0  0  0

+   -2.2677    2.1323    0.0000 H   0  0  0

+    2.4470    1.9678    0.0000 H   0  0  0

+    3.4814   -2.1035    0.0000 H   0  0  0

+    1.1638    3.2484    0.0000 H   0  0  0

+   -0.5688    3.7475    0.0000 H   0  0  0

+    4.1294    0.2236    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

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+  8  4  1  0

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+ 10  5  1  0

+ 11  6  2  0

+ 12  9  1  0

+ 13 10  2  0

+  8  9  2  0

+ 11 13  1  0

+  6 14  1  0

+  8 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74550-97-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 67                          1 V2000

+   -4.3921   -1.0471   -0.7225 N   0  0  0

+   -3.8483   -1.8647    0.1991 C   0  0  0

+   -3.6064   -0.2561   -1.4780 C   0  0  0

+   -5.8451   -1.0224   -0.9084 C   0  0  0

+   -2.3555   -1.8973    0.3980 C   0  0  0

+   -4.5627   -2.5773    0.8709 O   0  0  0

+   -2.1115   -0.2733   -1.2937 C   0  0  0

+   -4.1041    0.4727   -2.3091 O   0  0  0

+   -6.3905    0.2174   -0.3396 N   0  0  0

+   -1.7914   -0.5729    0.1075 N   0  0  0

+   -6.6473   -0.0476    1.0821 C   0  0  0

+   -7.6991    0.4317   -0.9714 C   0  0  0

+   -0.3309   -0.7094    0.1871 C   0  0  0

+   -7.3776    1.1451    1.7007 C   0  0  0

+   -8.4031    1.6124   -0.3014 C   0  0  0

+    0.3243    0.6417   -0.1065 C   0  0  0

+   -8.6484    1.3109    1.0721 O   0  0  0

+    1.7848    0.5052   -0.0269 N   0  0  0

+    2.3489    1.8296   -0.3174 C   0  0  0

+    2.1049    0.2061    1.3748 C   0  0  0

+    3.8417    1.7970   -0.1185 C   0  0  0

+    3.5999    0.1882    1.5583 C   0  0  0

+    4.3856    0.9788    0.8025 N   0  0  0

+    4.5561    2.5097   -0.7903 O   0  0  0

+    4.0976   -0.5409    2.3892 O   0  0  0

+    5.8391    0.9489    0.9835 C   0  0  0

+    6.4591    0.2469   -0.1483 N   0  0  0

+    6.4540   -1.1829    0.1880 C   0  0  0

+    7.8664    0.6661   -0.1852 C   0  0  0

+    7.2406   -1.9594   -0.8689 C   0  0  0

+    8.6176   -0.1567   -1.2327 C   0  0  0

+    8.6036   -1.5354   -0.8633 O   0  0  0

+   -6.8240   -1.2940    0.0000 H   0  0  0

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+   -2.5061   -2.9019    0.0000 H   0  0  0

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+   -7.5971    2.2307    0.0000 H   0  0  0

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+    0.5387    1.6347    0.0000 H   0  0  0

+   -0.6360    0.9729    0.0000 H   0  0  0

+    2.4995    2.8342    0.0000 H   0  0  0

+    1.3714    2.1061    0.0000 H   0  0  0

+    1.2348   -0.3181    0.0000 H   0  0  0

+    2.3711   -0.7743    0.0000 H   0  0  0

+    6.7423    1.4139    0.0000 H   0  0  0

+    5.6100    1.9386    0.0000 H   0  0  0

+    5.4728   -0.9198    0.0000 H   0  0  0

+    5.9488   -2.0642    0.0000 H   0  0  0

+    8.7106    1.2311    0.0000 H   0  0  0

+    7.4340    1.5853    0.0000 H   0  0  0

+    6.4188   -2.5566    0.0000 H   0  0  0

+    7.6961   -2.8674    0.0000 H   0  0  0

+    9.5928   -0.4411    0.0000 H   0  0  0

+    9.1549    0.7054    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 29 60  1  0

+ 30 61  1  0

+ 30 62  1  0

+ 31 63  1  0

+ 31 64  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16757-83-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.1633   -0.0300   -0.0014 C   0  0  0

+   -1.5063    0.3869   -0.0011 C   0  0  0

+    0.8665    0.9278    0.0001 C   0  0  0

+    0.1529   -1.4590    0.0029 C   0  0  0

+   -2.5459   -0.5695   -0.0017 C   0  0  0

+   -1.8049    1.7690    0.0002 C   0  0  0

+    2.2512    0.4601   -0.0002 C   0  0  0

+    0.5443    2.2980    0.0023 C   0  0  0

+    1.4755   -1.8699    0.0023 C   0  0  0

+   -0.9469   -2.4243    0.0074 C   0  0  0

+   -2.2276   -1.9951   -0.0021 C   0  0  0

+   -3.8700   -0.1258   -0.0014 C   0  0  0

+   -0.7490    2.7078    0.0007 C   0  0  0

+   -3.1455    2.1725    0.0004 C   0  0  0

+    2.5205   -0.9317   -0.0019 C   0  0  0

+    3.3160    1.3695    0.0007 C   0  0  0

+   -3.3470   -3.0041   -0.0022 C   0  0  0

+   -4.1510    1.2284   -0.0006 C   0  0  0

+    3.8608   -1.3673   -0.0026 C   0  0  0

+    4.5998    0.9115   -0.0001 C   0  0  0

+    4.8697   -0.4548   -0.0017 C   0  0  0

+    1.3178    3.0149    0.0000 H   0  0  0

+    1.7007   -2.9002    0.0000 H   0  0  0

+   -0.7389   -3.4583    0.0000 H   0  0  0

+   -4.6587   -0.8260    0.0000 H   0  0  0

+   -0.9688    3.7393    0.0000 H   0  0  0

+   -3.3867    3.1992    0.0000 H   0  0  0

+    3.1250    2.4067    0.0000 H   0  0  0

+   -4.0531   -2.2207    0.0000 H   0  0  0

+   -4.1304   -3.7102    0.0000 H   0  0  0

+   -2.6409   -3.7875    0.0000 H   0  0  0

+   -5.1566    1.5463    0.0000 H   0  0  0

+    4.0812   -2.3987    0.0000 H   0  0  0

+    5.3985    1.6002    0.0000 H   0  0  0

+    5.8707   -0.7868    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+ 11 17  1  0

+ 12 18  2  0

+ 15 19  1  0

+ 16 20  2  0

+ 19 21  2  0

+  8 13  2  0

+  9 15  1  0

+ 10 11  2  0

+ 14 18  1  0

+ 20 21  1  0

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+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+553-97-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.7389    0.8667    0.0020 C   0  0  0

+   -1.1676   -0.5468    0.0007 C   0  0  0

+    0.5663    1.1710    0.0017 C   0  0  0

+   -1.7690    1.9666   -0.0028 C   0  0  0

+   -0.1579   -1.6249   -0.0009 C   0  0  0

+   -2.3503   -0.8226    0.0004 O   0  0  0

+    1.5760    0.0929    0.0002 C   0  0  0

+    1.1472   -1.3206   -0.0011 C   0  0  0

+    2.7587    0.3686   -0.0004 O   0  0  0

+    0.8879    2.2311    0.0000 H   0  0  0

+   -0.9604    2.7239    0.0000 H   0  0  0

+   -2.5263    2.7752    0.0000 H   0  0  0

+   -2.5776    1.2093    0.0000 H   0  0  0

+   -0.4795   -2.6850    0.0000 H   0  0  0

+    1.9045   -2.1292    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  5  8  2  0

+  7  9  2  0

+  7  8  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+135768-83-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 53                          1 V2000

+    2.1735   -0.1152    0.0000 C   0  0  1

+    2.1735    1.5124    0.0000 C   0  0  1

+    0.7913   -0.9014    0.0000 C   0  0  1

+    3.7210   -0.5859    0.0000 C   0  0  0

+    3.5056   -0.1002    0.0000 C   0  0  0

+    3.7210    1.9682    0.0000 C   0  0  1

+    0.7913    2.3137    0.0000 C   0  0  0

+    2.1735    3.0950    0.0000 C   0  0  0

+   -0.5909   -0.0851    0.0000 C   0  0  2

+    0.7913   -2.4990    0.0000 C   0  0  0

+    4.6074    0.6861    0.0000 C   0  0  2

+    4.0615    0.6961    0.0000 C   0  0  0

+    4.2669    3.4005    0.0000 O   0  0  0

+   -0.5909    1.5124    0.0000 C   0  0  0

+   -1.9632   -0.9014    0.0000 C   0  0  0

+   -0.5909   -3.3003    0.0000 C   0  0  0

+    6.2000    0.6861    0.0000 O   0  0  0

+   -1.9632   -2.4990    0.0000 C   0  0  0

+   -3.3454   -0.0851    0.0000 C   0  0  0

+   -3.3454   -3.3003    0.0000 C   0  0  0

+   -4.7276   -0.9014    0.0000 C   0  0  0

+   -4.7276   -2.4990    0.0000 C   0  0  0

+   -6.1098   -3.3003    0.0000 O   0  0  0

+   -0.2493   -1.4954    0.0000 H   0  0  0

+    3.2547   -1.6896    0.0000 H   0  0  0

+    4.7701   -1.1647    0.0000 H   0  0  0

+    3.2727   -1.2755    0.0000 H   0  0  0

+    4.6080   -0.5696    0.0000 H   0  0  0

+    1.5620    3.2311    0.0000 H   0  0  0

+    0.0206    3.2311    0.0000 H   0  0  0

+    3.3717    3.0950    0.0000 H   0  0  0

+    2.1735    4.2932    0.0000 H   0  0  0

+    0.9753    3.0950    0.0000 H   0  0  0

+   -1.6324    0.5072    0.0000 H   0  0  0

+    1.2024   -3.6245    0.0000 H   0  0  0

+    1.9712   -2.2902    0.0000 H   0  0  0

+    5.1619   -0.3761    0.0000 H   0  0  0

+    4.8588   -0.1983    0.0000 H   0  0  0

+    5.1160    1.2651    0.0000 H   0  0  0

+    4.6936    4.5201    0.0000 H   0  0  0

+   -1.0020    2.6379    0.0000 H   0  0  0

+   -1.7708    1.3036    0.0000 H   0  0  0

+   -1.3635   -4.2161    0.0000 H   0  0  0

+    0.1789   -4.2185    0.0000 H   0  0  0

+    7.3982    0.6861    0.0000 H   0  0  0

+   -3.3454    1.1131    0.0000 H   0  0  0

+   -3.3454   -4.4985    0.0000 H   0  0  0

+   -5.7682   -0.3074    0.0000 H   0  0  0

+   -7.1464   -3.9012    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  1

+  2  6  1  0

+  2  7  1  0

+  2  8  1  1

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  6

+  7 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  6

+ 15 18  2  0

+ 15 19  1  0

+ 18 20  1  0

+ 19 21  2  0

+ 20 22  2  0

+ 22 23  1  0

+  6 11  1  0

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+  9 14  1  0

+ 16 18  1  0

+ 21 22  1  0

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+  4 25  1  0

+  4 26  1  0

+  5 27  1  0

+  5 28  1  0

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+ 17 45  1  0

+ 19 46  1  0

+ 20 47  1  0

+ 21 48  1  0

+ 23 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115-39-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+   -0.1546   -1.3552    0.1360 C   0  0  0

+   -0.0104   -2.2281   -1.0818 C   0  0  0

+    1.0850   -0.5108    0.2825 C   0  0  0

+   -1.3442   -0.4489   -0.0495 C   0  0  0

+   -0.3393   -2.1232    1.3335 O   0  0  0

+    0.3646   -3.5104   -0.7009 C   0  0  0

+   -0.1825   -1.9620   -2.4307 C   0  0  0

+    1.9965   -0.4372   -0.7548 C   0  0  0

+    1.3059    0.1934    1.4514 C   0  0  0

+   -2.5459   -0.7540    0.5618 C   0  0  0

+   -1.2300    0.6895   -0.8262 C   0  0  0

+    0.4259   -3.4358    1.0677 S   0  0  0

+    0.5836   -4.4979   -1.6253 C   0  0  0

+    0.0301   -2.9545   -3.3671 C   0  0  0

+    3.1340    0.3368   -0.6234 C   0  0  0

+    2.4420    0.9693    1.5884 C   0  0  0

+   -3.6389    0.0760    0.3937 C   0  0  0

+   -2.3193    1.5228   -0.9976 C   0  0  0

+    1.7818   -3.1940    1.4177 O   0  0  0

+   -0.3947   -4.4901    1.5517 O   0  0  0

+    0.4163   -4.2223   -2.9730 C   0  0  0

+    3.3609    1.0407    0.5512 C   0  0  0

+    4.3801    0.4363   -2.0422 Br  0  0  0

+    2.7436    1.9317    3.1880 Br  0  0  0

+   -3.5286    1.2161   -0.3894 C   0  0  0

+   -5.2825   -0.3426    1.2298 Br  0  0  0

+   -2.1620    3.0796   -2.0594 Br  0  0  0

+    4.4788    1.8028    0.6831 O   0  0  0

+   -4.6015    2.0339   -0.5563 O   0  0  0

+   -0.5408   -1.0966    0.0000 H   0  0  0

+    2.3080   -1.3205    0.0000 H   0  0  0

+    0.5534    0.7511    0.0000 H   0  0  0

+   -2.7324   -1.6719    0.0000 H   0  0  0

+   -0.3706    1.0619    0.0000 H   0  0  0

+    0.9327   -5.3670    0.0000 H   0  0  0

+   -0.8766   -3.1893    0.0000 H   0  0  0

+   -0.4387   -4.6048    0.0000 H   0  0  0

+    5.2527    2.3304    0.0000 H   0  0  0

+   -5.3464    2.6017    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  3  9  2  0

+  4 10  2  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  2  0

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+  9 16  1  0

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+ 11 18  2  0

+ 12 19  2  0

+ 12 20  2  0

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+ 15 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+ 17 25  2  0

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+ 18 27  1  0

+ 22 28  1  0

+ 25 29  1  0

+  6 12  1  0

+ 14 21  1  0

+ 16 22  2  0

+ 18 25  1  0

+  7 30  1  0

+  8 31  1  0

+  9 32  1  0

+ 10 33  1  0

+ 11 34  1  0

+ 13 35  1  0

+ 14 36  1  0

+ 21 37  1  0

+ 28 38  1  0

+ 29 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56183-24-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.5292    0.2796   -0.1249 C   0  0  0

+   -0.2585   -0.8494    0.0107 C   0  0  0

+    1.9257    0.1562   -0.0665 C   0  0  0

+   -0.1090    1.6247   -0.3400 C   0  0  2

+   -1.7340   -0.7040   -0.0433 C   0  0  0

+    0.3258   -2.1115    0.1965 C   0  0  0

+    2.5056   -1.1237    0.1233 C   0  0  0

+    2.7615    1.2800   -0.1939 C   0  0  0

+   -1.4111    1.7351    0.4486 C   0  0  1

+   -0.3779    1.8072   -1.7315 O   0  0  0

+   -2.2989    0.5537    0.1641 C   0  0  0

+   -2.5498   -1.8018   -0.2970 C   0  0  0

+    1.6757   -2.2520    0.2524 C   0  0  0

+    3.9046   -1.2430    0.1781 C   0  0  0

+    4.1122    1.1252   -0.1351 C   0  0  0

+   -1.1186    1.7852    1.8465 O   0  0  0

+   -3.6694    0.7050    0.1115 C   0  0  0

+   -3.9202   -1.6386   -0.3452 C   0  0  0

+    4.6821   -0.1331    0.0502 C   0  0  0

+   -4.4776   -0.3887   -0.1425 C   0  0  0

+    0.6761    2.2978    0.0000 H   0  0  0

+   -0.2754   -2.9529    0.0000 H   0  0  0

+    2.3506    2.2290    0.0000 H   0  0  0

+   -1.9498    2.6178    0.0000 H   0  0  0

+   -1.2336    2.3879    0.0000 H   0  0  0

+   -2.1408   -2.7516    0.0000 H   0  0  0

+    2.0940   -3.1977    0.0000 H   0  0  0

+    4.3426   -2.1798    0.0000 H   0  0  0

+    4.7213    1.9609    0.0000 H   0  0  0

+   -0.0993    1.9598    0.0000 H   0  0  0

+   -4.0837    1.6525    0.0000 H   0  0  0

+   -4.5336   -2.4712    0.0000 H   0  0  0

+    5.7118   -0.2290    0.0000 H   0  0  0

+   -5.5056   -0.2768    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99803-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    0.2791   -0.0301    0.9216 C   0  0  0

+   -1.0077   -0.0004    1.3425 O   0  0  0

+    0.9846    1.1637    0.7634 C   0  0  0

+    0.8930   -1.2542    0.6543 C   0  0  0

+   -1.9249    0.1336    0.0261 P   0  0  0

+    2.2788    1.1438    0.3407 C   0  0  0

+    2.1868   -1.2939    0.2306 C   0  0  0

+   -3.4611    0.3407    0.4612 O   0  0  0

+   -1.4374    1.3996   -0.8410 O   0  0  0

+   -1.7726   -1.4161   -0.9976 S   0  0  0

+    2.9072   -0.0906    0.0620 C   0  0  0

+    3.0384    2.4342    0.1702 C   0  0  0

+   -3.8033   -0.7604    1.3053 C   0  0  0

+   -2.3469    1.5250   -1.9360 C   0  0  0

+    4.1738   -0.1198   -0.3523 N   0  0  0

+    4.7119   -1.1859   -0.5915 O   0  0  0

+    0.4986    2.0309    0.0000 H   0  0  0

+    0.3579   -2.0921    0.0000 H   0  0  0

+    2.6637   -2.1662    0.0000 H   0  0  0

+    3.8951    1.9299    0.0000 H   0  0  0

+    3.5427    3.2909    0.0000 H   0  0  0

+    2.1817    2.9385    0.0000 H   0  0  0

+   -4.7526   -0.4654    0.0000 H   0  0  0

+   -4.0983   -1.7097    0.0000 H   0  0  0

+   -2.8540   -1.0554    0.0000 H   0  0  0

+   -2.2111    2.5098    0.0000 H   0  0  0

+   -3.3317    1.6608    0.0000 H   0  0  0

+   -2.4827    0.5402    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  1  0

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+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 15 16  2  0

+  7 11  2  0

+  3 17  1  0

+  4 18  1  0

+  7 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+79-36-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    0.6833    0.6458    0.0271 C   0  0  0

+   -0.4982   -0.1076   -0.5275 C   0  0  0

+    0.5131    1.6842    0.6199 O   0  0  0

+    2.2883    0.0174   -0.1798 Cl  0  0  0

+   -0.5672   -1.7488    0.2160 Cl  0  0  0

+   -2.0153    0.7890   -0.1464 Cl  0  0  0

+    0.5694   -0.7225    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2082-81-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 33                          1 V2000

+   -3.0765   -0.2294    0.0000 O   0  0  0

+   -4.2682    0.4005    0.0000 C   0  0  0

+   -1.8470    0.5431    0.0000 C   0  0  0

+   -5.5125   -0.3813    0.0000 C   0  0  0

+   -4.3137    1.6150    0.0000 O   0  0  0

+   -0.6477   -0.4070    0.0000 C   0  0  0

+   -5.4562   -1.8872    0.0000 C   0  0  0

+   -6.6891    0.2406    0.0000 C   0  0  0

+    0.6477    0.4070    0.0000 C   0  0  0

+    1.8470   -0.5431    0.0000 C   0  0  0

+    3.0765    0.2294    0.0000 O   0  0  0

+    4.2682   -0.4005    0.0000 C   0  0  0

+    5.5125    0.3813    0.0000 C   0  0  0

+    4.3137   -1.6150    0.0000 O   0  0  0

+    5.4562    1.8872    0.0000 C   0  0  0

+    6.6891   -0.2406    0.0000 C   0  0  0

+   -1.0786    1.3148    0.0000 H   0  0  0

+   -2.5269    1.3938    0.0000 H   0  0  0

+   -1.4161   -1.1787    0.0000 H   0  0  0

+    0.0322   -1.2577    0.0000 H   0  0  0

+   -6.5445   -1.9279    0.0000 H   0  0  0

+   -5.4155   -2.9755    0.0000 H   0  0  0

+   -4.3679   -1.8465    0.0000 H   0  0  0

+   -6.7298    1.3289    0.0000 H   0  0  0

+   -7.6112   -0.3388    0.0000 H   0  0  0

+    1.4161    1.1787    0.0000 H   0  0  0

+   -0.0322    1.2577    0.0000 H   0  0  0

+    1.0786   -1.3148    0.0000 H   0  0  0

+    2.5269   -1.3938    0.0000 H   0  0  0

+    6.5445    1.9279    0.0000 H   0  0  0

+    5.4155    2.9755    0.0000 H   0  0  0

+    4.3679    1.8465    0.0000 H   0  0  0

+    6.7298   -1.3289    0.0000 H   0  0  0

+    7.6112    0.3388    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  6  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+ 13 15  1  0

+ 13 16  2  0

+  3 17  1  0

+  3 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+535-80-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.9870    0.1732   -0.0034 C   0  0  0

+   -0.2013   -0.5593   -0.0030 C   0  0  0

+    0.9398    1.5689   -0.0010 C   0  0  0

+    2.2889   -0.5250   -0.0001 C   0  0  0

+   -1.4146    0.0999   -0.0003 C   0  0  0

+   -0.2787    2.2151    0.0017 C   0  0  0

+    3.4339    0.1848   -0.0004 O   0  0  0

+    2.3270   -1.7391    0.0029 O   0  0  0

+   -1.4535    1.4839    0.0025 C   0  0  0

+   -2.8941   -0.8083    0.0001 Cl  0  0  0

+   -0.1729   -1.5970    0.0000 H   0  0  0

+    1.8202    2.1190    0.0000 H   0  0  0

+   -0.3146    3.2526    0.0000 H   0  0  0

+    4.3162    0.7318    0.0000 H   0  0  0

+   -2.3680    1.9752    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6  9  1  0

+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+565-64-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+   -0.2357    0.1393   -0.4174 C   0  0  0

+   -1.6482    0.5388   -0.0763 C   0  0  0

+    0.7434    0.9528    0.4315 C   0  0  0

+   -0.0094   -1.6170   -0.0785 Cl  0  0  0

+   -2.5077   -0.3755    0.4002 O   0  0  0

+   -2.0070    1.6820   -0.2319 O   0  0  0

+    2.4334    0.4748    0.0235 Cl  0  0  0

+   -0.4488    1.1448    0.0000 H   0  0  0

+    1.2146    1.8662    0.0000 H   0  0  0

+   -0.0578    1.5966    0.0000 H   0  0  0

+   -3.2117   -1.1244    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+641-90-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.9919    1.0312   -0.0037 C   0  0  0

+   -1.0868   -0.3751   -0.0022 C   0  0  0

+    0.3321    1.6803   -0.0031 C   0  0  0

+   -2.1513    1.8031    0.0001 C   0  0  0

+    0.1365   -1.1988   -0.0005 C   0  0  0

+   -2.3427   -0.9820   -0.0018 C   0  0  0

+    1.5572    0.8531   -0.0009 C   0  0  0

+    0.4159    2.8930   -0.0040 O   0  0  0

+   -3.3920    1.1924    0.0053 C   0  0  0

+    1.4586   -0.5519   -0.0005 C   0  0  0

+    0.0529   -2.4123    0.0011 O   0  0  0

+   -3.4955   -0.1890   -0.0029 C   0  0  0

+   -2.4460   -2.3345    0.0001 O   0  0  0

+    2.8082    1.4563   -0.0002 C   0  0  0

+   -4.6408    2.0359    0.0098 C   0  0  0

+    2.6234   -1.3290    0.0004 C   0  0  0

+   -4.7198   -0.7755   -0.0030 O   0  0  0

+    3.9592    0.6726    0.0020 C   0  0  0

+    3.8664   -0.7101   -0.0002 C   0  0  0

+    2.5378   -2.6823    0.0023 O   0  0  0

+    5.1796    1.2666    0.0022 O   0  0  0

+   -2.0835    2.8453    0.0000 H   0  0  0

+   -2.5255   -3.3758    0.0000 H   0  0  0

+    2.8857    2.4978    0.0000 H   0  0  0

+   -4.0562    2.9013    0.0000 H   0  0  0

+   -5.5062    2.6205    0.0000 H   0  0  0

+   -5.2254    1.1705    0.0000 H   0  0  0

+   -5.6617   -1.2267    0.0000 H   0  0  0

+    4.7354   -1.2893    0.0000 H   0  0  0

+    2.4719   -3.7246    0.0000 H   0  0  0

+    6.1186    1.7237    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

+  3  8  2  0

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+  5 10  1  0

+  5 11  2  0

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+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

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+  7 10  2  0

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+ 15 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+621-96-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.8754    0.3064   -0.0019 C   0  0  0

+    0.4185    0.5253   -0.0019 C   0  0  0

+    2.7483    1.3987   -0.0019 C   0  0  0

+    2.3886   -0.9938    0.0040 C   0  0  0

+   -0.4185   -0.5253   -0.0019 C   0  0  0

+    4.1097    1.1900   -0.0014 C   0  0  0

+    3.7516   -1.1944    0.0044 C   0  0  0

+   -1.8754   -0.3064   -0.0019 C   0  0  0

+    4.6165   -0.1054   -0.0009 C   0  0  0

+   -2.7483   -1.3987   -0.0018 C   0  0  0

+   -2.3886    0.9938    0.0040 C   0  0  0

+    5.9964   -0.3128   -0.0004 N   0  0  0

+   -4.1097   -1.1900   -0.0014 C   0  0  0

+   -3.7516    1.1944    0.0044 C   0  0  0

+   -4.6165    0.1054   -0.0009 C   0  0  0

+   -5.9964    0.3128   -0.0004 N   0  0  0

+    0.0369    1.4963    0.0000 H   0  0  0

+    2.3689    2.3705    0.0000 H   0  0  0

+    1.7403   -1.8112    0.0000 H   0  0  0

+   -0.0369   -1.4963    0.0000 H   0  0  0

+    4.7616    2.0045    0.0000 H   0  0  0

+    4.1354   -2.1645    0.0000 H   0  0  0

+   -2.3689   -2.3705    0.0000 H   0  0  0

+   -1.7403    1.8112    0.0000 H   0  0  0

+    6.3779   -1.2838    0.0000 H   0  0  0

+    6.6465    0.5031    0.0000 H   0  0  0

+   -4.7616   -2.0045    0.0000 H   0  0  0

+   -4.1354    2.1645    0.0000 H   0  0  0

+   -6.3779    1.2838    0.0000 H   0  0  0

+   -6.6465   -0.5031    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

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+  8 10  1  0

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+  9 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 13 15  1  0

+ 15 16  1  0

+  7  9  2  0

+ 14 15  2  0

+  2 17  1  0

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+  7 22  1  0

+ 10 23  1  0

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+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1709-52-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.6004    0.2837   -0.2528 S   0  0  0

+   -0.1520    0.1451   -0.1315 C   0  0  0

+    2.2447   -0.3564    1.1319 N   0  0  0

+    1.9856   -0.5957   -1.3004 O   0  0  0

+    1.8820    1.6756   -0.2021 O   0  0  0

+   -0.8706    1.0867    0.5817 C   0  0  0

+   -0.8060   -0.9022   -0.7546 C   0  0  0

+    2.1204   -1.7908    1.4026 C   0  0  0

+   -2.2444    0.9810    0.6788 C   0  0  0

+   -2.1791   -1.0139   -0.6615 C   0  0  0

+   -2.9038   -0.0727    0.0591 C   0  0  0

+   -4.2928   -0.1828    0.1556 N   0  0  0

+    3.1675   -0.0184    0.0000 H   0  0  0

+   -0.4689    1.9836    0.0000 H   0  0  0

+   -0.2950   -1.7416    0.0000 H   0  0  0

+    1.1413   -1.7060    0.0000 H   0  0  0

+    2.0356   -2.7699    0.0000 H   0  0  0

+    3.0995   -1.8756    0.0000 H   0  0  0

+   -2.7532    1.8218    0.0000 H   0  0  0

+   -2.5769   -1.9125    0.0000 H   0  0  0

+   -4.8499    0.6268    0.0000 H   0  0  0

+   -4.7154   -1.0700    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  6  9  1  0

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+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+55256-58-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 43                          1 V2000

+    2.7731   -0.2378   -0.1242 C   0  0  0

+    1.5734   -0.8560    0.1619 C   0  0  0

+    2.8472    1.1476   -0.2326 C   0  0  0

+    4.1596   -0.7878   -0.3842 C   0  0  1

+    0.4201   -0.0797    0.3212 C   0  0  0

+    1.5122   -2.2055    0.2874 O   0  0  0

+    1.7001    1.9149   -0.0545 C   0  0  0

+    4.1196    1.5497   -0.4979 O   0  0  0

+    4.8808    0.4463   -1.0117 C   0  0  1

+    4.8902   -0.9248    0.9384 C   0  0  0

+    0.4754    1.3211    0.2385 C   0  0  0

+   -0.8937   -0.7113    0.5545 C   0  0  0

+    1.3642   -2.7366   -1.0309 C   0  0  0

+    6.1492    0.4124   -0.3297 O   0  0  0

+    5.9890   -0.2067    0.8610 C   0  0  0

+   -0.5823    2.1134    0.4471 O   0  0  0

+   -2.0415    0.1937    0.3256 C   0  0  0

+   -1.0211   -1.8713    0.9031 O   0  0  0

+   -1.7919    1.5723    0.2680 C   0  0  0

+   -3.3334   -0.3149    0.1672 C   0  0  0

+   -2.8699    2.4229    0.0104 C   0  0  0

+   -4.3835    0.5563   -0.0802 C   0  0  0

+   -3.5586   -1.6503    0.2552 O   0  0  0

+   -4.1396    1.9171   -0.1609 C   0  0  0

+   -5.9948   -0.0555   -0.2878 Cl  0  0  0

+   -3.5093   -2.1661   -1.0765 C   0  0  0

+    3.8757   -1.7696    0.0000 H   0  0  0

+    1.7706    2.9345    0.0000 H   0  0  0

+    5.3679    1.3448    0.0000 H   0  0  0

+    5.0900   -1.9271    0.0000 H   0  0  0

+    0.3796   -2.4622    0.0000 H   0  0  0

+    1.0898   -3.7212    0.0000 H   0  0  0

+    2.3488   -3.0110    0.0000 H   0  0  0

+    6.8193   -0.8027    0.0000 H   0  0  0

+   -2.7228    3.4343    0.0000 H   0  0  0

+   -4.9314    2.5634    0.0000 H   0  0  0

+   -4.5267   -2.2633    0.0000 H   0  0  0

+   -3.4121   -3.1835    0.0000 H   0  0  0

+   -2.4919   -2.0689    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+  5 11  1  0

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+  7 11  2  0

+  8  9  1  0

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+ 15 34  1  0

+ 21 35  1  0

+ 24 36  1  0

+ 26 37  1  0

+ 26 38  1  0

+ 26 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98033-21-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+   -0.2151   -0.5551   -0.0021 C   0  0  0

+   -1.2482    0.4032   -0.0012 C   0  0  0

+    1.1947   -0.1672   -0.0011 C   0  0  0

+   -0.5424   -1.9264    0.0019 C   0  0  0

+   -2.5858   -0.0188   -0.0017 C   0  0  0

+   -1.2821    1.8642    0.0009 C   0  0  0

+    2.1804   -1.1818   -0.0016 C   0  0  0

+    1.5826    1.1753   -0.0001 C   0  0  0

+   -1.8945   -2.3161    0.0063 C   0  0  0

+    0.4875   -2.8946    0.0019 C   0  0  0

+   -3.3688    1.1131   -0.0001 N   0  0  0

+   -2.8845   -1.3851   -0.0036 C   0  0  0

+   -2.5768    2.2267    0.0014 C   0  0  0

+    1.7891   -2.5395   -0.0026 C   0  0  0

+    3.5366   -0.8235   -0.0006 C   0  0  0

+    2.9245    1.4959    0.0004 C   0  0  0

+   -4.8337    1.1227   -0.0005 C   0  0  0

+    3.8933    0.4912    0.0009 C   0  0  0

+    3.3060    2.8001    0.0010 O   0  0  0

+   -0.4526    2.5087    0.0000 H   0  0  0

+    0.8574    1.9352    0.0000 H   0  0  0

+   -2.1412   -3.3372    0.0000 H   0  0  0

+    0.2336   -3.9139    0.0000 H   0  0  0

+   -3.8879   -1.6960    0.0000 H   0  0  0

+   -2.9269    3.2171    0.0000 H   0  0  0

+    2.5266   -3.2875    0.0000 H   0  0  0

+    4.2769   -1.5687    0.0000 H   0  0  0

+   -4.8268    2.1731    0.0000 H   0  0  0

+   -5.8841    1.1296    0.0000 H   0  0  0

+   -4.8406    0.0723    0.0000 H   0  0  0

+    4.9108    0.7522    0.0000 H   0  0  0

+    3.6009    3.8083    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  2  0

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+  3  7  2  0

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+ 15 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10087-89-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 50                          1 V2000

+   -1.2817   -0.2281   -0.4031 C   0  0  0

+   -2.5033   -1.0212   -0.0162 C   0  0  0

+   -1.4725    1.2134   -0.0070 C   0  0  0

+   -0.1186   -0.7675    0.2785 O   0  0  0

+   -1.0813   -0.3145   -1.8588 C   0  0  0

+   -2.3720   -2.1597    0.7564 C   0  0  0

+   -3.7560   -0.6069   -0.4294 C   0  0  0

+   -1.7032    2.1716   -0.9759 C   0  0  0

+   -1.4223    1.5764    1.3261 C   0  0  0

+    1.1006   -0.2462    0.0446 C   0  0  0

+   -0.9215   -0.3835   -3.0198 C   0  0  0

+   -3.4927   -2.8874    1.1113 C   0  0  0

+   -4.8763   -1.3344   -0.0746 C   0  0  0

+   -1.8781    3.4940   -0.6125 C   0  0  0

+   -1.5972    2.8984    1.6894 C   0  0  0

+    2.1953   -0.8298    0.5712 N   0  0  0

+    1.2138    0.7504   -0.6413 O   0  0  0

+   -4.7444   -2.4764    0.6935 C   0  0  0

+   -1.8223    3.8578    0.7197 C   0  0  0

+    3.5219   -0.2626    0.3168 C   0  0  0

+    4.4389   -0.5569    1.5056 C   0  0  0

+    4.1104   -0.8896   -0.9487 C   0  0  0

+    5.8244    0.0354    1.2398 C   0  0  0

+    5.4958   -0.2973   -1.2145 C   0  0  0

+    6.4129   -0.5915   -0.0257 C   0  0  0

+   -1.5302   -2.5560    0.0000 H   0  0  0

+   -3.8750    0.3159    0.0000 H   0  0  0

+   -2.6179    2.0015    0.0000 H   0  0  0

+   -0.4919    1.5737    0.0000 H   0  0  0

+   -0.0673   -0.7523    0.0000 H   0  0  0

+   -3.3727   -3.8100    0.0000 H   0  0  0

+   -5.7181   -0.9382    0.0000 H   0  0  0

+   -2.8085    3.5036    0.0000 H   0  0  0

+   -0.6820    3.0659    0.0000 H   0  0  0

+    2.1554   -1.7594    0.0000 H   0  0  0

+   -5.4654   -3.0645    0.0000 H   0  0  0

+   -1.8587    4.7875    0.0000 H   0  0  0

+    3.4784    0.6668    0.0000 H   0  0  0

+    3.9166   -1.3269    0.0000 H   0  0  0

+    5.0307   -1.2748    0.0000 H   0  0  0

+    3.3625   -1.4431    0.0000 H   0  0  0

+    4.5732   -1.6968    0.0000 H   0  0  0

+    6.5722    0.5889    0.0000 H   0  0  0

+    5.3616    0.8426    0.0000 H   0  0  0

+    6.0180    0.4728    0.0000 H   0  0  0

+    4.9039    0.4206    0.0000 H   0  0  0

+    6.4541   -1.5210    0.0000 H   0  0  0

+    7.2702   -0.2300    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

+  3  9  1  0

+  4 10  1  0

+  5 11  3  0

+  6 12  1  0

+  7 13  2  0

+  8 14  1  0

+  9 15  2  0

+ 10 16  1  0

+ 10 17  2  0

+ 12 18  2  0

+ 14 19  2  0

+ 16 20  1  0

+ 20 21  1  0

+ 20 22  1  0

+ 21 23  1  0

+ 22 24  1  0

+ 23 25  1  0

+ 13 18  1  0

+ 15 19  1  0

+ 24 25  1  0

+  6 26  1  0

+  7 27  1  0

+  8 28  1  0

+  9 29  1  0

+ 11 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 14 33  1  0

+ 15 34  1  0

+ 16 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 21 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+ 23 43  1  0

+ 23 44  1  0

+ 24 45  1  0

+ 24 46  1  0

+ 25 47  1  0

+ 25 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+145-49-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.2367    0.7648    0.0527 C   0  0  0

+   -1.3034   -0.6446    0.0520 C   0  0  0

+    0.0669    1.4337    0.2055 C   0  0  0

+   -2.4079    1.5128   -0.0974 C   0  0  0

+   -0.0670   -1.4340    0.2040 C   0  0  0

+   -2.5378   -1.2780   -0.0929 C   0  0  0

+    1.3030    0.6443    0.0509 C   0  0  0

+    0.1231    2.6231    0.4558 O   0  0  0

+   -3.6329    0.8589   -0.2468 C   0  0  0

+   -2.3537    2.8994   -0.0976 N   0  0  0

+    1.2364   -0.7647    0.0504 C   0  0  0

+   -0.1228   -2.6236    0.4535 O   0  0  0

+   -3.6966   -0.5155   -0.2365 C   0  0  0

+   -2.6108   -2.6324   -0.0946 O   0  0  0

+    2.5375    1.2781   -0.0949 C   0  0  0

+    2.4084   -1.5127   -0.0962 C   0  0  0

+    3.6959    0.5161   -0.2399 C   0  0  0

+    2.6104    2.6326   -0.0951 O   0  0  0

+    3.6336   -0.8588   -0.2408 C   0  0  0

+    2.3543   -2.8993   -0.0984 N   0  0  0

+   -4.5128    1.4147    0.0000 H   0  0  0

+   -1.4327    3.3842    0.0000 H   0  0  0

+   -3.2340    3.4546    0.0000 H   0  0  0

+   -4.6239   -0.9880    0.0000 H   0  0  0

+   -2.6668   -3.6716    0.0000 H   0  0  0

+    4.6229    0.9891    0.0000 H   0  0  0

+    2.6663    3.6719    0.0000 H   0  0  0

+    4.5138   -1.4142    0.0000 H   0  0  0

+    1.4334   -3.3841    0.0000 H   0  0  0

+    3.2346   -3.4544    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+ 11 16  1  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  7 11  2  0

+  9 13  2  0

+ 17 19  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+ 19 28  1  0

+ 20 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-18-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    1.1786    0.0001   -0.2959 C   0  0  0

+    0.0000    0.0001    0.5811 N   0  0  0

+    2.0182    1.2494   -0.0217 C   0  0  0

+    2.0184   -1.2491   -0.0215 C   0  0  0

+   -1.1786   -0.0002   -0.2958 C   0  0  0

+   -2.0182   -1.2494   -0.0213 C   0  0  0

+   -2.0184    1.2491   -0.0217 C   0  0  0

+    0.6479   -0.9962    0.0000 H   0  0  0

+   -0.0001    1.1290    0.0000 H   0  0  0

+    2.9551    0.6197    0.0000 H   0  0  0

+    2.6479    2.1863    0.0000 H   0  0  0

+    1.0813    1.8791    0.0000 H   0  0  0

+    1.0815   -1.8789    0.0000 H   0  0  0

+    2.6482   -2.1860    0.0000 H   0  0  0

+    2.9553   -0.6193    0.0000 H   0  0  0

+   -0.6477   -0.9964    0.0000 H   0  0  0

+   -2.9551   -0.6197    0.0000 H   0  0  0

+   -2.6479   -2.1863    0.0000 H   0  0  0

+   -1.0813   -1.8791    0.0000 H   0  0  0

+   -1.0815    1.8789    0.0000 H   0  0  0

+   -2.6482    2.1860    0.0000 H   0  0  0

+   -2.9553    0.6193    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  5  7  1  0

+  1  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  7 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4901-51-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.5014    0.6220    0.0017 C   0  0  0

+   -1.3827   -0.4442    0.0008 C   0  0  0

+    0.8641    0.3920    0.0010 C   0  0  0

+   -1.1074    2.2487   -0.0035 Cl  0  0  0

+   -0.8972   -1.7448   -0.0009 C   0  0  0

+   -3.0947   -0.1561    0.0023 Cl  0  0  0

+    1.3491   -0.9045   -0.0002 C   0  0  0

+    1.9689    1.7311    0.0022 Cl  0  0  0

+    0.4705   -1.9726   -0.0017 C   0  0  0

+   -1.7618   -2.7938   -0.0014 O   0  0  0

+    3.0615   -1.1900   -0.0006 Cl  0  0  0

+    0.8356   -2.9463    0.0000 H   0  0  0

+   -2.4232   -3.5963    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  5 10  1  0

+  7 11  1  0

+  7  9  1  0

+  9 12  1  0

+ 10 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+590-17-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+   -1.9154   -0.1708    0.0000 C   0  0  0

+   -0.7196   -1.0293    0.0000 C   0  0  0

+   -2.8381    0.4917    0.0000 N   0  0  0

+    0.8937    0.0942    0.0000 Br  0  0  0

+   -1.4607   -1.8476    0.0000 H   0  0  0

+    0.0097   -1.8582    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  3  0

+  2  4  1  0

+  2  5  1  0

+  2  6  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1951-56-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -0.9417    0.0421   -0.0266 C   0  0  0

+   -2.1030   -0.6433   -0.0769 O   0  0  0

+   -1.2475    1.3799    0.1140 C   0  0  0

+    0.3588   -0.5135   -0.0988 C   0  0  0

+   -3.1301    0.2114    0.0265 C   0  0  0

+   -2.6475    1.4682    0.1459 C   0  0  0

+    1.4460    0.2949   -0.0355 C   0  0  0

+   -4.5628   -0.1611    0.0115 N   0  3  0

+    2.7461   -0.2605   -0.1077 C   0  0  0

+   -5.4173    0.7010    0.1129 O   0  0  0

+   -4.8871   -1.3296   -0.1022 O   0  5  0

+    3.8264    0.5428   -0.0447 N   0  0  0

+    2.8883   -1.4640   -0.2268 O   0  0  0

+    5.1719   -0.0319   -0.1195 C   0  0  0

+    6.1241    0.9805   -0.7591 C   0  0  0

+    5.6604   -0.3716    1.2900 C   0  0  0

+   -0.5909    2.1523    0.0000 H   0  0  0

+    0.4780   -1.5202    0.0000 H   0  0  0

+   -3.1950    2.3213    0.0000 H   0  0  0

+    1.3268    1.3016    0.0000 H   0  0  0

+    3.7072    1.5495    0.0000 H   0  0  0

+    4.6809   -0.9188    0.0000 H   0  0  0

+    6.8625    0.2860    0.0000 H   0  0  0

+    6.8186    1.7189    0.0000 H   0  0  0

+    5.3857    1.6750    0.0000 H   0  0  0

+    5.0816   -1.2039    0.0000 H   0  0  0

+    6.4927   -0.9504    0.0000 H   0  0  0

+    6.2392    0.4607    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+  9 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+  5  6  2  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+ 12 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57491-68-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -2.7328    0.0432   -0.0017 C   0  0  0

+   -4.0799    0.4083   -0.0013 C   0  0  0

+   -1.4811    1.2833    0.0003 S   0  0  0

+   -2.3824   -1.2987    0.0022 C   0  0  0

+   -5.0594   -0.5724   -0.0024 C   0  0  0

+   -4.4407    1.7610    0.0006 N   0  0  0

+    0.0000    0.2360   -0.0011 C   0  0  0

+   -3.3666   -2.2702    0.0063 C   0  0  0

+   -4.7007   -1.9083   -0.0039 C   0  0  0

+    1.4811    1.2833    0.0007 S   0  0  0

+    2.7328    0.0432   -0.0010 C   0  0  0

+    4.0799    0.4083   -0.0003 C   0  0  0

+    2.3824   -1.2987    0.0027 C   0  0  0

+    5.0594   -0.5724   -0.0017 C   0  0  0

+    4.4407    1.7610    0.0013 N   0  0  0

+    3.3666   -2.2702    0.0013 C   0  0  0

+    4.7007   -1.9083   -0.0038 C   0  0  0

+   -1.3794   -1.5744    0.0000 H   0  0  0

+   -6.0643   -0.3038    0.0000 H   0  0  0

+   -3.7043    2.4957    0.0000 H   0  0  0

+   -5.4451    2.0314    0.0000 H   0  0  0

+   -0.6927   -0.5400    0.0000 H   0  0  0

+    0.6927   -0.5400    0.0000 H   0  0  0

+   -3.1022   -3.2762    0.0000 H   0  0  0

+   -5.4372   -2.6429    0.0000 H   0  0  0

+    1.3794   -1.5744    0.0000 H   0  0  0

+    6.0643   -0.3038    0.0000 H   0  0  0

+    5.4451    2.0314    0.0000 H   0  0  0

+    3.7043    2.4957    0.0000 H   0  0  0

+    3.1022   -3.2762    0.0000 H   0  0  0

+    5.4372   -2.6429    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+ 12 14  2  0

+ 12 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+  8  9  2  0

+ 16 17  2  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2832-19-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+   -0.1458    0.2134   -0.1636 C   0  0  0

+   -1.3299    0.8566   -0.1867 N   0  0  0

+    1.1141    0.9663    0.1782 C   0  0  0

+   -0.0948   -0.9724   -0.4129 O   0  0  0

+   -2.5547    0.1247   -0.5190 C   0  0  0

+    2.5206   -0.1606    0.1257 Cl  0  0  0

+   -3.1347   -0.4009    0.6766 O   0  0  0

+   -1.3512    1.8968    0.0000 H   0  0  0

+    1.8563    1.6953    0.0000 H   0  0  0

+    0.4783    1.7898    0.0000 H   0  0  0

+   -2.6388    1.1617    0.0000 H   0  0  0

+   -3.5221    0.5075    0.0000 H   0  0  0

+   -3.9056   -1.0995    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+69839-83-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.4610    0.0245    0.0040 C   0  0  0

+    0.4781   -1.0101    0.0034 C   0  0  0

+   -0.0313    1.3538    0.0022 C   0  0  0

+   -1.9039   -0.2864    0.0005 C   0  0  0

+    1.8274   -0.7140    0.0009 C   0  0  0

+    1.3161    1.6424   -0.0003 C   0  0  0

+   -2.8085    0.7127    0.0011 N   0  0  0

+   -2.2765   -1.4437   -0.0029 O   0  0  0

+    2.2493    0.6146   -0.0009 C   0  0  0

+    2.7441   -1.7187   -0.0002 O   0  0  0

+   -4.1928    0.4145   -0.0022 O   0  0  0

+    3.5761    0.9041   -0.0029 O   0  0  0

+    0.1624   -1.9996    0.0000 H   0  0  0

+   -0.7275    2.1246    0.0000 H   0  0  0

+    1.6342    2.6311    0.0000 H   0  0  0

+   -2.4903    1.7014    0.0000 H   0  0  0

+    3.4441   -2.4859    0.0000 H   0  0  0

+   -5.2081    0.1958    0.0000 H   0  0  0

+    4.5908    1.1255    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+  6  9  1  0

+  2 13  1  0

+  3 14  1  0

+  6 15  1  0

+  7 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2871-01-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.0263    0.5393   -0.0963 C   0  0  0

+    0.8085   -0.5692   -0.0513 C   0  0  0

+    0.5146    1.8179   -0.0573 C   0  0  0

+   -1.4128    0.3682   -0.1867 N   0  0  0

+    2.1767   -0.4004    0.0321 C   0  0  0

+    0.2321   -1.9318   -0.0933 N   0  3  0

+    1.8824    1.9866    0.0261 C   0  0  0

+   -2.2936    1.5379   -0.2341 C   0  0  0

+    2.7174    0.8778    0.0710 C   0  0  0

+    0.6648   -2.7990    0.6444 O   0  0  0

+   -0.6749   -2.1859   -0.8655 O   0  5  0

+   -3.7492    1.0766   -0.3313 C   0  0  0

+    4.1043    1.0489    0.1560 N   0  0  0

+   -4.0741    0.2816    0.8109 O   0  0  0

+   -0.1126    2.6487    0.0000 H   0  0  0

+   -1.8194   -0.5901    0.0000 H   0  0  0

+    2.8039   -1.2312    0.0000 H   0  0  0

+    2.2890    2.9449    0.0000 H   0  0  0

+   -1.3968    2.0665    0.0000 H   0  0  0

+   -2.7178    2.4885    0.0000 H   0  0  0

+   -3.8275    2.1146    0.0000 H   0  0  0

+   -4.7775    1.2387    0.0000 H   0  0  0

+    4.7312    0.2179    0.0000 H   0  0  0

+    4.5105    2.0073    0.0000 H   0  0  0

+   -4.4679   -0.6820    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

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+  9 13  1  0

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+  7  9  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112-80-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 53                          1 V2000

+    1.2905   -1.5114    0.3558 C   0  0  0

+    0.4332   -2.6998   -0.0840 C   0  0  0

+    2.7061   -1.6692   -0.2029 C   0  0  0

+   -0.9611   -2.5443    0.4664 C   0  0  0

+    3.5634   -0.4808    0.2369 C   0  0  0

+   -1.9834   -2.4744   -0.3497 C   0  0  0

+    4.9790   -0.6387   -0.3219 C   0  0  0

+   -3.3776   -2.3189    0.2007 C   0  0  0

+    5.8363    0.5498    0.1179 C   0  0  0

+   -3.9933   -1.0222   -0.3289 C   0  0  0

+    7.2519    0.3919   -0.4409 C   0  0  0

+   -5.4088   -0.8643    0.2299 C   0  0  0

+    8.0963    1.5625   -0.0077 C   0  0  0

+   -6.0245    0.4324   -0.2997 C   0  0  0

+    9.3829    1.6374   -0.3832 O   0  0  0

+    7.6154    2.4336    0.6776 O   0  0  0

+   -7.4400    0.5903    0.2591 C   0  0  0

+   -8.0556    1.8870   -0.2705 C   0  0  0

+   -9.4712    2.0449    0.2883 C   0  0  0

+  -10.0868    3.3416   -0.2412 C   0  0  0

+    1.5881   -0.4854    0.0000 H   0  0  0

+    0.3303   -1.0432    0.0000 H   0  0  0

+    0.1356   -3.7258    0.0000 H   0  0  0

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+    5.9392   -1.1069    0.0000 H   0  0  0

+   -4.4104   -2.5920    0.0000 H   0  0  0

+   -3.2989   -3.3843    0.0000 H   0  0  0

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+   -2.9605   -0.7491    0.0000 H   0  0  0

+   -4.0720    0.0432    0.0000 H   0  0  0

+    6.9543   -0.6341    0.0000 H   0  0  0

+    8.2121   -0.0763    0.0000 H   0  0  0

+   -6.4416   -1.1374    0.0000 H   0  0  0

+   -5.3301   -1.9297    0.0000 H   0  0  0

+   -4.9917    0.7055    0.0000 H   0  0  0

+   -6.1032    1.4978    0.0000 H   0  0  0

+   10.4494    1.6995    0.0000 H   0  0  0

+   -8.4728    0.3173    0.0000 H   0  0  0

+   -7.3614   -0.4751    0.0000 H   0  0  0

+   -7.0228    2.1600    0.0000 H   0  0  0

+   -8.1343    2.9524    0.0000 H   0  0  0

+  -10.5040    1.7719    0.0000 H   0  0  0

+   -9.3925    0.9795    0.0000 H   0  0  0

+   -9.1217    3.7998    0.0000 H   0  0  0

+  -10.5450    4.3067    0.0000 H   0  0  0

+  -11.0519    2.8834    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  2  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

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+ 14 17  1  0

+ 17 18  1  0

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+ 19 20  1  0

+  1 21  1  0

+  1 22  1  0

+  2 23  1  0

+  2 24  1  0

+  3 25  1  0

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+  4 27  1  0

+  5 28  1  0

+  5 29  1  0

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+  7 31  1  0

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+  8 33  1  0

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+  9 35  1  0

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+ 19 50  1  0

+ 19 51  1  0

+ 20 52  1  0

+ 20 53  1  0

+ 20 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2451-62-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+   -0.0027   -1.1580    0.4741 N   0  0  0

+   -1.1161   -0.5652   -0.0008 C   0  0  0

+    1.1151   -0.4316    0.6725 C   0  0  0

+   -0.0093   -2.5906    0.7802 C   0  0  0

+   -1.1117    0.7539   -0.2771 N   0  0  0

+   -2.1238   -1.2202   -0.1801 O   0  0  0

+    1.1194    0.8875    0.3962 N   0  0  0

+    2.1190   -0.9661    1.1003 O   0  0  0

+    0.4092   -3.3795   -0.4621 C   0  0  0

+    0.0059    1.4804   -0.0782 C   0  0  0

+   -2.3220    1.3982   -0.7933 C   0  0  0

+    2.3347    1.6769    0.6110 C   0  0  0

+    0.4024   -4.8757   -0.1424 C   0  0  0

+   -0.6581   -4.2420   -0.8606 O   0  0  0

+    0.0096    2.6698   -0.3266 O   0  0  0

+   -3.1675    1.9065    0.3761 C   0  0  0

+    3.1809    1.6676   -0.6637 C   0  0  0

+   -4.4314    2.5794   -0.1629 C   0  0  0

+   -4.4376    1.2518    0.3656 O   0  0  0

+    4.4501    2.4920   -0.4394 C   0  0  0

+    4.4469    1.0638   -0.3906 O   0  0  0

+   -0.9416   -2.2353    0.0000 H   0  0  0

+   -0.6699   -3.3383    0.0000 H   0  0  0

+    1.3779   -3.1408    0.0000 H   0  0  0

+   -3.1862    0.8996    0.0000 H   0  0  0

+   -2.3050    0.4006    0.0000 H   0  0  0

+    2.6664    2.6179    0.0000 H   0  0  0

+    1.5507    2.2940    0.0000 H   0  0  0

+    0.0504   -5.8093    0.0000 H   0  0  0

+    1.3835   -5.0568    0.0000 H   0  0  0

+   -2.6759    2.7747    0.0000 H   0  0  0

+    2.9554    0.6957    0.0000 H   0  0  0

+   -4.1103    3.5240    0.0000 H   0  0  0

+   -5.4154    2.7444    0.0000 H   0  0  0

+    5.4298    2.6809    0.0000 H   0  0  0

+    4.0770    3.4173    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

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+  7 10  1  0

+ 13 14  1  0

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+ 11 25  1  0

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+ 12 28  1  0

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+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88-53-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -2.1868   -0.4300    0.0003 S   0  0  0

+   -2.7329   -0.0442   -1.2536 O   0  0  0

+   -2.7178   -0.0806    1.2712 O   0  0  0

+   -2.1343   -1.9509   -0.0220 O   0  0  0

+   -0.5246    0.1546   -0.0012 C   0  0  0

+   -0.2679    1.5194    0.0020 C   0  0  0

+    0.5243   -0.7442    0.0003 C   0  0  0

+   -1.3270    2.4309    0.0068 N   0  0  0

+    1.0439    1.9768    0.0008 C   0  0  0

+    1.8297   -0.2858   -0.0009 C   0  0  0

+    2.0885    1.0738   -0.0035 C   0  0  0

+    3.1456   -1.4182    0.0015 Cl  0  0  0

+    3.5118    1.5692   -0.0048 C   0  0  0

+   -2.0984   -2.9918    0.0000 H   0  0  0

+    0.3323   -1.7679    0.0000 H   0  0  0

+   -1.1333    3.4543    0.0000 H   0  0  0

+   -2.3101    2.0869    0.0000 H   0  0  0

+    1.2392    2.9999    0.0000 H   0  0  0

+    3.8542    0.5855    0.0000 H   0  0  0

+    4.4955    1.9116    0.0000 H   0  0  0

+    3.1694    2.5529    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  2  0

+  4  1  1  0

+  5  1  1  0

+  6  5  2  0

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+ 10 11  1  0

+  4 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 13 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+513-31-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+   -0.4856    0.3002    0.0033 C   0  0  0

+    0.5274   -0.8156    0.0042 C   0  0  0

+   -0.0855    1.5489   -0.0002 C   0  0  0

+   -2.3336   -0.1006   -0.0006 Br  0  0  0

+    2.3402   -0.0548   -0.0005 Br  0  0  0

+   -0.5068   -1.5600    0.0000 H   0  0  0

+    1.1502   -1.9273    0.0000 H   0  0  0

+    1.1598    1.8189    0.0000 H   0  0  0

+   -0.9420    2.4924    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33229-34-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 39                          1 V2000

+   -1.4739   -0.2395   -0.1899 C   0  0  0

+   -2.8712   -0.2311   -0.1039 N   0  0  0

+   -0.7294    0.7014    0.5096 C   0  0  0

+   -0.8321   -1.1919   -0.9700 C   0  0  0

+   -3.6733    0.1982   -1.2522 C   0  0  0

+   -3.5313   -0.6516    1.1345 C   0  0  0

+    0.6487    0.6932    0.4247 C   0  0  0

+    0.5464   -1.2002   -1.0549 C   0  0  0

+   -3.6972    1.7267   -1.3146 C   0  0  0

+   -3.6419   -2.1774    1.1608 C   0  0  0

+    1.2903   -0.2557   -0.3606 C   0  0  0

+    1.4420    1.6959    1.1702 N   0  3  0

+   -2.4430    2.2030   -1.8065 O   0  0  0

+   -2.3598   -2.7431    1.4405 O   0  0  0

+    2.6876   -0.2638   -0.4471 N   0  0  0

+    1.1318    1.9929    2.3099 O   0  0  0

+    2.4051    2.2240    0.6439 O   0  5  0

+    3.3645   -1.2647   -1.2754 C   0  0  0

+    4.8778   -1.0537   -1.1957 C   0  0  0

+    5.3068   -1.1889    0.1607 O   0  0  0

+   -1.1331    1.5421    0.0000 H   0  0  0

+   -1.2726   -2.0139    0.0000 H   0  0  0

+   -4.5949    0.3407    0.0000 H   0  0  0

+   -3.9688   -0.6863    0.0000 H   0  0  0

+   -3.8546    0.2231    0.0000 H   0  0  0

+   -4.4546   -0.7825    0.0000 H   0  0  0

+    0.9510   -2.0404    0.0000 H   0  0  0

+   -3.9254    2.6309    0.0000 H   0  0  0

+   -4.6217    1.6045    0.0000 H   0  0  0

+   -4.5583   -2.0043    0.0000 H   0  0  0

+   -3.9185   -3.0680    0.0000 H   0  0  0

+   -1.5712    2.5341    0.0000 H   0  0  0

+   -1.5066   -3.1196    0.0000 H   0  0  0

+    3.1273    0.5586    0.0000 H   0  0  0

+    2.5218   -1.6641    0.0000 H   0  0  0

+    3.6317   -2.1582    0.0000 H   0  0  0

+    5.4649   -0.3291    0.0000 H   0  0  0

+    4.4191   -0.2417    0.0000 H   0  0  0

+    6.1963   -1.4692    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 15 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+65267-04-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    0.6325   -0.5358   -0.3542 N   0  0  0

+   -0.3648    0.3707   -0.3643 C   0  0  0

+    2.0064   -0.1166   -0.6421 C   0  0  0

+    0.3781   -1.7717   -0.0858 N   0  0  0

+   -1.6288   -0.0150   -0.0994 N   0  0  0

+   -0.1244    1.5355   -0.6121 O   0  0  0

+    2.7012    0.2833    0.6611 C   0  0  0

+    1.2793   -2.5909   -0.0766 O   0  0  0

+   -2.7128    0.9704   -0.1104 C   0  0  0

+    4.3921    0.7992    0.3067 Cl  0  0  0

+   -4.0161    0.2870    0.2145 C   0  0  0

+   -5.1581    1.0012    0.2615 N   0  0  0

+   -4.0373   -0.9056    0.4335 O   0  0  0

+    1.8548   -1.1057    0.0000 H   0  0  0

+    2.8321   -0.6819    0.0000 H   0  0  0

+   -1.8480   -0.9914    0.0000 H   0  0  0

+    2.8528    1.2724    0.0000 H   0  0  0

+    1.8755    0.8486    0.0000 H   0  0  0

+   -1.9581    1.6275    0.0000 H   0  0  0

+   -3.2775    1.7965    0.0000 H   0  0  0

+   -5.1228    2.0013    0.0000 H   0  0  0

+   -6.0418    0.5317    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

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+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-02-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.5817    0.0001   -0.0011 C   0  0  0

+   -2.0617    0.0000   -0.0006 N   0  3  0

+    0.1084    1.1980    0.0006 C   0  0  0

+    0.1086   -1.1982    0.0025 C   0  0  0

+   -2.6707   -1.0548   -0.0021 O   0  0  0

+   -2.6707    1.0548    0.0013 O   0  5  0

+    1.4900    1.2007    0.0006 C   0  0  0

+    1.4898   -1.2009    0.0025 C   0  0  0

+    2.1848    0.0001   -0.0011 C   0  0  0

+    3.5438    0.0001   -0.0016 O   0  0  0

+   -0.4112    2.0949    0.0000 H   0  0  0

+   -0.4110   -2.0951    0.0000 H   0  0  0

+    2.0069    2.0991    0.0000 H   0  0  0

+    2.0067   -2.0993    0.0000 H   0  0  0

+    4.5803    0.0001    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  7  9  2  0

+  9 10  1  0

+  8  9  1  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+  8 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19770-52-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+    0.0000    0.3388    0.0037 C   0  0  0

+   -1.1463    1.1376    0.0007 C   0  0  0

+    1.1463    1.1376    0.0032 C   0  0  0

+    0.0000   -1.1088    0.0014 C   0  0  0

+   -2.3877    0.4629   -0.0003 C   0  0  0

+   -0.6836    2.4705    0.0000 C   0  0  0

+    2.3877    0.4629    0.0027 C   0  0  0

+    0.6837    2.4705    0.0018 C   0  0  0

+   -1.2381   -1.7667   -0.0020 C   0  0  0

+    1.2381   -1.7667    0.0005 C   0  0  0

+   -2.4150   -1.0047    0.0061 C   0  0  0

+   -3.6002    1.1655   -0.0082 C   0  0  0

+    2.4149   -1.0048    0.0009 C   0  0  0

+    3.6002    1.1655    0.0042 C   0  0  0

+   -3.6717   -1.6508    0.0072 C   0  0  0

+   -4.7778    0.4816   -0.0083 C   0  0  0

+    3.6716   -1.6509   -0.0054 C   0  0  0

+    4.7779    0.4817   -0.0012 C   0  0  0

+   -4.8105   -0.9108    0.0000 C   0  0  0

+    4.8105   -0.9108   -0.0070 C   0  0  0

+   -1.2931    3.3273    0.0000 H   0  0  0

+    1.2933    3.3273    0.0000 H   0  0  0

+   -1.2834   -2.8172    0.0000 H   0  0  0

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+   -3.6007    2.2170    0.0000 H   0  0  0

+    3.6007    2.2170    0.0000 H   0  0  0

+   -3.7250   -2.7009    0.0000 H   0  0  0

+   -5.6829    1.0168    0.0000 H   0  0  0

+    3.7249   -2.7010    0.0000 H   0  0  0

+    5.6830    1.0170    0.0000 H   0  0  0

+   -5.7405   -1.4015    0.0000 H   0  0  0

+    5.7404   -1.4015    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  6  8  2  0

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+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75607-61-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 42                          1 V2000

+    0.7667   -0.5148   -0.1173 C   0  0  2

+   -0.4063    0.0804    0.5277 N   0  0  0

+    0.9577   -1.9219    0.3874 C   0  0  0

+    2.0073    0.3179    0.2122 C   0  0  0

+   -1.6232   -0.0468   -0.0375 C   0  0  0

+    1.9820   -2.6687   -0.0702 N   0  0  0

+    0.1895   -2.3822    1.2053 O   0  0  0

+    1.7775    2.0116   -0.3952 S   0  0  0

+   -2.8298    0.5654    0.6260 C   0  0  0

+   -1.7472   -0.6540   -1.0800 O   0  0  0

+    2.1676   -4.0366    0.4204 C   0  0  0

+    3.3539    2.7473    0.1188 C   0  0  0

+   -4.0753    0.2771   -0.2146 C   0  0  0

+    3.3742   -4.6489   -0.2431 C   0  0  0

+    3.3905    4.2186   -0.2992 C   0  0  0

+   -5.3003    0.8986    0.4590 C   0  0  1

+    3.7388   -5.9058    0.0553 O   0  0  0

+    4.0136   -4.0083   -1.0436 O   0  0  0

+    4.9574    4.9498    0.2117 Cl  0  0  0

+   -6.5271    0.6146   -0.3689 C   0  0  0

+   -5.4690    0.3198    1.7986 N   0  0  0

+   -6.9005    1.4724   -1.3315 O   0  0  0

+   -7.1745   -0.3852   -0.1663 O   0  0  0

+   -0.0353   -1.0850    0.0000 H   0  0  0

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+    2.4256   -0.5728    0.0000 H   0  0  0

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+    2.8271   -2.1646    0.0000 H   0  0  0

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+   -4.7538   -0.4356    0.0000 H   0  0  0

+   -3.5874   -0.5775    0.0000 H   0  0  0

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+    2.4146    4.0921    0.0000 H   0  0  0

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+    4.0129   -6.8509    0.0000 H   0  0  0

+   -6.4248    0.0859    0.0000 H   0  0  0

+   -4.7885   -0.3910    0.0000 H   0  0  0

+   -7.2933    2.3747    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 40  1  0

+ 21 41  1  0

+ 21 42  1  0

+ 22 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6724-53-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 68                          1 V2000

+   -5.7939    0.2300   -0.1853 C   0  0  0

+   -7.0137    0.4529   -1.0817 C   0  0  0

+   -5.6596    1.3987    0.7930 C   0  0  0

+   -5.9677   -1.0730    0.5976 C   0  0  0

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+   -6.7979    1.3426    1.8138 C   0  0  0

+   -4.3170    1.3031    1.5204 C   0  0  0

+   -4.6141   -1.7744    0.7273 C   0  0  0

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+   -8.2663   -0.3954   -3.0701 C   0  0  0

+   -6.6636    2.5112    2.7921 C   0  0  0

+   -4.1827    2.4717    2.4987 C   0  0  0

+   -4.7454   -2.9638    1.6806 C   0  0  0

+   -4.1774   -2.2421   -0.5926 N   0  0  0

+   -8.1784    0.9888   -3.7159 C   0  0  0

+   -5.3209    2.4157    3.5196 C   0  0  0

+   -3.3785   -3.6375    1.8366 C   0  0  0

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+ 21 64  1  0

+ 22 65  1  0

+ 25 66  1  0

+ 27 67  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6639-36-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -0.1256    0.0272   -0.0030 C   0  0  0

+   -1.4804   -0.5690   -0.0017 C   0  0  0

+   -0.0745    1.4291   -0.0011 C   0  0  0

+    1.1085   -0.6570   -0.0004 C   0  0  0

+   -2.5484    0.3401    0.0013 C   0  0  0

+   -1.8095   -1.9415   -0.0036 C   0  0  0

+   -1.7747    1.9369    0.0023 S   0  0  0

+    1.1201    2.1199   -0.0017 C   0  0  0

+    2.2926    0.0365   -0.0016 C   0  0  0

+   -3.8650   -0.0744    0.0028 C   0  0  0

+   -3.1203   -2.3461   -0.0025 C   0  0  0

+    2.3130    1.4228   -0.0042 C   0  0  0

+    3.5714   -0.7090    0.0013 N   0  3  0

+   -4.1567   -1.4245    0.0014 C   0  0  0

+    4.6287   -0.1045    0.0002 O   0  0  0

+    3.5662   -1.9270    0.0047 O   0  5  0

+    1.1208   -1.6969    0.0000 H   0  0  0

+   -1.0509   -2.6530    0.0000 H   0  0  0

+    1.1225    3.1599    0.0000 H   0  0  0

+   -4.6335    0.6263    0.0000 H   0  0  0

+   -3.3409   -3.3624    0.0000 H   0  0  0

+    3.2188    1.9338    0.0000 H   0  0  0

+   -5.1453   -1.7473    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  8 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5273-86-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    0.9296    0.7591    0.3839 C   0  0  0

+    0.9333   -0.6405    0.3731 C   0  0  0

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+    2.0758   -1.3203    0.6549 O   0  0  0

+   -1.4023    0.7546   -0.2037 C   0  0  0

+    3.1814    1.5006   -0.1450 C   0  0  0

+   -1.3944   -0.6387   -0.2133 C   0  0  0

+    2.2048   -2.3404   -0.3375 C   0  0  0

+   -2.5496    1.4293   -0.4867 O   0  0  0

+    3.2189    0.5016   -1.2726 C   0  0  0

+   -2.5334   -1.3208   -0.5060 O   0  0  0

+   -2.6889    2.4435    0.5103 C   0  0  0

+   -2.6650   -2.3471    0.4796 C   0  0  0

+   -0.2527    2.4505    0.0000 H   0  0  0

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+    2.3300   -3.3308    0.0000 H   0  0  0

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+   -2.7920   -3.3372    0.0000 H   0  0  0

+   -1.6749   -2.4741    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94339-56-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.6821   -0.2331    0.0600 C   0  0  0

+   -2.0591    0.0438   -0.0089 C   0  0  0

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+   -4.7740    0.5897   -0.1435 C   0  0  0

+    3.5189   -1.0955    0.2734 C   0  0  0

+    3.8828    1.3460   -0.0678 C   0  0  0

+    4.3002   -0.0333   -0.4968 C   0  0  0

+    5.6987   -0.2038   -0.2576 O   0  0  0

+    0.4630    2.9596    0.0000 H   0  0  0

+    1.4805   -2.8335    0.0000 H   0  0  0

+   -0.8576   -3.6233    0.0000 H   0  0  0

+   -1.8826    3.4339    0.0000 H   0  0  0

+   -4.2286    2.6327    0.0000 H   0  0  0

+   -3.2028   -3.1527    0.0000 H   0  0  0

+   -5.0580   -1.5067    0.0000 H   0  0  0

+    2.3000    2.6130    0.0000 H   0  0  0

+   -5.8078    0.7969    0.0000 H   0  0  0

+    3.1646   -2.0885    0.0000 H   0  0  0

+    4.4499   -1.5902    0.0000 H   0  0  0

+    4.5944    2.1240    0.0000 H   0  0  0

+    3.2611    0.1452    0.0000 H   0  0  0

+    6.7453   -0.3314    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+ 12 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 18 20  1  0

+ 20 21  1  0

+  8 11  2  0

+  9 15  1  0

+ 10 13  2  0

+ 14 17  1  0

+ 19 20  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+462-60-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    1.8245   -0.0180   -0.0013 C   0  0  0

+    0.4740    0.6506    0.0000 C   0  0  0

+    2.9418    0.7259   -0.0007 O   0  0  0

+    1.9016   -1.2238    0.0021 O   0  0  0

+   -0.5765   -0.3705   -0.0010 N   0  0  0

+   -1.8733   -0.0033   -0.0001 C   0  0  0

+   -2.8397   -0.9427   -0.0010 N   0  0  0

+   -2.1713    1.1755    0.0015 O   0  0  0

+    1.0220    1.5000    0.0000 H   0  0  0

+   -0.3080    1.2911    0.0000 H   0  0  0

+    3.7832    1.2861    0.0000 H   0  0  0

+   -0.3287   -1.3505    0.0000 H   0  0  0

+   -3.8123   -0.6673    0.0000 H   0  0  0

+   -2.5919   -1.9227    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  6  8  2  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  7 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-58-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -1.3993    0.0001   -0.3823 N   0  0  0

+   -0.7400   -1.1792    0.1921 C   0  0  0

+   -0.7400    1.1792    0.1924 C   0  0  0

+   -2.7789    0.0000    0.1222 C   0  0  0

+    0.7400   -1.1792   -0.1924 C   0  0  0

+    0.7400    1.1792   -0.1921 C   0  0  0

+    1.3993   -0.0001    0.3823 N   0  0  0

+    2.7789    0.0000   -0.1222 C   0  0  0

+   -1.7054   -1.5205    0.0000 H   0  0  0

+   -0.5668   -2.1885    0.0000 H   0  0  0

+   -0.5668    2.1885    0.0000 H   0  0  0

+   -1.7054    1.5206    0.0000 H   0  0  0

+   -2.7790    1.0240    0.0000 H   0  0  0

+   -3.8029   -0.0001    0.0000 H   0  0  0

+   -2.7788   -1.0240    0.0000 H   0  0  0

+    0.5668   -2.1885    0.0000 H   0  0  0

+    1.7054   -1.5206    0.0000 H   0  0  0

+    1.7054    1.5205    0.0000 H   0  0  0

+    0.5668    2.1885    0.0000 H   0  0  0

+    2.7790   -1.0240    0.0000 H   0  0  0

+    3.8029    0.0001    0.0000 H   0  0  0

+    2.7788    1.0240    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  6  7  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+70055-49-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+   -3.7058    1.4268    0.0203 C   0  0  0

+   -4.3540    0.2906    0.5312 C   0  0  0

+   -2.3822    1.3304   -0.4376 C   0  0  0

+   -4.4102    2.7064   -0.0403 C   0  0  0

+   -3.6967   -0.9030    0.5815 C   0  0  0

+   -1.7291    0.1342   -0.3852 C   0  0  0

+   -3.7911    3.7889   -0.5277 O   0  0  0

+   -5.6745    2.7958    0.3916 O   0  0  0

+   -2.3772   -0.9964    0.1244 C   0  0  0

+   -1.7202   -2.1942    0.1763 N   0  0  0

+   -0.5040   -2.2815   -0.2448 N   0  0  0

+    0.1693   -3.5090   -0.1916 N   0  0  0

+   -0.5079   -4.6934    0.3421 C   0  0  0

+    1.5505   -3.6082   -0.6698 C   0  0  0

+   11.2483    1.4912    0.1284 K   0  3  0

+   -5.3626    0.2982    0.0000 H   0  0  0

+   -1.8363    2.1786    0.0000 H   0  0  0

+   -4.2402   -1.7527    0.0000 H   0  0  0

+   -0.7205    0.1237    0.0000 H   0  0  0

+   -1.3835   -4.1927    0.0000 H   0  0  0

+   -1.0086   -5.5690    0.0000 H   0  0  0

+    0.3677   -5.1941    0.0000 H   0  0  0

+    1.4782   -4.6143    0.0000 H   0  0  0

+    2.5566   -3.6805    0.0000 H   0  0  0

+    1.6228   -2.6021    0.0000 H   0  0  0

+   -6.6806    2.8669    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  2  0

+ 11 12  1  0

+ 12 13  1  0

+ 12 14  1  0

+  6  9  2  0

+  2 16  1  0

+  3 17  1  0

+  5 18  1  0

+  6 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+  8 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+159092-79-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.4769   -1.2107   -0.0038 C   0  0  0

+   -0.9634   -1.4828   -0.0206 C   0  0  0

+    0.9135    0.1332    0.0098 C   0  0  0

+    1.4161   -2.2436    0.0047 C   0  0  0

+   -1.8605   -0.3905   -0.0225 C   0  0  0

+   -1.4610   -2.7867   -0.0351 C   0  0  0

+   -0.0351    1.1823    0.0075 C   0  0  0

+    2.2890    0.4048    0.0259 C   0  0  0

+    2.7491   -1.9462    0.0208 C   0  0  0

+   -3.2399   -0.6392   -0.0385 C   0  0  0

+   -1.3598    0.9323   -0.0089 C   0  0  0

+   -2.8109   -2.9961   -0.0509 C   0  0  0

+    0.4368    2.5853    0.0219 N   0  3  0

+    3.1826   -0.6257    0.0282 C   0  0  0

+   -3.6960   -1.9250   -0.0519 C   0  0  0

+   -4.1981    0.4890   -0.0403 N   0  3  0

+   -0.0462    3.3822    0.8061 O   0  0  0

+    1.3081    2.9426   -0.7506 O   0  5  0

+    4.6336   -0.3337    0.0453 N   0  3  0

+   -5.1476    0.4828    0.7225 O   0  0  0

+   -4.0371    1.4236   -0.8046 O   0  5  0

+    5.4388   -1.2477    0.0475 O   0  0  0

+    5.0225    0.8205    0.0572 O   0  5  0

+    1.1014   -3.2373    0.0000 H   0  0  0

+   -0.8055   -3.5972    0.0000 H   0  0  0

+    2.6275    1.3907    0.0000 H   0  0  0

+    3.4493   -2.7184    0.0000 H   0  0  0

+   -2.0295    1.7311    0.0000 H   0  0  0

+   -3.1812   -3.9705    0.0000 H   0  0  0

+   -4.7225   -2.1063    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  1  0

+ 10 16  1  0

+ 13 17  2  0

+ 13 18  1  0

+ 14 19  1  0

+ 16 20  2  0

+ 16 21  1  0

+ 19 22  2  0

+ 19 23  1  0

+  7 11  2  0

+  9 14  1  0

+ 12 15  2  0

+  4 24  1  0

+  6 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7085-19-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    0.1285   -0.4437    0.3594 C   0  0  0

+   -0.8514   -1.4132    0.2057 C   0  0  0

+    1.4245   -0.8093    0.5442 O   0  0  0

+   -0.2151    0.8999    0.3185 C   0  0  0

+   -2.1682   -1.0395    0.0175 C   0  0  0

+   -0.4800   -2.8732    0.2435 C   0  0  0

+    2.1736   -0.2306   -0.5263 C   0  0  1

+   -1.5317    1.2696    0.1249 C   0  0  0

+   -2.5095    0.3007   -0.0177 C   0  0  0

+    3.2107    0.7072    0.0358 C   0  0  0

+    2.8661   -1.3391   -1.3217 C   0  0  0

+   -4.1647    0.7677   -0.2543 Cl  0  0  0

+    4.0360    1.3685   -0.7907 O   0  0  0

+    3.2992    0.8639    1.2306 O   0  0  0

+    0.5213    1.6193    0.0000 H   0  0  0

+   -2.9060   -1.7575    0.0000 H   0  0  0

+   -1.4777   -3.1270    0.0000 H   0  0  0

+   -0.2262   -3.8709    0.0000 H   0  0  0

+    0.5177   -2.6194    0.0000 H   0  0  0

+    1.5132    0.5591    0.0000 H   0  0  0

+   -1.7899    2.2662    0.0000 H   0  0  0

+    1.9930   -1.8846    0.0000 H   0  0  0

+    3.4116   -2.2122    0.0000 H   0  0  0

+    3.7392   -0.7936    0.0000 H   0  0  0

+    4.8394    2.0123    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+  7 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+  8  9  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2213-63-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -1.3862    0.7087   -0.0026 C   0  0  0

+   -1.3863   -0.7088   -0.0019 C   0  0  0

+   -0.2232    1.3700   -0.0021 N   0  0  0

+   -2.6118    1.3970    0.0020 C   0  0  0

+   -0.2232   -1.3700   -0.0008 N   0  0  0

+   -2.6119   -1.3970   -0.0020 C   0  0  0

+    0.9073    0.7000   -0.0009 C   0  0  0

+   -3.7788    0.6970    0.0071 C   0  0  0

+    0.9072   -0.7000   -0.0003 C   0  0  0

+   -3.7788   -0.6969   -0.0027 C   0  0  0

+    2.4156    1.5595   -0.0002 Cl  0  0  0

+    2.4156   -1.5595    0.0018 Cl  0  0  0

+   -2.6267    2.4423    0.0000 H   0  0  0

+   -2.6269   -2.4423    0.0000 H   0  0  0

+   -4.6885    1.2121    0.0000 H   0  0  0

+   -4.6885   -1.2120    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  9 12  1  0

+  7  9  2  0

+  8 10  1  0

+  4 13  1  0

+  6 14  1  0

+  8 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-18-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    1.8296    0.0000   -0.3806 N   0  0  0

+    0.5744    0.4451    0.2392 C   0  0  0

+    2.8857    0.8912    0.1177 C   0  0  0

+    2.1158   -1.3363    0.1582 C   0  0  0

+   -0.5744   -0.4451   -0.2392 C   0  0  0

+   -1.8296    0.0000    0.3806 N   0  0  0

+   -2.1158    1.3363   -0.1582 C   0  0  0

+   -2.8857   -0.8912   -0.1177 C   0  0  0

+    1.0935    1.3289    0.0000 H   0  0  0

+   -0.1953    1.1219    0.0000 H   0  0  0

+    3.5467    0.1079    0.0000 H   0  0  0

+    3.6690    1.5522    0.0000 H   0  0  0

+    2.2247    1.6745    0.0000 H   0  0  0

+    1.1136   -1.5509    0.0000 H   0  0  0

+    2.3304   -2.3385    0.0000 H   0  0  0

+    3.1180   -1.1217    0.0000 H   0  0  0

+   -1.0935   -1.3289    0.0000 H   0  0  0

+    0.1953   -1.1219    0.0000 H   0  0  0

+   -1.1136    1.5509    0.0000 H   0  0  0

+   -2.3304    2.3385    0.0000 H   0  0  0

+   -3.1180    1.1217    0.0000 H   0  0  0

+   -3.5467   -0.1079    0.0000 H   0  0  0

+   -3.6690   -1.5522    0.0000 H   0  0  0

+   -2.2247   -1.6745    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  6  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  7 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  8 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-84-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.6211    0.7943    0.0018 C   0  0  0

+   -1.0472   -0.5321    0.0004 C   0  0  0

+    0.7358    1.0831    0.0017 C   0  0  0

+   -1.5595    1.8328   -0.0025 N   0  0  0

+   -0.1141   -1.5557   -0.0011 C   0  0  0

+   -2.3762   -0.8212    0.0009 O   0  0  0

+    1.6605    0.0557    0.0002 C   0  0  0

+    1.2368   -1.2603   -0.0013 C   0  0  0

+    3.1342    0.3709    0.0000 C   0  0  0

+    1.0568    2.0711    0.0000 H   0  0  0

+   -1.2402    2.8213    0.0000 H   0  0  0

+   -2.5752    1.6150    0.0000 H   0  0  0

+   -0.4292   -2.5456    0.0000 H   0  0  0

+   -3.3913   -1.0420    0.0000 H   0  0  0

+    1.9352   -2.0293    0.0000 H   0  0  0

+    3.3515   -0.6449    0.0000 H   0  0  0

+    4.1500    0.5882    0.0000 H   0  0  0

+    2.9169    1.3867    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+114460-40-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.2391    0.4822   -0.0029 C   0  0  0

+   -1.1813   -0.5672   -0.0017 C   0  0  0

+    1.1998    0.2199   -0.0018 C   0  0  0

+   -0.6866    1.8188    0.0006 C   0  0  0

+   -2.5475   -0.2581   -0.0023 C   0  0  0

+   -1.0788   -1.9177   -0.0006 N   0  0  0

+    2.0918    1.3176   -0.0028 C   0  0  0

+    1.7045   -1.0829    0.0007 C   0  0  0

+   -2.0671    2.0895    0.0050 C   0  0  0

+    0.2542    2.8743   -0.0007 C   0  0  0

+   -2.9696    1.0723   -0.0035 C   0  0  0

+   -3.2115   -1.4680   -0.0015 N   0  0  0

+   -2.2685   -2.4469   -0.0005 C   0  0  0

+    1.5819    2.6354   -0.0052 C   0  0  0

+    3.4744    1.0805   -0.0017 C   0  0  0

+    3.0696   -1.2838    0.0021 C   0  0  0

+   -2.5494    3.5173    0.0094 C   0  0  0

+   -2.5572   -3.9260    0.0006 C   0  0  0

+    3.9458   -0.1975    0.0003 C   0  0  0

+    3.5648   -2.5492    0.0050 O   0  0  0

+    1.0508   -1.9018    0.0000 H   0  0  0

+   -0.0877    3.8648    0.0000 H   0  0  0

+   -3.9946    1.2900    0.0000 H   0  0  0

+   -4.2502   -1.6063    0.0000 H   0  0  0

+    2.2488    3.4437    0.0000 H   0  0  0

+    4.1443    1.8862    0.0000 H   0  0  0

+   -1.5567    3.8526    0.0000 H   0  0  0

+   -2.8847    4.5100    0.0000 H   0  0  0

+   -3.5421    3.1820    0.0000 H   0  0  0

+   -3.5856   -3.7253    0.0000 H   0  0  0

+   -2.7579   -4.9545    0.0000 H   0  0  0

+   -1.5287   -4.1267    0.0000 H   0  0  0

+    4.9798   -0.3672    0.0000 H   0  0  0

+    3.9467   -3.5250    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+  7 15  1  0

+  8 16  2  0

+  9 17  1  0

+ 13 18  1  0

+ 15 19  2  0

+ 16 20  1  0

+  9 11  2  0

+ 10 14  2  0

+ 12 13  1  0

+ 16 19  1  0

+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-32-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -1.2031   -0.2260    0.1236 C   0  0  0

+   -2.3765    0.5964   -0.0322 C   0  0  0

+    0.1460    0.3603    0.1678 C   0  0  0

+   -1.4012   -1.5867    0.2353 C   0  0  0

+   -3.5673   -0.0335   -0.0614 C   0  0  0

+    1.2228   -0.4368    0.3146 N   0  0  0

+    0.2893    1.5645    0.0719 O   0  0  0

+   -3.1223   -1.7471    0.1324 S   0  0  0

+   -4.9171    0.5561   -0.2086 N   0  3  0

+    2.5099    0.1029    0.2247 C   0  0  0

+   -5.8990   -0.1646   -0.2150 O   0  0  0

+   -5.0459    1.7618   -0.3232 O   0  5  0

+    3.6184   -0.7341    0.2409 C   0  0  0

+    2.6824    1.4763    0.1132 C   0  0  0

+    4.8878   -0.1981    0.1520 C   0  0  0

+    3.9549    2.0061    0.0247 C   0  0  0

+    5.0563    1.1707    0.0469 C   0  0  0

+    6.0910   -1.1053    0.1701 C   0  0  0

+    6.4413   -1.5163   -1.2615 C   0  0  0

+   -2.3119    1.6300    0.0000 H   0  0  0

+   -0.6881   -2.3376    0.0000 H   0  0  0

+    1.0987   -1.4649    0.0000 H   0  0  0

+    3.4907   -1.7618    0.0000 H   0  0  0

+    1.8584    2.1035    0.0000 H   0  0  0

+    4.0863    3.0333    0.0000 H   0  0  0

+    6.0102    1.5737    0.0000 H   0  0  0

+    7.0930   -0.8439    0.0000 H   0  0  0

+    6.2921   -0.0894    0.0000 H   0  0  0

+    5.6532   -2.1880    0.0000 H   0  0  0

+    7.1130   -2.3044    0.0000 H   0  0  0

+    7.2294   -0.8446    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+ 18 19  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 20  1  0

+  4 21  1  0

+  6 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2243-47-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.3954   -0.2620    0.0557 C   0  0  0

+   -1.0745   -0.0618    0.0177 C   0  0  0

+    1.2521    0.8077   -0.1907 C   0  0  0

+    0.9219   -1.5197    0.3437 C   0  0  0

+   -1.8981   -1.0330   -0.5482 C   0  0  0

+   -1.6365    1.0952    0.5529 C   0  0  0

+    2.6249    0.6139   -0.1537 C   0  0  0

+    2.2899   -1.7047    0.3786 C   0  0  0

+   -3.2644   -0.8419   -0.5804 C   0  0  0

+   -3.0045    1.2761    0.5153 C   0  0  0

+    3.1411   -0.6455    0.1287 C   0  0  0

+    3.4885    1.6838   -0.4006 N   0  0  0

+   -3.8168    0.3113   -0.0522 C   0  0  0

+    0.8741    1.7607    0.0000 H   0  0  0

+    0.2979   -2.3331    0.0000 H   0  0  0

+   -1.5329   -1.9910    0.0000 H   0  0  0

+   -1.0366    1.9266    0.0000 H   0  0  0

+    2.6699   -2.6569    0.0000 H   0  0  0

+   -3.8697   -1.6694    0.0000 H   0  0  0

+   -3.3750    2.2320    0.0000 H   0  0  0

+    4.1557   -0.7926    0.0000 H   0  0  0

+    4.5014    1.5250    0.0000 H   0  0  0

+    3.1196    2.6403    0.0000 H   0  0  0

+   -4.8338    0.4407    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  9 13  1  0

+  8 11  2  0

+ 10 13  2  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64-18-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  5  4                          1 V2000

+    0.0618   -0.4614    0.0000 C   0  0  0

+   -1.1280    0.1599    0.0000 O   0  0  0

+    1.0817    0.1864    0.0000 O   0  0  0

+    0.1023   -1.4170    0.0000 H   0  0  0

+   -1.9758    0.6026    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105052-38-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -1.0783    0.0021    0.0020 C   0  0  0

+   -0.3995   -1.2970    0.0015 C   0  0  0

+   -0.2954    1.1644    0.0013 C   0  0  0

+   -2.4856    0.0572   -0.0027 C   0  0  0

+    0.9928   -1.2710    0.0004 C   0  0  0

+   -1.2185   -2.5080    0.0027 C   0  0  0

+    1.0364    1.0419    0.0007 O   0  0  0

+   -0.9523    2.4139    0.0017 C   0  0  0

+   -3.2149   -1.1438   -0.0082 C   0  0  0

+   -3.1028    1.3201   -0.0022 C   0  0  0

+    1.6229   -0.0238   -0.0002 C   0  0  0

+   -2.5784   -2.3840    0.0042 C   0  0  0

+   -2.3171    2.4708    0.0027 C   0  0  0

+    3.1032    0.0023   -0.0009 N   0  3  0

+    3.6935    1.0677   -0.0014 O   0  0  0

+    3.8327   -1.2114   -0.0009 O   0  5  0

+    1.5510   -2.1597    0.0000 H   0  0  0

+   -0.7690   -3.4564    0.0000 H   0  0  0

+   -0.3911    3.3007    0.0000 H   0  0  0

+   -4.2637   -1.1063    0.0000 H   0  0  0

+   -4.1496    1.3959    0.0000 H   0  0  0

+   -3.1656   -3.2539    0.0000 H   0  0  0

+   -2.7877    3.4089    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 11 14  1  0

+ 14 15  2  0

+ 14 16  1  0

+  7 11  1  0

+  9 12  2  0

+ 10 13  1  0

+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+148193-38-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    0.1815    0.7171   -0.3578 C   0  0  0

+    0.3872   -0.6795   -0.2950 C   0  0  0

+    1.8236    1.3719   -0.4818 S   0  0  0

+   -1.0803    1.2706   -0.3136 C   0  0  0

+    1.7938   -1.0536   -0.3517 C   0  0  0

+   -0.7612   -1.4950   -0.1889 C   0  0  0

+    2.7163   -0.0833   -0.4532 N   0  0  0

+   -2.1842    0.4396   -0.2045 C   0  0  0

+    2.1271   -2.2255   -0.3081 O   0  0  0

+   -2.0020   -0.9422   -0.1503 C   0  0  0

+    4.1713   -0.2392   -0.5236 C   0  0  0

+   -3.4347    0.9665   -0.1591 O   0  0  0

+    4.7555   -0.2181    0.8903 C   0  0  0

+   -4.3419   -0.1319   -0.0473 C   0  0  0

+    6.2750   -0.3809    0.8167 C   0  0  0

+    5.6505    0.8883    1.0194 O   0  0  0

+   -5.7770    0.3956    0.0089 C   0  0  0

+   -6.7483   -0.7805    0.1286 C   0  0  0

+   -6.3741    0.0200    1.2516 O   0  0  0

+   -1.2026    2.3211    0.0000 H   0  0  0

+   -0.6565   -2.5474    0.0000 H   0  0  0

+   -2.8494   -1.5749    0.0000 H   0  0  0

+    3.5893   -1.1222    0.0000 H   0  0  0

+    4.6895   -1.1611    0.0000 H   0  0  0

+    4.7182   -1.2750    0.0000 H   0  0  0

+   -4.8161   -1.0772    0.0000 H   0  0  0

+   -3.4559   -0.7094    0.0000 H   0  0  0

+    6.3608   -1.4350    0.0000 H   0  0  0

+    7.2945   -0.0996    0.0000 H   0  0  0

+   -5.8874    1.4474    0.0000 H   0  0  0

+   -7.8059   -0.7826    0.0000 H   0  0  0

+   -6.2967   -1.7368    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+ 17 18  1  0

+ 17 19  1  0

+  5  7  1  0

+  8 10  1  0

+ 15 16  1  0

+ 18 19  1  0

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+ 10 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 13 25  1  0

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+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+491-64-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -1.3211    0.8939    0.2377 C   0  0  0

+   -1.3436   -0.5061    0.1295 C   0  0  0

+   -0.2242    1.5957    0.5383 O   0  0  0

+   -2.5166    1.5849    0.0382 C   0  0  0

+   -0.0667   -1.2330    0.2683 C   0  0  0

+   -2.5369   -1.1963   -0.1164 C   0  0  0

+    0.9576    1.0169    0.2986 C   0  0  0

+   -3.6900    0.9023   -0.2283 C   0  0  0

+    1.1321   -0.3671    0.1677 C   0  0  0

+   -0.0036   -2.4354    0.4499 O   0  0  0

+   -3.7094   -0.4863   -0.2996 C   0  0  0

+   -2.5426   -2.5517   -0.1750 O   0  0  0

+    2.0857    1.8350    0.1777 C   0  0  0

+   -4.8389    1.5980   -0.4230 O   0  0  0

+    2.3910   -0.9193   -0.0529 C   0  0  0

+    3.3271    1.2880   -0.0473 C   0  0  0

+    3.4917   -0.0888   -0.1597 C   0  0  0

+    4.7271   -0.6147   -0.3737 O   0  0  0

+    5.6387    0.4840   -0.4355 C   0  0  0

+   -2.5180    2.6188    0.0000 H   0  0  0

+   -4.6137   -0.9876    0.0000 H   0  0  0

+   -2.5469   -3.5856    0.0000 H   0  0  0

+    1.9761    2.8631    0.0000 H   0  0  0

+   -5.7233    2.1335    0.0000 H   0  0  0

+    2.5112   -1.9462    0.0000 H   0  0  0

+    4.1580    1.9033    0.0000 H   0  0  0

+    6.4344   -0.1762    0.0000 H   0  0  0

+    6.2989    1.2797    0.0000 H   0  0  0

+    4.8430    1.1442    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 13 16  2  0

+ 15 17  2  0

+ 17 18  1  0

+ 18 19  1  0

+  7  9  2  0

+  8 11  1  0

+ 16 17  1  0

+  4 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 19 27  1  0

+ 19 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1606-67-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.9067    0.0653   -0.0022 C   0  0  0

+   -0.3631   -0.2352   -0.0019 C   0  0  0

+    1.3359    1.4766   -0.0009 C   0  0  0

+    1.9287   -0.9967    0.0024 C   0  0  0

+   -1.3795    0.8338   -0.0003 C   0  0  0

+   -0.8005   -1.6428   -0.0027 C   0  0  0

+    0.4359    2.4308    0.0009 C   0  0  0

+    2.7837    1.7500   -0.0011 C   0  0  0

+    1.4991   -2.4052    0.0076 C   0  0  0

+    3.1973   -0.6605    0.0020 C   0  0  0

+   -1.0028    2.0903    0.0008 C   0  0  0

+   -2.7962    0.4291    0.0006 C   0  0  0

+    0.2150   -2.7092   -0.0039 C   0  0  0

+   -2.0852   -1.9110   -0.0018 C   0  0  0

+    3.6304    0.7426   -0.0026 C   0  0  0

+   -3.1014   -0.8510   -0.0001 C   0  0  0

+   -3.7752    1.3658    0.0026 N   0  0  0

+    0.7520    3.4858    0.0000 H   0  0  0

+    3.1537    2.7873    0.0000 H   0  0  0

+    2.2527   -3.2083    0.0000 H   0  0  0

+    3.9602   -1.4548    0.0000 H   0  0  0

+   -1.7583    2.8916    0.0000 H   0  0  0

+   -0.0985   -3.7649    0.0000 H   0  0  0

+   -2.4110   -2.9630    0.0000 H   0  0  0

+    4.7098    0.9612    0.0000 H   0  0  0

+   -4.1642   -1.1396    0.0000 H   0  0  0

+   -3.5137    2.4356    0.0000 H   0  0  0

+   -4.8324    1.0573    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  8 15  2  0

+ 12 16  2  0

+ 12 17  1  0

+  7 11  1  0

+  9 13  2  0

+ 10 15  1  0

+ 14 16  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1204-41-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.3925    0.1639   -0.0010 C   0  0  0

+   -1.0902    0.2124   -0.0016 C   0  0  0

+    1.0907    0.1417   -1.2076 C   0  0  0

+    1.0896    0.1463    1.2058 C   0  0  0

+   -1.8287   -0.9697    0.0011 C   0  0  0

+   -1.7497    1.4399    0.0009 C   0  0  0

+    2.4683    0.0966   -1.2048 C   0  0  0

+    2.4677    0.1011    1.2042 C   0  0  0

+   -3.2077   -0.9186    0.0005 C   0  0  0

+   -1.1226   -2.3010    0.0041 C   0  0  0

+   -3.1295    1.4790    0.0003 C   0  0  0

+    3.1616    0.0733    0.0001 C   0  0  0

+   -3.8572    0.3029   -0.0028 C   0  0  0

+    4.5565    0.0276    0.0007 N   0  0  0

+    1.1241    1.1764    0.0000 H   0  0  0

+    1.1196    1.1811    0.0000 H   0  0  0

+   -1.2059    2.3208    0.0000 H   0  0  0

+    2.5026    1.1313    0.0000 H   0  0  0

+    2.5054    1.1357    0.0000 H   0  0  0

+   -3.7572   -1.7960    0.0000 H   0  0  0

+   -2.0372   -2.7861    0.0000 H   0  0  0

+   -0.6375   -3.2156    0.0000 H   0  0  0

+   -0.2080   -1.8159    0.0000 H   0  0  0

+   -3.6205    2.3904    0.0000 H   0  0  0

+   -4.8919    0.3367    0.0000 H   0  0  0

+    5.0445   -0.8854    0.0000 H   0  0  0

+    5.1032    0.9067    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60414-81-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 34                          1 V2000

+    0.0394    0.0305   -0.0567 N   0  0  0

+    0.7089    1.0128   -0.9129 C   0  0  0

+   -0.6156    0.4628    1.1804 C   0  0  0

+    0.0219   -1.2142   -0.3949 N   0  0  0

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+   -2.0739    0.8210    0.8871 C   0  0  0

+   -0.5348   -2.0309    0.3170 O   0  0  0

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+    2.8716    2.1729   -1.3813 C   0  0  0

+   -2.7609   -0.3432    0.3570 O   0  0  0

+   -2.7579    1.2723    2.1791 C   0  0  0

+    3.8519   -0.4552    0.1992 C   0  0  0

+   -3.7804   -0.1873   -0.5022 C   0  0  0

+    4.5386   -1.7899    0.0646 C   0  0  0

+    4.2174    0.3301    1.0415 O   0  0  0

+   -4.4935   -1.3955   -1.0524 C   0  0  0

+   -4.1264    0.9217   -0.8344 O   0  0  0

+    0.8346    1.9154    0.0000 H   0  0  0

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+    4.9555   -2.6003    0.0000 H   0  0  0

+    5.3490   -1.3730    0.0000 H   0  0  0

+   -5.2783   -0.9323    0.0000 H   0  0  0

+   -4.9567   -2.1803    0.0000 H   0  0  0

+   -3.7087   -1.8587    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2499-95-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+   -0.2630   -0.3782    0.0000 C   0  0  0

+   -1.4283    0.4882    0.0000 O   0  0  0

+    1.0069    0.4752    0.0000 C   0  0  0

+   -2.6657   -0.0466    0.0000 C   0  0  0

+    2.2347   -0.4377    0.0000 C   0  0  0

+   -3.8449    0.8302    0.0000 C   0  0  0

+   -2.8060   -1.2538    0.0000 O   0  0  0

+    3.5046    0.4157    0.0000 C   0  0  0

+   -5.0666    0.3023    0.0000 C   0  0  0

+    4.7325   -0.4972    0.0000 C   0  0  0

+    6.0024    0.3562    0.0000 C   0  0  0

+   -1.0318   -1.1992    0.0000 H   0  0  0

+    0.4659   -1.2349    0.0000 H   0  0  0

+    1.7757    1.2962    0.0000 H   0  0  0

+    0.2780    1.3319    0.0000 H   0  0  0

+    1.4659   -1.2587    0.0000 H   0  0  0

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+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+83996-50-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 82 82                          1 V2000

+   -3.4421    3.9455    0.2228 C   0  0  0

+   -4.6496    3.5736   -0.3726 N   0  0  0

+   -2.5252    2.9740    0.6029 C   0  0  0

+   -3.1531    5.2884    0.4309 C   0  0  0

+   -5.7504    4.5363   -0.4598 C   0  0  0

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+   -8.4342    4.9983   -0.3385 Cl  0  0  0

+   -5.3485   -0.4091   -0.4301 Cl  0  0  0

+    0.0795    1.4753    0.3786 C   0  0  1

+    1.5811    1.3532    0.3424 C   0  0  0

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+ 39 81  1  0

+ 42 82  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3175-89-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 43                          1 V2000

+   -0.5882    0.1496   -0.1088 C   0  0  0

+    0.3340   -0.8922   -0.2267 C   0  0  0

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+ 21 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+605-94-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -0.9769    0.1532   -0.0938 C   0  0  0

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+  9 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+73536-69-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 51                          1 V2000

+    0.7381    0.0341    0.3220 C   0  0  0

+   -0.7379   -0.0336    0.3224 C   0  0  0

+    1.4779   -0.7860    1.1762 C   0  0  0

+    1.4056    0.9227   -0.5448 C   0  0  0

+   -1.4771    0.7875    1.1755 C   0  0  0

+   -1.4060   -0.9237   -0.5430 C   0  0  0

+    2.8668   -0.7183    1.1722 C   0  0  0

+    1.0877   -1.7199    2.0914 O   0  0  0

+    2.8010    0.9790   -0.5372 C   0  0  0

+    0.6355    1.7871   -1.4542 C   0  0  0

+   -2.8665    0.7201    1.1719 C   0  0  0

+   -1.0867    1.7220    2.0900 O   0  0  0

+   -2.8010   -0.9797   -0.5351 C   0  0  0

+   -0.6363   -1.7898   -1.4511 C   0  0  0

+    3.5224    0.1675    0.3177 C   0  0  0

+    3.3494   -1.6100    2.0860 O   0  0  0

+    2.2605   -2.5129    2.3543 C   0  0  0

+    1.2771    2.6357   -2.2819 O   0  0  0

+   -0.5787    1.7354   -1.4588 O   0  0  0

+   -3.5223   -0.1655    0.3182 C   0  0  0

+   -3.3484    1.6127    2.0852 O   0  0  0

+   -2.2592    2.5154    2.3525 C   0  0  0

+   -1.2783   -2.6397   -2.2773 O   0  0  0

+    0.5780   -1.7385   -1.4560 O   0  0  0

+    4.8808    0.2277    0.3203 O   0  0  0

+    0.5176    3.4883   -3.1789 C   0  0  0

+   -4.8807   -0.2254    0.3211 O   0  0  0

+   -0.5191   -3.4939   -3.1729 C   0  0  0

+    5.2524    1.2124   -0.6463 C   0  0  0

+   -5.2528   -1.2105   -0.6449 C   0  0  0

+    3.1360    1.7671    0.0000 H   0  0  0

+   -3.1367   -1.7675    0.0000 H   0  0  0

+    1.7159   -3.1738    0.0000 H   0  0  0

+    2.8670   -3.1175    0.0000 H   0  0  0

+   -1.7144    3.1761    0.0000 H   0  0  0

+   -2.8655    3.1202    0.0000 H   0  0  0

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+   -0.1219    2.9187    0.0000 H   0  0  0

+   -1.1592   -4.0628    0.0000 H   0  0  0

+    0.0498   -4.1340    0.0000 H   0  0  0

+    0.1210   -2.9250    0.0000 H   0  0  0

+    6.0536    0.9100    0.0000 H   0  0  0

+    5.5548    2.0136    0.0000 H   0  0  0

+    4.4512    1.5148    0.0000 H   0  0  0

+   -6.0539   -0.9079    0.0000 H   0  0  0

+   -5.5554   -2.0116    0.0000 H   0  0  0

+   -4.4517   -1.5131    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  2  0

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+ 29 43  1  0

+ 29 44  1  0

+ 29 45  1  0

+ 30 46  1  0

+ 30 47  1  0

+ 30 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+83-32-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+   -0.0001    0.1723    0.0016 C   0  0  0

+   -1.1704    0.9239    0.0004 C   0  0  0

+    1.1708    0.9238    0.0003 C   0  0  0

+   -0.0003   -1.2341   -0.0016 C   0  0  0

+   -0.7718    2.3796   -0.0018 C   0  0  0

+   -2.3575    0.2571    0.0018 C   0  0  0

+    0.7725    2.3796   -0.0018 C   0  0  0

+    2.3574    0.2568    0.0008 C   0  0  0

+   -1.2421   -1.8897   -0.0060 C   0  0  0

+    1.2419   -1.8901   -0.0007 C   0  0  0

+   -2.3825   -1.1392    0.0044 C   0  0  0

+    2.3820   -1.1400    0.0026 C   0  0  0

+   -0.6786    3.4230    0.0000 H   0  0  0

+   -1.8028    2.5653    0.0000 H   0  0  0

+   -3.2568    0.7943    0.0000 H   0  0  0

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+   -1.2925   -2.9361    0.0000 H   0  0  0

+    1.2922   -2.9365    0.0000 H   0  0  0

+   -3.3091   -1.6280    0.0000 H   0  0  0

+    3.3085   -1.6290    0.0000 H   0  0  0

+  1  2  2  0

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+  1  4  1  0

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+  3  7  1  0

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+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104-98-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    1.1970    0.2387   -0.0010 C   0  0  0

+   -0.2262    0.5954    0.0000 C   0  0  0

+    2.2498    1.1120   -0.0001 C   0  0  0

+    1.7097   -1.0190    0.0028 N   0  0  0

+   -1.1673   -0.3767   -0.0011 C   0  0  0

+    3.3827    0.3592   -0.0016 N   0  0  0

+    3.0094   -0.9471    0.0004 C   0  0  0

+   -2.5399   -0.0326   -0.0001 C   0  0  0

+   -3.4787   -1.0023   -0.0013 O   0  0  0

+   -2.8739    1.1375    0.0017 O   0  0  0

+   -0.5058    1.5751    0.0000 H   0  0  0

+    2.1958    2.1294    0.0000 H   0  0  0

+   -0.8877   -1.3564    0.0000 H   0  0  0

+    4.3387    0.7114    0.0000 H   0  0  0

+    3.6451   -1.7432    0.0000 H   0  0  0

+   -4.1873   -1.7343    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

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+  6  7  1  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+10048-13-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.2123   -0.3121   -0.0998 C   0  0  0

+   -1.5821   -0.3098    0.1417 C   0  0  0

+    0.4525    0.9249   -0.1364 C   0  0  0

+    0.3991   -1.4830   -0.3121 O   0  0  0

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+   -0.2526    2.1239    0.0095 C   0  0  0

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+   -3.7963   -0.7285    0.9291 C   0  0  0

+   -3.1045   -1.8163   -1.0761 C   0  0  0

+    0.3998    3.3110   -0.0678 O   0  0  0

+    2.5449   -0.4008   -0.0849 C   0  0  0

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+    2.2957   -2.7687    0.2093 C   0  0  0

+   -4.8817   -1.2914    0.1677 O   0  0  0

+   -4.4123   -1.6864   -1.0366 C   0  0  0

+   -0.5805    4.3339    0.1189 C   0  0  0

+    3.9231   -0.5157    0.1147 C   0  0  0

+    3.6515   -2.8739    0.4309 C   0  0  0

+    4.4720   -1.7609    0.3782 C   0  0  0

+    4.7173    0.5825    0.0516 O   0  0  0

+   -1.8836   -2.2180    0.0000 H   0  0  0

+   -2.1472    2.9737    0.0000 H   0  0  0

+   -4.6356   -0.1369    0.0000 H   0  0  0

+   -2.8518   -2.8116    0.0000 H   0  0  0

+    1.7122   -3.6137    0.0000 H   0  0  0

+   -4.8115   -2.6325    0.0000 H   0  0  0

+    0.1609    5.0444    0.0000 H   0  0  0

+   -1.2910    5.0753    0.0000 H   0  0  0

+   -1.3219    3.6234    0.0000 H   0  0  0

+    4.0787   -3.8077    0.0000 H   0  0  0

+    5.4927   -1.8737    0.0000 H   0  0  0

+    5.3190    1.4146    0.0000 H   0  0  0

+  1  2  2  0

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+ 20 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+ 24 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+135-88-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -2.0416    0.3461    0.4987 C   0  0  0

+   -2.4817   -0.5875   -0.4734 C   0  0  0

+   -0.7400    0.2431    1.0147 C   0  0  0

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+   -0.3540   -1.6807   -0.3915 C   0  0  0

+   -4.6054    0.5111   -0.5476 C   0  0  0

+    1.3846   -0.8685    1.0794 N   0  0  0

+    2.4474   -0.2434    0.4225 C   0  0  0

+    3.7534   -0.4742    0.8353 C   0  0  0

+    2.2007    0.6062   -0.6490 C   0  0  0

+    4.8018    0.1452    0.1834 C   0  0  0

+    3.2534    1.2220   -1.2963 C   0  0  0

+    4.5524    0.9941   -0.8792 C   0  0  0

+   -0.3038    1.0804    0.0000 H   0  0  0

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+   -2.0302   -2.4467    0.0000 H   0  0  0

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+    3.9218   -1.4032    0.0000 H   0  0  0

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+    5.6801   -0.2012    0.0000 H   0  0  0

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+    5.1815    1.6980    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15687-27-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+   -1.0760   -0.6620    0.0365 C   0  0  0

+   -2.5708   -0.6927    0.2255 C   0  0  0

+   -0.2492   -1.2620    0.9676 C   0  0  0

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+   -4.4085    0.9358    0.4834 O   0  0  0

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+    1.6663   -0.6056   -0.3101 C   0  0  0

+    3.1611   -0.5749   -0.4991 C   0  0  0

+    3.7509    0.5962    0.2894 C   0  0  0

+    4.8765    0.0877    1.1923 C   0  0  0

+    4.3084    1.6369   -0.6838 C   0  0  0

+   -2.1881   -1.5363    0.0000 H   0  0  0

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+ 14 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+31430-15-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+   -1.1737   -0.7326    0.1261 C   0  0  0

+   -1.4173   -1.7238   -0.8425 C   0  0  0

+    0.0988   -0.6117    0.6806 C   0  0  0

+   -2.3399   -0.0586    0.3097 N   0  0  0

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+   -0.3947   -2.5761   -1.2424 C   0  0  0

+    1.1121   -1.4742    0.2679 C   0  0  0

+   -3.2633   -0.5625   -0.4680 C   0  0  0

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+    2.8346   -2.1470    1.6929 O   0  0  0

+   -4.9508    0.9753    0.1532 C   0  0  0

+    4.5852   -0.0659    1.0538 C   0  0  0

+    3.0014    0.5477   -0.6662 C   0  0  0

+   -6.1939    1.4697    0.0032 O   0  0  0

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+    3.8464    1.5565   -1.0758 C   0  0  0

+   -6.6019    2.6469    0.7488 C   0  0  0

+    5.0545    1.7592   -0.4259 C   0  0  0

+    5.8789    2.7496   -0.8317 F   0  0  0

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+   -5.7151    2.9542    0.0000 H   0  0  0

+   -6.9092    3.5337    0.0000 H   0  0  0

+   -7.4887    2.3396    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  6  9  2  0

+  7 10  1  0

+  8 11  1  0

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+ 12 16  2  0

+ 14 17  1  0

+ 14 18  2  0

+ 15 19  2  0

+ 16 20  1  0

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+ 19 22  1  0

+ 22 23  1  0

+  5  8  1  0

+  7  9  1  0

+ 20 22  2  0

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+ 11 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+530-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+   -2.2350   -0.7378    0.5685 C   0  0  0

+   -3.0632    0.3111    0.1374 C   0  0  0

+   -0.9558   -0.4695    1.0381 N   0  0  0

+   -2.7045   -2.0451    0.5280 C   0  0  0

+   -4.3485    0.0266   -0.3330 C   0  0  0

+   -2.5809    1.7022    0.1810 C   0  0  0

+    0.1053   -0.3378    0.1386 C   0  0  0

+   -3.9775   -2.3083    0.0664 C   0  0  0

+   -4.7935   -1.2763   -0.3707 C   0  0  0

+   -3.4200    2.7158   -0.1103 O   0  0  0

+   -1.4263    1.9359    0.4796 O   0  0  0

+    1.4099   -0.2552    0.6084 C   0  0  0

+   -0.1416   -0.2948   -1.2280 C   0  0  0

+    2.4564   -0.1250   -0.2836 C   0  0  0

+    0.9093   -0.1645   -2.1141 C   0  0  0

+    2.2067   -0.0768   -1.6426 C   0  0  0

+    3.8721   -0.0348    0.2252 C   0  0  0

+    4.7495    0.0911   -0.8572 F   0  0  0

+    3.9976    1.0811    1.0595 F   0  0  0

+    4.1834   -1.1930    0.9455 F   0  0  0

+   -1.1161    0.4925    0.0000 H   0  0  0

+   -2.0651   -2.7816    0.0000 H   0  0  0

+   -4.9987    0.7535    0.0000 H   0  0  0

+   -4.3109   -3.2248    0.0000 H   0  0  0

+   -5.7547   -1.4413    0.0000 H   0  0  0

+   -4.0419    3.4670    0.0000 H   0  0  0

+    1.5010   -1.2262    0.0000 H   0  0  0

+   -1.1166   -0.2709    0.0000 H   0  0  0

+    0.8164    0.8063    0.0000 H   0  0  0

+    2.2667    0.8966    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  1  0

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+  7 12  2  0

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+ 17 20  1  0

+  8  9  1  0

+ 15 16  1  0

+  3 21  1  0

+  4 22  1  0

+  5 23  1  0

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+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+133-07-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.3945    0.0027   -0.8511 N   0  0  0

+    1.1105   -1.1074   -0.5969 C   0  0  0

+    1.1129    1.1109   -0.5952 C   0  0  0

+   -1.1636    0.0048   -1.4119 S   0  0  0

+    2.4505   -0.7048   -0.1202 C   0  0  0

+    0.7210   -2.2493   -0.7355 O   0  0  0

+    2.4520    0.7047   -0.1191 C   0  0  0

+    0.7261    2.2539   -0.7326 O   0  0  0

+   -2.0650   -0.0002    0.1622 C   0  0  0

+    3.5825   -1.3954    0.2820 C   0  0  0

+    3.5856    1.3923    0.2839 C   0  0  0

+   -1.6259    1.4688    1.1110 Cl  0  0  0

+   -3.8388    0.0012   -0.1609 Cl  0  0  0

+   -1.6264   -1.4755    1.1013 Cl  0  0  0

+    4.7090   -0.6942    0.6829 C   0  0  0

+    4.7107    0.6881    0.6833 C   0  0  0

+    3.5870   -2.3909    0.0000 H   0  0  0

+    3.5926    2.3878    0.0000 H   0  0  0

+    5.5790   -1.1781    0.0000 H   0  0  0

+    5.5818    1.1699    0.0000 H   0  0  0

+  1  2  1  0

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+  5  7  2  0

+ 15 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 15 19  1  0

+ 16 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3328-25-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 79                          1 V2000

+    3.0627   -0.6802    0.0886 C   0  0  2

+    1.7654   -0.2144   -0.5522 C   0  0  2

+    3.9661    0.5422    0.2733 C   0  0  1

+    3.7938   -1.7103   -0.7670 C   0  0  0

+    2.7594   -1.2967    1.4556 C   0  0  0

+    1.0216    0.6570    0.4734 C   0  0  2

+    0.8969   -1.3700   -1.0243 C   0  0  0

+    3.2263    1.6560    0.9378 C   0  0  0

+    5.2158    0.1255    1.0416 C   0  0  0

+    4.3806    0.9893   -1.0191 O   0  0  0

+    5.0681   -2.1403   -0.0310 C   0  0  0

+   -0.2044    1.2072   -0.2191 C   0  0  1

+    1.9270    1.7141    1.0135 C   0  0  0

+   -0.4304   -0.8425   -1.6047 C   0  0  0

+    5.9662   -0.9296    0.2209 C   0  0  2

+    5.2431    2.1593   -0.8072 O   0  0  0

+   -1.1085   -0.0187   -0.5316 C   0  0  2

+   -1.1384    2.0618    0.6450 C   0  0  0

+    7.1350   -1.3432    0.9316 O   0  0  0

+   -2.4468    0.6145   -0.8925 C   0  0  2

+   -1.2671   -0.8738    0.7272 C   0  0  0

+   -2.5021    1.9377   -0.0883 C   0  0  0

+   -3.5838   -0.3044   -0.4413 C   0  0  1

+   -4.9065    0.4636   -0.4812 C   0  0  0

+   -3.6664   -1.5113   -1.3781 C   0  0  0

+   -6.0436   -0.4553   -0.0300 C   0  0  0

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+   -8.5034   -0.6062    0.3812 C   0  0  0

+   -8.2352   -1.0861    1.8091 C   0  0  0

+   -9.8260    0.1618    0.3413 C   0  0  0

+    2.3387    0.6155    0.0000 H   0  0  0

+    2.8311   -2.0113    0.0000 H   0  0  0

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+    2.3141   -2.2018    0.0000 H   0  0  0

+    3.6645   -1.7420    0.0000 H   0  0  0

+    0.4168   -0.1502    0.0000 H   0  0  0

+    0.4428   -2.2707    0.0000 H   0  0  0

+    1.7538   -1.9022    0.0000 H   0  0  0

+    3.7227    2.5340    0.0000 H   0  0  0

+    6.1780    0.4283    0.0000 H   0  0  0

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+   -9.2225   -1.3135    0.0000 H   0  0  0

+   -9.1157   -1.5782    0.0000 H   0  0  0

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+   -7.3547   -0.5940    0.0000 H   0  0  0

+   -9.3195    1.0341    0.0000 H   0  0  0

+  -10.6983    0.6683    0.0000 H   0  0  0

+  -10.3325   -0.7105    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 29 72  1  0

+ 29 73  1  0

+ 30 74  1  0

+ 30 75  1  0

+ 30 76  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+823-40-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.0002   -0.7315   -0.0014 C   0  0  0

+   -1.2009   -0.0360   -0.0009 C   0  0  0

+    1.2010   -0.0362   -0.0005 C   0  0  0

+   -0.0005   -2.2385    0.0035 C   0  0  0

+   -1.1971    1.3539    0.0004 C   0  0  0

+   -2.4119   -0.7318   -0.0012 N   0  0  0

+    1.1976    1.3533    0.0008 C   0  0  0

+    2.4118   -0.7324   -0.0015 N   0  0  0

+    0.0002    2.0429    0.0013 C   0  0  0

+   -1.0426   -2.2383    0.0000 H   0  0  0

+   -0.0007   -3.2806    0.0000 H   0  0  0

+    1.0416   -2.2387    0.0000 H   0  0  0

+   -2.0985    1.8768    0.0000 H   0  0  0

+   -3.3133   -0.2089    0.0000 H   0  0  0

+   -2.4141   -1.7739    0.0000 H   0  0  0

+    2.0992    1.8760    0.0000 H   0  0  0

+    2.4136   -1.7745    0.0000 H   0  0  0

+    3.3134   -0.2097    0.0000 H   0  0  0

+    0.0004    3.0850    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+72-55-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.0000   -0.7956   -0.0039 C   0  0  0

+   -1.2836   -0.0544   -0.0159 C   0  0  0

+    1.2837   -0.0545    0.0111 C   0  0  0

+   -0.0001   -2.1376   -0.0010 C   0  0  0

+   -2.2018   -0.2288    1.0185 C   0  0  0

+   -1.5744    0.8242   -1.0590 C   0  0  0

+    2.2018   -0.2249   -1.0240 C   0  0  0

+    1.5746    0.8199    1.0577 C   0  0  0

+   -1.5035   -3.0055   -0.0113 Cl  0  0  0

+    1.5032   -3.0057    0.0131 Cl  0  0  0

+   -3.3951    0.4640    1.0027 C   0  0  0

+   -2.7703    1.5120   -1.0651 C   0  0  0

+    3.3952    0.4678   -1.0054 C   0  0  0

+    2.7705    1.5075    1.0665 C   0  0  0

+   -3.6811    1.3311   -0.0379 C   0  0  0

+    3.6813    1.3306    0.0386 C   0  0  0

+   -5.1844    2.1992   -0.0519 Cl  0  0  0

+    5.1844    2.1990    0.0558 Cl  0  0  0

+   -2.3760   -1.2486    0.0000 H   0  0  0

+   -0.7727    1.4782    0.0000 H   0  0  0

+    2.3781   -1.2444    0.0000 H   0  0  0

+    0.7734    1.4745    0.0000 H   0  0  0

+   -4.1985   -0.1879    0.0000 H   0  0  0

+   -2.6025    2.5329    0.0000 H   0  0  0

+    4.1980   -0.1848    0.0000 H   0  0  0

+    2.6006    2.5281    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  3  7  2  0

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+  4 10  1  0

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+ 12 15  1  0

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+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84174-24-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -0.6667   -0.6867   -0.6029 C   0  0  0

+    0.2152   -1.6614   -0.1741 C   0  0  0

+   -0.2328    0.6158   -0.7629 C   0  0  0

+   -2.0994   -1.0457   -0.9019 C   0  0  0

+    1.5306   -1.3332    0.0946 C   0  0  0

+    1.0831    0.9440   -0.4941 C   0  0  0

+   -2.9843   -0.3367    0.0258 N   0  0  0

+    1.9647   -0.0303   -0.0654 C   0  0  0

+   -3.3333    0.8808   -0.2191 N   0  0  0

+   -3.4727   -1.0104    1.2315 C   0  0  0

+    3.3736    0.3210    0.2219 N   0  3  0

+   -4.0690    1.4702    0.5522 O   0  0  0

+    3.7559    1.4688    0.0809 O   0  0  0

+    4.1505   -0.5378    0.5993 O   0  5  0

+   -0.0718   -2.6044    0.0000 H   0  0  0

+   -0.9024    1.3391    0.0000 H   0  0  0

+   -2.8666   -1.6645    0.0000 H   0  0  0

+   -1.6600   -1.9280    0.0000 H   0  0  0

+    2.2002   -2.0565    0.0000 H   0  0  0

+    1.3701    1.8869    0.0000 H   0  0  0

+   -4.2707   -0.4319    0.0000 H   0  0  0

+   -4.0512   -1.8084    0.0000 H   0  0  0

+   -2.6747   -1.5889    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

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+  6  8  2  0

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+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+479-27-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -1.2501   -2.2676    0.0012 N   0  0  0

+   -1.2281   -0.8749    0.0018 C   0  0  0

+   -0.0001   -0.1832    0.0012 C   0  0  0

+   -2.4084   -0.1602   -0.0027 C   0  0  0

+   -0.0003    1.2328    0.0014 C   0  0  0

+    1.2285   -0.8747   -0.0001 C   0  0  0

+   -2.3967    1.2308   -0.0025 C   0  0  0

+    1.2239    1.9242    0.0003 C   0  0  0

+   -1.2242    1.9237    0.0022 C   0  0  0

+    1.2509   -2.2674   -0.0008 N   0  0  0

+    2.4083   -0.1598   -0.0011 C   0  0  0

+    2.3961    1.2316   -0.0009 C   0  0  0

+   -2.1629   -2.7756    0.0000 H   0  0  0

+   -0.3538   -2.8042    0.0000 H   0  0  0

+   -3.3206   -0.6692    0.0000 H   0  0  0

+   -3.3019    1.7523    0.0000 H   0  0  0

+    1.2341    2.9688    0.0000 H   0  0  0

+   -1.2346    2.9683    0.0000 H   0  0  0

+    0.3547   -2.8042    0.0000 H   0  0  0

+    2.1639   -2.7751    0.0000 H   0  0  0

+    3.3207   -0.6685    0.0000 H   0  0  0

+    3.3011    1.7533    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  2  0

+  8  5  1  0

+  9  5  2  0

+ 10  6  1  0

+ 11  6  2  0

+ 12  8  2  0

+  7  9  1  0

+ 11 12  1  0

+  1 13  1  0

+  1 14  1  0

+  4 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+201-06-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+   -1.1026    0.1347   -0.0026 C   0  0  0

+   -0.2269   -0.8124   -0.0027 C   0  0  0

+   -0.8142    1.5678   -0.0025 C   0  0  0

+   -2.5542   -0.0368    0.0039 C   0  0  0

+    1.1897   -0.4226   -0.0014 C   0  0  0

+   -0.7250   -2.1968   -0.0047 C   0  0  0

+    0.4537    1.9137   -0.0029 C   0  0  0

+   -2.1283    2.2224   -0.0009 C   0  0  0

+   -3.1007    1.3254    0.0026 C   0  0  0

+   -2.9992   -1.2739    0.0084 C   0  0  0

+    1.4970    0.8641   -0.0014 C   0  0  0

+    2.2504   -1.4402    0.0010 C   0  0  0

+   -2.0342   -2.3926   -0.0044 C   0  0  0

+    2.9156    1.2665    0.0006 C   0  0  0

+    3.5152   -1.0752    0.0036 C   0  0  0

+    3.8638    0.3559    0.0034 C   0  0  0

+   -0.0297   -3.0445    0.0000 H   0  0  0

+    0.7367    2.9729    0.0000 H   0  0  0

+   -2.2829    3.3078    0.0000 H   0  0  0

+   -4.1701    1.5669    0.0000 H   0  0  0

+   -4.0772   -1.4737    0.0000 H   0  0  0

+    1.9878   -2.5047    0.0000 H   0  0  0

+   -2.4156   -3.4205    0.0000 H   0  0  0

+    3.1809    2.3303    0.0000 H   0  0  0

+    4.3066   -1.8340    0.0000 H   0  0  0

+    4.9165    0.6624    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+ 11 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+  7 11  1  0

+  8  9  2  0

+ 10 13  1  0

+ 15 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-31-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.0402    0.0000    0.3821 C   0  0  0

+    0.7635   -1.2491   -0.1255 C   0  0  0

+    0.7630    1.2494   -0.1255 C   0  0  0

+   -1.3430   -0.0003   -0.1124 N   0  0  0

+   -0.5008    0.9377    0.0000 H   0  0  0

+   -0.1733   -1.7916    0.0000 H   0  0  0

+    1.3060   -2.1859    0.0000 H   0  0  0

+    1.7003   -0.7066    0.0000 H   0  0  0

+    1.7000    0.7073    0.0000 H   0  0  0

+    1.3051    2.1864    0.0000 H   0  0  0

+   -0.1740    1.7915    0.0000 H   0  0  0

+   -1.8845    0.9371    0.0000 H   0  0  0

+   -1.8841   -0.9379    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+134682-95-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 49                          1 V2000

+   -3.2046   -0.5559    0.0279 C   0  0  0

+   -3.3260    0.8178    0.2199 C   0  0  0

+   -1.9596   -1.1192   -0.1378 C   0  0  0

+   -4.4128   -1.4107    0.0081 N   0  3  0

+   -2.1906    1.6235    0.2447 C   0  0  0

+   -4.5835    1.3862    0.3867 N   0  0  0

+   -0.8207   -0.3079   -0.1124 C   0  0  0

+   -4.3061   -2.6123   -0.1599 O   0  0  0

+   -5.5139   -0.9124    0.1598 O   0  5  0

+   -0.9524    1.0710    0.0810 C   0  0  0

+   -4.5827    2.0334    1.7055 C   0  0  0

+   -4.6974    2.4593   -0.6100 C   0  0  0

+    0.5152   -0.9046   -0.2892 C   0  0  0

+    1.6117   -0.1214   -0.2646 O   0  0  0

+    0.6281   -2.1028   -0.4572 O   0  0  0

+    2.9278   -0.7093   -0.4387 C   0  0  0

+    3.9904    0.3894   -0.3695 C   0  0  0

+    5.3772   -0.2301   -0.5530 C   0  0  0

+    3.7383    1.4131   -1.4783 C   0  0  0

+    6.2187    0.0232    0.6995 C   0  0  0

+    3.5846    2.8050   -0.8619 C   0  0  0

+    7.5666   -0.6872    0.5605 C   0  0  0

+    8.4081   -0.4339    1.8130 C   0  0  0

+   -1.8594   -2.1486    0.0000 H   0  0  0

+   -2.2925    2.6528    0.0000 H   0  0  0

+   -0.1125    1.6746    0.0000 H   0  0  0

+   -3.5484    2.0321    0.0000 H   0  0  0

+   -4.5814    3.0677    0.0000 H   0  0  0

+   -5.6170    2.0347    0.0000 H   0  0  0

+   -3.6689    2.5685    0.0000 H   0  0  0

+   -4.8066    3.4878    0.0000 H   0  0  0

+   -5.7259    2.3501    0.0000 H   0  0  0

+    2.3993   -1.5984    0.0000 H   0  0  0

+    3.7496   -1.3373    0.0000 H   0  0  0

+    4.7841    1.0526    0.0000 H   0  0  0

+    4.7060   -1.0170    0.0000 H   0  0  0

+    5.9427   -1.0961    0.0000 H   0  0  0

+    2.7739    1.7869    0.0000 H   0  0  0

+    2.9616    0.7301    0.0000 H   0  0  0

+    6.9233    0.7803    0.0000 H   0  0  0

+    5.6721    0.9012    0.0000 H   0  0  0

+    4.6126    2.9185    0.0000 H   0  0  0

+    3.4711    3.8330    0.0000 H   0  0  0

+    2.5566    2.6915    0.0000 H   0  0  0

+    6.8620   -1.4443    0.0000 H   0  0  0

+    8.1132   -1.5652    0.0000 H   0  0  0

+    8.7062   -1.4243    0.0000 H   0  0  0

+    9.3985   -0.1358    0.0000 H   0  0  0

+    8.1100    0.5565    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  6 12  1  0

+  7 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+ 14 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+ 17 19  1  0

+ 18 20  1  0

+ 19 21  1  0

+ 20 22  1  0

+ 22 23  1  0

+  7 10  1  0

+  3 24  1  0

+  5 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 12 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

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+ 18 37  1  0

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+ 20 40  1  0

+ 20 41  1  0

+ 21 42  1  0

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+ 21 44  1  0

+ 22 45  1  0

+ 22 46  1  0

+ 23 47  1  0

+ 23 48  1  0

+ 23 49  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+82419-36-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 49                          1 V2000

+    1.4970   -0.8929    0.0560 C   0  0  0

+    0.1549   -1.2831    0.0462 C   0  0  0

+    1.8312    0.4666    0.0150 C   0  0  0

+    2.5045   -1.8364    0.1183 N   0  0  0

+   -0.8420   -0.3129    0.0128 C   0  0  0

+   -0.1978   -2.5925    0.0529 O   0  0  0

+    0.8144    1.4450   -0.0219 C   0  0  0

+    3.2528    0.8428    0.0078 C   0  0  0

+    2.1211   -3.2526    0.2198 C   0  0  0

+    3.8102   -1.4839    0.0941 C   0  0  0

+   -2.1843   -0.7026    0.0126 N   0  0  0

+   -0.5192    1.0414   -0.0210 C   0  0  0

+    0.7288   -3.3145    0.8590 C   0  0  0

+    1.1592    2.8757   -0.0608 C   0  0  0

+    4.2120   -0.1962    0.0416 C   0  0  0

+    3.5942    2.0143   -0.0267 O   0  0  0

+    2.0675   -3.8680   -1.1799 C   0  0  0

+   -2.7936   -0.1164   -1.1875 C   0  0  0

+   -2.8122   -0.0532    1.1699 C   0  0  0

+   -1.5027    1.9672   -0.0525 F   0  0  0

+    1.3075    3.5648    1.0881 O   0  0  0

+    1.3101    3.4355   -1.1290 O   0  0  0

+   -4.2963   -0.3995   -1.1918 C   0  0  0

+   -4.3149   -0.3362    1.1656 C   0  0  0

+   -4.9242    0.2499   -0.0346 N   0  0  0

+   -6.3350   -0.1596   -0.0347 C   0  0  0

+    3.1484   -3.4349    0.0000 H   0  0  0

+    4.5335   -2.2358    0.0000 H   0  0  0

+   -0.1199   -3.9213    0.0000 H   0  0  0

+    1.0694   -4.3006    0.0000 H   0  0  0

+    5.2298    0.0330    0.0000 H   0  0  0

+    1.0281   -3.7775    0.0000 H   0  0  0

+    1.9770   -4.9074    0.0000 H   0  0  0

+    3.1069   -3.9585    0.0000 H   0  0  0

+   -1.9317    0.4714    0.0000 H   0  0  0

+   -3.1925    0.8476    0.0000 H   0  0  0

+   -1.9363    0.5137    0.0000 H   0  0  0

+   -3.1995    0.9156    0.0000 H   0  0  0

+    1.5270    4.5848    0.0000 H   0  0  0

+   -5.1721   -0.9664    0.0000 H   0  0  0

+   -3.9090   -1.3683    0.0000 H   0  0  0

+   -5.1768   -0.9241    0.0000 H   0  0  0

+   -3.9160   -1.3002    0.0000 H   0  0  0

+   -6.6258    0.8424    0.0000 H   0  0  0

+   -7.3370   -0.4504    0.0000 H   0  0  0

+   -6.0442   -1.1616    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  2  0

+  9 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 14 21  1  0

+ 14 22  2  0

+ 18 23  1  0

+ 19 24  1  0

+ 23 25  1  0

+ 25 26  1  0

+  7 12  2  0

+  9 13  1  0

+ 10 15  2  0

+ 24 25  1  0

+  9 27  1  0

+ 10 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 19 37  1  0

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+ 21 39  1  0

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+ 23 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+ 26 44  1  0

+ 26 45  1  0

+ 26 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97-99-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.2095   -0.2645   -0.4804 C   0  0  0

+   -0.9094   -1.2926   -0.2238 C   0  0  0

+   -0.2581    1.0056    0.0037 O   0  0  0

+    1.4652   -0.6738    0.2921 C   0  0  0

+   -2.0556   -0.4586    0.3984 C   0  0  0

+   -1.7000    0.9775   -0.0636 C   0  0  0

+    2.5027    0.2795    0.0542 O   0  0  0

+    0.9470    0.5013    0.0000 H   0  0  0

+   -1.5904   -2.1090    0.0000 H   0  0  0

+   -0.1399   -2.0261    0.0000 H   0  0  0

+    0.9687   -1.6139    0.0000 H   0  0  0

+    2.3071   -1.3229    0.0000 H   0  0  0

+   -3.0462   -0.0727    0.0000 H   0  0  0

+   -2.5655   -1.3915    0.0000 H   0  0  0

+   -1.6278    2.0382    0.0000 H   0  0  0

+   -2.7503    1.1420    0.0000 H   0  0  0

+    3.2855    0.9988    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  6  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+513-86-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.6799    0.3638   -0.3713 C   0  0  0

+   -0.7368   -0.0306   -0.0421 C   0  0  0

+    1.2179    1.2913    0.7201 C   0  0  0

+    1.4953   -0.8074   -0.4456 O   0  0  0

+   -1.8869    0.8069   -0.5390 C   0  0  0

+   -0.9505   -1.0177    0.6199 O   0  0  0

+    0.0271    1.2078    0.0000 H   0  0  0

+    2.1409    0.7559    0.0000 H   0  0  0

+    1.7533    2.2143    0.0000 H   0  0  0

+    0.2949    1.8267    0.0000 H   0  0  0

+    2.1050   -1.6831    0.0000 H   0  0  0

+   -1.2588    1.6695    0.0000 H   0  0  0

+   -2.7495    1.4350    0.0000 H   0  0  0

+   -2.5150   -0.0557    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  1  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2058-02-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.0754    0.5601    0.0127 C   0  0  0

+    0.1235   -0.8321    0.0014 C   0  0  0

+    1.0198    1.4193    0.0156 C   0  0  0

+   -1.4499    1.1103    0.0152 C   0  0  0

+   -1.0327   -1.7443   -0.0033 C   0  0  0

+    1.4270   -1.3477   -0.0059 C   0  0  0

+    2.3062    0.9127    0.0080 C   0  0  0

+    0.8059    2.8839    0.0275 N   0  3  0

+   -2.6089    0.1945    0.0059 C   0  0  0

+   -1.6242    2.3125    0.0254 O   0  0  0

+   -2.4058   -1.1971    0.0044 C   0  0  0

+   -0.8577   -2.9474   -0.0139 O   0  0  0

+    2.5224   -0.4646   -0.0018 C   0  0  0

+    1.6344   -2.7116   -0.0165 N   0  0  0

+    0.1214    3.4064   -0.8339 O   0  0  0

+    1.3143    3.5666    0.8988 O   0  5  0

+   -3.9056    0.7021    0.0086 C   0  0  0

+   -3.5029   -2.0534    0.0000 C   0  0  0

+    3.8987   -0.9956   -0.0089 C   0  0  0

+   -4.9848   -0.1636    0.0003 C   0  0  0

+   -4.7849   -1.5322    0.0072 C   0  0  0

+    4.6804   -0.8266   -1.0934 O   0  0  0

+    4.3273   -1.5853    0.9629 O   0  0  0

+    3.1208    1.5656    0.0000 H   0  0  0

+    0.8190   -3.3636    0.0000 H   0  0  0

+    2.6067   -3.0917    0.0000 H   0  0  0

+   -4.0631    1.7342    0.0000 H   0  0  0

+   -3.3590   -3.0874    0.0000 H   0  0  0

+   -5.9563    0.2186    0.0000 H   0  0  0

+   -5.6065   -2.1763    0.0000 H   0  0  0

+    5.7008   -0.6060    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  2  0

+  6 14  1  0

+  8 15  2  0

+  8 16  1  0

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+ 11 18  1  0

+ 13 19  1  0

+ 17 20  2  0

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+  7 13  1  0

+  9 11  2  0

+ 20 21  1  0

+  7 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 20 29  1  0

+ 21 30  1  0

+ 22 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33704-61-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 38                          1 V2000

+   -0.4968    0.2473    0.0325 C   0  0  0

+    0.0872   -0.9593    0.0131 C   0  0  0

+    0.5218    1.3363    0.2276 C   0  0  0

+   -1.9516    0.4092   -0.1285 C   0  0  0

+    1.5784   -0.8201    0.1945 C   0  0  0

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+   -2.7045   -0.8303   -0.5814 C   0  0  0

+   -2.5124    1.4634    0.0868 O   0  0  0

+    1.9749   -1.1769    1.6285 C   0  0  0

+    2.3207   -1.7154   -0.7996 C   0  0  0

+   -2.1451   -2.0330    0.1968 C   0  0  0

+    2.2004    0.8486   -1.5767 C   0  0  0

+   -0.9596   -3.2582    0.0000 H   0  0  0

+    0.2876   -2.6629    0.0000 H   0  0  0

+    2.7261    0.0527    0.0000 H   0  0  0

+    1.2767    2.7266    0.0000 H   0  0  0

+    0.0227    3.5128    0.0000 H   0  0  0

+   -0.7635    2.2588    0.0000 H   0  0  0

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+   -0.5462    1.7863    0.0000 H   0  0  0

+   -3.4756   -0.1228    0.0000 H   0  0  0

+   -3.5490   -1.4484    0.0000 H   0  0  0

+    1.2749   -1.9548    0.0000 H   0  0  0

+    2.7528   -1.8769    0.0000 H   0  0  0

+    2.6749   -0.3990    0.0000 H   0  0  0

+    1.5151   -2.3834    0.0000 H   0  0  0

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+  1  2  2  0

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+ 14 33  1  0

+ 14 34  1  0

+ 15 35  1  0

+ 15 36  1  0

+ 15 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33389-33-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.6256   -0.0783   -0.5744 C   0  0  0

+   -0.8133   -0.0628   -0.1269 C   0  0  0

+    1.3751    0.9540    0.1521 N   0  0  0

+    1.2018   -1.3981   -0.3180 N   0  0  0

+   -2.2877    0.2241   -1.0918 S   0  0  0

+   -1.3244   -0.2690    1.1115 C   0  0  0

+    2.7642    0.9037    0.1321 C   0  0  0

+    2.5203   -1.5502   -0.0755 C   0  0  0

+   -3.4849    0.0570    0.2220 C   0  0  0

+   -2.6936   -0.2064    1.2906 C   0  0  0

+    3.3791   -0.3554    0.0116 C   0  0  0

+    3.5406    2.0457    0.2255 C   0  0  0

+    2.9947   -2.6604    0.0699 O   0  0  0

+   -4.9595    0.1722    0.1598 N   0  3  0

+    4.7683   -0.4471   -0.0177 C   0  0  0

+    4.9181    1.9401    0.1968 C   0  0  0

+   -5.6249    0.0259    1.1695 O   0  0  0

+   -5.5073    0.4131   -0.9010 O   0  5  0

+    5.5275    0.7011    0.0751 C   0  0  0

+    0.1603    0.8468    0.0000 H   0  0  0

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+   -1.1503   -1.2898    0.0000 H   0  0  0

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+    5.2283   -1.3749    0.0000 H   0  0  0

+    5.4986    2.7976    0.0000 H   0  0  0

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+  1  2  1  0

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+ 16 27  1  0

+ 19 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7085-55-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 94 98                          1 V2000

+   -2.3514    0.9096   -0.1649 C   0  0  0

+   -2.2693   -0.0228   -1.1551 C   0  0  0

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+   -3.3498   -1.7012   -2.3035 O   0  0  0

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+    0.4986    3.2996   -0.6802 C   0  0  0

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+   -1.2350    3.1639    0.0000 H   0  0  0

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+ 52 94  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84434-45-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    1.1112    0.0160   -0.0014 C   0  0  0

+   -0.1907    0.4132   -0.0013 N   0  0  0

+    2.1419    0.9737   -0.0011 C   0  0  0

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+ 17 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+217-59-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -1.0246    1.0117    0.0024 C   0  0  0

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+    0.4004    1.3831    0.0016 C   0  0  0

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+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15323-35-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+    0.3941    0.5574    0.0393 C   0  0  0

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+ 17 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-54-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

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+  6 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+38915-14-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 56                          1 V2000

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+ 28 56  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+192-97-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

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+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3520-42-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 72                          1 V2000

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+ 38 67  1  0

+ 38 68  1  0

+ 24 69  1  0

+ 34 70  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+158321-20-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.2390    0.1301    0.0028 C   0  0  0

+   -0.5729   -1.0143    0.0016 C   0  0  0

+    1.6220   -0.0149    0.0008 C   0  0  0

+   -0.5795    1.2457    0.0006 N   0  0  0

+   -1.9683   -0.5372    0.0038 C   0  0  0

+    0.0041   -2.2829   -0.0013 C   0  0  0

+    2.1852   -1.2800   -0.0025 C   0  0  0

+    2.4919    1.1827    0.0016 N   0  3  0

+   -1.9101    0.8642   -0.0022 C   0  0  0

+   -3.2016   -1.1846    0.0038 C   0  0  0

+    1.3745   -2.4130   -0.0029 C   0  0  0

+    3.5747   -1.4210   -0.0046 N   0  0  0

+    2.8512    1.6737    1.0568 O   0  0  0

+    2.8484    1.6772   -1.0529 O   0  5  0

+   -3.0942    1.5949   -0.0051 C   0  0  0

+   -4.3637   -0.4435    0.0063 C   0  0  0

+   -4.3080    0.9418   -0.0075 C   0  0  0

+   -0.2422    2.2326    0.0000 H   0  0  0

+   -0.6013   -3.1322    0.0000 H   0  0  0

+   -3.2455   -2.2266    0.0000 H   0  0  0

+    1.8069   -3.3621    0.0000 H   0  0  0

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+    4.1847   -0.5751    0.0000 H   0  0  0

+   -3.0633    2.6374    0.0000 H   0  0  0

+   -5.2881   -0.9265    0.0000 H   0  0  0

+   -5.1924    1.4946    0.0000 H   0  0  0

+  1  2  2  0

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+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+20921-50-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 56                          1 V2000

+   -0.9069    0.2510   -0.5243 C   0  0  0

+   -2.2452   -0.4025   -0.2939 C   0  0  0

+   -0.9108    1.6309    0.0815 C   0  0  0

+    0.1349   -0.5473    0.0966 O   0  0  0

+   -0.6522    0.3508   -1.9707 C   0  0  0

+   -2.3125   -1.6489    0.2996 C   0  0  0

+   -3.4058    0.2472   -0.6711 C   0  0  0

+   -0.9579    2.7444   -0.7360 C   0  0  0

+   -0.8729    1.7829    1.4551 C   0  0  0

+    1.4251   -0.1818   -0.0240 C   0  0  0

+   -0.4490    0.4305   -3.1242 C   0  0  0

+   -3.5402   -2.2484    0.5110 C   0  0  0

+   -4.6332   -0.3522   -0.4598 C   0  0  0

+   -0.9613    4.0103   -0.1802 C   0  0  0

+   -0.8765    3.0484    2.0107 C   0  0  0

+    2.4004   -0.9907    0.4354 N   0  0  0

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+   -4.7002   -1.6015    0.1287 C   0  0  0

+   -3.6137   -3.6076    1.1577 C   0  0  0

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+ 25 50  1  0

+ 26 51  1  0

+ 26 52  1  0

+ 27 53  1  0

+ 27 54  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2179-59-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.3638    1.1224   -0.3250 S   0  0  0

+   -0.4529   -0.7005   -0.7858 S   0  0  0

+    1.7657    0.5905    0.6961 C   0  0  0

+   -1.6059   -0.8889    0.6019 C   0  0  0

+    2.6848   -0.3117   -0.1298 C   0  0  0

+   -2.5965    0.2467    0.5896 C   0  0  0

+    3.8672   -0.7603    0.7314 C   0  0  0

+   -3.8775   -0.0027    0.4759 C   0  0  0

+    2.6638    0.9797    0.0000 H   0  0  0

+    1.7431    1.5690    0.0000 H   0  0  0

+   -2.4493   -1.3856    0.0000 H   0  0  0

+   -1.2730   -1.8093    0.0000 H   0  0  0

+    1.7867   -0.7009    0.0000 H   0  0  0

+    2.7075   -1.2902    0.0000 H   0  0  0

+   -2.2788    1.1725    0.0000 H   0  0  0

+    3.5200   -1.6754    0.0000 H   0  0  0

+    4.7823   -1.1075    0.0000 H   0  0  0

+    4.2144    0.1548    0.0000 H   0  0  0

+   -4.5199    0.7358    0.0000 H   0  0  0

+   -4.1959   -0.9283    0.0000 H   0  0  0

+  1  2  1  0

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+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109-70-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+   -0.8698   -0.0113    0.0000 C   0  0  0

+   -2.1591    0.8123    0.0000 C   0  0  0

+    0.3366    0.9298    0.0000 C   0  0  0

+   -3.5807   -0.2967    0.0000 Cl  0  0  0

+    1.9934   -0.1285    0.0000 Br  0  0  0

+   -1.6574   -0.9818    0.0000 H   0  0  0

+    0.0055   -0.9036    0.0000 H   0  0  0

+   -1.3715    1.7828    0.0000 H   0  0  0

+   -3.0344    1.7046    0.0000 H   0  0  0

+    1.1242    1.9003    0.0000 H   0  0  0

+   -0.5387    1.8221    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+37151-16-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 47                          1 V2000

+   -0.8898    1.2681   -0.0098 C   0  0  0

+   -2.2142    0.9115   -0.0593 N   0  0  0

+   -0.8703    2.6669    0.1306 C   0  0  0

+    0.2602    0.6075   -0.0688 N   0  0  0

+   -2.7414   -0.4481   -0.2003 C   0  0  2

+   -2.9491    2.0547    0.0477 C   0  0  0

+    0.3774    3.3121    0.2079 C   0  0  0

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+   -4.0274   -0.4002   -0.8558 O   0  0  0

+   -3.0331   -1.0349    1.1986 C   0  0  1

+    1.4785    2.5742    0.1449 N   0  0  0

+    0.4548    4.6870    0.3460 N   0  0  0

+    2.6751    0.4781   -0.0606 C   0  0  0

+   -4.6891   -1.6295   -0.4860 C   0  0  1

+   -4.3439   -1.8300    1.0064 C   0  0  1

+   -1.9826   -1.9305    1.5680 O   0  0  0

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+   -6.2018   -1.4612   -0.6413 C   0  0  0

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+   -6.5125   -1.1866   -2.0089 O   0  0  0

+    5.0310   -0.9703   -0.1907 C   0  0  0

+    6.2906   -1.7447   -0.2607 N   0  3  0

+    6.2549   -2.9555   -0.3879 O   0  0  0

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+   -1.7965   -0.8651    0.0000 H   0  0  0

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+  1  2  1  0

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+ 20 39  1  0

+ 20 40  1  0

+ 21 41  1  0

+ 22 42  1  0

+ 23 43  1  0

+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+157730-36-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.9049    0.5287    0.0039 C   0  0  0

+   -0.7842   -0.8828    0.0027 C   0  0  0

+    0.2116    1.3153    0.0028 C   0  0  0

+   -2.2664    0.7991    0.0004 N   0  0  0

+    0.4099   -1.4625    0.0013 N   0  0  0

+   -2.0388   -1.3827    0.0036 N   0  0  0

+    1.4666    0.6806    0.0006 C   0  0  0

+   -2.9119   -0.4036   -0.0027 C   0  0  0

+   -2.8918    2.1239    0.0006 C   0  0  0

+    1.5268   -0.7389    0.0010 C   0  0  0

+    2.6652    1.4090   -0.0009 C   0  0  0

+   -4.2766   -0.5651   -0.0066 N   0  0  0

+    2.8003   -1.3434   -0.0010 C   0  0  0

+    3.8159    0.7758   -0.0033 N   0  0  0

+    3.9038   -0.5477   -0.0017 C   0  0  0

+    0.1371    2.3369    0.0000 H   0  0  0

+   -1.9655    2.5612    0.0000 H   0  0  0

+   -3.3291    3.0502    0.0000 H   0  0  0

+   -3.8181    1.6866    0.0000 H   0  0  0

+    2.6432    2.4331    0.0000 H   0  0  0

+   -4.8895    0.2557    0.0000 H   0  0  0

+   -4.6810   -1.5062    0.0000 H   0  0  0

+    2.8932   -2.3635    0.0000 H   0  0  0

+    4.8306   -0.9839    0.0000 H   0  0  0

+  1  2  2  0

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+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+947-73-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.9061   -0.5182   -0.0014 C   0  0  0

+   -0.5469   -0.7139   -0.0007 C   0  0  0

+    1.4263    0.7957   -0.0009 C   0  0  0

+    1.7806   -1.6077    0.0034 C   0  0  0

+   -1.3868    0.4215    0.0003 C   0  0  0

+   -1.1124   -1.9906   -0.0016 C   0  0  0

+    0.5581    1.9095    0.0006 C   0  0  0

+    2.8184    0.9789   -0.0015 C   0  0  0

+    3.1295   -1.3956    0.0032 C   0  0  0

+   -0.7902    1.7568    0.0002 C   0  0  0

+   -2.7756    0.2481    0.0009 C   0  0  0

+   -2.4714   -2.1283   -0.0014 C   0  0  0

+    3.6455   -0.1049   -0.0025 C   0  0  0

+   -1.6129    2.8812    0.0008 N   0  0  0

+   -3.2995   -1.0123    0.0005 C   0  0  0

+    1.4026   -2.5844    0.0000 H   0  0  0

+   -0.4976   -2.8384    0.0000 H   0  0  0

+    0.9639    2.8749    0.0000 H   0  0  0

+    3.2205    1.9459    0.0000 H   0  0  0

+    3.7825   -2.2144    0.0000 H   0  0  0

+   -3.4098    1.0815    0.0000 H   0  0  0

+   -2.8943   -3.0864    0.0000 H   0  0  0

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+   -1.1902    3.8393    0.0000 H   0  0  0

+   -2.6540    2.7682    0.0000 H   0  0  0

+   -4.3389   -1.1400    0.0000 H   0  0  0

+  1  2  2  0

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+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4533-39-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 46                          1 V2000

+    1.4026    0.9327    0.0054 C   0  0  0

+    0.7633   -0.2496   -0.4179 C   0  0  0

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+   -6.0263   -1.3860    1.4656 C   0  0  0

+   -5.5704    0.2279   -0.1908 C   0  0  0

+   -0.6587    0.7594    0.0000 H   0  0  0

+    4.3417    2.0642    0.0000 H   0  0  0

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+   -0.0899   -2.7341    0.0000 H   0  0  0

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+   -4.1456   -1.8921    0.0000 H   0  0  0

+   -3.1142   -1.6781    0.0000 H   0  0  0

+   -6.3457   -0.4457    0.0000 H   0  0  0

+   -6.9666   -1.7054    0.0000 H   0  0  0

+   -5.7069   -2.3263    0.0000 H   0  0  0

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+   -6.5213   -0.0581    0.0000 H   0  0  0

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+ 24 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17026-81-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -1.1185    0.4537   -0.4153 C   0  0  0

+   -0.6719   -0.8604   -0.4271 C   0  0  0

+   -0.2152    1.4928   -0.2361 C   0  0  0

+   -2.4804    0.7320   -0.5901 N   0  0  0

+    0.6772   -1.1337   -0.2597 C   0  0  0

+    1.1298    1.2214   -0.0691 C   0  0  0

+   -3.3947    0.1563    0.2156 C   0  0  0

+    1.5804   -0.0882   -0.0801 C   0  0  0

+    1.1307   -2.4576   -0.2707 N   0  0  0

+   -4.8647    0.3534   -0.0512 C   0  0  0

+   -3.0343   -0.5205    1.1555 O   0  0  0

+    2.9048   -0.3537    0.0844 O   0  0  0

+    3.5619    0.9054    0.2425 C   0  0  0

+    5.0627    0.6770    0.4329 C   0  0  0

+   -1.3572   -1.6393    0.0000 H   0  0  0

+   -0.5495    2.4749    0.0000 H   0  0  0

+   -2.6663    1.7527    0.0000 H   0  0  0

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+   -5.8930    0.4913    0.0000 H   0  0  0

+   -5.0026   -0.6749    0.0000 H   0  0  0

+    3.8296    1.9077    0.0000 H   0  0  0

+    2.5950    1.2815    0.0000 H   0  0  0

+    4.9066   -0.3487    0.0000 H   0  0  0

+    6.0884    0.5209    0.0000 H   0  0  0

+    5.2188    1.7027    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+103-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    1.7630    0.2406   -0.0016 C   0  0  0

+    0.4191    0.4903   -0.0017 N   0  0  0

+    2.6740    1.3002   -0.0016 C   0  0  0

+    2.2327   -1.0760    0.0043 C   0  0  0

+   -0.4191   -0.4903   -0.0017 N   0  0  0

+    4.0286    1.0404   -0.0016 C   0  0  0

+    3.5898   -1.3201    0.0043 C   0  0  0

+   -1.7630   -0.2406   -0.0018 C   0  0  0

+    4.4862   -0.2654   -0.0015 C   0  0  0

+   -2.6740   -1.3002   -0.0019 C   0  0  0

+   -2.2327    1.0760    0.0039 C   0  0  0

+   -4.0286   -1.0404   -0.0015 C   0  0  0

+   -3.5898    1.3201    0.0042 C   0  0  0

+   -4.4862    0.2654   -0.0011 C   0  0  0

+    2.3322    2.2801    0.0000 H   0  0  0

+    1.5618   -1.8677    0.0000 H   0  0  0

+    4.7063    1.8263    0.0000 H   0  0  0

+    3.9400   -2.2970    0.0000 H   0  0  0

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+   -4.7063   -1.8263    0.0000 H   0  0  0

+   -3.9400    2.2970    0.0000 H   0  0  0

+   -5.5065    0.4550    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95791-46-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.1073    1.0840    0.0021 C   0  0  0

+   -0.6891   -0.1981    0.0015 C   0  0  0

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+   -2.7929   -1.5433    0.0001 C   0  0  0

+    1.4749   -1.2535   -0.0002 C   0  0  0

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+   -4.3179    0.7940    0.0019 C   0  0  0

+   -4.1565   -1.5970   -0.0005 C   0  0  0

+    2.4279   -2.7045   -0.0014 Cl  0  0  0

+    4.1188    1.3200    0.0005 C   0  0  0

+   -4.9153   -0.4311    0.0010 C   0  0  0

+   -0.4690    3.1811    0.0000 H   0  0  0

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+ 18 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+171866-15-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 61 65                          1 V2000

+   -1.2118   -1.2537   -0.6606 C   0  0  0

+   -2.0556   -2.2552   -0.2520 C   0  0  0

+    0.2259   -1.5065   -1.0359 C   0  0  2

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+    1.0776   -1.0900    0.0333 O   0  0  0

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+   -3.8566   -0.6514    0.0238 C   0  0  0

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+   -0.0974   -3.7982   -0.1425 C   0  0  2

+    1.9627   -0.1049   -0.5035 C   0  0  1

+   -3.4744    1.7664   -0.4734 C   0  0  0

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+ 35 60  1  0

+ 36 61  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142438-63-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.2688    0.3669   -0.2879 C   0  0  0

+    0.6741   -0.8193   -0.0202 C   0  0  0

+    0.1900   -0.5003   -1.3266 O   0  0  0

+    0.5837    1.6040   -0.1666 C   0  0  0

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+    2.0364   -0.1607    0.2513 C   0  0  0

+    0.2854   -2.0940    0.7315 C   0  0  0

+    1.8482    1.2841    0.1323 N   0  0  0

+    0.1783    2.7368   -0.3198 O   0  0  0

+   -2.5740   -0.5167   -0.3166 O   0  0  0

+   -2.0979    1.2729    0.8891 O   0  0  0

+    2.5114   -0.5096    1.6632 C   0  0  0

+    2.9942   -0.6107   -0.7090 O   0  0  0

+   -0.5538   -2.9892   -0.1824 C   0  0  0

+   -3.9662   -0.4772    0.0939 C   0  0  0

+    0.7011   -2.9624    0.0000 H   0  0  0

+    1.2454   -2.0216    0.0000 H   0  0  0

+    2.5680    1.9234    0.0000 H   0  0  0

+    1.9415   -1.2855    0.0000 H   0  0  0

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+    3.8655   -1.0201    0.0000 H   0  0  0

+   -1.2562   -2.3308    0.0000 H   0  0  0

+   -1.2122   -3.6916    0.0000 H   0  0  0

+    0.1486   -3.6476    0.0000 H   0  0  0

+   -3.9389    0.4851    0.0000 H   0  0  0

+   -4.9285   -0.4499    0.0000 H   0  0  0

+   -3.9935   -1.4395    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105500-28-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 45                          1 V2000

+   -1.7856   -0.0527    0.1038 C   0  0  0

+   -1.9780   -1.5398    0.1594 C   0  0  2

+   -0.4795    0.4756    0.0597 C   0  0  0

+   -2.8454    0.7982    0.1004 C   0  0  0

+   -3.3300   -2.0554   -0.2947 C   0  0  1

+   -2.9878   -1.9392    1.0880 O   0  0  0

+   -0.2921    1.9272    0.0182 C   0  0  0

+    0.6498   -0.3532    0.0533 C   0  0  0

+   -4.2465    0.2408    0.1360 C   0  0  1

+   -2.6669    2.1827    0.0620 C   0  0  0

+   -4.3202   -0.9996   -0.7573 C   0  0  1

+    0.9336    2.4402   -0.0200 N   0  0  0

+   -1.4348    2.7511    0.0204 C   0  0  0

+    1.9010    0.2513    0.0109 C   0  0  0

+   -4.5854   -0.1105    1.4791 O   0  0  0

+   -4.0337   -0.6380   -2.1098 O   0  0  0

+    2.0127    1.6656   -0.0237 C   0  0  0

+    3.1218   -0.5668    0.0021 C   0  0  0

+    3.3392    2.2816   -0.0638 C   0  0  0

+    4.3796    0.0709   -0.0372 C   0  0  0

+    3.0549   -1.9609    0.0314 C   0  0  0

+    4.4557    1.5283   -0.0699 C   0  0  0

+    5.5448   -0.7067   -0.0450 C   0  0  0

+    4.2171   -2.6986    0.0221 C   0  0  0

+    5.4543   -2.0682   -0.0154 C   0  0  0

+   -1.1519   -2.1828    0.0000 H   0  0  0

+   -3.5840   -3.0710    0.0000 H   0  0  0

+    0.5541   -1.3957    0.0000 H   0  0  0

+   -4.8298    1.1101    0.0000 H   0  0  0

+   -3.5107    2.8023    0.0000 H   0  0  0

+   -5.3047   -1.3556    0.0000 H   0  0  0

+   -1.3342    3.7931    0.0000 H   0  0  0

+   -5.3122   -0.8639    0.0000 H   0  0  0

+   -3.3836    0.1825    0.0000 H   0  0  0

+    3.4222    3.3252    0.0000 H   0  0  0

+    2.1257   -2.4431    0.0000 H   0  0  0

+    5.3926    1.9954    0.0000 H   0  0  0

+    6.4838   -0.2438    0.0000 H   0  0  0

+    4.1677   -3.7443    0.0000 H   0  0  0

+    6.3283   -2.6445    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  7 12  2  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 12 17  1  0

+ 14 18  1  0

+ 17 19  1  0

+ 18 20  2  0

+ 18 21  1  0

+ 19 22  2  0

+ 20 23  1  0

+ 21 24  2  0

+ 23 25  2  0

+  5  6  1  0

+  9 11  1  0

+ 10 13  2  0

+ 14 17  2  0

+ 20 22  1  0

+ 24 25  1  0

+  2 26  1  0

+  5 27  1  0

+  8 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 11 31  1  0

+ 13 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 19 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+ 24 39  1  0

+ 25 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142022-84-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+   -0.0299   -0.2429    0.0048 C   0  0  0

+   -1.3874   -0.7073    0.0018 C   0  0  0

+    0.1700    1.1452    0.0044 C   0  0  0

+    1.0244   -1.1674    0.0022 C   0  0  0

+   -2.3947    0.2547   -0.0031 C   0  0  0

+   -1.6644   -2.0894    0.0044 C   0  0  0

+   -1.4907    1.7835   -0.0006 S   0  0  0

+    1.4096    1.6540    0.0064 C   0  0  0

+    2.3782   -0.6164   -0.0003 C   0  0  0

+    0.7138   -2.5379    0.0017 C   0  0  0

+   -3.6833   -0.1437   -0.0081 C   0  0  0

+   -0.5733   -2.9834    0.0118 C   0  0  0

+   -3.0126   -2.4711   -0.0012 C   0  0  0

+   -1.7043    2.3866    1.2683 O   0  0  0

+   -1.6965    2.3870   -1.2705 O   0  0  0

+    2.5372    0.7926    0.0053 C   0  0  0

+    3.5064   -1.4403   -0.0097 C   0  0  0

+   -3.9850   -1.5098   -0.0077 C   0  0  0

+    3.8347    1.3292    0.0039 C   0  0  0

+    4.7524   -0.8840   -0.0116 C   0  0  0

+    4.9138    0.4976   -0.0006 C   0  0  0

+    1.5473    2.6958    0.0000 H   0  0  0

+    1.4967   -3.2389    0.0000 H   0  0  0

+   -4.4564    0.5681    0.0000 H   0  0  0

+   -0.7579   -4.0179    0.0000 H   0  0  0

+   -3.2745   -3.4888    0.0000 H   0  0  0

+    3.3958   -2.4854    0.0000 H   0  0  0

+   -4.9929   -1.8072    0.0000 H   0  0  0

+    3.9732    2.3709    0.0000 H   0  0  0

+    5.5993   -1.5062    0.0000 H   0  0  0

+    5.8822    0.9058    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  6 12  1  0

+  6 13  1  0

+  7 14  2  0

+  7 15  2  0

+  8 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 16 19  1  0

+ 17 20  2  0

+ 19 21  2  0

+  5  7  1  0

+  9 16  2  0

+ 10 12  2  0

+ 13 18  2  0

+ 20 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5329-87-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.4086   -0.3276    0.0100 C   0  0  0

+   -1.8904   -0.3819    0.0147 C   0  0  0

+    0.2224    0.9048    0.1792 C   0  0  0

+    0.3481   -1.4806   -0.1653 C   0  0  0

+   -2.6100    0.7923   -0.2066 C   0  0  0

+   -2.5606   -1.5797    0.2359 C   0  0  0

+    1.6003    0.9734    0.1700 C   0  0  0

+   -0.6017    2.1479    0.3779 C   0  0  0

+    1.7273   -1.3997   -0.1701 C   0  0  0

+   -1.8797    2.0844   -0.4538 C   0  0  0

+   -3.9892    0.7593   -0.1998 C   0  0  0

+   -3.9419   -1.6006    0.2385 C   0  0  0

+    2.3503   -0.1766   -0.0015 C   0  0  0

+   -4.6530   -0.4343    0.0219 C   0  0  0

+    3.8283   -0.0964   -0.0107 N   0  3  0

+    4.4921   -1.1064   -0.1613 O   0  0  0

+    4.3807    0.9797    0.1324 O   0  5  0

+   -0.1164   -2.4048    0.0000 H   0  0  0

+   -2.0307   -2.4680    0.0000 H   0  0  0

+    2.0702    1.8949    0.0000 H   0  0  0

+    0.3482    2.5572    0.0000 H   0  0  0

+   -0.8357    3.1554    0.0000 H   0  0  0

+    2.2934   -2.2654    0.0000 H   0  0  0

+   -1.7370    3.1089    0.0000 H   0  0  0

+   -2.8594    2.4161    0.0000 H   0  0  0

+   -4.5242    1.6446    0.0000 H   0  0  0

+   -4.4415   -2.5063    0.0000 H   0  0  0

+   -5.6871   -0.4550    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  1  0

+ 11 14  1  0

+ 13 15  1  0

+ 15 16  2  0

+ 15 17  1  0

+  8 10  1  0

+  9 13  2  0

+ 12 14  2  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63-74-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    1.7673   -0.0001   -0.0659 S   0  0  0

+    0.0057    0.0000   -0.0317 C   0  0  0

+    2.2929    0.0032    1.5045 N   0  0  0

+    2.1431   -1.2638   -0.5961 O   0  0  0

+    2.1432    1.2612   -0.6015 O   0  0  0

+   -0.6839    1.1983   -0.0209 C   0  0  0

+   -0.6843   -1.1987   -0.0215 C   0  0  0

+   -2.0649    1.2020    0.0058 C   0  0  0

+   -2.0649   -1.2022    0.0052 C   0  0  0

+   -2.7608    0.0002    0.0219 C   0  0  0

+   -4.1573    0.0003    0.0494 N   0  0  0

+    2.8170   -0.8915    0.0000 H   0  0  0

+    2.8057    0.9044    0.0000 H   0  0  0

+   -0.1636    2.0952    0.0000 H   0  0  0

+   -0.1641   -2.0957    0.0000 H   0  0  0

+   -2.5816    2.1010    0.0000 H   0  0  0

+   -2.5817   -2.1011    0.0000 H   0  0  0

+   -4.6757    0.8983    0.0000 H   0  0  0

+   -4.6758   -0.8977    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  7  9  2  0

+  8 10  2  0

+ 10 11  1  0

+  9 10  1  0

+  3 12  1  0

+  3 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+88-23-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    2.0209   -0.7127   -0.0749 S   0  0  0

+    2.8007    0.2160   -0.8156 O   0  0  0

+    1.8656   -2.0901   -0.3876 O   0  0  0

+    2.5658   -0.6700    1.3456 O   0  0  0

+    0.3911   -0.0443   -0.0341 C   0  0  0

+    0.2063    1.3276   -0.0096 C   0  0  0

+   -0.7032   -0.8904   -0.0325 C   0  0  0

+    1.2818    2.1605   -0.0173 O   0  0  0

+   -1.0838    1.8535    0.0226 C   0  0  0

+   -1.9843   -0.3698   -0.0005 C   0  0  0

+   -1.2759    3.2397    0.0471 N   0  0  0

+   -2.1768    1.0000    0.0299 C   0  0  0

+   -3.3533   -1.4372    0.0008 Cl  0  0  0

+    3.6008   -0.5889    0.0000 H   0  0  0

+   -0.5623   -1.9190    0.0000 H   0  0  0

+    2.1026    2.7962    0.0000 H   0  0  0

+   -0.4565    3.8773    0.0000 H   0  0  0

+   -2.2378    3.6305    0.0000 H   0  0  0

+   -3.1394    1.3890    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  2  0

+  4  1  1  0

+  5  1  1  0

+  6  5  2  0

+  7  5  1  0

+  8  6  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  9  1  0

+ 12  9  2  0

+ 13 10  1  0

+ 10 12  1  0

+  4 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+125486-24-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 61                          1 V2000

+    3.7082   -0.1755   -0.4872 C   0  0  0

+    4.4019   -1.2944    0.0145 C   0  0  0

+    4.4429    1.0058   -0.7113 C   0  0  0

+    2.3576   -0.2361   -0.7551 N   0  0  0

+    5.7945   -1.1939    0.2724 C   0  0  0

+    3.7345   -2.5061    0.2628 C   0  0  0

+    5.8338    1.0266   -0.4283 C   0  0  0

+    3.8174    2.1613   -1.2100 C   0  0  0

+    1.6654    0.2057    0.4629 C   0  0  0

+    6.4484   -0.0560    0.0458 N   0  0  0

+    6.4764   -2.3214    0.7744 C   0  0  0

+    4.4290   -3.5707    0.7479 C   0  0  0

+    6.5569    2.2152   -0.6572 C   0  0  0

+    4.5508    3.2886   -1.4167 C   0  0  0

+    0.1532    0.1627    0.2341 C   0  0  0

+    5.7974   -3.4766    1.0018 C   0  0  0

+    5.9179    3.3131   -1.1407 C   0  0  0

+   -0.5678    0.6229    1.5027 C   0  0  0

+   -2.0573    0.5805    1.2773 C   0  0  0

+   -2.7668   -0.5704    1.5689 C   0  0  0

+   -2.7123    1.6941    0.7848 C   0  0  0

+   -4.1316   -0.6126    1.3636 C   0  0  0

+   -4.0774    1.6587    0.5771 C   0  0  0

+   -4.7921    0.5028    0.8635 C   0  0  0

+   -6.1725    0.4634    0.6542 N   0  0  0

+   -6.7029    0.2174   -0.6891 C   0  0  0

+   -7.0898    0.6680    1.7779 C   0  0  0

+   -6.6656   -1.2832   -0.9853 C   0  0  0

+   -7.1871    2.1624    2.0913 C   0  0  0

+   -7.3184   -1.5858   -2.6384 Cl  0  0  0

+    2.0953   -1.2156    0.0000 H   0  0  0

+    2.7212   -2.5439    0.0000 H   0  0  0

+    2.8043    2.2022    0.0000 H   0  0  0

+    2.4551    0.8417    0.0000 H   0  0  0

+    1.3147    1.1571    0.0000 H   0  0  0

+    7.4903   -2.3150    0.0000 H   0  0  0

+    3.9770   -4.4783    0.0000 H   0  0  0

+    7.5708    2.2053    0.0000 H   0  0  0

+    4.0594    4.1755    0.0000 H   0  0  0

+   -0.6365   -0.4733    0.0000 H   0  0  0

+    0.5039   -0.7887    0.0000 H   0  0  0

+    6.3309   -4.3389    0.0000 H   0  0  0

+    6.4155    4.1966    0.0000 H   0  0  0

+    0.2219    1.2589    0.0000 H   0  0  0

+   -0.9185    1.5743    0.0000 H   0  0  0

+   -2.2589   -1.4480    0.0000 H   0  0  0

+   -2.2203    2.5807    0.0000 H   0  0  0

+   -4.6201   -1.5012    0.0000 H   0  0  0

+   -4.5825    2.5379    0.0000 H   0  0  0

+   -7.0004    1.1867    0.0000 H   0  0  0

+   -7.7037    0.0545    0.0000 H   0  0  0

+   -8.1033    0.6982    0.0000 H   0  0  0

+   -7.2158   -0.3381    0.0000 H   0  0  0

+   -6.3682   -2.2526    0.0000 H   0  0  0

+   -5.6648   -1.1204    0.0000 H   0  0  0

+   -6.1753    2.2283    0.0000 H   0  0  0

+   -7.2530    3.1742    0.0000 H   0  0  0

+   -8.1989    2.0965    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 11 16  2  0

+ 13 17  2  0

+ 15 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+ 19 21  2  0

+ 20 22  2  0

+ 21 23  1  0

+ 22 24  1  0

+ 24 25  1  0

+ 25 26  1  0

+ 25 27  1  0

+ 26 28  1  0

+ 27 29  1  0

+ 28 30  1  0

+  7 10  1  0

+ 12 16  1  0

+ 14 17  1  0

+ 23 24  2  0

+  4 31  1  0

+  6 32  1  0

+  8 33  1  0

+  9 34  1  0

+  9 35  1  0

+ 11 36  1  0

+ 12 37  1  0

+ 13 38  1  0

+ 14 39  1  0

+ 15 40  1  0

+ 15 41  1  0

+ 16 42  1  0

+ 17 43  1  0

+ 18 44  1  0

+ 18 45  1  0

+ 20 46  1  0

+ 21 47  1  0

+ 22 48  1  0

+ 23 49  1  0

+ 26 50  1  0

+ 26 51  1  0

+ 27 52  1  0

+ 27 53  1  0

+ 28 54  1  0

+ 28 55  1  0

+ 29 56  1  0

+ 29 57  1  0

+ 29 58  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-90-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.3545    0.0001    0.0030 C   0  0  0

+    0.3377   -1.1981    0.0018 C   0  0  0

+    0.3374    1.1979    0.0018 C   0  0  0

+   -2.0905    0.0000   -0.0011 Cl  0  0  0

+    1.7196   -1.1974   -0.0007 C   0  0  0

+    1.7197    1.1973   -0.0006 C   0  0  0

+    2.4106    0.0002   -0.0019 C   0  0  0

+   -0.1804   -2.0964    0.0000 H   0  0  0

+   -0.1808    2.0961    0.0000 H   0  0  0

+    2.2384   -2.0953    0.0000 H   0  0  0

+    2.2385    2.0952    0.0000 H   0  0  0

+    3.4476    0.0003    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  6  7  2  0

+  2  8  1  0

+  3  9  1  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91897-48-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 47                          1 V2000

+    1.0046   -0.1137   -0.5070 C   0  0  0

+   -0.1665   -0.8705   -0.6251 C   0  0  0

+    1.0837    1.3477   -0.5053 C   0  0  0

+    2.3014   -0.6232   -0.3763 C   0  0  0

+   -1.4321   -0.0897   -0.7831 C   0  0  2

+    0.0051   -2.2166   -0.5858 C   0  0  0

+   -0.1955    2.1437   -0.6118 C   0  0  0

+    2.3709    1.6331   -0.3897 C   0  0  0

+    3.1167    0.4662   -0.3121 N   0  0  0

+    2.4436   -2.0094   -0.3454 C   0  0  0

+   -1.3239    1.2591   -0.0692 C   0  0  1

+   -2.6153   -0.8412   -0.2437 C   0  0  0

+    1.2807   -2.7615   -0.4444 C   0  0  0

+    4.5749    0.4130   -0.1819 C   0  0  0

+   -2.6137    1.9492   -0.1587 N   0  0  0

+   -3.5508   -0.2358    0.4310 C   0  0  0

+    4.9490    0.4055    1.2779 C   0  0  0

+   -3.5312    1.2329    0.7344 C   0  0  0

+   -2.4186    3.2853    0.4197 C   0  0  0

+   -4.7132   -1.0535    0.9323 C   0  0  0

+    5.6244   -0.6005    1.7759 C   0  0  0

+   -4.5412   -2.4166    0.5395 O   0  0  0

+   -2.3231    0.4474    0.0000 H   0  0  0

+   -0.8250   -2.8437    0.0000 H   0  0  0

+    0.4530    2.9572    0.0000 H   0  0  0

+   -0.9281    2.8823    0.0000 H   0  0  0

+    2.7683    2.5945    0.0000 H   0  0  0

+    3.3816   -2.4593    0.0000 H   0  0  0

+   -0.4074    0.7668    0.0000 H   0  0  0

+   -2.6197   -1.8815    0.0000 H   0  0  0

+    1.3692   -3.7981    0.0000 H   0  0  0

+    4.0271   -0.4714    0.0000 H   0  0  0

+    5.0719   -0.5009    0.0000 H   0  0  0

+    5.4476    1.3186    0.0000 H   0  0  0

+   -3.9719    2.1753    0.0000 H   0  0  0

+   -4.5482    1.0139    0.0000 H   0  0  0

+   -1.3892    3.1350    0.0000 H   0  0  0

+   -2.2683    4.3147    0.0000 H   0  0  0

+   -3.4480    3.4356    0.0000 H   0  0  0

+   -5.1662   -0.1170    0.0000 H   0  0  0

+   -5.7107   -1.3490    0.0000 H   0  0  0

+    5.1663   -1.5346    0.0000 H   0  0  0

+    6.6624   -0.5302    0.0000 H   0  0  0

+   -4.4110   -3.4487    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  7 11  1  0

+  8  9  1  0

+ 10 13  1  0

+ 16 18  1  0

+  5 23  1  0

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+  7 25  1  0

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+ 20 40  1  0

+ 20 41  1  0

+ 21 42  1  0

+ 21 43  1  0

+ 22 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93-58-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.2378    0.0946   -0.0010 C   0  0  0

+   -1.2277    0.2803   -0.0002 C   0  0  0

+    1.0852    1.2042    0.0003 C   0  0  0

+    0.7819   -1.1915    0.0027 C   0  0  0

+   -2.0426   -0.7924   -0.0015 O   0  0  0

+   -1.6980    1.4003    0.0017 O   0  0  0

+    2.4530    1.0235   -0.0005 C   0  0  0

+    2.1510   -1.3577    0.0018 C   0  0  0

+   -3.4831   -0.6099   -0.0007 C   0  0  0

+    2.9852   -0.2534   -0.0027 C   0  0  0

+    0.6872    2.1626    0.0000 H   0  0  0

+    0.1574   -2.0203    0.0000 H   0  0  0

+    3.0840    1.8474    0.0000 H   0  0  0

+    2.5566   -2.3129    0.0000 H   0  0  0

+   -3.3527    0.4196    0.0000 H   0  0  0

+   -4.5126   -0.4795    0.0000 H   0  0  0

+   -3.6135   -1.6394    0.0000 H   0  0  0

+    4.0147   -0.3838    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+  9 16  1  0

+  9 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91379-15-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 45                          1 V2000

+    2.8086   -0.2340   -0.3695 C   0  0  0

+    1.5733    0.1009    0.2318 C   0  0  0

+    3.9573    0.2409    0.1443 C   0  0  0

+    0.4127   -0.3789   -0.2873 C   0  0  0

+    5.1390   -0.0794   -0.4309 O   0  0  0

+   -0.8170   -0.0456    0.3113 C   0  0  0

+    6.1590    0.5676    0.3328 C   0  0  0

+   -1.9791   -0.5261   -0.2086 C   0  0  0

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+    7.7384   -1.1688   -0.2426 O   0  0  0

+   -4.3685   -0.6716   -0.1279 C   0  0  0

+    9.8995    0.6354   -0.0118 O   0  0  0

+   -5.6451   -0.3255    0.4935 C   0  0  0

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+   -8.1022   -0.4403    0.6241 C   0  0  0

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+  -10.3179    0.6554    0.2597 C   0  0  0

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+    2.8694   -1.1876    0.0000 H   0  0  0

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+   -0.8778    0.9080    0.0000 H   0  0  0

+    6.6084    1.4109    0.0000 H   0  0  0

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+   -1.9183   -1.4797    0.0000 H   0  0  0

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+   -5.7059    0.6281    0.0000 H   0  0  0

+   -6.7250   -1.7507    0.0000 H   0  0  0

+   -8.9429   -0.8946    0.0000 H   0  0  0

+   -7.9922   -1.3895    0.0000 H   0  0  0

+   -8.1406    0.7474    0.0000 H   0  0  0

+   -9.0913    1.2423    0.0000 H   0  0  0

+  -11.1585    0.2011    0.0000 H   0  0  0

+  -10.2079   -0.2938    0.0000 H   0  0  0

+  -10.5849    2.1225    0.0000 H   0  0  0

+  -11.9308    2.0008    0.0000 H   0  0  0

+  -11.8091    0.6549    0.0000 H   0  0  0

+  1  2  1  0

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+ 20 44  1  0

+ 20 45  1  0

+ 20 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24684-41-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.7070    0.7313   -0.0436 C   0  0  0

+   -0.1407   -0.3976   -0.0197 C   0  0  0

+    2.0998    0.5476   -0.0616 C   0  0  0

+    0.1487    2.0310   -0.0551 C   0  0  0

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+   -0.4774   -2.8916    0.0051 C   0  0  0

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+    4.4808    0.7882    0.3429 C   0  0  0

+   -3.4733    1.3434    0.0198 C   0  0  0

+   -3.8281   -1.0258    0.0543 C   0  0  0

+   -4.3199    0.2742    0.0479 C   0  0  0

+    0.7896    2.8673    0.0000 H   0  0  0

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+   -1.5654    3.2055    0.0000 H   0  0  0

+   -2.1207   -2.2529    0.0000 H   0  0  0

+    2.1875   -2.7923    0.0000 H   0  0  0

+   -1.3261   -2.2672    0.0000 H   0  0  0

+   -1.1018   -3.7403    0.0000 H   0  0  0

+    0.3713   -3.5160    0.0000 H   0  0  0

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+    5.1725   -0.8061    0.0000 H   0  0  0

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+    4.9375    1.7377    0.0000 H   0  0  0

+   -3.8595    2.3237    0.0000 H   0  0  0

+   -4.5005   -1.8370    0.0000 H   0  0  0

+   -5.3611    0.4359    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109-89-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.0000   -0.3487    0.0000 N   0  0  0

+   -1.1786    0.5282    0.0000 C   0  0  0

+    1.1786    0.5282    0.0000 C   0  0  0

+   -2.4488   -0.3248    0.0000 C   0  0  0

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+   -1.8218   -1.2585    0.0000 H   0  0  0

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+  1  2  1  0

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+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+614-45-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    1.5235    0.2446    0.0343 C   0  0  0

+    0.1788    0.8533    0.0927 C   0  0  0

+    2.6543    1.0531   -0.0993 C   0  0  0

+    1.6701   -1.1413    0.1181 C   0  0  0

+   -0.9099    0.0705    0.2216 O   0  0  0

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+   -2.0475    0.5925    0.3667 O   0  0  0

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+   -2.8744   -1.6443    0.7586 C   0  0  0

+   -4.4145    0.2008    0.0760 C   0  0  0

+   -2.7469   -0.7008   -1.5514 C   0  0  0

+    2.5561    2.0814    0.0000 H   0  0  0

+    0.8343   -1.7484    0.0000 H   0  0  0

+    4.7475    1.0784    0.0000 H   0  0  0

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+   -4.8025   -0.7566    0.0000 H   0  0  0

+   -3.5618   -1.3356    0.0000 H   0  0  0

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+   -1.9320   -0.0660    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117-05-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -0.2850    0.7517    0.3707 C   0  0  0

+   -1.4214    1.5760    0.2532 C   0  0  0

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+ 17 22  2  0

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+ 22 24  1  0

+ 23 25  2  0

+ 24 26  2  0

+  8 13  2  0

+  9 11  2  0

+ 19 20  1  0

+ 25 26  1  0

+  6 27  1  0

+  7 28  1  0

+  8 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+ 24 36  1  0

+ 25 37  1  0

+ 26 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17024-19-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.2034    0.2306   -0.0028 C   0  0  0

+   -1.5356   -0.3802   -0.0015 C   0  0  0

+   -0.1032    1.6404   -0.0006 C   0  0  0

+    0.9570   -0.5456   -0.0003 C   0  0  0

+   -2.6693    0.4638    0.0019 C   0  0  0

+   -1.7048   -1.7661   -0.0040 C   0  0  0

+   -1.2762    2.4299    0.0023 C   0  0  0

+    1.1666    2.2353   -0.0018 C   0  0  0

+    2.1792    0.0641   -0.0011 C   0  0  0

+   -2.5020    1.8679    0.0035 C   0  0  0

+   -3.9486   -0.1100    0.0031 C   0  0  0

+   -2.9643   -2.2942   -0.0032 C   0  0  0

+    2.2820    1.4502   -0.0050 C   0  0  0

+    3.4083   -0.7607    0.0015 N   0  3  0

+   -4.0817   -1.4675    0.0011 C   0  0  0

+    4.5017   -0.2242    0.0008 O   0  0  0

+    3.3262   -1.9760    0.0044 O   0  5  0

+    0.8907   -1.5905    0.0000 H   0  0  0

+   -0.8698   -2.3978    0.0000 H   0  0  0

+   -1.1912    3.4735    0.0000 H   0  0  0

+    1.2582    3.2783    0.0000 H   0  0  0

+   -3.3482    2.4846    0.0000 H   0  0  0

+   -4.7987    0.5013    0.0000 H   0  0  0

+   -3.0896   -3.3337    0.0000 H   0  0  0

+    3.2286    1.8978    0.0000 H   0  0  0

+   -5.0386   -1.8926    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+  9 14  1  0

+ 11 15  2  0

+ 14 16  2  0

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+  7 10  1  0

+  9 13  1  0

+ 12 15  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+56-53-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 41                          1 V2000

+    0.4281    0.4825   -0.5525 C   0  0  0

+   -0.4139   -0.5603   -0.4673 C   0  0  0

+    1.8606    0.2986   -0.2607 C   0  0  0

+   -0.0912    1.8394   -0.9526 C   0  0  0

+   -1.8466   -0.3314   -0.2105 C   0  0  0

+    0.1067   -1.9647   -0.6343 C   0  0  0

+    2.2849    0.0685    1.0509 C   0  0  0

+    2.7990    0.3479   -1.2957 C   0  0  0

+   -0.0158    2.7880    0.2455 C   0  0  0

+   -2.8022   -0.7637   -1.1342 C   0  0  0

+   -2.2547    0.3139    0.9606 C   0  0  0

+   -0.1133   -2.7476    0.6617 C   0  0  0

+    3.6259   -0.1028    1.3189 C   0  0  0

+    4.1375    0.1754   -1.0179 C   0  0  0

+   -4.1411   -0.5473   -0.8896 C   0  0  0

+   -3.5956    0.5257    1.1963 C   0  0  0

+    4.5550   -0.0473    0.2882 C   0  0  0

+   -4.5413    0.0993    0.2725 C   0  0  0

+    5.8759   -0.2164    0.5573 O   0  0  0

+   -5.8624    0.3108    0.5091 O   0  0  0

+   -0.9885    2.2780    0.0000 H   0  0  0

+   -0.8282    1.1653    0.0000 H   0  0  0

+    0.9378   -2.5186    0.0000 H   0  0  0

+    0.8902   -1.3453    0.0000 H   0  0  0

+    1.9783   -0.8820    0.0000 H   0  0  0

+    2.8368    1.3459    0.0000 H   0  0  0

+    0.9798    2.7089    0.0000 H   0  0  0

+    0.0633    3.7836    0.0000 H   0  0  0

+   -1.0114    2.8671    0.0000 H   0  0  0

+   -2.6705   -1.7537    0.0000 H   0  0  0

+   -1.7059    1.1484    0.0000 H   0  0  0

+   -1.0748   -2.4774    0.0000 H   0  0  0

+   -0.3835   -3.7091    0.0000 H   0  0  0

+    0.8482   -3.0178    0.0000 H   0  0  0

+    3.5923   -1.1010    0.0000 H   0  0  0

+    4.4413    1.1268    0.0000 H   0  0  0

+   -4.6954   -1.3781    0.0000 H   0  0  0

+   -3.7285    1.5156    0.0000 H   0  0  0

+    6.8666   -0.3432    0.0000 H   0  0  0

+   -6.8486    0.4687    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  2  0

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+  5 10  2  0

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+ 15 18  2  0

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+ 14 17  1  0

+ 16 18  1  0

+  4 21  1  0

+  4 22  1  0

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+ 12 33  1  0

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+ 13 35  1  0

+ 14 36  1  0

+ 15 37  1  0

+ 16 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6755-13-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.4546   -0.0311   -0.0033 C   0  0  0

+   -1.6303   -0.6934   -0.0030 O   0  0  0

+   -0.7320    1.3202   -0.0001 C   0  0  0

+    0.8340   -0.6184   -0.0010 C   0  0  0

+   -2.6391    0.1888    0.0002 C   0  0  0

+   -2.1299    1.4407    0.0021 C   0  0  0

+    1.9382    0.1691   -0.0016 C   0  0  0

+   -4.0795   -0.1531    0.0008 N   0  3  0

+    3.2262   -0.4179    0.0006 C   0  0  0

+   -4.9156    0.7326    0.0039 O   0  0  0

+   -4.4285   -1.3200   -0.0018 O   0  5  0

+    4.3235    0.3646    0.0000 N   0  0  0

+    3.3429   -1.6301    0.0031 O   0  0  0

+    5.6565   -0.2429    0.0024 C   0  0  0

+    4.1831    1.8229   -0.0030 C   0  0  0

+   -0.0558    2.0801    0.0000 H   0  0  0

+    0.9314   -1.6309    0.0000 H   0  0  0

+   -2.6609    2.3083    0.0000 H   0  0  0

+    1.8408    1.1816    0.0000 H   0  0  0

+    5.2347   -1.1685    0.0000 H   0  0  0

+    6.5821   -0.6647    0.0000 H   0  0  0

+    6.0783    0.6827    0.0000 H   0  0  0

+    5.1956    1.9204    0.0000 H   0  0  0

+    4.0856    2.8354    0.0000 H   0  0  0

+    3.1706    1.7254    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

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+  5  6  2  0

+  3 16  1  0

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+ 14 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77-46-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+   -0.0029   -1.8345   -0.0365 S   0  0  0

+   -1.4120   -0.7801   -0.1220 C   0  0  0

+    1.4174   -0.8037    0.1214 C   0  0  0

+   -0.1149   -2.5293    1.1980 O   0  0  0

+    0.1021   -2.4430   -1.3163 O   0  0  0

+   -1.8607   -0.3264   -1.3485 C   0  0  0

+   -2.0703   -0.4127    1.0376 C   0  0  0

+    1.8705   -0.4411    1.3764 C   0  0  0

+    2.0801   -0.3638   -1.0100 C   0  0  0

+   -2.9654    0.4999   -1.4189 C   0  0  0

+   -3.1752    0.4131    0.9739 C   0  0  0

+    2.9840    0.3664    1.5036 C   0  0  0

+    3.1938    0.4437   -0.8896 C   0  0  0

+   -3.6253    0.8748   -0.2562 C   0  0  0

+    3.6483    0.8141    0.3695 C   0  0  0

+   -4.7446    1.7118   -0.3242 N   0  0  0

+    4.7765    1.6322    0.4949 N   0  0  0

+   -5.9504    1.2579    0.0714 C   0  0  0

+    5.9366    1.2748   -0.0907 C   0  0  0

+   -7.1729    2.1233   -0.0948 C   0  0  0

+   -6.0517    0.1529    0.5613 O   0  0  0

+    7.1118    2.2179   -0.0723 C   0  0  0

+    6.0347    0.1941   -0.6325 O   0  0  0

+   -1.2884    0.3306    0.0000 H   0  0  0

+   -2.5445   -1.1437    0.0000 H   0  0  0

+    1.3424    0.2519    0.0000 H   0  0  0

+    2.5769   -1.0796    0.0000 H   0  0  0

+   -2.4883    1.2290    0.0000 H   0  0  0

+   -3.7497   -0.2420    0.0000 H   0  0  0

+    2.4847    1.0805    0.0000 H   0  0  0

+    3.7250   -0.2470    0.0000 H   0  0  0

+   -4.6221    2.5745    0.0000 H   0  0  0

+    4.6340    2.4918    0.0000 H   0  0  0

+   -6.6695    2.8345    0.0000 H   0  0  0

+   -7.8841    2.6267    0.0000 H   0  0  0

+   -7.6763    1.4121    0.0000 H   0  0  0

+    7.6571    1.5383    0.0000 H   0  0  0

+    7.7914    2.7632    0.0000 H   0  0  0

+    6.5665    2.8975    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

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+  2  7  1  0

+  3  8  2  0

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+ 11 14  1  0

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+ 16 32  1  0

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+ 20 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+613-65-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+   -3.8714    0.6871   -0.0021 C   0  0  0

+   -4.2947   -0.6667   -0.0017 C   0  0  0

+   -2.5008    0.9826   -0.0016 C   0  0  0

+   -4.8358    1.7115    0.0028 C   0  0  0

+   -3.3361   -1.6968   -0.0008 C   0  0  0

+   -5.6691   -0.9567   -0.0017 C   0  0  0

+   -1.5798   -0.0547   -0.0007 C   0  0  0

+   -6.1584    1.3911    0.0079 C   0  0  0

+   -2.0133   -1.3939   -0.0004 C   0  0  0

+   -6.5738    0.0608   -0.0021 C   0  0  0

+   -0.2426    0.2254   -0.0002 N   0  0  0

+    0.6177   -0.7358    0.0006 N   0  0  0

+    1.9529   -0.4561    0.0011 C   0  0  0

+    2.8876   -1.4972    0.0020 C   0  0  0

+    2.3914    0.8729   -0.0051 C   0  0  0

+    4.2340   -1.2109    0.0020 C   0  0  0

+    3.7391    1.1509   -0.0051 C   0  0  0

+    4.6660    0.1121    0.0012 C   0  0  0

+    6.0289    0.3976    0.0012 N   0  0  0

+    6.4857    1.7896    0.0003 C   0  0  0

+    7.0060   -0.6940    0.0022 C   0  0  0

+   -2.1761    1.9752    0.0000 H   0  0  0

+   -4.5382    2.7126    0.0000 H   0  0  0

+   -3.6429   -2.6951    0.0000 H   0  0  0

+   -5.9957   -1.9487    0.0000 H   0  0  0

+   -6.8725    2.1532    0.0000 H   0  0  0

+   -1.3080   -2.1641    0.0000 H   0  0  0

+   -7.5948   -0.1590    0.0000 H   0  0  0

+    2.5642   -2.4902    0.0000 H   0  0  0

+    1.6967    1.6527    0.0000 H   0  0  0

+    4.9323   -1.9875    0.0000 H   0  0  0

+    4.0670    2.1424    0.0000 H   0  0  0

+    7.4780    1.4640    0.0000 H   0  0  0

+    6.8113    2.7819    0.0000 H   0  0  0

+    5.4934    2.1152    0.0000 H   0  0  0

+    6.2278   -1.3905    0.0000 H   0  0  0

+    7.7025   -1.4722    0.0000 H   0  0  0

+    7.7842    0.0025    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  7  9  2  0

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+ 17 18  1  0

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+ 10 28  1  0

+ 14 29  1  0

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+ 17 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-34-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.6191    0.0827   -0.0007 C   0  0  0

+   -0.6026    0.9650    0.0016 C   0  0  0

+    1.8438    0.6321    0.0005 O   0  0  0

+    0.4962   -1.1193    0.0016 O   0  0  0

+   -2.0851   -0.0612   -0.0007 Cl  0  0  0

+    3.0209   -0.2181   -0.0017 C   0  0  0

+    0.1307    1.7701    0.0000 H   0  0  0

+   -1.3197    1.7846    0.0000 H   0  0  0

+    2.3832   -1.1009    0.0000 H   0  0  0

+    3.9037   -0.8558    0.0000 H   0  0  0

+    3.6586    0.6647    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  2  7  1  0

+  2  8  1  0

+  6  9  1  0

+  6 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+814-78-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.7892   -0.0655   -0.0016 C   0  0  0

+   -0.6696    0.0396   -0.0003 C   0  0  0

+    1.6346    1.1820   -0.0008 C   0  0  0

+    1.3717   -1.2663    0.0022 C   0  0  0

+   -1.3273    1.3955    0.0017 C   0  0  0

+   -1.3502   -0.9648   -0.0009 O   0  0  0

+    2.5427    0.5666    0.0000 H   0  0  0

+    2.2500    2.0901    0.0000 H   0  0  0

+    0.7265    1.7974    0.0000 H   0  0  0

+    0.7564   -2.1744    0.0000 H   0  0  0

+    2.4658   -1.3452    0.0000 H   0  0  0

+   -0.3403    1.8742    0.0000 H   0  0  0

+   -1.8060    2.3825    0.0000 H   0  0  0

+   -2.3143    0.9168    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93673-33-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 38                          1 V2000

+   -0.5106    0.5477   -0.1169 C   0  0  0

+   -1.7879    0.0153   -0.0976 C   0  0  0

+   -0.6458    2.0468   -0.2315 C   0  0  0

+    0.5577   -0.3300   -0.0390 C   0  0  0

+   -2.8130    0.9563   -0.1856 C   0  0  0

+   -2.0576   -1.4102    0.0053 C   0  0  0

+   -2.1658    2.3168   -0.2763 C   0  0  0

+   -1.3753    2.5434    0.8925 O   0  0  0

+    1.9437    0.1570   -0.0556 C   0  0  0

+    0.3183   -1.7734    0.0617 C   0  0  0

+   -4.0952    0.5049   -0.1746 C   0  0  0

+   -0.9772   -2.2904    0.0899 C   0  0  0

+   -3.4076   -1.8134    0.0126 C   0  0  0

+    3.0023   -0.7721    0.0232 C   0  0  0

+    2.2250    1.5213   -0.1474 C   0  0  0

+    1.4657   -2.6776    0.1423 C   0  0  0

+   -4.3769   -0.8597   -0.0772 C   0  0  0

+    2.7240   -2.2011    0.1236 C   0  0  0

+    4.3244   -0.3063    0.0043 C   0  0  0

+    3.5337    1.9479   -0.1624 C   0  0  0

+    4.5751    1.0318   -0.0878 C   0  0  0

+    0.2551    2.5765    0.0000 H   0  0  0

+   -2.8414    3.1141    0.0000 H   0  0  0

+   -4.8823    1.1924    0.0000 H   0  0  0

+   -1.1354   -3.3235    0.0000 H   0  0  0

+   -3.6596   -2.8277    0.0000 H   0  0  0

+    1.4459    2.2179    0.0000 H   0  0  0

+    1.3067   -3.7105    0.0000 H   0  0  0

+   -5.3769   -1.1635    0.0000 H   0  0  0

+    3.5230   -2.8748    0.0000 H   0  0  0

+    5.1179   -0.9864    0.0000 H   0  0  0

+    3.7446    2.9715    0.0000 H   0  0  0

+    5.5631    1.3725    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

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+  5 11  1  0

+  6 12  1  0

+  6 13  2  0

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+ 15 20  2  0

+ 19 21  2  0

+  5  7  1  0

+  7  8  1  0

+ 10 12  2  0

+ 13 17  1  0

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+ 20 21  1  0

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+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101-73-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -0.3293   -0.7588   -0.0754 C   0  0  0

+   -1.6051   -1.3327   -0.1165 N   0  0  0

+    0.2827   -0.5119    1.1469 C   0  0  0

+    0.3280   -0.4411   -1.2566 C   0  0  0

+   -2.7391   -0.5198   -0.0479 C   0  0  0

+    1.5413    0.0543    1.1865 C   0  0  0

+    1.5870    0.1253   -1.2151 C   0  0  0

+   -3.9998   -1.0920    0.0707 C   0  0  0

+   -2.6086    0.8624   -0.0922 C   0  0  0

+    2.1948    0.3767    0.0059 C   0  0  0

+   -5.1185   -0.2856    0.1388 C   0  0  0

+   -3.7319    1.6631   -0.0237 C   0  0  0

+    3.4345    0.9344    0.0459 O   0  0  0

+   -4.9854    1.0902    0.0890 C   0  0  0

+    4.3727   -0.1435    0.0405 C   0  0  0

+    5.2680   -0.0342   -1.1953 C   0  0  0

+    5.2349   -0.0754    1.3026 C   0  0  0

+   -1.7080   -2.3620    0.0000 H   0  0  0

+    0.6885   -1.4634    0.0000 H   0  0  0

+   -0.1093    0.4964    0.0000 H   0  0  0

+    1.9824   -0.8814    0.0000 H   0  0  0

+    1.1771    1.0750    0.0000 H   0  0  0

+   -4.1023   -2.1214    0.0000 H   0  0  0

+   -1.6678    1.2924    0.0000 H   0  0  0

+   -6.0610   -0.7120    0.0000 H   0  0  0

+   -3.6335    2.6928    0.0000 H   0  0  0

+   -5.8277    1.6906    0.0000 H   0  0  0

+    3.9814   -1.1011    0.0000 H   0  0  0

+    5.3934   -1.0610    0.0000 H   0  0  0

+    6.2948    0.0912    0.0000 H   0  0  0

+    5.1426    0.9926    0.0000 H   0  0  0

+    5.3164   -1.1066    0.0000 H   0  0  0

+    6.2661    0.0061    0.0000 H   0  0  0

+    5.1534    0.9558    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

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+  7 10  2  0

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+ 14 27  1  0

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+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-66-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.7347    0.2125   -0.4052 C   0  0  0

+    0.5055    0.4849   -1.0100 N   0  0  0

+    2.7380    1.1729   -0.4042 C   0  0  0

+    1.9544   -1.0177    0.2019 C   0  0  0

+   -0.5054   -0.4850   -1.0101 N   0  0  0

+    3.9524    0.9002    0.1948 C   0  0  0

+    3.1707   -1.2838    0.7989 C   0  0  0

+   -1.7346   -0.2125   -0.4054 C   0  0  0

+    4.1697   -0.3272    0.7931 C   0  0  0

+   -2.7380   -1.1729   -0.4045 C   0  0  0

+   -1.9545    1.0177    0.2016 C   0  0  0

+   -3.9524   -0.9002    0.1944 C   0  0  0

+   -3.1708    1.2838    0.7985 C   0  0  0

+   -4.1698    0.3272    0.7926 C   0  0  0

+    0.2525    1.3874    0.0000 H   0  0  0

+    2.4868    2.0759    0.0000 H   0  0  0

+    1.2790   -1.6675    0.0000 H   0  0  0

+   -0.2524   -1.3875    0.0000 H   0  0  0

+    4.6301    1.5476    0.0000 H   0  0  0

+    3.4245   -2.1861    0.0000 H   0  0  0

+    5.0606   -0.6184    0.0000 H   0  0  0

+   -2.4868   -2.0759    0.0000 H   0  0  0

+   -1.2791    1.6676    0.0000 H   0  0  0

+   -4.6301   -1.5477    0.0000 H   0  0  0

+   -3.4246    2.1861    0.0000 H   0  0  0

+   -5.0607    0.6184    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

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+  7  9  1  0

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+  4 17  1  0

+  5 18  1  0

+  6 19  1  0

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+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25413-02-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    1.4653   -1.1539   -0.1080 C   0  0  0

+    0.1022   -0.6169   -0.1072 N   0  0  0

+    2.4520   -0.0199   -0.0016 C   0  0  0

+   -0.9514   -1.4527   -0.1945 C   0  0  0

+    3.7695   -0.2761    0.0161 O   0  0  0

+    2.0572    1.1199    0.0679 O   0  0  0

+   -2.3535   -0.9002   -0.1937 C   0  0  0

+   -0.7712   -2.6494   -0.2738 O   0  0  0

+    4.7203    0.8166    0.1187 C   0  0  0

+   -3.1254   -1.4700    0.9981 C   0  0  0

+   -2.2856    1.0596   -0.0540 Br  0  0  0

+    6.1438    0.2557    0.1179 C   0  0  0

+    0.9551   -2.1130    0.0000 H   0  0  0

+    2.3604   -1.7695    0.0000 H   0  0  0

+   -0.0576    0.4576    0.0000 H   0  0  0

+   -3.3147   -0.3940    0.0000 H   0  0  0

+    5.2305    1.7757    0.0000 H   0  0  0

+    3.8252    1.4322    0.0000 H   0  0  0

+   -3.7706   -0.5960    0.0000 H   0  0  0

+   -3.9994   -2.1152    0.0000 H   0  0  0

+   -2.4802   -2.3440    0.0000 H   0  0  0

+    5.7456   -0.7550    0.0000 H   0  0  0

+    7.1545   -0.1425    0.0000 H   0  0  0

+    6.5420    1.2664    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

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+  7 16  1  0

+  9 17  1  0

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+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+39147-43-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+    0.0447    0.6349   -0.0050 C   0  0  0

+    0.1505   -0.7769   -0.0037 C   0  0  0

+    1.2677    1.4622   -0.0033 C   0  0  0

+   -1.1946    1.2548   -0.0022 C   0  0  0

+    1.4835   -1.4117   -0.0004 C   0  0  0

+   -0.9836   -1.5737   -0.0048 C   0  0  0

+    2.5327    0.8514   -0.0006 C   0  0  0

+    1.1728    2.8547   -0.0039 C   0  0  0

+   -2.3597    0.4798    0.0017 C   0  0  0

+    2.6431   -0.6184    0.0009 C   0  0  0

+    1.5990   -2.8027    0.0018 C   0  0  0

+   -2.2505   -0.9807   -0.0078 C   0  0  0

+    3.6813    1.6448    0.0014 C   0  0  0

+    2.3180    3.6203   -0.0018 C   0  0  0

+   -3.6376    1.0660    0.0052 C   0  0  0

+    3.8977   -1.2304    0.0044 C   0  0  0

+    2.8462   -3.3878    0.0053 C   0  0  0

+   -3.4285   -1.7509   -0.0090 C   0  0  0

+    3.5672    3.0176    0.0009 C   0  0  0

+   -4.7431    0.2654    0.0093 C   0  0  0

+    3.9909   -2.6048    0.0066 C   0  0  0

+   -4.6365   -1.1284   -0.0118 C   0  0  0

+   -5.9760    0.8365    0.0126 O   0  0  0

+   -1.2590    2.2997    0.0000 H   0  0  0

+   -0.8923   -2.6166    0.0000 H   0  0  0

+    0.2332    3.3164    0.0000 H   0  0  0

+    0.7394   -3.4003    0.0000 H   0  0  0

+    4.6278    1.1973    0.0000 H   0  0  0

+    2.2449    4.6647    0.0000 H   0  0  0

+   -3.7404    2.1079    0.0000 H   0  0  0

+    4.7663   -0.6459    0.0000 H   0  0  0

+    2.9305   -4.4313    0.0000 H   0  0  0

+   -3.3745   -2.7964    0.0000 H   0  0  0

+    4.4300    3.6106    0.0000 H   0  0  0

+    4.9329   -3.0617    0.0000 H   0  0  0

+   -5.5090   -1.7071    0.0000 H   0  0  0

+   -6.9260    1.2765    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

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+ 18 22  2  0

+ 20 23  1  0

+  7 10  1  0

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+ 14 19  1  0

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+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+137-18-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.2248    0.7650    0.0016 C   0  0  0

+   -1.2154   -0.7121    0.0006 C   0  0  0

+   -0.0686    1.4424    0.0016 C   0  0  0

+   -2.5347    1.5101   -0.0036 C   0  0  0

+    0.0686   -1.4424   -0.0005 C   0  0  0

+   -2.2632   -1.3260    0.0010 O   0  0  0

+    1.2154    0.7121    0.0006 C   0  0  0

+    1.2248   -0.7650   -0.0004 C   0  0  0

+    2.2632    1.3260    0.0002 O   0  0  0

+    2.5347   -1.5101   -0.0015 C   0  0  0

+   -0.0757    2.5502    0.0000 H   0  0  0

+   -1.9869    2.4731    0.0000 H   0  0  0

+   -3.4977    2.0579    0.0000 H   0  0  0

+   -3.0825    0.5471    0.0000 H   0  0  0

+    0.0757   -2.5502    0.0000 H   0  0  0

+    1.9869   -2.4731    0.0000 H   0  0  0

+    3.4977   -2.0579    0.0000 H   0  0  0

+    3.0825   -0.5471    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  7  8  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120065-51-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -0.4651   -0.1010    0.9594 C   0  0  0

+   -1.8059   -0.0651    1.6464 C   0  0  0

+    0.2007    1.0779    0.6813 C   0  0  0

+    0.1017   -1.3134    0.6125 C   0  0  0

+   -2.8986    0.0133    0.6114 C   0  0  0

+    1.4308    1.0450    0.0511 C   0  0  0

+    1.3315   -1.3462   -0.0175 C   0  0  0

+   -3.4505   -1.1460    0.1000 C   0  0  0

+   -3.3528    1.2451    0.1778 C   0  0  0

+    1.9948   -0.1667   -0.3009 C   0  0  0

+   -4.4529   -1.0740   -0.8495 C   0  0  0

+   -4.3549    1.3170   -0.7714 C   0  0  0

+    3.3356   -0.2026   -0.9878 C   0  0  0

+   -4.9030    0.1573   -1.2872 C   0  0  0

+    4.4449   -0.2822    0.0629 C   0  0  0

+    5.8062   -0.3186   -0.6346 C   0  0  0

+    5.2826    0.8709   -0.0405 O   0  0  0

+   -2.3450   -0.8874    0.0000 H   0  0  0

+   -1.3502   -0.9364    0.0000 H   0  0  0

+   -0.2836    1.9336    0.0000 H   0  0  0

+   -0.4372   -2.1358    0.0000 H   0  0  0

+    1.9704    1.8669    0.0000 H   0  0  0

+    1.8166   -2.2015    0.0000 H   0  0  0

+   -2.9557   -1.9956    0.0000 H   0  0  0

+   -2.7620    2.0311    0.0000 H   0  0  0

+   -5.0448   -1.8591    0.0000 H   0  0  0

+   -4.8510    2.1659    0.0000 H   0  0  0

+    3.8747    0.6197    0.0000 H   0  0  0

+    2.8799    0.6687    0.0000 H   0  0  0

+   -5.8852    0.2020    0.0000 H   0  0  0

+    4.3966   -1.2643    0.0000 H   0  0  0

+    5.9243   -1.2947    0.0000 H   0  0  0

+    6.7545   -0.0587    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  1  0

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+  2 18  1  0

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+ 13 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+22506-53-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.9710    0.5189    0.0215 C   0  0  0

+   -0.1521   -0.6919   -0.0149 C   0  0  0

+   -0.2327    1.5802    0.0513 C   0  0  0

+   -2.4285    0.4835    0.0170 C   0  0  0

+    1.2282   -0.1836   -0.0028 C   0  0  0

+   -0.7829   -1.8392   -0.0471 C   0  0  0

+    1.1720    1.1426    0.0364 C   0  0  0

+   -0.9468    2.8707    0.0893 C   0  0  0

+   -3.0461   -0.8529   -0.0258 C   0  0  0

+   -3.0643    1.6299    0.0513 C   0  0  0

+    2.5318   -0.8648   -0.0264 C   0  0  0

+   -2.2532   -1.9092   -0.0471 C   0  0  0

+    2.4276    1.9160    0.0568 C   0  0  0

+   -2.2679    2.8763    0.0906 C   0  0  0

+   -4.3936   -0.9955   -0.0330 N   0  3  0

+    3.6471   -0.1679   -0.0081 C   0  0  0

+    3.5897    1.3034    0.0351 C   0  0  0

+   -4.9249   -1.7992    0.7122 O   0  0  0

+   -5.0734   -0.3201   -0.7848 O   0  5  0

+    4.8448   -0.8011   -0.0302 N   0  3  0

+    5.8764   -0.1538   -0.0132 O   0  0  0

+    4.8898   -2.0177   -0.0670 O   0  5  0

+   -0.2450   -2.7012    0.0000 H   0  0  0

+   -0.4289    3.7449    0.0000 H   0  0  0

+   -4.0799    1.6615    0.0000 H   0  0  0

+    2.5709   -1.8801    0.0000 H   0  0  0

+   -2.6857   -2.8287    0.0000 H   0  0  0

+    2.3936    2.9315    0.0000 H   0  0  0

+   -2.7541    3.7685    0.0000 H   0  0  0

+    4.4493    1.8451    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 11 16  2  0

+ 13 17  2  0

+ 15 18  2  0

+ 15 19  1  0

+ 16 20  1  0

+ 20 21  2  0

+ 20 22  1  0

+  5  7  2  0

+  9 12  2  0

+ 10 14  1  0

+ 16 17  1  0

+  6 23  1  0

+  8 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21626-89-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    0.0012    0.7053   -0.5976 N   0  0  0

+   -0.0016   -0.6978   -0.6031 N   0  0  0

+    1.1376    1.3667   -0.2936 C   0  0  0

+   -1.2232    1.4390   -0.9265 C   0  0  0

+   -1.1355   -1.3624   -0.2978 C   0  0  0

+    1.2229   -1.4289   -0.9380 C   0  0  0

+    2.3435    0.5842    0.0593 C   0  0  0

+    1.1704    2.5817   -0.3097 O   0  0  0

+   -2.3948    0.7801   -0.2428 C   0  0  0

+   -2.3417   -0.5841    0.0628 C   0  0  0

+   -1.1660   -2.5774   -0.3189 O   0  0  0

+    2.3925   -0.7780   -0.2433 C   0  0  0

+    3.4262    1.1939    0.6906 C   0  0  0

+   -3.5126    1.5136    0.0924 C   0  0  0

+   -3.4216   -1.2003    0.6927 C   0  0  0

+    3.5062   -1.5170    0.0932 C   0  0  0

+    4.5372    0.4436    1.0197 C   0  0  0

+   -4.5834    0.8977    0.7167 C   0  0  0

+   -4.5345   -0.4551    1.0268 C   0  0  0

+    4.5757   -0.9075    0.7259 C   0  0  0

+   -0.5663    2.1990    0.0000 H   0  0  0

+   -1.8589    2.2168    0.0000 H   0  0  0

+    0.5657   -2.1886    0.0000 H   0  0  0

+    1.8567   -2.2083    0.0000 H   0  0  0

+    3.4669    2.1976    0.0000 H   0  0  0

+   -3.4831    2.5177    0.0000 H   0  0  0

+   -3.4575   -2.2042    0.0000 H   0  0  0

+    3.4721   -2.5209    0.0000 H   0  0  0

+    5.4175    0.9275    0.0000 H   0  0  0

+   -5.4619    1.3849    0.0000 H   0  0  0

+   -5.4119   -0.9441    0.0000 H   0  0  0

+    5.4513   -1.3998    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 12 16  1  0

+ 13 17  2  0

+ 14 18  2  0

+ 15 19  2  0

+ 16 20  2  0

+  7 12  2  0

+  9 10  2  0

+ 17 20  1  0

+ 18 19  1  0

+  4 21  1  0

+  4 22  1  0

+  6 23  1  0

+  6 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-54-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.5252    0.6974    0.0018 C   0  0  0

+   -0.5252   -0.6974    0.0004 C   0  0  0

+    0.6780    1.3866    0.0017 C   0  0  0

+   -1.7366    1.3995   -0.0025 N   0  0  0

+    0.6780   -1.3866   -0.0011 C   0  0  0

+   -1.7366   -1.3995    0.0010 N   0  0  0

+    1.8731    0.6913    0.0001 C   0  0  0

+    1.8731   -0.6913   -0.0013 C   0  0  0

+    0.6815    2.4266    0.0000 H   0  0  0

+   -1.7349    2.4395    0.0000 H   0  0  0

+   -2.6381    0.8810    0.0000 H   0  0  0

+    0.6815   -2.4266    0.0000 H   0  0  0

+   -2.6381   -0.8810    0.0000 H   0  0  0

+   -1.7349   -2.4395    0.0000 H   0  0  0

+    2.7746    1.2098    0.0000 H   0  0  0

+    2.7746   -1.2098    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2157-01-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 35                          1 V2000

+   -2.2642   -0.2437    0.0000 O   0  0  0

+   -3.4758    0.3471    0.0000 C   0  0  0

+   -1.0605    0.5683    0.0000 C   0  0  0

+   -4.6940   -0.4747    0.0000 C   0  0  0

+   -3.5606    1.5595    0.0000 O   0  0  0

+    0.1690   -0.3423    0.0000 C   0  0  0

+   -4.5888   -1.9780    0.0000 C   0  0  0

+   -5.8902    0.1086    0.0000 C   0  0  0

+    1.4374    0.5133    0.0000 C   0  0  0

+    2.6669   -0.3973    0.0000 C   0  0  0

+    3.9353    0.4583    0.0000 C   0  0  0

+    5.1647   -0.4523    0.0000 C   0  0  0

+    6.4331    0.4033    0.0000 C   0  0  0

+    7.6626   -0.5073    0.0000 C   0  0  0

+   -0.2777    1.4073    0.0000 H   0  0  0

+   -1.8056    1.4409    0.0000 H   0  0  0

+   -0.6138   -1.1813    0.0000 H   0  0  0

+    0.9141   -1.2149    0.0000 H   0  0  0

+   -5.7334   -2.0581    0.0000 H   0  0  0

+   -4.5087   -3.1226    0.0000 H   0  0  0

+   -3.4442   -1.8979    0.0000 H   0  0  0

+   -5.9703    1.2532    0.0000 H   0  0  0

+   -6.8414   -0.5331    0.0000 H   0  0  0

+    2.2202    1.3523    0.0000 H   0  0  0

+    0.6923    1.3859    0.0000 H   0  0  0

+    1.8841   -1.2363    0.0000 H   0  0  0

+    3.4120   -1.2699    0.0000 H   0  0  0

+    4.7181    1.2972    0.0000 H   0  0  0

+    3.1902    1.3309    0.0000 H   0  0  0

+    4.3819   -1.2912    0.0000 H   0  0  0

+    5.9098   -1.3249    0.0000 H   0  0  0

+    7.2159    1.2423    0.0000 H   0  0  0

+    5.6880    1.2759    0.0000 H   0  0  0

+    6.9797   -1.4294    0.0000 H   0  0  0

+    8.5847   -1.1902    0.0000 H   0  0  0

+    8.3455    0.4148    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  6  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+  3 15  1  0

+  3 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 14 34  1  0

+ 14 35  1  0

+ 14 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3096-64-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.6526    0.0202    0.0022 C   0  0  0

+   -0.3030   -1.3244    0.0007 C   0  0  0

+    0.3393    0.9925    0.0019 C   0  0  0

+   -1.9985    0.3935   -0.0020 N   0  0  0

+    1.0286   -1.6899   -0.0010 C   0  0  0

+   -1.3758   -2.3827    0.0004 C   0  0  0

+    1.6694    0.6198    0.0003 C   0  0  0

+   -2.3530    1.7644   -0.0005 O   0  0  0

+    2.0138   -0.7192   -0.0012 C   0  0  0

+    2.7463    1.6740   -0.0005 C   0  0  0

+    0.0804    2.0017    0.0000 H   0  0  0

+   -2.7416   -0.3367    0.0000 H   0  0  0

+    1.2915   -2.6980    0.0000 H   0  0  0

+   -2.1075   -1.6410    0.0000 H   0  0  0

+   -2.1175   -3.1144    0.0000 H   0  0  0

+   -0.6441   -3.1244    0.0000 H   0  0  0

+   -2.6138    2.7731    0.0000 H   0  0  0

+    3.0178   -0.9976    0.0000 H   0  0  0

+    3.4751    0.9295    0.0000 H   0  0  0

+    3.4908    2.4028    0.0000 H   0  0  0

+    2.0175    2.4185    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  7  9  2  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105-48-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.0983    0.1068   -0.0127 C   0  0  0

+   -1.1290    0.5907    0.2350 O   0  0  0

+    1.3144    0.8517    0.4745 C   0  0  0

+    0.2279   -0.9285   -0.6219 O   0  0  0

+   -2.3007   -0.1270   -0.2344 C   0  0  0

+    2.8021   -0.0439   -0.0107 Cl  0  0  0

+   -2.7544   -1.1193    0.8382 C   0  0  0

+   -3.4280    0.8676   -0.5186 C   0  0  0

+    1.9796    1.6388    0.0000 H   0  0  0

+    0.6432    1.6336    0.0000 H   0  0  0

+   -1.5294   -0.8104    0.0000 H   0  0  0

+   -3.6916   -0.6908    0.0000 H   0  0  0

+   -3.1829   -2.0565    0.0000 H   0  0  0

+   -1.8172   -1.5478    0.0000 H   0  0  0

+   -2.7462    1.6404    0.0000 H   0  0  0

+   -4.2008    1.5494    0.0000 H   0  0  0

+   -4.1098    0.0948    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  2  1  0

+  6  3  1  0

+  7  5  1  0

+  8  5  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  7 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25870-67-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -2.4453   -0.9086   -0.0048 C   0  0  0

+   -3.6667   -1.5845   -0.0046 C   0  0  0

+   -2.4272    0.4876   -0.0026 C   0  0  0

+   -1.1761   -1.6680   -0.0013 C   0  0  0

+   -4.8469   -0.8701   -0.0021 C   0  0  0

+   -3.6143    1.1896   -0.0002 C   0  0  0

+    0.1014   -0.9567   -0.0016 C   0  0  0

+   -1.1950   -2.8851    0.0019 O   0  0  0

+   -4.8218    0.5132    0.0000 C   0  0  0

+    1.2606   -1.6502    0.0017 C   0  0  0

+   -6.0920    1.2732    0.0026 N   0  3  0

+    2.5458   -0.9346    0.0014 C   0  0  0

+   -6.0731    2.4910    0.0046 O   0  0  0

+   -7.1562    0.6806    0.0029 O   0  5  0

+    3.7484   -1.6491    0.0047 C   0  0  0

+    2.5719    0.4643   -0.0080 C   0  0  0

+    4.9490   -0.9708    0.0045 C   0  0  0

+    3.7804    1.1275   -0.0082 C   0  0  0

+    4.9662    0.4130    0.0009 C   0  0  0

+    6.2594    1.1331    0.0012 N   0  3  0

+    6.2784    2.3510   -0.0019 O   0  0  0

+    7.3047    0.5078    0.0045 O   0  5  0

+   -3.6869   -2.6222    0.0000 H   0  0  0

+   -1.5223    0.9960    0.0000 H   0  0  0

+   -5.7557   -1.3715    0.0000 H   0  0  0

+   -3.6021    2.2275    0.0000 H   0  0  0

+    0.1175    0.0811    0.0000 H   0  0  0

+    1.2445   -2.6880    0.0000 H   0  0  0

+    3.7371   -2.6870    0.0000 H   0  0  0

+    1.6837    1.0013    0.0000 H   0  0  0

+    5.8422   -1.4995    0.0000 H   0  0  0

+    3.8014    2.1652    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  4  7  1  0

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+ 15 17  1  0

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+  6  9  1  0

+ 18 19  1  0

+  2 23  1  0

+  3 24  1  0

+  5 25  1  0

+  6 26  1  0

+  7 27  1  0

+ 10 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26266-68-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+   -0.8490    0.0457    0.4643 C   0  0  0

+    0.4550    0.0435   -0.2913 C   0  0  0

+   -1.2920    1.4889    0.7126 C   0  0  0

+   -1.8996   -0.6701   -0.3450 C   0  0  0

+    1.5150   -0.5197    0.2333 C   0  0  0

+   -1.4778    2.2032   -0.6276 C   0  0  0

+   -2.3690   -1.7074    0.0575 O   0  0  0

+    2.8189   -0.5219   -0.5222 C   0  0  0

+    3.8856    0.2049    0.2993 C   0  0  0

+   -0.5667   -0.8727    0.0000 H   0  0  0

+    0.6881    0.9756    0.0000 H   0  0  0

+   -2.2218    1.7309    0.0000 H   0  0  0

+   -1.9565    0.7950    0.0000 H   0  0  0

+   -2.6352   -0.0520    0.0000 H   0  0  0

+    1.2819   -1.4518    0.0000 H   0  0  0

+   -0.5480    2.4451    0.0000 H   0  0  0

+   -1.7197    3.1330    0.0000 H   0  0  0

+   -2.4076    1.9613    0.0000 H   0  0  0

+    2.5118   -1.4323    0.0000 H   0  0  0

+    3.5843   -1.1026    0.0000 H   0  0  0

+    4.4266   -0.5891    0.0000 H   0  0  0

+    4.6796    0.7459    0.0000 H   0  0  0

+    3.3446    0.9989    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

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+  5 15  1  0

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+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17369-59-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.4323    0.6614    0.0800 C   0  0  0

+   -1.2213   -0.5024   -0.0351 C   0  0  0

+    0.9632    0.1958    0.1822 C   0  0  0

+   -1.0408    1.9100    0.0823 C   0  0  0

+   -0.2849   -1.6354    0.0006 C   0  0  0

+   -2.6037   -0.3892   -0.1503 C   0  0  0

+    0.9657   -1.1592    0.1281 O   0  0  0

+    2.0396    0.9748    0.3061 C   0  0  0

+   -2.4145    2.0026   -0.0281 C   0  0  0

+   -0.5912   -2.8095   -0.0730 O   0  0  0

+   -3.1900    0.8603   -0.1510 C   0  0  0

+    3.4106    0.3562    0.4002 C   0  0  0

+    4.2750    0.8531   -0.7603 C   0  0  0

+   -0.4628    2.7690    0.0000 H   0  0  0

+   -3.1942   -1.2397    0.0000 H   0  0  0

+    1.9349    2.0048    0.0000 H   0  0  0

+   -2.8681    2.9333    0.0000 H   0  0  0

+   -4.2221    0.9418    0.0000 H   0  0  0

+    2.7987   -0.4790    0.0000 H   0  0  0

+    4.1011   -0.4152    0.0000 H   0  0  0

+    4.7910   -0.0445    0.0000 H   0  0  0

+    5.1726    1.3691    0.0000 H   0  0  0

+    3.7590    1.7507    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  8 12  1  0

+ 12 13  1  0

+  5  7  1  0

+  9 11  1  0

+  4 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+842-07-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+    1.9418   -0.4418   -0.0547 C   0  0  0

+    0.8202    0.4825   -0.2186 C   0  0  0

+    3.2473    0.0858    0.0952 C   0  0  0

+    1.7492   -1.8278   -0.0375 C   0  0  0

+   -0.4478    0.0167   -0.3657 N   0  0  0

+    1.0817    1.8554   -0.2209 C   0  0  0

+    3.4382    1.4791    0.0830 C   0  0  0

+    4.3294   -0.7966    0.2531 C   0  0  0

+    2.8218   -2.6555    0.1181 C   0  0  0

+   -1.4020    0.5064    0.3510 N   0  0  0

+    2.3854    2.3251   -0.0698 C   0  0  0

+    0.0608    2.7361   -0.3716 O   0  0  0

+    4.1076   -2.1404    0.2597 C   0  0  0

+   -2.6773    0.0379    0.2030 C   0  0  0

+   -3.7137    0.5660    0.9777 C   0  0  0

+   -2.9525   -0.9677   -0.7282 C   0  0  0

+   -4.9983    0.0885    0.8223 C   0  0  0

+   -4.2417   -1.4350   -0.8723 C   0  0  0

+   -5.2621   -0.9108   -0.0977 C   0  0  0

+    0.8035   -2.2140    0.0000 H   0  0  0

+    4.3872    1.8569    0.0000 H   0  0  0

+    5.2848   -0.4353    0.0000 H   0  0  0

+    2.6812   -3.6673    0.0000 H   0  0  0

+    2.5537    3.3326    0.0000 H   0  0  0

+   -0.7127    3.4033    0.0000 H   0  0  0

+    4.9040   -2.7801    0.0000 H   0  0  0

+   -3.6548    1.5858    0.0000 H   0  0  0

+   -2.2017   -1.6603    0.0000 H   0  0  0

+   -5.7550    0.7746    0.0000 H   0  0  0

+   -4.3064   -2.4544    0.0000 H   0  0  0

+   -6.1952   -1.3265    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 14 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 16 18  2  0

+ 17 19  2  0

+  7 11  1  0

+  9 13  1  0

+ 18 19  1  0

+  4 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+103748-25-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.3481    0.6812   -0.0045 C   0  0  0

+    0.7658   -0.6596   -0.0018 C   0  0  0

+    1.4692    1.4495   -0.0029 N   0  0  0

+   -1.0175    0.9764   -0.0030 C   0  0  0

+    2.1513   -0.6315    0.0014 N   0  0  0

+   -0.1749   -1.6783   -0.0024 C   0  0  0

+    2.5294    0.6805    0.0006 C   0  0  0

+   -1.9388   -0.0481    0.0011 C   0  0  0

+    3.0440   -1.7931    0.0045 C   0  0  0

+   -1.5199   -1.3714   -0.0055 C   0  0  0

+    3.8334    1.1290    0.0031 N   0  0  0

+   -3.6356    0.3188    0.0031 Cl  0  0  0

+   -1.3373    1.9653    0.0000 H   0  0  0

+    0.1327   -2.6711    0.0000 H   0  0  0

+    2.2199   -2.4264    0.0000 H   0  0  0

+    3.6773   -2.6172    0.0000 H   0  0  0

+    3.8681   -1.1598    0.0000 H   0  0  0

+   -2.2240   -2.1359    0.0000 H   0  0  0

+    4.6176    0.4469    0.0000 H   0  0  0

+    4.0321    2.1492    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

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+  5  7  1  0

+  8 10  1  0

+  4 13  1  0

+  6 14  1  0

+  9 15  1  0

+  9 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1892-54-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.9571   -0.3659   -0.0012 C   0  0  0

+   -0.4815   -0.0837   -0.0004 C   0  0  0

+    1.8619    0.7199   -0.0010 C   0  0  0

+    1.4456   -1.6736    0.0037 C   0  0  0

+   -0.9094    1.2638    0.0006 C   0  0  0

+   -1.4254   -1.1108   -0.0010 C   0  0  0

+    1.3704    2.0457    0.0004 C   0  0  0

+    3.2400    0.4613   -0.0018 C   0  0  0

+    2.7938   -1.8925    0.0032 C   0  0  0

+    0.0469    2.3052    0.0003 C   0  0  0

+   -2.2828    1.5496    0.0014 C   0  0  0

+   -2.7725   -0.7990   -0.0007 C   0  0  0

+    3.6868   -0.8275   -0.0027 C   0  0  0

+   -3.1902    0.5339    0.0012 C   0  0  0

+   -3.7211   -1.8228   -0.0018 N   0  0  0

+    0.7815   -2.4830    0.0000 H   0  0  0

+   -1.1159   -2.1110    0.0000 H   0  0  0

+    2.0486    2.8433    0.0000 H   0  0  0

+    3.9235    1.2544    0.0000 H   0  0  0

+    3.1587   -2.8738    0.0000 H   0  0  0

+   -0.2796    3.2999    0.0000 H   0  0  0

+   -2.6104    2.5440    0.0000 H   0  0  0

+    4.7165   -1.0170    0.0000 H   0  0  0

+   -4.2136    0.7549    0.0000 H   0  0  0

+   -4.7420   -1.5905    0.0000 H   0  0  0

+   -3.4118   -2.8230    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

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+ 11 14  2  0

+ 12 15  1  0

+  7 10  1  0

+  9 13  1  0

+ 12 14  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85-83-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 52                          1 V2000

+    4.5763    0.9243   -0.0194 C   0  0  0

+    3.8026   -0.2488    0.3877 C   0  0  0

+    5.9889    0.8348   -0.0523 C   0  0  0

+    3.9501    2.1225   -0.3796 C   0  0  0

+    2.4465   -0.2046    0.4321 N   0  0  0

+    4.4914   -1.4169    0.7296 C   0  0  0

+    6.6165   -0.3725    0.3043 C   0  0  0

+    6.7381    1.9577   -0.4422 C   0  0  0

+    4.7076    3.1933   -0.7536 C   0  0  0

+    1.7522   -1.1383   -0.1248 N   0  0  0

+    5.8839   -1.4539    0.6808 C   0  0  0

+    3.8005   -2.5200    1.1112 O   0  0  0

+    6.0971    3.1108   -0.7814 C   0  0  0

+    0.3922   -1.0423   -0.1699 C   0  0  0

+   -0.3686   -2.1077   -0.6655 C   0  0  0

+   -0.2431    0.1195    0.2850 C   0  0  0

+   -1.7297   -2.0119   -0.7101 C   0  0  0

+    0.3149   -3.3603   -1.1502 C   0  0  0

+   -1.6039    0.2153    0.2403 C   0  0  0

+   -2.3645   -0.8483   -0.2603 C   0  0  0

+   -3.7247   -0.7524   -0.3053 N   0  0  0

+   -4.3098    0.3200    0.1092 N   0  0  0

+   -5.6718    0.4160    0.0641 C   0  0  0

+   -6.3093    1.5764    0.5124 C   0  0  0

+   -6.4346   -0.6436   -0.4359 C   0  0  0

+   -7.6847    1.6659    0.4638 C   0  0  0

+   -5.4959    2.7264    1.0479 C   0  0  0

+   -7.8088   -0.5394   -0.4782 C   0  0  0

+   -8.4333    0.6107   -0.0272 C   0  0  0

+    2.9369    2.1905    0.0000 H   0  0  0

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+    7.7528    1.9166    0.0000 H   0  0  0

+    4.2678    4.1086    0.0000 H   0  0  0

+    6.3478   -2.3573    0.0000 H   0  0  0

+    3.2615   -3.3806    0.0000 H   0  0  0

+    6.6377    3.9705    0.0000 H   0  0  0

+    0.3052    0.9743    0.0000 H   0  0  0

+   -2.2784   -2.8664    0.0000 H   0  0  0

+   -0.5765   -3.8467    0.0000 H   0  0  0

+    0.8013   -4.2517    0.0000 H   0  0  0

+    1.2063   -2.8739    0.0000 H   0  0  0

+   -2.0363    1.1341    0.0000 H   0  0  0

+   -6.0061   -1.5643    0.0000 H   0  0  0

+   -8.1213    2.5828    0.0000 H   0  0  0

+   -4.6668    2.1400    0.0000 H   0  0  0

+   -4.9095    3.5555    0.0000 H   0  0  0

+   -6.3250    3.3128    0.0000 H   0  0  0

+   -8.3607   -1.3919    0.0000 H   0  0  0

+   -9.4470    0.6714    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  1  0

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+ 16 19  2  0

+ 17 20  2  0

+ 20 21  1  0

+ 21 22  2  0

+ 22 23  1  0

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+ 25 28  2  0

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+ 28 29  1  0

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+ 25 43  1  0

+ 26 44  1  0

+ 27 45  1  0

+ 27 46  1  0

+ 27 47  1  0

+ 28 48  1  0

+ 29 49  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-86-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.4372   -0.0735    0.0000 C   0  0  0

+   -1.0333   -0.0088    0.0000 C   0  0  0

+    0.9151   -0.8165    1.2492 C   0  0  0

+    0.9151   -0.8165   -1.2492 C   0  0  0

+    0.9723    1.2515    0.0000 O   0  0  0

+   -2.1682    0.0411    0.0000 N   0  0  0

+    0.1985   -1.2774    0.0000 H   0  0  0

+    1.3760   -1.5331    0.0000 H   0  0  0

+    1.6317   -0.3556    0.0000 H   0  0  0

+    0.1985   -1.2774    0.0000 H   0  0  0

+    1.3760   -1.5331    0.0000 H   0  0  0

+    1.6317   -0.3556    0.0000 H   0  0  0

+    1.2913    2.0415    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  3  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94-74-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.2048   -0.3229    0.0036 C   0  0  0

+    0.7224   -1.3545    0.0020 C   0  0  0

+    0.2272    0.9955    0.0033 C   0  0  0

+   -1.5347   -0.6033   -0.0001 O   0  0  0

+    2.0739   -1.0675    0.0000 C   0  0  0

+    0.2559   -2.7875    0.0019 C   0  0  0

+    1.5791    1.2784    0.0013 C   0  0  0

+   -2.2211    0.6501    0.0028 C   0  0  0

+    2.5026    0.2478   -0.0003 C   0  0  0

+   -3.7085    0.4082   -0.0011 C   0  0  0

+    4.2013    0.6059   -0.0022 Cl  0  0  0

+   -4.5575    1.4479    0.0007 O   0  0  0

+   -4.1369   -0.7215   -0.0058 O   0  0  0

+   -0.4651    1.7687    0.0000 H   0  0  0

+    2.7679   -1.8392    0.0000 H   0  0  0

+   -0.7310   -2.4662    0.0000 H   0  0  0

+   -0.0654   -3.7744    0.0000 H   0  0  0

+    1.2428   -3.1088    0.0000 H   0  0  0

+    1.9026    2.2646    0.0000 H   0  0  0

+   -1.2603    1.0425    0.0000 H   0  0  0

+   -2.5024    1.6491    0.0000 H   0  0  0

+   -5.2139    2.2518    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  8 10  1  0

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+ 10 13  2  0

+  7  9  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86247-86-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+   -2.2747    0.0603   -0.0905 C   0  0  0

+   -3.3069    0.9708    0.0030 C   0  0  0

+   -0.9534    0.5262   -0.0788 C   0  0  0

+   -2.4538   -1.2770   -0.2108 O   0  0  0

+   -3.0335    2.3281    0.0914 C   0  0  0

+   -4.7533    0.5369    0.0273 C   0  0  0

+   -0.6877    1.8788    0.0142 C   0  0  0

+    0.0753   -0.3597   -0.1599 O   0  0  0

+   -3.6938   -1.6683    0.3591 C   0  0  0

+   -1.7307    2.7830    0.0974 C   0  0  0

+   -4.8309   -0.9414   -0.3711 C   0  0  0

+    1.2823    0.4046   -0.1246 C   0  0  0

+   -6.0865   -1.4817    0.0453 O   0  0  0

+    2.4849   -0.5371   -0.2126 C   0  0  0

+    3.7772    0.2812   -0.1749 C   0  0  0

+    2.4624   -1.4431    0.8923 O   0  0  0

+    4.9319   -0.6230   -0.2594 N   0  0  0

+    6.1331    0.2215   -0.2183 C   0  0  0

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+    7.2570   -0.4515   -1.0088 C   0  0  0

+   -3.8138    3.0080    0.0000 H   0  0  0

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+    0.2910    2.2154    0.0000 H   0  0  0

+   -4.4369   -2.3887    0.0000 H   0  0  0

+   -3.1637   -2.5572    0.0000 H   0  0  0

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+   -4.9149   -1.9729    0.0000 H   0  0  0

+    2.0089    1.1416    0.0000 H   0  0  0

+    0.6327    1.2103    0.0000 H   0  0  0

+   -7.0372   -1.8908    0.0000 H   0  0  0

+    1.5489   -0.9787    0.0000 H   0  0  0

+    4.5038    1.0182    0.0000 H   0  0  0

+    3.1277    1.0869    0.0000 H   0  0  0

+    2.4367   -2.4777    0.0000 H   0  0  0

+    4.9052   -1.6576    0.0000 H   0  0  0

+    5.6288    1.1253    0.0000 H   0  0  0

+    6.9820   -0.5406    0.0000 H   0  0  0

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+    6.7253   -1.3394    0.0000 H   0  0  0

+    8.1449   -0.9832    0.0000 H   0  0  0

+    7.7887    0.4364    0.0000 H   0  0  0

+  1  2  2  0

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+ 19 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+ 20 41  1  0

+ 20 42  1  0

+ 20 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75586-70-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -2.3976    0.6215   -0.1411 C   0  0  0

+   -3.1405   -0.4252    0.4616 C   0  0  0

+   -1.1126    0.4024   -0.5678 N   0  3  0

+   -2.9821    1.8731   -0.2901 C   0  0  0

+   -2.5594   -1.6877    0.6212 C   0  0  0

+   -4.4619   -0.1853    0.8958 C   0  0  0

+   -0.5266   -0.8283   -0.4191 C   0  0  0

+   -0.3588    1.4942   -1.1890 C   0  0  0

+   -4.2788    2.0852    0.1495 C   0  0  0

+   -1.2415   -1.8927    0.1772 C   0  0  0

+   -5.0139    1.0444    0.7345 C   0  0  0

+    0.7800   -1.0447   -0.8554 C   0  0  0

+   -4.8590    3.3355   -0.0008 N   0  0  0

+   -0.6247   -3.1496    0.3219 C   0  0  0

+    1.3575   -2.2839   -0.7015 C   0  0  0

+    0.6531   -3.3303   -0.1135 C   0  0  0

+   10.7603    1.1346    0.3426 Cl  0  0  0

+   -2.3799    2.6685    0.0000 H   0  0  0

+   -3.1607   -2.4838    0.0000 H   0  0  0

+   -5.0769   -0.9709    0.0000 H   0  0  0

+    0.4622    0.9274    0.0000 H   0  0  0

+    0.2080    2.3152    0.0000 H   0  0  0

+   -1.1798    2.0610    0.0000 H   0  0  0

+   -6.0069    1.1405    0.0000 H   0  0  0

+    1.3833   -0.2501    0.0000 H   0  0  0

+   -4.2852    4.1517    0.0000 H   0  0  0

+   -5.8527    3.4243    0.0000 H   0  0  0

+   -1.2105   -3.9572    0.0000 H   0  0  0

+    2.3521   -2.3618    0.0000 H   0  0  0

+    1.0589   -4.2417    0.0000 H   0  0  0

+   11.7580    1.1346    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+  7 10  1  0

+  9 11  1  0

+ 15 16  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  8 21  1  0

+  8 22  1  0

+  8 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+645-45-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    1.5341   -0.3944    0.0058 C   0  0  0

+    0.1242   -0.9264    0.0134 C   0  0  0

+    2.1807   -0.1331    1.1991 C   0  0  0

+    2.1830   -0.1729   -1.1948 C   0  0  0

+   -0.8622    0.2430   -0.0035 C   0  0  0

+    3.4742    0.3550    1.1922 C   0  0  0

+    3.4761    0.3151   -1.2018 C   0  0  0

+   -2.2722   -0.2891    0.0041 C   0  0  0

+    4.1207    0.5818   -0.0082 C   0  0  0

+   -2.4679   -1.4807    0.0213 O   0  0  0

+   -3.6151    0.8109   -0.0117 Cl  0  0  0

+   -0.7386   -1.5009    0.0000 H   0  0  0

+    0.5975   -1.8487    0.0000 H   0  0  0

+    1.8035    0.8324    0.0000 H   0  0  0

+    2.5335   -1.1484    0.0000 H   0  0  0

+    0.0006    0.8175    0.0000 H   0  0  0

+   -1.3355    1.1652    0.0000 H   0  0  0

+    3.1196    1.3291    0.0000 H   0  0  0

+    3.8573   -0.6489    0.0000 H   0  0  0

+    5.0891    0.9517    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  2  0

+  8 11  1  0

+  7  9  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5134-49-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    3.1935    0.5998    0.0018 C   0  0  0

+    2.2981   -0.4755    0.0002 C   0  0  0

+    4.5845    0.3239    0.0012 C   0  0  0

+    3.0718    1.9378   -0.0013 N   0  0  0

+    0.9481   -0.2633    0.0003 N   0  0  0

+    2.8040   -1.7332   -0.0019 N   0  0  0

+    5.1976    1.5057    0.0030 N   0  0  0

+    5.0005   -0.9567   -0.0013 N   0  0  0

+    4.2788    2.4619    0.0026 C   0  0  0

+    0.0274   -1.4028   -0.0014 C   0  0  0

+    4.1462   -1.9389   -0.0024 C   0  0  0

+   -1.3935   -0.9006   -0.0009 C   0  0  0

+   -2.0448   -0.6687   -1.1977 C   0  0  0

+   -2.0473   -0.6773    1.1966 C   0  0  0

+   -3.3484   -0.2079   -1.1973 C   0  0  0

+   -3.3504   -0.2167    1.1970 C   0  0  0

+   -4.0001    0.0208   -0.0001 C   0  0  0

+   -5.3957    0.5140    0.0004 N   0  3  0

+   -5.9700    0.7156    1.0554 O   0  0  0

+   -5.9697    0.7184   -1.0543 O   0  5  0

+    0.5855    0.6780    0.0000 H   0  0  0

+    2.1774   -2.5237    0.0000 H   0  0  0

+    4.4771    3.4510    0.0000 H   0  0  0

+   -0.4141   -2.3098    0.0000 H   0  0  0

+    0.8787   -1.9440    0.0000 H   0  0  0

+    4.4935   -2.8860    0.0000 H   0  0  0

+   -1.7075    0.2820    0.0000 H   0  0  0

+   -2.3784   -1.6302    0.0000 H   0  0  0

+   -3.0133    0.7436    0.0000 H   0  0  0

+   -3.6917   -1.1660    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  1  0

+ 10 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+ 17 18  1  0

+ 18 19  2  0

+ 18 20  1  0

+  7  9  1  0

+  8 11  2  0

+ 16 17  1  0

+  5 21  1  0

+  6 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93285-74-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 47                          1 V2000

+    0.1387    0.1387    0.0033 C   0  0  0

+   -1.2419   -0.0148   -0.0011 C   0  0  0

+    0.4852    1.5527    0.0075 C   0  0  0

+    1.0726   -0.8992   -0.0015 C   0  0  0

+   -1.8046    1.3291    0.0006 C   0  0  0

+   -1.7213   -1.3469   -0.0065 C   0  0  0

+   -0.7990    2.2511    0.0049 C   0  0  0

+    1.8237    1.8812    0.0119 C   0  0  0

+    2.4888   -0.5089    0.0038 C   0  0  0

+    0.6010   -2.2019   -0.0114 C   0  0  0

+   -3.2712    1.6922   -0.0012 C   0  0  0

+   -0.7913   -2.4231   -0.0070 C   0  0  0

+   -3.0955   -1.6203   -0.0118 C   0  0  0

+   -1.0215    3.7433    0.0053 C   0  0  0

+    2.8165    0.8707    0.0119 C   0  0  0

+    3.5027   -1.4642    0.0007 C   0  0  0

+   -3.4151    3.1580    0.4210 C   0  0  0

+   -1.2840   -3.7445   -0.0135 C   0  0  0

+   -3.5309   -2.9108   -0.0188 C   0  0  0

+   -2.4684    4.0235   -0.4151 C   0  0  0

+    4.1736    1.2415    0.0151 C   0  0  0

+    4.8206   -1.0643    0.0056 C   0  0  0

+   -2.6244   -3.9697   -0.0189 C   0  0  0

+    5.1457    0.2868    0.0152 C   0  0  0

+    2.1120    2.8962    0.0000 H   0  0  0

+    1.2730   -3.0153    0.0000 H   0  0  0

+   -4.3262    1.7087    0.0000 H   0  0  0

+   -3.4071    0.6459    0.0000 H   0  0  0

+   -3.7919   -0.8277    0.0000 H   0  0  0

+    0.0330    3.7801    0.0000 H   0  0  0

+   -0.9391    4.7952    0.0000 H   0  0  0

+    3.2616   -2.4914    0.0000 H   0  0  0

+   -3.9452    4.0703    0.0000 H   0  0  0

+   -4.4193    2.8340    0.0000 H   0  0  0

+   -0.6122   -4.5581    0.0000 H   0  0  0

+   -4.5668   -3.1114    0.0000 H   0  0  0

+   -2.0534    4.9936    0.0000 H   0  0  0

+   -3.3289    4.6342    0.0000 H   0  0  0

+    4.4396    2.2626    0.0000 H   0  0  0

+    5.5882   -1.7883    0.0000 H   0  0  0

+   -2.9844   -4.9615    0.0000 H   0  0  0

+    6.1600    0.5775    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  2  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 13 19  2  0

+ 14 20  1  0

+ 15 21  1  0

+ 16 22  2  0

+ 18 23  2  0

+ 21 24  2  0

+  5  7  2  0

+  9 15  2  0

+ 10 12  1  0

+ 17 20  1  0

+ 19 23  1  0

+ 22 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-24-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    1.1651    0.1020   -0.0012 C   0  0  0

+    0.0000    0.7747    0.0002 O   0  0  0

+    2.4702    0.8555   -0.0007 C   0  0  0

+    1.1651   -1.1061    0.0022 O   0  0  0

+   -1.1651    0.1020   -0.0002 C   0  0  0

+   -2.4702    0.8555    0.0013 C   0  0  0

+   -1.1651   -1.1061   -0.0018 O   0  0  0

+    2.9747   -0.0183    0.0000 H   0  0  0

+    3.3440    1.3600    0.0000 H   0  0  0

+    1.9657    1.7293    0.0000 H   0  0  0

+   -1.9657    1.7293    0.0000 H   0  0  0

+   -3.3440    1.3600    0.0000 H   0  0  0

+   -2.9747   -0.0183    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  5  7  2  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+630-17-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    1.6360    0.0000    0.0000 C   0  0  0

+    0.4692   -0.8003   -0.5822 C   0  0  0

+    1.5584   -0.0234    1.5279 C   0  0  0

+    2.9580   -0.6228   -0.4531 C   0  0  0

+    1.5584    1.4465   -0.4925 C   0  0  0

+   -1.2295    0.0000    0.0000 Br  0  0  0

+   -0.1592   -1.6866    0.0000 H   0  0  0

+    1.2314   -1.5745    0.0000 H   0  0  0

+    1.2447    1.0168    0.0000 H   0  0  0

+    0.5182   -0.3371    0.0000 H   0  0  0

+    1.8721   -1.0636    0.0000 H   0  0  0

+    2.4950   -1.6056    0.0000 H   0  0  0

+    3.9408   -1.0858    0.0000 H   0  0  0

+    3.4210    0.3600    0.0000 H   0  0  0

+    2.6433    1.5047    0.0000 H   0  0  0

+    1.5002    2.5314    0.0000 H   0  0  0

+    0.4735    1.3883    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2702-72-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -1.3103   -0.2057    0.0507 C   0  0  0

+   -2.2341    0.7714   -0.2937 C   0  0  0

+   -0.0495    0.1612    0.4972 C   0  0  0

+   -1.6429   -1.5205   -0.0442 O   0  0  0

+   -1.8954    2.1079   -0.1909 C   0  0  0

+   -3.8133    0.3158   -0.8524 Cl  0  0  0

+    0.2848    1.4978    0.5984 C   0  0  0

+   -0.4987   -2.2672    0.3743 C   0  0  0

+   -0.6370    2.4710    0.2548 C   0  0  0

+   -0.8030   -3.7408    0.2922 C   0  0  0

+   -0.2137    4.1497    0.3825 Cl  0  0  0

+   -1.9020   -4.1181   -0.0906 O   0  0  0

+    0.0490   -4.5600    0.6085 O   0  0  0

+   12.3740   -0.2036   -0.4320 Na  0  3  0

+    0.6833   -0.5442    0.0000 H   0  0  0

+   -2.6263    2.8153    0.0000 H   0  0  0

+    1.2687    1.7559    0.0000 H   0  0  0

+    0.4641   -2.5954    0.0000 H   0  0  0

+   -0.0532   -1.3528    0.0000 H   0  0  0

+    0.7822   -5.2650    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  2  0

+ 10 13  1  0

+  7  9  1  0

+  3 15  1  0

+  5 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1229-55-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+    2.4265   -0.4185    0.0091 C   0  0  0

+    1.2495    0.3474   -0.3992 C   0  0  0

+    3.6626    0.2552    0.1616 C   0  0  0

+    2.3530   -1.7942    0.2556 C   0  0  0

+    0.0443   -0.2617   -0.5564 N   0  0  0

+    1.3910    1.7191   -0.6236 C   0  0  0

+    3.7332    1.6387   -0.0805 C   0  0  0

+    4.7975   -0.4747    0.5537 C   0  0  0

+    3.4740   -2.4719    0.6344 C   0  0  0

+   -1.0098    0.2436   -0.0110 N   0  0  0

+    2.6300    2.3364   -0.4599 C   0  0  0

+    0.3160    2.4547   -1.0036 O   0  0  0

+    4.6923   -1.8136    0.7802 C   0  0  0

+   -2.2197   -0.3679   -0.1688 C   0  0  0

+   -3.3688    0.1781    0.4224 C   0  0  0

+   -2.3224   -1.5389   -0.9254 C   0  0  0

+   -4.5918   -0.4509    0.2552 C   0  0  0

+   -3.2826    1.3176    1.1557 O   0  0  0

+   -3.5476   -2.1509   -1.0810 C   0  0  0

+   -4.6784   -1.6109   -0.4909 C   0  0  0

+   -4.6026    1.6131    1.6164 C   0  0  0

+    1.4579   -2.2680    0.0000 H   0  0  0

+    4.6325    2.1045    0.0000 H   0  0  0

+    5.7048   -0.0247    0.0000 H   0  0  0

+    3.4495   -3.4844    0.0000 H   0  0  0

+    2.6815    3.3479    0.0000 H   0  0  0

+   -0.5198    3.0266    0.0000 H   0  0  0

+    5.5412   -2.3660    0.0000 H   0  0  0

+   -1.4851   -2.1087    0.0000 H   0  0  0

+   -5.4361    0.1085    0.0000 H   0  0  0

+   -3.5386   -3.1636    0.0000 H   0  0  0

+   -5.5546   -2.1189    0.0000 H   0  0  0

+   -4.3814    2.6014    0.0000 H   0  0  0

+   -5.5909    1.8343    0.0000 H   0  0  0

+   -4.8238    0.6248    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 14 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+ 16 19  2  0

+ 17 20  2  0

+ 18 21  1  0

+  7 11  1  0

+  9 13  1  0

+ 19 20  1  0

+  4 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60719-84-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    0.0425   -0.1668   -0.0436 C   0  0  0

+   -1.4362   -0.0565   -0.0183 C   0  0  0

+    0.8425    0.9621    0.2427 C   0  0  0

+    0.6348   -1.3599   -0.3377 C   0  0  0

+   -2.1999   -0.8373    0.8549 C   0  0  0

+   -2.1043    0.8350   -0.8628 C   0  0  0

+    2.2018    0.8376    0.2142 C   0  0  0

+    1.9871   -1.4739   -0.3636 N   0  0  0

+   -3.5724   -0.7032    0.8458 C   0  0  0

+   -3.4808    0.9058   -0.8069 C   0  0  0

+    2.7755   -0.4151   -0.1004 C   0  0  0

+    3.0192    1.9401    0.4934 N   0  0  0

+   -4.1646    0.1469    0.0283 N   0  0  0

+    3.9893   -0.5382   -0.1294 O   0  0  0

+    0.4168    1.8866    0.0000 H   0  0  0

+    0.0626   -2.2016    0.0000 H   0  0  0

+   -1.8513   -1.7936    0.0000 H   0  0  0

+   -1.6257    1.7333    0.0000 H   0  0  0

+    2.4052   -2.4019    0.0000 H   0  0  0

+   -4.0868   -1.5815    0.0000 H   0  0  0

+   -3.8706    1.8460    0.0000 H   0  0  0

+    4.0304    1.8239    0.0000 H   0  0  0

+    2.6142    2.8739    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 11 14  2  0

+  8 11  1  0

+ 10 13  2  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89-58-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.3022    0.0996    0.0076 C   0  0  0

+   -0.0222   -1.2504   -0.0891 C   0  0  0

+    0.7303    1.0161    0.0821 C   0  0  0

+   -1.7073    0.5646    0.0253 N   0  3  0

+    1.2903   -1.6843   -0.1114 C   0  0  0

+   -1.1476   -2.2494   -0.1697 C   0  0  0

+    2.0424    0.5823    0.0599 C   0  0  0

+   -2.1479    1.2074   -0.9108 O   0  0  0

+   -2.4230    0.3045    0.9760 O   0  5  0

+    2.3224   -0.7681   -0.0374 C   0  0  0

+    3.1677    1.5813    0.1416 C   0  0  0

+    0.5212    2.0302    0.0000 H   0  0  0

+    1.4994   -2.6984    0.0000 H   0  0  0

+   -1.8350   -1.4750    0.0000 H   0  0  0

+   -1.9220   -2.9368    0.0000 H   0  0  0

+   -0.4602   -3.0238    0.0000 H   0  0  0

+    3.3052   -1.0940    0.0000 H   0  0  0

+    3.8551    0.8070    0.0000 H   0  0  0

+    3.9420    2.2687    0.0000 H   0  0  0

+    2.4803    2.3556    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25637-99-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+   -2.2162    0.6753    0.3595 C   0  0  0

+   -2.2162   -0.6752   -0.3595 C   0  0  0

+   -1.5696    1.7314   -0.5391 C   0  0  0

+   -4.0666    1.2027    0.7634 Br  0  0  0

+   -1.5696   -1.7313    0.5391 C   0  0  0

+   -4.0666   -1.2025   -0.7634 Br  0  0  0

+   -0.4495    2.4371    0.2279 C   0  0  0

+   -0.4496   -2.4371   -0.2279 C   0  0  0

+    0.8438    2.3762   -0.5873 C   0  0  0

+    0.8437   -2.3762    0.5873 C   0  0  0

+    1.9638    1.7921    0.2761 C   0  0  0

+    0.5706    1.2359   -2.1654 Br  0  0  0

+    1.9637   -1.7922   -0.2761 C   0  0  0

+    0.5705   -1.2359    2.1654 Br  0  0  0

+    2.6105    0.6144   -0.4557 C   0  0  0

+    3.3184    3.1759    0.6161 Br  0  0  0

+    2.6104   -0.6145    0.4557 C   0  0  0

+    3.3182   -3.1760   -0.6161 Br  0  0  0

+   -1.2710    0.4089    0.0000 H   0  0  0

+   -1.2710   -0.4088    0.0000 H   0  0  0

+   -1.7567    2.6954    0.0000 H   0  0  0

+   -2.5359    1.9061    0.0000 H   0  0  0

+   -2.5359   -1.9060    0.0000 H   0  0  0

+   -1.7567   -2.6953    0.0000 H   0  0  0

+   -0.0966    3.3535    0.0000 H   0  0  0

+   -1.2080    3.0607    0.0000 H   0  0  0

+   -1.2082   -3.0606    0.0000 H   0  0  0

+   -0.0968   -3.3535    0.0000 H   0  0  0

+    1.0999    3.3242    0.0000 H   0  0  0

+    1.0998   -3.3242    0.0000 H   0  0  0

+    1.2769    1.0903    0.0000 H   0  0  0

+    1.2769   -1.0904    0.0000 H   0  0  0

+    3.5308    0.2719    0.0000 H   0  0  0

+    3.2524    1.3575    0.0000 H   0  0  0

+    3.2523   -1.3577    0.0000 H   0  0  0

+    3.5307   -0.2721    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  1  0

+ 11 15  1  0

+ 11 16  1  0

+ 13 17  1  0

+ 13 18  1  0

+ 15 17  1  0

+  1 19  1  0

+  2 20  1  0

+  3 21  1  0

+  3 22  1  0

+  5 23  1  0

+  5 24  1  0

+  7 25  1  0

+  7 26  1  0

+  8 27  1  0

+  8 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 11 31  1  0

+ 13 32  1  0

+ 15 33  1  0

+ 15 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+128-37-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 40                          1 V2000

+    1.2007   -0.1566   -0.0028 C   0  0  0

+    0.0002    0.5383   -0.0007 C   0  0  0

+    2.5070    0.5949   -0.0006 C   0  0  0

+    1.1979   -1.5382   -0.0013 C   0  0  0

+   -1.2008   -0.1565   -0.0028 C   0  0  0

+    0.0003    1.8973    0.0039 O   0  0  0

+    3.6684   -0.4011   -0.0061 C   0  0  0

+    2.5883    1.4801   -1.2459 C   0  0  0

+    2.5905    1.4687    1.2526 C   0  0  0

+   -0.0001   -2.2281    0.0024 C   0  0  0

+   -2.5070    0.5952    0.0000 C   0  0  0

+   -1.1983   -1.5377   -0.0071 C   0  0  0

+   -0.0002   -3.7351    0.0041 C   0  0  0

+   -3.6685   -0.4006   -0.0033 C   0  0  0

+   -2.5891    1.4703    1.2523 C   0  0  0

+   -2.5894    1.4791   -1.2461 C   0  0  0

+    2.0952   -2.0581    0.0000 H   0  0  0

+    0.0004    2.9343    0.0000 H   0  0  0

+    2.9933   -1.1883    0.0000 H   0  0  0

+    4.4556   -1.0762    0.0000 H   0  0  0

+    4.3435    0.3861    0.0000 H   0  0  0

+    3.6209    1.3853    0.0000 H   0  0  0

+    2.6831    2.5127    0.0000 H   0  0  0

+    1.5557    1.5749    0.0000 H   0  0  0

+    3.6228    1.3701    0.0000 H   0  0  0

+    2.6891    2.5010    0.0000 H   0  0  0

+    1.5582    1.5673    0.0000 H   0  0  0

+   -2.0957   -2.0574    0.0000 H   0  0  0

+   -1.0372   -3.7350    0.0000 H   0  0  0

+   -0.0003   -4.7721    0.0000 H   0  0  0

+    1.0368   -3.7352    0.0000 H   0  0  0

+   -4.3435    0.3867    0.0000 H   0  0  0

+   -4.4558   -1.0756    0.0000 H   0  0  0

+   -2.9935   -1.1879    0.0000 H   0  0  0

+   -1.5566    1.5672    0.0000 H   0  0  0

+   -2.6860    2.5028    0.0000 H   0  0  0

+   -3.6216    1.3734    0.0000 H   0  0  0

+   -1.5569    1.5754    0.0000 H   0  0  0

+   -2.6857    2.5116    0.0000 H   0  0  0

+   -3.6219    1.3828    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+ 10 13  1  0

+ 11 14  1  0

+ 11 15  1  0

+ 11 16  1  0

+ 10 12  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+ 14 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+ 15 35  1  0

+ 15 36  1  0

+ 15 37  1  0

+ 16 38  1  0

+ 16 39  1  0

+ 16 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-13-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.0563   -0.3492   -0.9858 C   0  0  0

+   -2.5612   -0.9166    0.1449 Br  0  0  0

+   -0.5050    0.9553   -0.4707 C   0  0  0

+    0.5051    0.9543    0.4727 C   0  0  0

+   -1.0057    2.1532   -0.9460 C   0  0  0

+    1.0552   -0.3514    0.9862 C   0  0  0

+    1.0112    2.1511    0.9450 C   0  0  0

+   -0.5001    3.3496   -0.4736 C   0  0  0

+    2.5595   -0.9189   -0.1452 Br  0  0  0

+    0.5067    3.3486    0.4740 C   0  0  0

+   -0.9521   -1.3182    0.0000 H   0  0  0

+   -0.0922   -0.4913    0.0000 H   0  0  0

+   -1.9803    2.1551    0.0000 H   0  0  0

+    0.0909   -0.4928    0.0000 H   0  0  0

+    0.9506   -1.3203    0.0000 H   0  0  0

+    1.9858    2.1504    0.0000 H   0  0  0

+   -1.0382    4.1621    0.0000 H   0  0  0

+    1.0461    4.1603    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  4  1  0

+  8  5  2  0

+  9  6  1  0

+ 10  7  2  0

+  8 10  1  0

+  1 11  1  0

+  1 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107-44-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.8534   -0.0887    0.0435 P   0  0  0

+   -0.5475   -0.1960    0.8297 O   0  0  0

+    2.2273   -0.3638    1.2097 C   0  0  0

+    0.8998   -1.1129   -1.0239 O   0  0  0

+    0.9955    1.4302   -0.6359 F   0  0  0

+   -1.5796    0.0276   -0.1331 C   0  0  0

+   -2.4873   -1.2021   -0.2025 C   0  0  0

+   -2.4051    1.2483    0.2785 C   0  0  0

+    2.0204   -1.3970    0.0000 H   0  0  0

+    3.2605   -0.5707    0.0000 H   0  0  0

+    2.4342    0.6694    0.0000 H   0  0  0

+   -0.9892    0.9004    0.0000 H   0  0  0

+   -3.3351   -0.5763    0.0000 H   0  0  0

+   -3.1131   -2.0499    0.0000 H   0  0  0

+   -1.6395   -1.8279    0.0000 H   0  0  0

+   -1.5322    1.8386    0.0000 H   0  0  0

+   -2.9954    2.1212    0.0000 H   0  0  0

+   -3.2780    0.6580    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  6  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6217-22-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    0.6536   -0.5089   -0.0024 C   0  0  0

+   -0.6536   -0.5089   -0.0017 C   0  0  0

+    1.4372    0.7393   -0.0015 C   0  0  0

+    1.3902   -1.7908    0.0021 C   0  0  0

+   -1.4372    0.7394    0.0002 C   0  0  0

+   -1.3904   -1.7907   -0.0021 C   0  0  0

+    0.7400    2.0396   -0.0003 C   0  0  0

+    2.7489    0.6867   -0.0013 C   0  0  0

+    0.7379   -2.9286    0.0066 C   0  0  0

+    2.8632   -1.7475    0.0018 C   0  0  0

+   -0.7398    2.0396    0.0005 C   0  0  0

+   -2.7488    0.6869    0.0010 C   0  0  0

+   -0.7381   -2.9285   -0.0034 C   0  0  0

+   -2.8633   -1.7472   -0.0006 C   0  0  0

+    1.3593    3.0744    0.0003 O   0  0  0

+    3.4793   -0.5862   -0.0020 C   0  0  0

+   -1.3591    3.0745    0.0019 O   0  0  0

+   -3.4794   -0.5859    0.0002 C   0  0  0

+    3.3195    1.6279    0.0000 H   0  0  0

+    1.2897   -3.8810    0.0000 H   0  0  0

+    3.4443   -2.6823    0.0000 H   0  0  0

+   -3.3193    1.6282    0.0000 H   0  0  0

+   -1.2899   -3.8809    0.0000 H   0  0  0

+   -3.4445   -2.6819    0.0000 H   0  0  0

+    4.5798   -0.5679    0.0000 H   0  0  0

+   -4.5799   -0.5676    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  2  0

+  6 14  1  0

+  7 15  2  0

+  8 16  1  0

+ 11 17  2  0

+ 12 18  1  0

+  7 11  1  0

+  9 13  1  0

+ 10 16  2  0

+ 14 18  2  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+159092-85-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.4059    1.4070   -0.0118 C   0  0  0

+    0.0182   -0.0066    0.0021 C   0  0  0

+    1.7807    1.7336   -0.0248 C   0  0  0

+   -0.5477    2.4267   -0.0181 C   0  0  0

+    1.0343   -0.9890    0.0019 C   0  0  0

+   -1.3217   -0.3972    0.0158 C   0  0  0

+    2.7496    0.7032   -0.0247 C   0  0  0

+    2.1626    3.0826   -0.0381 C   0  0  0

+   -0.1435    3.7313   -0.0315 C   0  0  0

+   -1.9903    2.0955   -0.0109 N   0  3  0

+    2.3933   -0.5970   -0.0110 C   0  0  0

+    0.6749   -2.3438    0.0151 C   0  0  0

+   -1.6395   -1.7257    0.0290 C   0  0  0

+    1.2078    4.0566   -0.0383 C   0  0  0

+   -2.5862    1.9461   -1.0626 O   0  0  0

+   -2.5816    1.9722    1.0469 O   0  5  0

+    3.4470   -1.6366   -0.0111 N   0  3  0

+   -0.6435   -2.6946    0.0279 C   0  0  0

+   -3.0611   -2.1379    0.0435 N   0  3  0

+    4.3810   -1.5571    0.7666 O   0  0  0

+    3.3799   -2.5716   -0.7888 O   0  5  0

+   -3.3523   -3.3205    0.0553 O   0  0  0

+   -3.9398   -1.2944    0.0437 O   0  5  0

+   -2.0766    0.3217    0.0000 H   0  0  0

+    3.7613    0.9546    0.0000 H   0  0  0

+    3.1727    3.3403    0.0000 H   0  0  0

+   -0.8566    4.4917    0.0000 H   0  0  0

+    1.4123   -3.0806    0.0000 H   0  0  0

+    1.4954    5.0586    0.0000 H   0  0  0

+   -0.9072   -3.7031    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  8 14  2  0

+ 10 15  2  0

+ 10 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+ 17 20  2  0

+ 17 21  1  0

+ 19 22  2  0

+ 19 23  1  0

+  7 11  2  0

+  9 14  1  0

+ 13 18  2  0

+  6 24  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85431-61-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 43                          1 V2000

+    1.0776    0.4773    0.7469 C   0  0  0

+    0.0612   -0.6778    0.6911 C   0  0  0

+    2.5674    0.1631    0.8976 C   0  0  0

+    0.1656    0.1998    1.8128 O   0  0  0

+    0.7146    1.7635    0.0418 C   0  0  0

+   -1.2569   -0.4089   -0.0470 C   0  0  0

+    3.0714   -0.5363   -0.3664 C   0  0  0

+    3.3040    0.8511   -0.1154 O   0  0  0

+   -0.5777    1.9089   -0.6134 C   0  0  0

+    1.5062    2.6828    0.0217 O   0  0  0

+   -1.5049    0.9603   -0.6330 C   0  0  0

+   -2.3985   -0.6863    0.9323 C   0  0  0

+   -1.3609   -1.4233   -1.1876 C   0  0  0

+    4.3360   -1.3329   -0.0387 C   0  0  0

+   -2.8450    1.2263   -1.2852 C   0  0  0

+   -3.7371   -0.5755    0.2001 C   0  0  0

+   -2.2464   -2.0963    1.5066 C   0  0  0

+    4.8067   -1.9862   -1.2192 O   0  0  0

+   -3.9479    0.8593   -0.2859 C   0  0  0

+   -3.7424   -1.4634   -0.9196 O   0  0  0

+    0.3779   -1.6209    0.0000 H   0  0  0

+    2.0246   -0.6706    0.0000 H   0  0  0

+    2.3902   -1.2613    0.0000 H   0  0  0

+   -0.9117    2.8460    0.0000 H   0  0  0

+   -2.4759    0.3055    0.0000 H   0  0  0

+   -2.3506   -1.3218    0.0000 H   0  0  0

+   -1.4624   -2.4130    0.0000 H   0  0  0

+   -0.3712   -1.5248    0.0000 H   0  0  0

+    5.3049   -1.1072    0.0000 H   0  0  0

+    4.5010   -0.3518    0.0000 H   0  0  0

+   -2.3274    2.0759    0.0000 H   0  0  0

+   -3.4647    2.0046    0.0000 H   0  0  0

+   -4.7295   -0.6450    0.0000 H   0  0  0

+   -3.2355   -2.2030    0.0000 H   0  0  0

+   -2.1397   -3.0854    0.0000 H   0  0  0

+   -1.2573   -1.9896    0.0000 H   0  0  0

+    5.3883   -2.7934    0.0000 H   0  0  0

+   -4.2063    1.8200    0.0000 H   0  0  0

+   -4.9221    0.6574    0.0000 H   0  0  0

+   -3.7483   -2.4582    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  5  9  1  0

+  5 10  2  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+ 11 15  1  0

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+ 14 18  1  0

+ 15 19  1  0

+ 16 20  1  0

+  2  4  1  0

+  7  8  1  0

+  9 11  2  0

+ 16 19  1  0

+  2 21  1  0

+  3 22  1  0

+  7 23  1  0

+  9 24  1  0

+ 12 25  1  0

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+ 14 30  1  0

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+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 19 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4164-28-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.7895    0.0000   -0.0016 N   0  0  0

+   -0.6115    0.0000   -0.0003 N   0  3  0

+    1.5221    1.2687   -0.0007 C   0  0  0

+    1.5220   -1.2687    0.0022 C   0  0  0

+   -1.2204    1.0548    0.0016 O   0  0  0

+   -1.2205   -1.0548   -0.0010 O   0  5  0

+    2.4320    0.7433    0.0000 H   0  0  0

+    2.0475    2.1786    0.0000 H   0  0  0

+    0.6122    1.7941    0.0000 H   0  0  0

+    0.6120   -1.7941    0.0000 H   0  0  0

+    2.0474   -2.1787    0.0000 H   0  0  0

+    2.4320   -0.7433    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25103-58-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 38                          1 V2000

+    1.5570    0.5546    0.9355 C   0  0  0

+    0.0438    0.6112    0.7165 C   0  0  0

+    2.1738   -0.4628   -0.0264 C   0  0  0

+   -0.5019   -0.8092    0.5568 C   0  0  0

+   -0.6211    1.2806    1.9209 C   0  0  0

+   -0.3149    1.5688   -0.7818 S   0  0  0

+    1.4826   -0.3619   -1.3876 C   0  0  0

+    3.6667   -0.1705   -0.1895 C   0  0  0

+    1.9889   -1.8736    0.5361 C   0  0  0

+   -1.8902   -0.7531   -0.0837 C   0  0  0

+   -2.6557    0.4536    0.4629 C   0  0  0

+   -1.7468   -0.6213   -1.6013 C   0  0  0

+   -2.6565   -2.0355    0.2467 C   0  0  0

+    2.5474    0.9171    0.0000 H   0  0  0

+    1.3924    1.5963    0.0000 H   0  0  0

+   -0.6587   -1.8521    0.0000 H   0  0  0

+    0.5178   -1.0783    0.0000 H   0  0  0

+    0.1271    2.0238    0.0000 H   0  0  0

+   -1.3643    2.0288    0.0000 H   0  0  0

+   -1.3693    0.5374    0.0000 H   0  0  0

+   -0.6848    2.5564    0.0000 H   0  0  0

+    1.6349    0.6817    0.0000 H   0  0  0

+    0.4390   -0.2096    0.0000 H   0  0  0

+    1.3303   -1.4055    0.0000 H   0  0  0

+    3.8693   -1.2055    0.0000 H   0  0  0

+    4.7017    0.0321    0.0000 H   0  0  0

+    3.4641    0.8645    0.0000 H   0  0  0

+    0.9432   -1.7366    0.0000 H   0  0  0

+    1.8519   -2.9193    0.0000 H   0  0  0

+    3.0346   -2.0106    0.0000 H   0  0  0

+   -1.7652    1.0185    0.0000 H   0  0  0

+   -3.2206    1.3441    0.0000 H   0  0  0

+   -3.5462   -0.1113    0.0000 H   0  0  0

+   -1.0331   -1.3978    0.0000 H   0  0  0

+   -0.9703    0.0924    0.0000 H   0  0  0

+   -2.4605    0.1552    0.0000 H   0  0  0

+   -3.5618   -1.4945    0.0000 H   0  0  0

+   -3.1975   -2.9408    0.0000 H   0  0  0

+   -1.7512   -2.5765    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

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+ 11 31  1  0

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+ 12 34  1  0

+ 12 35  1  0

+ 12 36  1  0

+ 13 37  1  0

+ 13 38  1  0

+ 13 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-27-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -1.4150    0.0001    0.0546 C   0  0  0

+   -0.7309   -1.1972    0.1554 C   0  0  0

+   -0.7311    1.1971    0.1531 C   0  0  0

+   -2.8788   -0.0001   -0.1651 N   0  3  0

+    0.6367   -1.1970    0.3548 C   0  0  0

+    0.6370    1.1973    0.3526 C   0  0  0

+   -3.4814    1.0546   -0.2540 O   0  0  0

+   -3.4807   -1.0550   -0.2570 O   0  5  0

+    1.3208    0.0004    0.4534 C   0  0  0

+    2.8121    0.0006    0.6703 C   0  0  0

+    3.5244   -0.0005   -0.6838 C   0  0  0

+    4.9385   -0.0003   -0.4781 O   0  0  0

+   -1.2498   -2.0915    0.0000 H   0  0  0

+   -1.2501    2.0913    0.0000 H   0  0  0

+    1.1557   -2.0912    0.0000 H   0  0  0

+    1.1559    2.0915    0.0000 H   0  0  0

+    3.3299    0.8955    0.0000 H   0  0  0

+    2.2955    0.8962    0.0000 H   0  0  0

+    3.0066   -0.8954    0.0000 H   0  0  0

+    4.0410   -0.8961    0.0000 H   0  0  0

+    5.9724   -0.0002    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  6 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24085-06-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+   -0.0656   -0.0971   -0.2922 C   0  0  0

+    0.0043   -1.4673   -0.5170 C   0  0  0

+    1.0844    0.6257   -0.0691 C   0  0  0

+   -1.4021    0.5990   -0.2989 C   0  0  0

+    1.2350   -2.1148   -0.5173 C   0  0  0

+   -1.1326   -2.1754   -0.7364 O   0  0  0

+    2.3258   -0.0212   -0.0689 C   0  0  0

+   -1.2115    2.0154   -0.0422 O   0  0  0

+    2.3906   -1.4015   -0.2953 C   0  0  0

+   -1.7980   -2.7149    0.2981 C   0  0  0

+    3.5565    0.7454    0.1681 C   0  0  0

+   -2.2708    2.8387   -0.0017 C   0  0  0

+   -2.9966   -3.5933    0.0474 C   0  0  0

+   -1.4355   -2.4960    1.4297 O   0  0  0

+    4.8915    0.0464    0.1679 C   0  0  0

+    3.4980    1.9409    0.3641 O   0  0  0

+   -2.0729    4.3087    0.2648 C   0  0  0

+   -3.3831    2.4012   -0.1789 O   0  0  0

+    1.0427    1.6575    0.0000 H   0  0  0

+   -2.4029    0.8537    0.0000 H   0  0  0

+   -1.7704   -0.3658    0.0000 H   0  0  0

+    1.2705   -3.1469    0.0000 H   0  0  0

+    3.3040   -1.8833    0.0000 H   0  0  0

+   -3.6070   -2.7604    0.0000 H   0  0  0

+   -3.8295   -4.2037    0.0000 H   0  0  0

+   -2.3862   -4.4262    0.0000 H   0  0  0

+    4.4125   -0.8685    0.0000 H   0  0  0

+    5.8064   -0.4326    0.0000 H   0  0  0

+    5.3705    0.9613    0.0000 H   0  0  0

+   -1.0495    4.1709    0.0000 H   0  0  0

+   -1.9351    5.3321    0.0000 H   0  0  0

+   -3.0963    4.4465    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96918-24-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 33                          1 V2000

+   -0.1257   -0.1976   -0.0016 C   0  0  0

+   -1.5105    0.0482   -0.0010 C   0  0  0

+    0.7706    0.8927   -0.0004 C   0  0  0

+    0.3584   -1.5285    0.0026 C   0  0  0

+   -1.9903    1.3772    0.0002 C   0  0  0

+   -2.4165   -1.0368   -0.0022 C   0  0  0

+    2.1552    0.6304   -0.0009 C   0  0  0

+    0.2666    2.2101    0.0017 C   0  0  0

+    1.7354   -1.7577    0.0021 C   0  0  0

+   -0.5555   -2.6119    0.0068 C   0  0  0

+   -1.0669    2.4482    0.0013 C   0  0  0

+   -3.3717    1.5982    0.0007 C   0  0  0

+   -1.8908   -2.3991   -0.0040 C   0  0  0

+   -3.7872   -0.7762   -0.0012 C   0  0  0

+    2.6261   -0.6937   -0.0025 C   0  0  0

+    3.3503    1.4752    0.0008 C   0  0  0

+   -4.2448    0.5290    0.0000 C   0  0  0

+    3.9759   -0.6356   -0.0019 O   0  0  0

+    4.4007    0.6389    0.0000 C   0  0  0

+    0.9384    3.0223    0.0000 H   0  0  0

+    2.1012   -2.7462    0.0000 H   0  0  0

+   -0.1881   -3.5998    0.0000 H   0  0  0

+   -1.4197    3.4414    0.0000 H   0  0  0

+   -3.7466    2.5833    0.0000 H   0  0  0

+   -2.5538   -3.2185    0.0000 H   0  0  0

+   -4.4748   -1.5750    0.0000 H   0  0  0

+    3.3804    2.5288    0.0000 H   0  0  0

+   -5.2829    0.7112    0.0000 H   0  0  0

+    5.4112    0.9386    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  1  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+131-17-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+    0.6964   -1.0552   -0.3272 C   0  0  0

+   -0.6696   -0.9107   -0.0192 C   0  0  0

+    1.5101    0.1297   -0.6733 C   0  0  0

+    1.2778   -2.3200   -0.2981 C   0  0  0

+   -1.2995    0.4267   -0.0409 C   0  0  0

+   -1.4240   -2.0351    0.3056 C   0  0  0

+    2.6138    0.4210    0.0418 O   0  0  0

+    1.1834    0.8403   -1.6025 O   0  0  0

+    0.5143   -3.4241    0.0316 C   0  0  0

+   -2.6297    0.5476    0.1343 O   0  0  0

+   -0.6177    1.4163   -0.2166 O   0  0  0

+   -0.8308   -3.2834    0.3241 C   0  0  0

+    3.4130    1.5847   -0.2982 C   0  0  0

+   -3.2483    1.8611    0.1130 C   0  0  0

+    4.5822    1.6846    0.6473 C   0  0  0

+   -4.7328    1.7207    0.3310 C   0  0  0

+    4.7393    0.7904    1.5916 C   0  0  0

+   -5.2605    0.5338    0.5014 C   0  0  0

+    2.2889   -2.4083    0.0000 H   0  0  0

+   -2.4362   -1.9604    0.0000 H   0  0  0

+    0.9381   -4.3463    0.0000 H   0  0  0

+   -1.4170   -4.1120    0.0000 H   0  0  0

+    3.5584    2.5892    0.0000 H   0  0  0

+    2.4678    1.9543    0.0000 H   0  0  0

+   -2.2865    2.1850    0.0000 H   0  0  0

+   -3.4595    2.8538    0.0000 H   0  0  0

+    5.2011    2.4890    0.0000 H   0  0  0

+   -5.3253    2.5447    0.0000 H   0  0  0

+    3.9614    0.1385    0.0000 H   0  0  0

+    5.6928    0.4427    0.0000 H   0  0  0

+   -6.2698    0.4272    0.0000 H   0  0  0

+   -4.6635   -0.2870    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1116-54-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.1124   -0.1324    0.0628 N   0  0  0

+    1.1189   -0.9482    0.7467 C   0  0  0

+   -0.7793   -0.7452   -0.9249 C   0  0  0

+    0.0078    1.1243    0.3341 N   0  0  0

+    2.4198   -0.9340   -0.0585 C   0  0  0

+   -2.0403   -1.2567   -0.2254 C   0  0  0

+   -0.8290    1.8026   -0.2345 O   0  0  0

+    2.8937    0.4092   -0.1742 O   0  0  0

+   -2.7098   -0.1647    0.4081 O   0  0  0

+    0.3197   -1.4912    0.0000 H   0  0  0

+    1.4080   -1.8701    0.0000 H   0  0  0

+   -0.8430   -1.7093    0.0000 H   0  0  0

+    0.0604   -1.2231    0.0000 H   0  0  0

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+   -2.8905   -1.7158    0.0000 H   0  0  0

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+   -3.2148    0.6590    0.0000 H   0  0  0

+  1  2  1  0

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+  4  7  2  0

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+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+20846-00-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.8852    0.0000   -0.0017 C   0  0  0

+   -0.5941    0.0000   -0.0004 N   0  3  0

+    1.6387    1.3051   -0.0010 C   0  0  0

+    1.6387   -1.3051    0.0024 C   0  0  0

+   -1.3021    1.2263    0.0016 O   0  5  0

+   -1.3021   -1.2263   -0.0011 O   0  5  0

+    2.5995    0.7504    0.0000 H   0  0  0

+    2.1934    2.2659    0.0000 H   0  0  0

+    0.6779    1.8598    0.0000 H   0  0  0

+    0.6779   -1.8598    0.0000 H   0  0  0

+    2.1934   -2.2659    0.0000 H   0  0  0

+    2.5995   -0.7504    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24225-71-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 53 58                          1 V2000

+   -3.8504   -0.6462    0.2998 C   0  0  0

+   -5.1651   -1.3187    0.1565 C   0  0  0

+   -3.9295    0.6424   -0.2225 C   0  0  0

+   -2.6428   -1.0970    0.8386 C   0  0  0

+   -6.0658   -0.4511   -0.4551 C   0  0  0

+   -5.5869   -2.5989    0.5211 C   0  0  0

+   -2.8280    1.4693   -0.2047 C   0  0  0

+   -5.3366    0.8410   -0.7308 C   0  0  0

+   -1.5430   -0.2676    0.8562 C   0  0  0

+   -7.3623   -0.8530   -0.6979 C   0  0  0

+   -6.8855   -2.9924    0.2741 C   0  0  0

+   -1.6296    1.0187    0.3366 C   0  0  0

+   -7.7735   -2.1229   -0.3337 C   0  0  0

+   -0.5110    1.8575    0.3550 N   0  0  0

+    0.5586    1.5799    1.2163 N   0  0  0

+   -0.4618    2.9330   -0.4557 C   0  0  0

+    1.7107    0.9661    0.7227 C   0  0  0

+   -0.7298    4.3081    0.0996 C   0  0  0

+   -0.2018    2.7942   -1.6322 O   0  0  0

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+    3.9297    0.1322    1.0769 C   0  0  0

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+    7.8837   -1.9450   -0.5000 C   0  0  0

+   -2.5036   -2.0538    0.0000 H   0  0  0

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+    5.3340   -2.2250    0.0000 H   0  0  0

+    7.8865   -0.6073    0.0000 H   0  0  0

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+    8.7780   -2.3123    0.0000 H   0  0  0

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+  5  8  1  0

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+ 25 48  1  0

+ 25 49  1  0

+ 28 50  1  0

+ 29 51  1  0

+ 30 52  1  0

+ 31 53  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+20589-85-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.3374    0.6847    0.0695 C   0  0  0

+   -0.2637   -0.6910   -0.0609 C   0  0  0

+    1.6412    0.8289    0.1244 C   0  0  0

+   -0.6938    2.0795    0.1400 Cl  0  0  0

+   -1.2179   -1.0728    1.4205 Cl  0  0  0

+   -1.3462   -0.7397   -1.5020 Cl  0  0  0

+    2.6769   -0.5456   -0.1036 Cl  0  0  0

+    0.4704   -1.4485    0.0000 H   0  0  0

+    2.0592    1.7974    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  2  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+491-70-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -1.7445    0.7169   -0.0036 C   0  0  0

+   -2.2616   -0.5899   -0.0023 C   0  0  0

+   -0.4083    0.9092   -0.0027 O   0  0  0

+   -2.6163    1.7947    0.0001 C   0  0  0

+   -1.3166   -1.7195   -0.0005 C   0  0  0

+   -3.6463   -0.8002   -0.0024 C   0  0  0

+    0.4630   -0.1122   -0.0005 C   0  0  0

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+    0.0648   -1.4128   -0.0001 C   0  0  0

+   -1.7096   -2.8749    0.0010 O   0  0  0

+   -4.5001    0.2873   -0.0036 C   0  0  0

+   -4.1462   -2.0619   -0.0017 O   0  0  0

+    1.9073    0.1875    0.0000 C   0  0  0

+   -4.8329    2.6401    0.0085 O   0  0  0

+    2.8389   -0.8544    0.0023 C   0  0  0

+    2.3474    1.5139   -0.0076 C   0  0  0

+    4.1905   -0.5682    0.0028 C   0  0  0

+    3.6972    1.7920   -0.0071 C   0  0  0

+    4.6224    0.7571    0.0010 C   0  0  0

+    5.0997   -1.5796    0.0054 O   0  0  0

+    5.9518    1.0366    0.0019 O   0  0  0

+   -2.2429    2.7650    0.0000 H   0  0  0

+    0.7705   -2.1763    0.0000 H   0  0  0

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+   -4.5292   -3.0285    0.0000 H   0  0  0

+   -5.4817    3.4525    0.0000 H   0  0  0

+    2.5155   -1.8425    0.0000 H   0  0  0

+    1.6566    2.2908    0.0000 H   0  0  0

+    4.0233    2.7792    0.0000 H   0  0  0

+    5.7948   -2.3528    0.0000 H   0  0  0

+    6.9692    1.2505    0.0000 H   0  0  0

+  1  2  2  0

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+  7  9  2  0

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+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+30461-65-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+   -0.2165   -0.1256   -0.1014 C   0  0  0

+   -1.5868   -0.0967    0.1384 C   0  0  0

+    0.4737    1.0973   -0.1260 C   0  0  0

+    0.3703   -1.3070   -0.3239 O   0  0  0

+   -2.5985   -1.2172    0.2647 C   0  0  1

+   -2.2678    1.0984    0.3060 C   0  0  0

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+   -3.1415   -1.5460   -1.1133 C   0  0  0

+   -3.5961    0.8847    0.5090 O   0  0  0

+   -1.5699    2.3081    0.2458 C   0  0  0

+    2.5374   -0.2711   -0.0819 C   0  0  0

+    2.5957    2.0462   -0.5978 O   0  0  0

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+    2.2454   -2.6405    0.1531 C   0  0  0

+   -4.9094   -1.0065    0.1375 O   0  0  0

+   -4.4465   -1.3895   -1.0733 C   0  0  0

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+    4.4367   -1.6744    0.3670 C   0  0  0

+    4.7231    0.6730    0.1130 O   0  0  0

+   -1.9438   -2.0097    0.0000 H   0  0  0

+   -4.6382    0.1362    0.0000 H   0  0  0

+   -2.9246   -2.5508    0.0000 H   0  0  0

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+ 16 28  1  0

+ 17 29  1  0

+ 19 30  1  0

+ 21 31  1  0

+ 22 32  1  0

+ 23 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+892-21-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.1343    0.2996    0.0165 C   0  0  0

+    0.6636   -1.0637   -0.0381 C   0  0  0

+    1.0499    1.2149    0.0524 C   0  0  0

+   -1.3057    0.5599    0.0221 C   0  0  0

+    2.1259   -0.9053   -0.0341 C   0  0  0

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+    3.1362   -1.7373   -0.0700 C   0  0  0

+   -1.6471   -1.8167   -0.0654 C   0  0  0

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+   -0.6983    2.8814    0.1184 C   0  0  0

+   -3.5387   -0.4670   -0.0265 N   0  3  0

+    4.5173   -1.2224   -0.0493 C   0  0  0

+    4.7334    0.0748    0.0036 C   0  0  0

+   -4.2240   -1.1349    0.7270 O   0  0  0

+   -4.0640    0.3346   -0.7782 O   0  5  0

+    0.1638   -3.0473    0.0000 H   0  0  0

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+   -1.0181    3.8884    0.0000 H   0  0  0

+    5.3325   -1.8945    0.0000 H   0  0  0

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+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68498-25-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.9969    0.2468   -0.1897 C   0  0  0

+   -1.8812   -0.7087    0.3181 C   0  0  0

+    0.2637   -0.2345    0.0615 N   0  0  0

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+   -1.1400   -1.7069    0.8440 N   0  0  0

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+   -3.6976    0.7173   -0.4321 N   0  0  0

+   -4.4006   -1.1071    0.5359 N   0  0  0

+    2.5377   -0.5825   -0.5305 O   0  0  0

+    2.0467    1.2182    0.9285 C   0  0  0

+   -5.0674    0.7309   -0.4351 C   0  0  0

+   -5.4785   -0.4044    0.1671 C   0  0  0

+    3.7989    0.0939   -0.3361 C   0  0  1

+    3.5758    0.9986    0.8960 C   0  0  1

+    4.8866   -0.9355   -0.0226 C   0  0  0

+    4.2326    2.2512    0.6923 O   0  0  0

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+    0.8751    1.1399    0.0000 H   0  0  0

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+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99-65-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    1.1972    0.2303   -0.0034 C   0  0  0

+   -0.0002   -0.4609   -0.0032 C   0  0  0

+    1.1972    1.6125   -0.0012 C   0  0  0

+    2.4790   -0.5098    0.0002 N   0  3  0

+   -1.1971    0.2302   -0.0007 C   0  0  0

+   -0.0001    2.3038    0.0013 C   0  0  0

+    3.5339    0.0992    0.0000 O   0  0  0

+    2.4790   -1.7278    0.0033 O   0  5  0

+   -1.1971    1.6128    0.0015 C   0  0  0

+   -2.4790   -0.5098    0.0001 N   0  3  0

+   -3.5338    0.0992    0.0022 O   0  0  0

+   -2.4791   -1.7278   -0.0015 O   0  5  0

+   -0.0003   -1.4975    0.0000 H   0  0  0

+    2.0949    2.1308    0.0000 H   0  0  0

+   -0.0001    3.3404    0.0000 H   0  0  0

+   -2.0948    2.1311    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  5 10  1  0

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+ 10 12  1  0

+  6  9  2  0

+  2 13  1  0

+  3 14  1  0

+  6 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+136112-71-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    1.4689   -0.0122   -0.0016 N   0  0  0

+    0.9795   -1.2951    0.0311 C   0  0  0

+    2.8405   -0.0987   -0.0059 C   0  0  0

+    0.7107    1.1655   -0.0312 C   0  0  0

+   -0.4533   -1.6603    0.0460 C   0  0  0

+    1.9761   -2.1465    0.0467 N   0  0  0

+    3.1468   -1.4709    0.0252 C   0  0  0

+    3.8332    0.7842   -0.0319 N   0  0  0

+    0.6512    1.9830    1.0899 C   0  0  0

+    0.0221    1.5207   -1.1831 C   0  0  0

+   -0.9487   -2.5914   -0.8676 C   0  0  0

+   -1.3150   -1.0794    0.9778 C   0  0  0

+    4.5025   -1.8476    0.0282 C   0  0  0

+    5.0876    0.3846   -0.0287 C   0  0  0

+   -0.0966    3.1435    1.0575 C   0  0  0

+   -0.7242    2.6828   -1.2093 C   0  0  0

+   -2.2867   -2.9281   -0.8481 C   0  0  0

+   -2.6505   -1.4247    0.9868 C   0  0  0

+    5.4252   -0.8919    0.0016 N   0  0  0

+    4.8664   -3.1823    0.0586 N   0  0  0

+   -0.7858    3.4920   -0.0899 C   0  0  0

+   -3.1364   -2.3448    0.0746 C   0  0  0

+   -1.5868    4.7363   -0.1211 N   0  3  0

+   -4.5707   -2.7104    0.0895 N   0  3  0

+   -2.1942    5.0444   -1.1309 O   0  0  0

+   -1.6384    5.4522    0.8629 O   0  5  0

+   -5.3212   -2.1984    0.9008 O   0  0  0

+   -5.0004   -3.5231   -0.7094 O   0  5  0

+    1.5962    2.2988    0.0000 H   0  0  0

+   -0.6483    0.7837    0.0000 H   0  0  0

+   -0.3346   -3.3759    0.0000 H   0  0  0

+   -1.1464   -0.0974    0.0000 H   0  0  0

+    5.8094    1.0713    0.0000 H   0  0  0

+    0.5702    3.8838    0.0000 H   0  0  0

+   -1.6689    2.3662    0.0000 H   0  0  0

+   -2.4627   -3.9088    0.0000 H   0  0  0

+   -3.2684   -0.6431    0.0000 H   0  0  0

+    4.1650   -3.8899    0.0000 H   0  0  0

+    5.8299   -3.4360    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  6  7  1  0

+ 14 19  1  0

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+ 15 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64810-99-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+    1.3349   -0.7084    0.1005 C   0  0  0

+   -0.0177   -1.0612    0.2545 C   0  0  0

+    1.7276    0.6345    0.2420 C   0  0  0

+    2.3255   -1.7429   -0.2003 C   0  0  0

+   -0.9675   -0.0571    0.5502 C   0  0  0

+   -0.4196   -2.4086    0.1147 C   0  0  0

+    3.1413    0.9671    0.0756 C   0  0  0

+    0.7633    1.6158    0.5374 C   0  0  0

+    3.6576   -1.3952   -0.3524 C   0  0  0

+    1.8777   -3.1295   -0.3338 C   0  0  0

+   -2.3161   -0.4212    0.7019 C   0  0  0

+   -0.5440    1.2824    0.6855 C   0  0  0

+    0.5703   -3.4381   -0.1900 C   0  0  0

+   -1.7699   -2.7316    0.2728 C   0  0  0

+    4.0724   -0.0598   -0.2211 C   0  0  0

+    3.5873    2.2880    0.2052 C   0  0  0

+   -2.6940   -1.7466    0.5612 C   0  0  0

+   -3.2475    0.5245    0.9865 O   0  0  0

+    5.4316    0.2770   -0.3790 C   0  0  0

+    4.9100    2.5764    0.0456 C   0  0  0

+   -3.7856    1.0268   -0.3456 S   0  0  0

+    5.8289    1.5713   -0.2459 C   0  0  0

+   -4.9237    0.1026   -0.7542 O   0  0  0

+   -4.3889    2.2834   -0.0692 O   0  0  0

+   -2.7481    0.8027   -1.2904 O   0  0  0

+    1.0433    2.6188    0.0000 H   0  0  0

+    4.3768   -2.1482    0.0000 H   0  0  0

+    2.5838   -3.8949    0.0000 H   0  0  0

+   -1.2592    2.0392    0.0000 H   0  0  0

+    0.2759   -4.4369    0.0000 H   0  0  0

+   -2.0689   -3.7290    0.0000 H   0  0  0

+    2.8930    3.0640    0.0000 H   0  0  0

+   -3.7060   -1.9920    0.0000 H   0  0  0

+    6.1474   -0.4792    0.0000 H   0  0  0

+    5.2254    3.5688    0.0000 H   0  0  0

+    6.8448    1.8000    0.0000 H   0  0  0

+   -5.7320   -0.5538    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 32  1  0

+ 17 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23256-30-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -4.2986    0.5717    0.2670 S   0  0  0

+   -3.5755   -1.0417    0.6789 C   0  0  0

+   -2.7822    1.5593    0.1225 C   0  0  0

+   -4.9178    0.4876   -1.0092 O   0  0  0

+   -5.0489    1.0386    1.3799 O   0  0  0

+   -2.5968   -1.4512   -0.4248 C   0  0  0

+   -1.8705    0.9300   -0.9342 C   0  0  0

+   -1.5425   -0.4423   -0.5434 N   0  0  0

+   -1.9717   -2.8034   -0.0762 C   0  0  0

+   -0.3170   -0.7643   -0.3016 N   0  0  0

+    0.6536    0.1581   -0.4091 C   0  0  0

+    1.9621   -0.1858   -0.1509 C   0  0  0

+    3.0398    0.6306   -0.2176 O   0  0  0

+    2.4590   -1.5137    0.2579 C   0  0  0

+    4.1393   -0.0576    0.1007 C   0  0  0

+    3.8093   -1.3801    0.3975 C   0  0  0

+    5.5088    0.5027    0.1372 N   0  3  0

+    6.4499   -0.2085    0.4407 O   0  0  0

+    5.7249    1.8656   -0.1806 O   0  5  0

+   -4.5805   -1.1924    0.0000 H   0  0  0

+   -3.7009   -2.0501    0.0000 H   0  0  0

+   -2.1016    2.3139    0.0000 H   0  0  0

+   -3.4423    2.3319    0.0000 H   0  0  0

+   -3.3020   -2.1828    0.0000 H   0  0  0

+   -0.8553    0.8843    0.0000 H   0  0  0

+   -1.5464    1.8931    0.0000 H   0  0  0

+   -2.8941   -3.2298    0.0000 H   0  0  0

+   -1.5453   -3.7258    0.0000 H   0  0  0

+   -1.0493   -2.3770    0.0000 H   0  0  0

+    0.4007    1.1423    0.0000 H   0  0  0

+    1.9218   -2.3763    0.0000 H   0  0  0

+    4.4736   -2.1491    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  9 27  1  0

+  9 28  1  0

+  9 29  1  0

+ 11 30  1  0

+ 14 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+476-57-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -1.4139    0.7596   -0.0023 C   0  0  0

+   -1.4720   -0.6485   -0.0014 C   0  0  0

+   -0.1090    1.4451   -0.0021 C   0  0  0

+   -2.5982    1.4992    0.0023 C   0  0  0

+   -0.2283   -1.4378   -0.0002 C   0  0  0

+   -2.7136   -1.2891   -0.0011 C   0  0  0

+    1.1348    0.6582   -0.0009 C   0  0  0

+   -0.0601    2.6607   -0.0026 O   0  0  0

+   -3.8274    0.8423    0.0079 C   0  0  0

+   -2.5525    2.8548    0.0019 O   0  0  0

+    1.0797   -0.7492    0.0001 C   0  0  0

+   -0.2775   -2.6526    0.0003 O   0  0  0

+   -3.8844   -0.5334   -0.0018 C   0  0  0

+   -2.7792   -2.6437   -0.0006 O   0  0  0

+    2.3776    1.3034   -0.0002 C   0  0  0

+    2.2575   -1.4855    0.0008 C   0  0  0

+   -5.2224   -1.2268   -0.0020 C   0  0  0

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+    3.4870   -0.8321    0.0005 C   0  0  0

+    4.6352   -1.5556    0.0012 O   0  0  0

+    5.7140   -0.6184    0.0007 C   0  0  0

+   -4.7126    1.3981    0.0000 H   0  0  0

+   -2.5173    3.8994    0.0000 H   0  0  0

+   -2.8298   -3.6877    0.0000 H   0  0  0

+    2.2208   -2.5301    0.0000 H   0  0  0

+   -5.7033   -0.2988    0.0000 H   0  0  0

+   -6.1504   -1.7077    0.0000 H   0  0  0

+   -4.7415   -2.1548    0.0000 H   0  0  0

+    4.4732    1.0340    0.0000 H   0  0  0

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+    6.3995   -1.4074    0.0000 H   0  0  0

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+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+185-72-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.7844    0.0000   -0.1894 C   0  0  0

+   -2.2654    0.0000   -0.5536 C   0  0  0

+   -1.8072    0.0000    0.8010 O   0  0  0

+    0.0154   -1.2884   -0.4072 C   0  0  0

+    0.0154    1.2884   -0.4072 C   0  0  0

+    1.3510   -1.1543    0.3347 C   0  0  0

+    1.3510    1.1544    0.3346 C   0  0  0

+    2.0451    0.0000   -0.1344 O   0  0  0

+   -2.7705    0.8748    0.0000 H   0  0  0

+   -2.7705   -0.8748    0.0000 H   0  0  0

+   -0.9136   -1.6852    0.0000 H   0  0  0

+    0.2672   -2.2667    0.0000 H   0  0  0

+    0.2671    2.2667    0.0000 H   0  0  0

+   -0.9136    1.6852    0.0000 H   0  0  0

+    1.2363   -2.1580    0.0000 H   0  0  0

+    2.3075   -1.4793    0.0000 H   0  0  0

+    2.3075    1.4794    0.0000 H   0  0  0

+    1.2363    2.1581    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  4  6  1  0

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+  4 11  1  0

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+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+69795-73-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+    0.1304   -0.5732    0.0609 C   0  0  0

+   -1.0575    0.1553    0.1486 C   0  0  0

+    1.3440    0.1279    0.0000 C   0  0  0

+    0.0912   -1.9851    0.0410 C   0  0  0

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+    3.7478    0.1118   -0.1463 C   0  0  0

+   -4.1850    0.5632   -0.8414 O   0  0  0

+    3.7271    1.4941   -0.1152 C   0  0  0

+   -1.2236   -3.6441    0.0000 H   0  0  0

+    1.3148   -3.7338    0.0000 H   0  0  0

+    0.0810    3.2843    0.0000 H   0  0  0

+   -2.1703    2.9384    0.0000 H   0  0  0

+   -3.4818    2.4102    0.0000 H   0  0  0

+   -3.7043   -0.3482    0.0000 H   0  0  0

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+    3.3897   -2.5617    0.0000 H   0  0  0

+    4.6626   -0.3990    0.0000 H   0  0  0

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+    4.6368    2.0141    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+680-31-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    0.0132   -0.0262    0.1301 P   0  0  0

+   -1.2803   -0.9031   -0.4947 N   0  0  0

+    1.4595   -0.7256   -0.3716 N   0  0  0

+   -0.0646    1.5608   -0.4247 N   0  0  0

+   -0.0525   -0.0357    1.6086 O   0  0  0

+   -0.7727   -2.2486   -0.7945 C   0  0  0

+   -2.2544   -1.0525    0.5947 C   0  0  0

+    2.1322    0.2623   -1.2256 C   0  0  0

+    2.2915   -0.8821    0.8289 C   0  0  0

+   -1.3407    1.6958   -1.1398 C   0  0  0

+   -0.1538    2.4196    0.7637 C   0  0  0

+   -1.6423   -2.5767    0.0000 H   0  0  0

+   -0.4446   -3.1182    0.0000 H   0  0  0

+    0.0969   -1.9205    0.0000 H   0  0  0

+   -2.3953   -0.1338    0.0000 H   0  0  0

+   -3.1731   -1.1934    0.0000 H   0  0  0

+   -2.1135   -1.9712    0.0000 H   0  0  0

+    2.9004   -0.2608    0.0000 H   0  0  0

+    2.6553    1.0305    0.0000 H   0  0  0

+    1.3640    0.7854    0.0000 H   0  0  0

+    2.1197   -1.7955    0.0000 H   0  0  0

+    3.2049   -1.0539    0.0000 H   0  0  0

+    2.4633    0.0313    0.0000 H   0  0  0

+   -1.2429    2.6200    0.0000 H   0  0  0

+   -2.2649    1.7936    0.0000 H   0  0  0

+   -1.4385    0.7716    0.0000 H   0  0  0

+    0.7706    2.5156    0.0000 H   0  0  0

+   -0.2498    3.3440    0.0000 H   0  0  0

+   -1.0782    2.3236    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5417-50-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -2.2686    0.9327   -0.0908 N   0  0  0

+   -3.3271    0.1053    0.0164 C   0  0  0

+   -0.9694    0.4140   -0.0621 C   0  0  0

+   -4.7187    0.6727    0.1282 C   0  0  0

+   -3.1596   -1.0959    0.0228 O   0  0  0

+    0.1181    1.2655   -0.0366 C   0  0  0

+   -0.7644   -0.9709   -0.0534 C   0  0  0

+    1.4036    0.6951   -0.0084 C   0  0  0

+    0.4389   -1.4870   -0.0268 N   0  0  0

+    1.5311   -0.7163   -0.0073 C   0  0  0

+    2.5570    1.4967    0.0181 C   0  0  0

+    2.8166   -1.2853    0.0209 C   0  0  0

+    3.7845    0.9088    0.0445 C   0  0  0

+    3.9124   -0.4789    0.0465 C   0  0  0

+   -2.4163    1.9674    0.0000 H   0  0  0

+   -4.3241    1.6405    0.0000 H   0  0  0

+   -5.6865    1.0673    0.0000 H   0  0  0

+   -5.1133   -0.2951    0.0000 H   0  0  0

+   -0.0105    2.3027    0.0000 H   0  0  0

+   -1.5925   -1.6087    0.0000 H   0  0  0

+    2.4731    2.5385    0.0000 H   0  0  0

+    2.9301   -2.3243    0.0000 H   0  0  0

+    4.6424    1.5059    0.0000 H   0  0  0

+    4.8658   -0.9072    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  2  2  0

+  6  3  2  0

+  7  3  1  0

+  8  6  1  0

+  9  7  2  0

+ 10  8  2  0

+ 11  8  1  0

+ 12 10  1  0

+ 13 11  2  0

+ 14 12  2  0

+  9 10  1  0

+ 13 14  1  0

+  1 15  1  0

+  4 16  1  0

+  4 17  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98-85-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.1969   -0.1738   -0.1173 C   0  0  0

+    0.6704   -1.2157   -0.3864 C   0  0  0

+    0.3003    1.0588    0.2633 C   0  0  0

+   -1.6844   -0.3796   -0.2446 C   0  0  0

+    2.0353   -1.0253   -0.2752 C   0  0  0

+    1.6648    1.2492    0.3745 C   0  0  0

+   -2.2495   -0.8578    1.0944 C   0  0  0

+   -2.3062    0.8537   -0.6109 O   0  0  0

+    2.5324    0.2070    0.1052 C   0  0  0

+    0.3036   -2.1643    0.0000 H   0  0  0

+   -0.3257    1.8604    0.0000 H   0  0  0

+   -1.2698   -1.3083    0.0000 H   0  0  0

+    2.6613   -1.8269    0.0000 H   0  0  0

+    2.0316    2.1978    0.0000 H   0  0  0

+   -2.9065   -0.0814    0.0000 H   0  0  0

+   -3.0259   -1.5148    0.0000 H   0  0  0

+   -1.5925   -1.6342    0.0000 H   0  0  0

+   -2.7641    1.7619    0.0000 H   0  0  0

+    3.5372    0.3644    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  4  7  1  0

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+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2417-77-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.6790    1.2057    0.3436 C   0  0  0

+    0.0301   -0.0001    0.6015 C   0  0  0

+    2.0422    1.2093   -0.1974 C   0  0  0

+    0.0436    2.4422    0.5889 C   0  0  0

+    0.6849   -1.2030    0.3421 C   0  0  0

+   -1.3708   -0.0038    1.1569 C   0  0  0

+    2.6974    0.0070   -0.4560 C   0  0  0

+    2.6696    2.4490   -0.4474 C   0  0  0

+    0.7043    3.5985    0.3260 C   0  0  0

+    2.0481   -1.1993   -0.1989 C   0  0  0

+    0.0581   -2.4425    0.5918 C   0  0  0

+   -2.6631   -0.0063   -0.3246 Br  0  0  0

+    2.0032    3.6019   -0.1839 C   0  0  0

+    2.6817   -2.4352   -0.4494 C   0  0  0

+    0.7248   -3.5955    0.3282 C   0  0  0

+    2.0213   -3.5920   -0.1864 C   0  0  0

+   -0.9808    2.4650    0.0000 H   0  0  0

+   -1.8812   -0.8923    0.0000 H   0  0  0

+   -0.8563   -0.8900    0.0000 H   0  0  0

+    3.7221    0.0097    0.0000 H   0  0  0

+    3.6939    2.4775    0.0000 H   0  0  0

+    0.1888    4.4841    0.0000 H   0  0  0

+   -0.9662   -2.4712    0.0000 H   0  0  0

+    2.5141    4.4901    0.0000 H   0  0  0

+    3.7061   -2.4583    0.0000 H   0  0  0

+    0.2140   -4.4837    0.0000 H   0  0  0

+    2.5370   -4.4774    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  2  0

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+ 14 16  1  0

+  7 10  1  0

+  9 13  1  0

+ 15 16  2  0

+  4 17  1  0

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+  6 19  1  0

+  7 20  1  0

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+  9 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3333-66-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    0.4130    0.7302    0.0035 C   0  0  0

+   -0.0328   -0.6163    0.0018 C   0  0  0

+    1.8606    0.9946    0.0025 C   0  0  0

+   -0.4418    1.7418    0.0004 N   0  0  0

+   -1.4016   -0.8983    0.0025 C   0  0  0

+    0.9369   -1.7087   -0.0012 C   0  0  0

+    2.7633   -0.0888    0.0000 C   0  0  0

+    2.3498    2.3026    0.0036 C   0  0  0

+   -1.7577    1.5446   -0.0046 C   0  0  0

+   -2.2940    0.1812    0.0053 C   0  0  0

+   -1.9779   -2.5358   -0.0007 Cl  0  0  0

+    2.2612   -1.4595   -0.0020 C   0  0  0

+    0.4493   -3.1347   -0.0028 C   0  0  0

+    4.1413    0.1675   -0.0009 C   0  0  0

+    3.6987    2.5214    0.0022 C   0  0  0

+   -2.6637    2.6226   -0.0079 C   0  0  0

+   -3.6878   -0.0067    0.0066 C   0  0  0

+    3.2353   -2.6094   -0.0045 C   0  0  0

+    4.5905    1.4565    0.0006 C   0  0  0

+   -4.0005    2.3759   -0.0130 C   0  0  0

+   -4.5080    1.0783    0.0098 C   0  0  0

+    1.6835    3.1152    0.0000 H   0  0  0

+   -0.5450   -2.7947    0.0000 H   0  0  0

+    0.1093   -4.1290    0.0000 H   0  0  0

+    1.4436   -3.4747    0.0000 H   0  0  0

+    4.8260   -0.6296    0.0000 H   0  0  0

+    4.0654    3.5062    0.0000 H   0  0  0

+   -2.3086    3.6116    0.0000 H   0  0  0

+   -4.0919   -0.9767    0.0000 H   0  0  0

+    2.4335   -3.2886    0.0000 H   0  0  0

+    3.9145   -3.4112    0.0000 H   0  0  0

+    4.0371   -1.9302    0.0000 H   0  0  0

+    5.6242    1.6456    0.0000 H   0  0  0

+   -4.6696    3.1862    0.0000 H   0  0  0

+   -5.5490    0.9345    0.0000 H   0  0  0

+  1  2  2  0

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+  1  4  1  0

+  2  5  1  0

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+ 14 19  2  0

+ 16 20  2  0

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+  7 12  1  0

+  9 10  1  0

+ 15 19  1  0

+ 20 21  1  0

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+ 15 27  1  0

+ 16 28  1  0

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+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+619-72-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.9517    0.0001    0.0038 C   0  0  0

+   -0.2629   -1.2002    0.0040 C   0  0  0

+   -0.2632    1.2000    0.0020 C   0  0  0

+   -2.4317    0.0000   -0.0008 N   0  3  0

+    1.1163   -1.2075    0.0024 C   0  0  0

+    1.1165    1.2073    0.0004 C   0  0  0

+   -3.0407    1.0549   -0.0009 O   0  0  0

+   -3.0407   -1.0548   -0.0043 O   0  5  0

+    1.8177    0.0001    0.0006 C   0  0  0

+    3.2497    0.0001   -0.0015 C   0  0  0

+    4.3857    0.0001   -0.0032 N   0  0  0

+   -0.7852   -2.0967    0.0000 H   0  0  0

+   -0.7855    2.0965    0.0000 H   0  0  0

+    1.6315   -2.1081    0.0000 H   0  0  0

+    1.6317    2.1079    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

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+ 10 11  3  0

+  6  9  2  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+111-40-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.0000   -0.5205    0.0000 N   0  0  0

+   -1.1786    0.3564    0.0000 C   0  0  0

+    1.1786    0.3564    0.0000 C   0  0  0

+   -2.4488   -0.4965    0.0000 C   0  0  0

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+   -3.6274    0.3804    0.0000 N   0  0  0

+    3.6274    0.3804    0.0000 N   0  0  0

+    0.0000   -1.6223    0.0000 H   0  0  0

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+    0.4252    1.1603    0.0000 H   0  0  0

+   -3.2022   -1.3004    0.0000 H   0  0  0

+   -1.7352   -1.3359    0.0000 H   0  0  0

+    1.7352   -1.3359    0.0000 H   0  0  0

+    3.2022   -1.3004    0.0000 H   0  0  0

+   -3.4998    1.4748    0.0000 H   0  0  0

+   -4.6389   -0.0563    0.0000 H   0  0  0

+    4.6389   -0.0563    0.0000 H   0  0  0

+    3.4998    1.4748    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

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+  4 13  1  0

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+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+930-55-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.2432   -0.2522    0.0329 N   0  0  0

+   -0.8573   -1.2250   -0.0303 C   0  0  0

+   -0.3247    1.0904    0.2525 C   0  0  0

+    1.4982   -0.5285   -0.0795 N   0  0  0

+   -2.1746   -0.4379    0.1333 C   0  0  0

+   -1.7741    1.0010   -0.2868 C   0  0  0

+    2.3264    0.3620   -0.0108 O   0  0  0

+   -1.5114   -2.1011    0.0000 H   0  0  0

+   -0.0530   -1.9656    0.0000 H   0  0  0

+    0.7238    1.4002    0.0000 H   0  0  0

+   -0.5145    2.1671    0.0000 H   0  0  0

+   -3.1976   -0.0522    0.0000 H   0  0  0

+   -2.6497   -1.4226    0.0000 H   0  0  0

+   -1.7201    2.0930    0.0000 H   0  0  0

+   -2.8534    1.1757    0.0000 H   0  0  0

+  1  2  1  0

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+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+613-35-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+    0.7411    0.4909    0.0822 C   0  0  0

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+   -3.5105    0.5051   -0.0541 C   0  0  0

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+    5.5884   -0.6422   -0.1103 C   0  0  0

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+ 17 32  1  0

+ 17 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+498-21-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.7041   -0.8642   -0.3360 C   0  0  0

+   -0.6484   -1.0938    0.3414 C   0  0  0

+    1.2859    0.4439    0.1346 C   0  0  0

+    1.6563   -2.0057    0.0265 C   0  0  0

+   -1.6343   -0.0620   -0.1428 C   0  0  0

+    0.6808    1.1228    0.9301 O   0  0  0

+    2.4763    0.8547   -0.3300 O   0  0  0

+   -1.3278    0.6956   -1.0327 O   0  0  0

+   -2.8529    0.0155    0.4147 O   0  0  0

+    0.0990   -0.0849    0.0000 H   0  0  0

+   -1.4820   -1.6217    0.0000 H   0  0  0

+   -0.2950   -2.0150    0.0000 H   0  0  0

+    0.8986   -2.6377    0.0000 H   0  0  0

+    2.2883   -2.7634    0.0000 H   0  0  0

+    2.4140   -1.3737    0.0000 H   0  0  0

+    3.4090    1.1766    0.0000 H   0  0  0

+   -3.8376    0.0781    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  3  2  0

+  7  3  1  0

+  8  5  2  0

+  9  5  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  4 13  1  0

+  4 14  1  0

+  4 15  1  0

+  7 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2461-18-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 47                          1 V2000

+   -7.2249    0.3813   -0.2829 C   0  0  0

+   -8.4406   -0.5437   -0.1974 C   0  0  0

+   -7.9992    0.2439    0.9103 O   0  0  0

+   -5.9444   -0.4466   -0.1580 C   0  0  0

+   -4.8089    0.4174   -0.2379 O   0  0  0

+   -3.6506   -0.4105   -0.1155 C   0  0  0

+   -2.3930    0.4574   -0.1933 C   0  0  0

+   -1.1528   -0.4289   -0.0623 C   0  0  0

+    0.1048    0.4390   -0.1401 C   0  0  0

+    1.3451   -0.4474   -0.0091 C   0  0  0

+    2.6027    0.4205   -0.0870 C   0  0  0

+    3.8429   -0.4658    0.0440 C   0  0  0

+    5.1005    0.4021   -0.0338 C   0  0  0

+    6.3407   -0.4843    0.0972 C   0  0  0

+    7.5983    0.3836    0.0194 C   0  0  0

+    8.8385   -0.5028    0.1504 C   0  0  0

+   10.0962    0.3651    0.0726 C   0  0  0

+   -6.9987    1.5021    0.0000 H   0  0  0

+   -9.5752   -0.4026    0.0000 H   0  0  0

+   -8.1430   -1.6476    0.0000 H   0  0  0

+   -6.6717   -1.3288    0.0000 H   0  0  0

+   -5.1518   -1.2707    0.0000 H   0  0  0

+   -4.4181   -1.2580    0.0000 H   0  0  0

+   -2.8972   -1.2705    0.0000 H   0  0  0

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+   -3.1465    1.3174    0.0000 H   0  0  0

+   -1.9203   -1.2764    0.0000 H   0  0  0

+   -0.3993   -1.2889    0.0000 H   0  0  0

+    0.8723    1.2865    0.0000 H   0  0  0

+   -0.6487    1.2990    0.0000 H   0  0  0

+    0.5776   -1.2949    0.0000 H   0  0  0

+    2.0986   -1.3074    0.0000 H   0  0  0

+    3.3702    1.2680    0.0000 H   0  0  0

+    1.8492    1.2805    0.0000 H   0  0  0

+    3.0754   -1.3133    0.0000 H   0  0  0

+    4.5964   -1.3258    0.0000 H   0  0  0

+    5.8680    1.2496    0.0000 H   0  0  0

+    4.3470    1.2621    0.0000 H   0  0  0

+    5.5732   -1.3318    0.0000 H   0  0  0

+    7.0942   -1.3443    0.0000 H   0  0  0

+    8.3658    1.2311    0.0000 H   0  0  0

+    6.8448    1.2436    0.0000 H   0  0  0

+    8.0710   -1.3503    0.0000 H   0  0  0

+    9.5919   -1.3628    0.0000 H   0  0  0

+   10.7456   -0.5759    0.0000 H   0  0  0

+   11.0372    1.0145    0.0000 H   0  0  0

+    9.4468    1.3061    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  1  0

+  9 10  1  0

+ 10 11  1  0

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+ 12 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+  2  3  1  0

+  1 18  1  0

+  2 19  1  0

+  2 20  1  0

+  4 21  1  0

+  4 22  1  0

+  6 23  1  0

+  6 24  1  0

+  7 25  1  0

+  7 26  1  0

+  8 27  1  0

+  8 28  1  0

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+ 16 43  1  0

+ 16 44  1  0

+ 17 45  1  0

+ 17 46  1  0

+ 17 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21466-07-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.6093   -0.4811   -0.3237 C   0  0  0

+   -0.8710   -0.4164   -0.2657 C   0  0  0

+    1.3718    0.6661   -0.0869 C   0  0  0

+    1.2462   -1.6871   -0.6090 C   0  0  0

+   -1.5753    0.3771   -1.1763 C   0  0  0

+   -1.5662   -1.1503    0.6926 C   0  0  0

+    2.7553    0.5969   -0.1426 C   0  0  0

+    0.7591    1.8453    0.1975 O   0  0  0

+    2.6250   -1.7426   -0.6615 C   0  0  0

+   -2.9588    0.4317   -1.1155 C   0  0  0

+   -0.9056    1.0920   -2.1181 O   0  0  0

+   -2.9451   -1.0873    0.7426 C   0  0  0

+    3.3776   -0.6034   -0.4321 C   0  0  0

+    3.7923    2.1457    0.1769 Br  0  0  0

+    0.8128    2.0237    1.7967 P   0  0  0

+    3.4880   -3.3802   -1.0481 Br  0  0  0

+   -3.6395   -0.2972   -0.1570 C   0  0  0

+   -3.9169    1.5030   -2.3444 Br  0  0  0

+   -3.8875   -2.0847    2.0438 Br  0  0  0

+    0.2748    3.4889    2.1915 O   0  0  0

+   -0.1139    0.9062    2.4928 O   0  0  0

+    2.2085    1.8682    2.2639 O   0  0  0

+    0.6952   -2.5610    0.0000 H   0  0  0

+   -1.1797   -2.1084    0.0000 H   0  0  0

+   -0.1993    1.8460    0.0000 H   0  0  0

+    4.4093   -0.6579    0.0000 H   0  0  0

+   -4.6725   -0.2816    0.0000 H   0  0  0

+   -0.0813    4.4587    0.0000 H   0  0  0

+   -0.7734    0.1109    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  2  0

+  7 14  1  0

+  8 15  1  0

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+  9 13  1  0

+ 12 17  2  0

+  4 23  1  0

+  6 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 17 27  1  0

+ 20 28  1  0

+ 21 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18024-11-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+    0.4122   -0.7001   -0.0023 C   0  0  0

+   -1.0556   -0.5597   -0.0015 C   0  0  0

+    0.9364    0.6010   -0.0007 C   0  0  0

+    1.2703   -1.7974    0.0009 C   0  0  0

+   -1.3235    0.8175    0.0005 C   0  0  0

+   -2.1059   -1.4740   -0.0027 C   0  0  0

+   -0.1181    1.4964    0.0009 N   0  0  0

+    2.3166    0.7798   -0.0011 C   0  0  0

+    2.6342   -1.6001   -0.0011 C   0  0  0

+    0.7088   -3.1959    0.0069 C   0  0  0

+   -2.6444    1.2548    0.0013 C   0  0  0

+   -3.4080   -1.0215   -0.0019 C   0  0  0

+    0.0216    2.9548    0.0033 C   0  0  0

+    3.1540   -0.3147   -0.0029 C   0  0  0

+    2.8957    2.1711    0.0001 C   0  0  0

+   -3.6745    0.3388    0.0000 C   0  0  0

+   -1.9079   -2.4987    0.0000 H   0  0  0

+    3.2783   -2.4213    0.0000 H   0  0  0

+   -0.2597   -2.8070    0.0000 H   0  0  0

+    0.3199   -4.1644    0.0000 H   0  0  0

+    1.6773   -3.5848    0.0000 H   0  0  0

+   -2.8554    2.2769    0.0000 H   0  0  0

+   -4.1961   -1.7057    0.0000 H   0  0  0

+    1.0605    2.8553    0.0000 H   0  0  0

+    0.1211    3.9937    0.0000 H   0  0  0

+   -1.0173    3.0543    0.0000 H   0  0  0

+    4.1883   -0.1748    0.0000 H   0  0  0

+    3.8592    1.7700    0.0000 H   0  0  0

+    3.2968    3.1346    0.0000 H   0  0  0

+    1.9322    2.5722    0.0000 H   0  0  0

+   -4.6635    0.6723    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

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+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

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+  5  7  1  0

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+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+161696-98-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.6822    0.4747   -0.0024 C   0  0  0

+   -0.9612   -0.9161   -0.0012 C   0  0  0

+    0.6524    0.9100   -0.0017 C   0  0  0

+   -1.6934    1.3512    0.0015 N   0  0  0

+    0.1027   -1.8367    0.0006 C   0  0  0

+   -2.2315   -1.3334   -0.0014 N   0  0  0

+    1.6702   -0.0183    0.0000 C   0  0  0

+    0.9696    2.3832   -0.0025 C   0  0  0

+   -2.9328    0.9153    0.0063 C   0  0  0

+    1.3858   -1.3905    0.0011 C   0  0  0

+   -3.2068   -0.4534   -0.0026 C   0  0  0

+    2.9968    0.4117    0.0002 N   0  0  0

+    4.0848   -0.5693    0.0020 C   0  0  0

+   -0.0942   -2.8644    0.0000 H   0  0  0

+    1.9926    2.1629    0.0000 H   0  0  0

+    1.1899    3.4062    0.0000 H   0  0  0

+   -0.0534    2.6035    0.0000 H   0  0  0

+   -3.7229    1.6014    0.0000 H   0  0  0

+    2.1723   -2.0807    0.0000 H   0  0  0

+   -4.2002   -0.7821    0.0000 H   0  0  0

+    3.2151    1.4351    0.0000 H   0  0  0

+    3.3841   -1.3464    0.0000 H   0  0  0

+    4.8619   -1.2700    0.0000 H   0  0  0

+    4.7855    0.2078    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

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+  7 12  1  0

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+  7 10  1  0

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+  5 14  1  0

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+  8 16  1  0

+  8 17  1  0

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+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+138835-34-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+    0.4166    0.2538    0.0012 C   0  0  0

+   -0.9147    0.6992    0.0153 C   0  0  0

+    1.4694    1.1893    0.0149 C   0  0  0

+    0.7148   -1.1781   -0.0216 C   0  0  0

+   -1.9726   -0.2368    0.0021 C   0  0  0

+   -1.1810    2.0877    0.0433 C   0  0  0

+    2.8302    0.6563   -0.0005 C   0  0  0

+    1.1823    2.5632    0.0427 C   0  0  0

+    1.9715   -1.5909   -0.0347 N   0  3  0

+   -0.4044   -2.1205   -0.0297 C   0  0  0

+   -3.2870    0.2348    0.0166 C   0  0  0

+   -1.6776   -1.6666   -0.0259 C   0  0  0

+   -0.1036    3.0018    0.0560 C   0  0  0

+   -2.5130    2.5184    0.0571 C   0  0  0

+    3.0123   -0.7504   -0.0279 C   0  0  0

+    3.9427    1.5031    0.0108 C   0  0  0

+    2.2263   -2.9836   -0.0562 O   0  5  0

+   -3.5378    1.5949    0.0435 C   0  0  0

+   -4.4158   -0.7240    0.0027 N   0  3  0

+    4.3260   -1.2598   -0.0427 C   0  0  0

+    5.1988    0.9721   -0.0045 C   0  0  0

+   -5.3493   -0.5547   -0.7611 O   0  0  0

+   -4.4105   -1.6819    0.7550 O   0  5  0

+    5.3861   -0.4075   -0.0306 C   0  0  0

+    1.9699    3.2596    0.0000 H   0  0  0

+   -0.2175   -3.1551    0.0000 H   0  0  0

+   -2.4708   -2.3566    0.0000 H   0  0  0

+   -0.2995    4.0347    0.0000 H   0  0  0

+   -2.7325    3.5465    0.0000 H   0  0  0

+    3.8113    2.5462    0.0000 H   0  0  0

+   -4.5332    1.9331    0.0000 H   0  0  0

+    4.4869   -2.2987    0.0000 H   0  0  0

+    6.0339    1.6108    0.0000 H   0  0  0

+    6.3627   -0.7968    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+  8 13  2  0

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+ 14 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 24 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6358-07-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.3916    0.5413    0.0031 C   0  0  0

+   -0.2960   -0.8390    0.0015 C   0  0  0

+    0.7530    1.3172    0.0028 C   0  0  0

+   -1.7226    1.1891   -0.0010 N   0  3  0

+    0.9453   -1.4491   -0.0008 C   0  0  0

+   -1.7370   -1.8071    0.0019 Cl  0  0  0

+    1.9995    0.7135    0.0009 C   0  0  0

+   -1.8085    2.4041    0.0003 O   0  0  0

+   -2.7318    0.5072   -0.0058 O   0  5  0

+    2.0973   -0.6761   -0.0012 C   0  0  0

+    3.1260    1.4761    0.0010 O   0  0  0

+    3.3546   -1.2909   -0.0040 N   0  0  0

+    0.6779    2.3527    0.0000 H   0  0  0

+    1.0149   -2.4850    0.0000 H   0  0  0

+    3.9857    2.0581    0.0000 H   0  0  0

+    3.4260   -2.3267    0.0000 H   0  0  0

+    4.2159   -0.7112    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  7 11  1  0

+ 10 12  1  0

+  7 10  2  0

+  3 13  1  0

+  5 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 12 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-99-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -0.4475   -0.4790    0.0737 C   0  0  0

+   -1.7687   -0.0072   -0.3618 N   0  0  0

+    0.6299    0.4809   -0.4350 C   0  0  0

+   -2.7519   -0.9676    0.1566 C   0  0  0

+   -2.0132    1.2638    0.3329 C   0  0  0

+    2.2516   -0.0982    0.0995 Cl  0  0  0

+   -0.9608   -1.3975    0.0000 H   0  0  0

+    0.3731   -1.1376    0.0000 H   0  0  0

+    1.1432    1.3994    0.0000 H   0  0  0

+   -0.1907    1.1395    0.0000 H   0  0  0

+   -3.4871   -0.2149    0.0000 H   0  0  0

+   -3.5046   -1.7028    0.0000 H   0  0  0

+   -2.0167   -1.7203    0.0000 H   0  0  0

+   -0.9800    1.4626    0.0000 H   0  0  0

+   -2.2120    2.2970    0.0000 H   0  0  0

+   -3.0464    1.0650    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-63-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.4627   -0.2729    0.0023 C   0  0  0

+    0.4782   -1.2946    0.0012 C   0  0  0

+   -0.0448    1.0521    0.0015 C   0  0  0

+   -1.8259   -0.5769   -0.0017 N   0  0  0

+    1.8256   -0.9904   -0.0006 C   0  0  0

+    1.3037    1.3491   -0.0003 C   0  0  0

+   -2.7500    0.4291   -0.0006 N   0  0  0

+    2.2380    0.3293   -0.0014 C   0  0  0

+    0.1695   -2.2847    0.0000 H   0  0  0

+   -0.7449    1.8173    0.0000 H   0  0  0

+   -2.1366   -1.5664    0.0000 H   0  0  0

+    2.5287   -1.7528    0.0000 H   0  0  0

+    1.6163    2.3380    0.0000 H   0  0  0

+   -2.4393    1.4186    0.0000 H   0  0  0

+   -3.7623    0.2034    0.0000 H   0  0  0

+    3.2503    0.5550    0.0000 H   0  0  0

+  1  2  2  0

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+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+131-53-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    0.5747    0.5213   -0.1058 C   0  0  0

+   -0.7893    1.0731   -0.1605 C   0  0  0

+    1.6850    1.3798   -0.1507 C   0  0  0

+    0.7701   -0.8604   -0.0030 C   0  0  0

+   -1.9487    0.1659   -0.2555 C   0  0  0

+   -0.9601    2.2772   -0.1273 O   0  0  0

+    2.9629    0.8495   -0.0981 C   0  0  0

+    1.5066    2.7213   -0.2447 O   0  0  0

+    2.0353   -1.3706    0.0481 C   0  0  0

+   -2.6195   -0.2452    0.9051 C   0  0  0

+   -2.3886   -0.2843   -1.5034 C   0  0  0

+    3.1387   -0.5232   -0.0015 C   0  0  0

+   -3.7086   -1.0979    0.8036 C   0  0  0

+   -2.2049    0.1888    2.1216 O   0  0  0

+   -3.4722   -1.1310   -1.5852 C   0  0  0

+    4.3917   -1.0418    0.0496 O   0  0  0

+   -4.1291   -1.5391   -0.4353 C   0  0  0

+    4.2479   -2.4604    0.1454 C   0  0  0

+   -0.0422   -1.4960    0.0000 H   0  0  0

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+   -4.4016   -0.3341    0.0000 H   0  0  0

+   -1.4925    0.9346    0.0000 H   0  0  0

+   -2.8817   -1.9766    0.0000 H   0  0  0

+   -4.9293   -2.1898    0.0000 H   0  0  0

+    3.2218   -2.3564    0.0000 H   0  0  0

+    4.1439   -3.4865    0.0000 H   0  0  0

+    5.2740   -2.5644    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 27  1  0

+ 18 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91-68-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+    0.1993    0.1526    0.1464 C   0  0  0

+    1.5583   -0.1010   -0.0523 N   0  0  0

+   -0.7532   -0.5717   -0.5575 C   0  0  0

+   -0.2014    1.1262    1.0530 C   0  0  0

+    2.3139   -0.8659    0.9429 C   0  0  0

+    2.2282    0.3978   -1.2559 C   0  0  0

+   -2.1006   -0.3174   -0.3572 C   0  0  0

+   -1.5457    1.3766    1.2497 C   0  0  0

+    2.0258   -2.3580    0.7655 C   0  0  0

+    2.5547    1.8822   -1.0797 C   0  0  0

+   -2.4949    0.6602    0.5460 C   0  0  0

+   -3.0355   -1.0244   -1.0450 O   0  0  0

+   -0.5477   -1.4425    0.0000 H   0  0  0

+    0.3627    1.8206    0.0000 H   0  0  0

+    3.1411   -1.2069    0.0000 H   0  0  0

+    2.8126   -0.1231    0.0000 H   0  0  0

+    2.5388   -0.4412    0.0000 H   0  0  0

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+    2.7469    2.7560    0.0000 H   0  0  0

+    1.6809    2.0744    0.0000 H   0  0  0

+   -3.3571    0.8992    0.0000 H   0  0  0

+   -3.7491   -1.5640    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23043-60-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -1.0608    0.2168   -0.0027 C   0  0  0

+   -0.8458   -1.1864   -0.0018 C   0  0  0

+    0.0435    1.0867   -0.0024 C   0  0  0

+   -2.3802    0.7204    0.0020 C   0  0  0

+    0.3903   -1.6853   -0.0003 N   0  0  0

+   -1.9606   -2.0477   -0.0020 C   0  0  0

+    1.3320    0.5134   -0.0013 C   0  0  0

+   -0.1273    2.4543   -0.0028 N   0  0  0

+   -3.4414   -0.1611    0.0075 C   0  0  0

+   -2.6075    2.0919    0.0017 N   0  0  0

+    1.4662   -0.8996    0.0000 C   0  0  0

+   -3.2210   -1.5351   -0.0032 C   0  0  0

+    2.4814    1.3210   -0.0004 C   0  0  0

+    2.7598   -1.4599    0.0017 C   0  0  0

+    3.7126    0.7410    0.0013 C   0  0  0

+    3.8492   -0.6468    0.0029 C   0  0  0

+   -1.8192   -3.0829    0.0000 H   0  0  0

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+   -4.0388   -2.1854    0.0000 H   0  0  0

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+    2.8809   -2.4976    0.0000 H   0  0  0

+    4.5663    1.3432    0.0000 H   0  0  0

+    4.8050   -1.0688    0.0000 H   0  0  0

+  1  2  2  0

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+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-00-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.1745   -0.2281   -0.2194 C   0  0  0

+    0.7266   -1.1840    0.0702 C   0  0  0

+    0.4506    0.9606   -0.2122 O   0  0  0

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+    1.7492    0.7818    0.0798 C   0  0  0

+   -2.4262    0.2530    0.4492 O   0  0  0

+    0.5617   -2.1697    0.0000 H   0  0  0

+   -2.4543   -1.0276    0.0000 H   0  0  0

+   -1.2631   -1.3808    0.0000 H   0  0  0

+    2.8615   -0.9781    0.0000 H   0  0  0

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+  1  2  2  0

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+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+133331-34-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 85 89                          1 V2000

+   -1.6521   -1.2519   -0.3449 C   0  0  0

+   -2.2928    0.0667   -0.7383 C   0  0  2

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+ 36 85  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-56-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+    0.2842   -0.0203   -0.5839 C   0  0  0

+   -0.8068   -0.8066    0.1458 C   0  0  0

+   -0.7753    0.6220    0.1282 O   0  0  0

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+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98046-74-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.3629   -0.8152    0.0333 C   0  0  0

+   -1.7424   -0.7802    0.0305 N   0  0  0

+    0.0639    0.5258   -0.0218 C   0  0  0

+    0.5253   -1.7958    0.0795 N   0  0  0

+   -2.1180    0.5393   -0.0245 C   0  0  0

+   -2.6856   -1.7668    0.0700 C   0  0  0

+   -1.0348    1.3016   -0.0550 N   0  0  0

+    1.4390    0.7992   -0.0317 C   0  0  0

+    1.8192   -1.5528    0.0694 C   0  0  0

+   -3.4909    0.8698   -0.0402 C   0  0  0

+   -4.0003   -1.4640    0.0557 C   0  0  0

+    2.3110   -0.2570    0.0128 C   0  0  0

+    1.9448    2.2175   -0.0904 C   0  0  0

+   -4.4178   -0.1236   -0.0007 C   0  0  0

+   -3.9247    2.3117   -0.1008 C   0  0  0

+    3.7714   -0.0160    0.0039 N   0  3  0

+    4.4406   -0.3662   -0.9517 O   0  0  0

+    4.3040    0.5324    0.9521 O   0  5  0

+   -2.3909   -2.7517    0.0000 H   0  0  0

+    2.4790   -2.3412    0.0000 H   0  0  0

+   -4.6993   -2.2179    0.0000 H   0  0  0

+    2.9132    1.8722    0.0000 H   0  0  0

+    2.2901    3.1859    0.0000 H   0  0  0

+    0.9764    2.5628    0.0000 H   0  0  0

+   -5.4201    0.1052    0.0000 H   0  0  0

+   -2.9402    2.6079    0.0000 H   0  0  0

+   -4.2209    3.2962    0.0000 H   0  0  0

+   -4.9092    2.0155    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+  8 13  1  0

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+ 10 15  1  0

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+ 16 17  2  0

+ 16 18  1  0

+  5  7  2  0

+  9 12  1  0

+ 11 14  1  0

+  6 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+557-48-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    0.8149    0.3259   -0.3724 C   0  0  0

+   -0.3968    1.1538    0.0603 C   0  0  0

+    2.0644    0.9080    0.2366 C   0  0  0

+   -1.6463    0.5717   -0.5487 C   0  0  0

+    3.0323    0.1167    0.6279 C   0  0  0

+   -2.6318    0.1358    0.2386 C   0  0  0

+    3.7206   -0.7811   -0.3677 C   0  0  0

+   -3.8445   -0.4292   -0.3524 C   0  0  0

+    5.2024   -0.9018   -0.0063 C   0  0  0

+   -4.7404   -0.8255    0.3633 O   0  0  0

+    0.1108   -0.3889    0.0000 H   0  0  0

+    1.3934   -0.4940    0.0000 H   0  0  0

+    0.3073    1.8686    0.0000 H   0  0  0

+   -0.9753    1.9737    0.0000 H   0  0  0

+    2.1892    1.9036    0.0000 H   0  0  0

+   -1.2315   -0.3419    0.0000 H   0  0  0

+    3.7528    0.8150    0.0000 H   0  0  0

+   -3.0466    1.0494    0.0000 H   0  0  0

+    2.7999   -1.1801    0.0000 H   0  0  0

+    3.8843   -1.7711    0.0000 H   0  0  0

+   -3.4297   -1.3428    0.0000 H   0  0  0

+    5.1209   -1.9019    0.0000 H   0  0  0

+    6.2025   -0.9833    0.0000 H   0  0  0

+    5.2839    0.0983    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  2  0

+  4  6  2  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  2  0

+  1 11  1  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+  9 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+28289-54-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.3125   -0.0098    0.0289 C   0  0  0

+   -1.1654   -0.0029    0.0032 C   0  0  0

+    1.0389    1.1285    0.6939 C   0  0  0

+    0.9586   -1.0145   -0.5259 C   0  0  0

+   -1.8812   -1.0418    0.5989 C   0  0  0

+   -1.8506    1.0457   -0.6120 C   0  0  0

+    2.4973    0.7280    0.9324 C   0  0  0

+    2.4569   -1.1056   -0.5433 C   0  0  0

+   -3.2609   -1.0292    0.5718 C   0  0  0

+   -3.2300    1.0464   -0.6321 C   0  0  0

+    3.0580    0.2160   -0.3266 N   0  0  0

+   -3.9340    0.0104   -0.0441 C   0  0  0

+    4.4907   -0.0072   -0.0907 C   0  0  0

+    1.4072    2.0836    0.0000 H   0  0  0

+    0.1253    1.5903    0.0000 H   0  0  0

+    0.4411   -1.8977    0.0000 H   0  0  0

+   -1.4092   -1.9502    0.0000 H   0  0  0

+   -1.3632    1.9459    0.0000 H   0  0  0

+    3.4125    1.1866    0.0000 H   0  0  0

+    2.3969    1.7467    0.0000 H   0  0  0

+    2.2708   -2.1122    0.0000 H   0  0  0

+    3.4334   -1.4128    0.0000 H   0  0  0

+   -3.7541   -1.9262    0.0000 H   0  0  0

+   -3.7088    1.9512    0.0000 H   0  0  0

+   -4.9576    0.0218    0.0000 H   0  0  0

+    4.3331   -1.0186    0.0000 H   0  0  0

+    5.5021   -0.1648    0.0000 H   0  0  0

+    4.6483    1.0042    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  9 12  2  0

+ 11 13  1  0

+  8 11  1  0

+ 10 12  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

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+  9 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+63041-76-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.6025   -0.2039   -0.0012 C   0  0  0

+   -1.9860    0.0475   -0.0010 C   0  0  0

+    0.3035    0.8717    0.0003 C   0  0  0

+   -0.1153   -1.5840    0.0030 C   0  0  0

+   -2.4495    1.3834    0.0002 C   0  0  0

+   -2.9022   -1.0277   -0.0026 C   0  0  0

+    1.7347    0.5754    0.0000 C   0  0  0

+   -0.1819    2.1929    0.0025 C   0  0  0

+    1.2473   -1.8315    0.0024 C   0  0  0

+   -1.0903   -2.6753    0.0075 C   0  0  0

+   -1.5152    2.4433    0.0008 C   0  0  0

+   -3.8291    1.6217    0.0005 C   0  0  0

+   -2.4135   -2.4043   -0.0039 C   0  0  0

+   -4.2702   -0.7474   -0.0023 C   0  0  0

+    2.1709   -0.7734   -0.0017 C   0  0  0

+    2.6808    1.6077    0.0010 C   0  0  0

+   -4.7130    0.5629   -0.0006 C   0  0  0

+    3.5541   -1.0427   -0.0024 C   0  0  0

+    4.0108    1.3092    0.0003 C   0  0  0

+    4.4447   -0.0142   -0.0014 C   0  0  0

+    5.9221   -0.3113   -0.0016 C   0  0  0

+    0.4993    2.9980    0.0000 H   0  0  0

+    1.5958   -2.8269    0.0000 H   0  0  0

+   -0.7587   -3.6764    0.0000 H   0  0  0

+   -1.8583    3.4406    0.0000 H   0  0  0

+   -4.1928    2.6116    0.0000 H   0  0  0

+   -3.1056   -3.2001    0.0000 H   0  0  0

+   -4.9684   -1.5378    0.0000 H   0  0  0

+    2.3650    2.6139    0.0000 H   0  0  0

+   -5.7496    0.7567    0.0000 H   0  0  0

+    3.8983   -2.0396    0.0000 H   0  0  0

+    4.7199    2.0899    0.0000 H   0  0  0

+    5.7142   -1.3452    0.0000 H   0  0  0

+    6.9560   -0.5192    0.0000 H   0  0  0

+    6.1300    0.7226    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

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+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

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+ 20 21  1  0

+  8 11  2  0

+  9 15  1  0

+ 10 13  2  0

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+ 19 20  1  0

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+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 21 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+61421-83-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+    0.5745    0.0017   -0.7248 C   0  0  0

+    1.2005   -1.2069   -0.3586 C   0  0  0

+    1.2070    1.2060   -0.3570 C   0  0  0

+   -0.6132    0.0054   -1.4239 N   0  0  0

+    2.4266   -1.1688    0.3564 C   0  0  0

+    0.6279   -2.4459   -0.6909 C   0  0  0

+    2.4328    1.1603    0.3579 C   0  0  0

+    0.6409    2.4489   -0.6877 C   0  0  0

+   -1.8306    0.0053   -0.7347 C   0  0  0

+    2.9882   -0.0057    0.6834 N   0  0  0

+    3.0420   -2.3847    0.7164 C   0  0  0

+    1.2538   -3.5977   -0.3244 C   0  0  0

+    3.0549    2.3729    0.7196 C   0  0  0

+    1.2728    3.5965   -0.3197 C   0  0  0

+   -3.0277    0.0091   -1.4388 C   0  0  0

+   -1.8429   -0.0043    0.6545 C   0  0  0

+    2.4584   -3.5648    0.3771 C   0  0  0

+    2.4776    3.5562    0.3819 C   0  0  0

+   -4.2290    0.0090   -0.7575 C   0  0  0

+   -3.0447   -0.0044    1.3338 C   0  0  0

+   -4.2402    0.0052    0.6295 C   0  0  0

+   -5.4235    0.0051    1.2994 O   0  0  0

+   -0.6118    0.9254    0.0000 H   0  0  0

+   -0.2916   -2.4757    0.0000 H   0  0  0

+   -0.2785    2.4838    0.0000 H   0  0  0

+    3.9620   -2.3804    0.0000 H   0  0  0

+    0.7944   -4.3948    0.0000 H   0  0  0

+    3.9749    2.3636    0.0000 H   0  0  0

+    0.8180    4.3963    0.0000 H   0  0  0

+   -3.0263    0.9291    0.0000 H   0  0  0

+   -1.5436   -0.8743    0.0000 H   0  0  0

+    2.9544   -4.3397    0.0000 H   0  0  0

+    2.9781    4.3282    0.0000 H   0  0  0

+   -4.3788    0.9167    0.0000 H   0  0  0

+   -3.0484   -0.9244    0.0000 H   0  0  0

+   -6.3435    0.0050    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  2  0

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+  7 13  1  0

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+ 15 19  1  0

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+ 19 21  2  0

+ 21 22  1  0

+  7 10  2  0

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+ 14 18  1  0

+ 20 21  1  0

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+  8 25  1  0

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+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-14-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+   -1.3007   -0.1721    0.0000 C   0  0  0

+   -0.0409   -0.9336    0.0000 C   0  0  0

+   -2.2728    0.4156    0.0000 N   0  0  0

+    1.3528    0.2103    0.0000 Cl  0  0  0

+   -0.7152   -1.8078    0.0000 H   0  0  0

+    0.7515   -1.7024    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  3  0

+  2  4  1  0

+  2  5  1  0

+  2  6  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16664-45-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.2975   -0.3314   -0.0023 C   0  0  0

+   -1.1672   -0.3882   -0.0014 C   0  0  0

+    0.9276    0.9334   -0.0007 C   0  0  0

+    1.0743   -1.4915    0.0011 C   0  0  0

+   -1.8933    0.8241    0.0010 C   0  0  0

+   -1.8519   -1.6049   -0.0025 C   0  0  0

+    0.1440    2.1109    0.0021 C   0  0  0

+    2.3282    0.9993   -0.0015 C   0  0  0

+    2.4365   -1.3939    0.0007 C   0  0  0

+   -1.2032    2.0587    0.0020 C   0  0  0

+   -3.2948    0.7814    0.0018 C   0  0  0

+   -3.2177   -1.6130   -0.0012 C   0  0  0

+    3.0601   -0.1517   -0.0038 C   0  0  0

+    3.0223    2.3369   -0.0004 C   0  0  0

+    3.2731   -2.6473    0.0049 C   0  0  0

+   -3.9354   -0.4228    0.0003 C   0  0  0

+    0.6135   -2.4343    0.0000 H   0  0  0

+   -1.3195   -2.5092    0.0000 H   0  0  0

+    0.6215    3.0453    0.0000 H   0  0  0

+   -1.7516    2.9534    0.0000 H   0  0  0

+   -3.8488    1.6726    0.0000 H   0  0  0

+   -3.7310   -2.5283    0.0000 H   0  0  0

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+    3.9537    1.8536    0.0000 H   0  0  0

+    3.5056    3.2683    0.0000 H   0  0  0

+    2.0909    2.8202    0.0000 H   0  0  0

+    2.4003   -3.2299    0.0000 H   0  0  0

+    3.8557   -3.5201    0.0000 H   0  0  0

+    4.1459   -2.0647    0.0000 H   0  0  0

+   -4.9844   -0.4510    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 14 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98931-07-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+    0.9870    0.2693    0.3790 C   0  0  0

+   -0.0013    1.2581    0.4129 C   0  0  0

+    2.3692    0.4886    0.3848 C   0  0  0

+    0.7518   -1.1739    0.3219 C   0  0  0

+   -1.4165    0.7715    0.4164 C   0  0  2

+    0.4565    2.5363    0.4436 C   0  0  0

+    2.9353   -0.7501    0.3520 N   0  0  0

+    2.8064    1.8116    0.4189 C   0  0  0

+   -0.6713   -1.6749    0.2783 C   0  0  0

+    1.9535   -1.7290    0.3125 C   0  0  0

+   -1.5316   -0.5601   -0.3302 C   0  0  1

+   -2.3451    1.7973   -0.2326 C   0  0  0

+    1.8266    2.7949    0.4460 C   0  0  0

+    4.3769   -1.0111    0.3566 C   0  0  0

+   -2.9398   -0.9711   -0.3503 N   0  0  0

+   -3.7924    1.3082   -0.1290 C   0  0  2

+    4.8835   -1.0573   -1.0619 C   0  0  0

+   -3.9376   -0.0241   -0.8699 C   0  0  0

+   -3.3121   -2.1938    0.0997 C   0  0  0

+   -4.7271    2.3448   -0.7558 C   0  0  0

+    5.8032   -0.2121   -1.4568 C   0  0  0

+   -3.6243   -3.2189    0.4769 N   0  0  0

+   -2.4032    0.4393    0.0000 H   0  0  0

+   -0.2195    3.3281    0.0000 H   0  0  0

+    3.8195    2.0512    0.0000 H   0  0  0

+   -1.5583   -2.2200    0.0000 H   0  0  0

+   -0.2234   -2.6147    0.0000 H   0  0  0

+    2.1354   -2.7541    0.0000 H   0  0  0

+   -0.5327   -0.2669    0.0000 H   0  0  0

+   -1.4853    2.3844    0.0000 H   0  0  0

+   -2.8096    2.7290    0.0000 H   0  0  0

+    2.1346    3.7894    0.0000 H   0  0  0

+    3.7277   -1.8250    0.0000 H   0  0  0

+    4.7855   -1.9687    0.0000 H   0  0  0

+   -4.7830    0.9880    0.0000 H   0  0  0

+    5.2170   -2.0435    0.0000 H   0  0  0

+   -4.9240    0.3088    0.0000 H   0  0  0

+   -4.4750   -0.9158    0.0000 H   0  0  0

+   -3.9539    3.0420    0.0000 H   0  0  0

+   -5.4243    3.1180    0.0000 H   0  0  0

+   -5.5003    1.6476    0.0000 H   0  0  0

+    6.7966   -0.5237    0.0000 H   0  0  0

+    5.5764    0.8040    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 14 17  1  0

+ 15 18  1  0

+ 15 19  1  0

+ 16 20  1  0

+ 17 21  2  0

+ 19 22  3  0

+  7 10  1  0

+  8 13  1  0

+  9 11  1  0

+ 16 18  1  0

+  5 23  1  0

+  6 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+ 21 42  1  0

+ 21 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13177-29-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.1431    0.8486    0.0014 C   0  0  0

+    0.1405   -0.6111   -0.0005 C   0  0  0

+    1.5320    1.2976    0.0000 C   0  0  0

+   -0.8994    1.6088   -0.0009 C   0  0  0

+    1.5597   -1.0042   -0.0002 C   0  0  0

+   -1.0356   -1.1984   -0.0011 C   0  0  0

+    2.3403    0.0666   -0.0001 C   0  0  0

+    1.7316    2.5969   -0.0003 C   0  0  0

+   -2.2164    0.9533   -0.0056 C   0  0  0

+   -0.6781    3.0631    0.0001 C   0  0  0

+    2.1707   -2.3487   -0.0001 C   0  0  0

+   -2.2591   -0.3699    0.0016 C   0  0  0

+    3.8073   -0.1037    0.0003 C   0  0  0

+    0.5686    3.5085    0.0012 C   0  0  0

+    3.4757   -2.4924    0.0002 C   0  0  0

+   -3.4662   -0.9855    0.0010 N   0  3  0

+    4.3434   -1.3022    0.0008 C   0  0  0

+   -4.4880   -0.3226    0.0032 O   0  0  0

+   -3.5294   -2.2019   -0.0016 O   0  5  0

+   -1.1053   -2.2516    0.0000 H   0  0  0

+    2.7131    2.9853    0.0000 H   0  0  0

+   -3.1047    1.5234    0.0000 H   0  0  0

+   -1.4926    3.7344    0.0000 H   0  0  0

+    1.5514   -3.2035    0.0000 H   0  0  0

+    4.4316    0.7474    0.0000 H   0  0  0

+    0.7376    4.5504    0.0000 H   0  0  0

+    3.9018   -3.4581    0.0000 H   0  0  0

+    5.3931   -1.4125    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+ 16 18  2  0

+ 16 19  1  0

+  5  7  2  0

+  9 12  2  0

+ 10 14  2  0

+ 15 17  1  0

+  6 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75590-19-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    2.7282   -0.1028   -0.1768 C   0  0  0

+    1.2227   -0.0683   -0.1201 C   0  0  0

+    3.4867    1.1561    0.2485 C   0  0  0

+    3.4431   -0.0209    1.0578 O   0  0  0

+    3.3311   -0.9544   -1.2958 C   0  0  0

+    0.5133   -1.2297    0.1234 C   0  0  0

+    0.5513    1.1254   -0.3059 C   0  0  0

+   -0.8675   -1.1981    0.1754 C   0  0  0

+   -0.8299    1.1571   -0.2539 C   0  0  0

+   -1.5394   -0.0050   -0.0162 C   0  0  0

+   -3.0181    0.0288    0.0395 N   0  3  0

+   -3.6100    1.0799   -0.1292 O   0  0  0

+   -3.6430   -0.9944    0.2541 O   0  5  0

+    4.4594    1.4764    0.0000 H   0  0  0

+    2.8481    1.9567    0.0000 H   0  0  0

+    2.4953   -1.5461    0.0000 H   0  0  0

+    3.9228   -1.7902    0.0000 H   0  0  0

+    4.1669   -0.3627    0.0000 H   0  0  0

+    1.0041   -2.1285    0.0000 H   0  0  0

+    1.0784    2.0034    0.0000 H   0  0  0

+   -1.3944   -2.0762    0.0000 H   0  0  0

+   -1.3207    2.0559    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  6  8  2  0

+  7  9  1  0

+  8 10  1  0

+ 10 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  3  4  1  0

+  9 10  2  0

+  3 14  1  0

+  3 15  1  0

+  5 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2923-68-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.0975   -0.2547   -0.0870 C   0  0  0

+   -1.1411    0.5764    0.2538 C   0  0  0

+    1.3570    0.5349    0.2753 C   0  0  0

+    0.0639   -1.7952    0.8492 Cl  0  0  0

+    0.1045   -0.5412   -1.4563 F   0  0  0

+   -2.4006   -0.2132   -0.1084 C   0  0  0

+   -1.1481    0.8629    1.6232 F   0  0  0

+   -1.1150    1.7717   -0.4726 F   0  0  0

+    2.5920   -0.2180   -0.2236 C   0  0  0

+    1.3055    1.7968   -0.3265 F   0  0  0

+    1.4308    0.6834    1.6644 F   0  0  0

+   -3.6391    0.6179    0.2324 C   0  0  0

+   -2.3916   -0.5824   -1.8732 Cl  0  0  0

+   -2.4267   -1.4085    0.6180 F   0  0  0

+    3.8354    0.6496   -0.0187 C   0  0  0

+    2.7727   -1.7554    0.7009 Cl  0  0  0

+    2.4439   -0.5068   -1.5844 F   0  0  0

+   -4.8745   -0.2279    0.0605 C   0  0  0

+   -3.5556    1.0573    1.5580 F   0  0  0

+   -3.7084    1.7236   -0.6219 F   0  0  0

+    5.2908   -0.2377   -0.6065 Cl  0  0  0

+    3.6952    1.8424   -0.7360 F   0  0  0

+    3.9835    0.9384    1.3422 F   0  0  0

+   -5.5477   -0.5163    1.0215 O   0  0  0

+   -5.2269   -0.6608   -1.1601 O   0  0  0

+   -5.7943   -1.3578    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  1  1  0

+  6  2  1  0

+  7  2  1  0

+  8  2  1  0

+  9  3  1  0

+ 10  3  1  0

+ 11  3  1  0

+ 12  6  1  0

+ 13  6  1  0

+ 14  6  1  0

+ 15  9  1  0

+ 16  9  1  0

+ 17  9  1  0

+ 18 12  1  0

+ 19 12  1  0

+ 20 12  1  0

+ 21 15  1  0

+ 22 15  1  0

+ 23 15  1  0

+ 24 18  2  0

+ 25 18  1  0

+ 25 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5332-73-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.6272   -0.3954    0.0000 C   0  0  0

+   -0.6754    0.4072    0.0000 C   0  0  0

+    1.8181    0.5652    0.0000 C   0  0  0

+   -1.7877   -0.4900    0.0000 O   0  0  0

+    3.0687   -0.2054    0.0000 N   0  0  0

+   -2.9680    0.3155    0.0000 C   0  0  0

+   -0.0530   -1.2620    0.0000 H   0  0  0

+    1.4114   -1.1692    0.0000 H   0  0  0

+    0.0048    1.2738    0.0000 H   0  0  0

+   -1.4596    1.1810    0.0000 H   0  0  0

+    2.4984    1.4318    0.0000 H   0  0  0

+    1.0339    1.3390    0.0000 H   0  0  0

+    3.0372   -1.3067    0.0000 H   0  0  0

+    4.0382    0.3179    0.0000 H   0  0  0

+   -2.3470    1.2255    0.0000 H   0  0  0

+   -3.8780    0.9365    0.0000 H   0  0  0

+   -3.5890   -0.5945    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  1  7  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+102408-26-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.1865   -0.2215   -0.0021 C   0  0  0

+   -1.2568   -0.4403   -0.0010 C   0  0  0

+    0.6639    1.0926   -0.0008 C   0  0  0

+    1.2557   -1.0406    0.0011 N   0  0  0

+   -2.1213    0.6811    0.0014 C   0  0  0

+   -1.8064   -1.7287   -0.0027 C   0  0  0

+    2.0459    0.9980   -0.0023 N   0  0  0

+   -0.2275    2.1668    0.0016 C   0  0  0

+    2.3577   -0.3295   -0.0020 C   0  0  0

+   -1.5716    1.9772    0.0026 C   0  0  0

+   -3.4451    0.4956    0.0020 N   0  0  0

+   -3.1699   -1.8496   -0.0019 C   0  0  0

+    2.9943    2.1146   -0.0017 C   0  0  0

+    3.6369   -0.8456   -0.0001 N   0  0  0

+   -3.9656   -0.7086    0.0005 C   0  0  0

+    3.8415   -2.2963    0.0052 C   0  0  0

+   -1.1947   -2.5712    0.0000 H   0  0  0

+    0.1480    3.1378    0.0000 H   0  0  0

+   -2.2057    2.8029    0.0000 H   0  0  0

+   -3.6102   -2.7930    0.0000 H   0  0  0

+    3.7878    1.4406    0.0000 H   0  0  0

+    3.6683    2.9081    0.0000 H   0  0  0

+    2.2008    2.7886    0.0000 H   0  0  0

+    4.4570   -0.2042    0.0000 H   0  0  0

+   -5.0015   -0.8130    0.0000 H   0  0  0

+    2.8106   -2.4417    0.0000 H   0  0  0

+    3.9869   -3.3272    0.0000 H   0  0  0

+    4.8724   -2.1509    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 14 16  1  0

+  7  9  1  0

+  8 10  2  0

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+  6 17  1  0

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+ 10 19  1  0

+ 12 20  1  0

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+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5131-60-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.0851    0.9511    0.0017 C   0  0  0

+   -0.6939   -0.2988    0.0001 C   0  0  0

+    1.2993    1.0466    0.0019 C   0  0  0

+   -0.8663    2.1097   -0.0026 N   0  0  0

+    0.0786   -1.4452   -0.0014 C   0  0  0

+   -2.4257   -0.4200    0.0005 Cl  0  0  0

+    2.0715   -0.1063    0.0004 C   0  0  0

+    1.4571   -1.3527   -0.0012 C   0  0  0

+    3.4658   -0.0140    0.0000 N   0  0  0

+    1.7581    1.9824    0.0000 H   0  0  0

+   -0.4093    3.0463    0.0000 H   0  0  0

+   -1.9060    2.0372    0.0000 H   0  0  0

+   -0.3798   -2.3812    0.0000 H   0  0  0

+    2.0369   -2.2188    0.0000 H   0  0  0

+    4.0454   -0.8802    0.0000 H   0  0  0

+    3.9261    0.9210    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  7  9  1  0

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+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  8 14  1  0

+  9 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-84-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -1.2251    0.7850    0.2065 C   0  0  0

+   -1.3622   -0.5910    0.0711 C   0  0  0

+    0.0001    1.3705    0.5254 N   0  0  0

+   -2.3282    1.6101    0.0162 C   0  0  0

+    0.0000   -1.6795    0.2926 S   0  0  0

+   -2.6056   -1.1278   -0.2492 C   0  0  0

+    1.2249    0.7853    0.2048 C   0  0  0

+   -3.5575    1.0679   -0.3072 C   0  0  0

+    1.3619   -0.5912    0.0692 C   0  0  0

+   -3.6971   -0.3014   -0.4332 C   0  0  0

+    2.3285    1.6098    0.0178 C   0  0  0

+    2.6047   -1.1279   -0.2520 C   0  0  0

+    3.5591    1.0671   -0.3017 C   0  0  0

+    3.6965   -0.3013   -0.4363 C   0  0  0

+    0.0001    2.3998    0.0000 H   0  0  0

+   -2.2117    2.6327    0.0000 H   0  0  0

+   -2.7291   -2.1496    0.0000 H   0  0  0

+   -4.3901    1.6730    0.0000 H   0  0  0

+   -4.6408   -0.7122    0.0000 H   0  0  0

+    2.2123    2.6325    0.0000 H   0  0  0

+    2.7281   -2.1497    0.0000 H   0  0  0

+    4.3921    1.6716    0.0000 H   0  0  0

+    4.6399   -0.7128    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+  7 11  2  0

+  9 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+  7  9  1  0

+  8 10  1  0

+ 13 14  2  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107027-12-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 47                          1 V2000

+    0.7177    1.4996    0.0347 C   0  0  0

+   -0.6992    1.5568   -0.0099 C   0  0  0

+    1.4517    2.7087    0.1059 C   0  0  0

+    1.3571    0.3313    0.0050 N   0  0  0

+   -1.3308    2.7918    0.0171 C   0  0  0

+   -1.4923    0.3166   -0.0848 C   0  0  0

+    2.8596    2.6543    0.1504 C   0  0  0

+    0.7715    3.9365    0.1307 C   0  0  0

+    2.6757    0.2699    0.0462 C   0  0  0

+   -0.5912    3.9651    0.0872 C   0  0  0

+   -2.8380    0.3788   -0.1269 N   0  0  0

+   -0.9324   -0.7627   -0.1086 O   0  0  0

+    3.4603    1.4306    0.1227 C   0  0  0

+    3.3413   -1.0542    0.0105 C   0  0  0

+   -3.6262   -0.8539   -0.2013 C   0  0  0

+    4.5091   -1.2306   -0.7300 C   0  0  0

+    2.8049   -2.1266    0.7222 C   0  0  0

+   -5.1156   -0.5054   -0.2369 C   0  0  0

+    5.1247   -2.4656   -0.7590 C   0  0  0

+    3.4290   -3.3566    0.6857 C   0  0  0

+   -5.9060   -1.7414   -0.3115 N   0  0  0

+    4.5850   -3.5270   -0.0553 C   0  0  0

+   -5.6978   -2.4528    0.9567 C   0  0  0

+   -7.3182   -1.3381   -0.3424 C   0  0  0

+   -2.3673    2.8383    0.0000 H   0  0  0

+    3.4252    3.5242    0.0000 H   0  0  0

+    1.3076    4.8249    0.0000 H   0  0  0

+   -1.0829    4.8788    0.0000 H   0  0  0

+   -3.3152    1.3002    0.0000 H   0  0  0

+    4.4954    1.3590    0.0000 H   0  0  0

+   -3.9750   -1.8311    0.0000 H   0  0  0

+   -2.6946   -1.3107    0.0000 H   0  0  0

+    5.1197   -0.3917    0.0000 H   0  0  0

+    1.7673   -2.1296    0.0000 H   0  0  0

+   -4.7668    0.4718    0.0000 H   0  0  0

+   -6.0472   -0.0486    0.0000 H   0  0  0

+    6.1623   -2.4697    0.0000 H   0  0  0

+    2.8229   -4.1988    0.0000 H   0  0  0

+    5.0614   -4.4488    0.0000 H   0  0  0

+   -6.6936   -2.7442    0.0000 H   0  0  0

+   -5.4064   -3.4486    0.0000 H   0  0  0

+   -4.7020   -2.1614    0.0000 H   0  0  0

+   -7.0333   -0.3404    0.0000 H   0  0  0

+   -8.3159   -1.0532    0.0000 H   0  0  0

+   -7.6031   -2.3358    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  8 10  2  0

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+ 20 22  1  0

+  5 25  1  0

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+ 10 28  1  0

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+ 23 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+ 24 45  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+607-30-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.2548    0.2990   -0.0019 C   0  0  0

+   -1.1280   -0.8166   -0.0012 C   0  0  0

+    1.1403    0.0849   -0.0008 C   0  0  0

+   -0.7925    1.5955    0.0021 C   0  0  0

+   -0.5911   -2.1151    0.0012 C   0  0  0

+   -2.5174   -0.6029   -0.0023 C   0  0  0

+    1.6269   -1.2053    0.0011 C   0  0  0

+    2.0176    1.1670   -0.0020 N   0  0  0

+   -2.1435    1.7649    0.0066 C   0  0  0

+    0.7590   -2.2928    0.0027 C   0  0  0

+   -3.0034    0.6684   -0.0040 C   0  0  0

+    3.4161    0.9448   -0.0008 O   0  0  0

+   -0.1590    2.4267    0.0000 H   0  0  0

+   -1.2276   -2.9440    0.0000 H   0  0  0

+   -3.1738   -1.4161    0.0000 H   0  0  0

+    2.6592   -1.3681    0.0000 H   0  0  0

+    1.6436    2.1429    0.0000 H   0  0  0

+   -2.5413    2.7313    0.0000 H   0  0  0

+    1.1497   -3.2621    0.0000 H   0  0  0

+   -4.0368    0.8245    0.0000 H   0  0  0

+    4.4483    0.7808    0.0000 H   0  0  0

+  1  2  1  0

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+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105360-93-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    0.2603    0.0507   -0.0019 C   0  0  0

+   -1.0398    0.0141   -0.0015 C   0  0  0

+    0.9746    1.3433   -0.0005 C   0  0  0

+    1.0608   -1.1880    0.0025 C   0  0  0

+   -1.8146    1.2693    0.0003 C   0  0  0

+   -1.7491   -1.2780   -0.0023 C   0  0  0

+    2.4473    1.2635   -0.0005 C   0  0  0

+    0.2944    2.4599    0.0010 C   0  0  0

+    2.3302   -1.0946    0.0029 N   0  0  0

+    0.3578   -2.4820    0.0067 C   0  0  0

+   -1.1856    2.4207    0.0014 C   0  0  0

+   -3.2837    1.1585    0.0013 C   0  0  0

+   -0.9623   -2.5227   -0.0048 C   0  0  0

+   -3.0612   -1.2799   -0.0014 C   0  0  0

+    3.0057    0.0695   -0.0017 C   0  0  0

+   -3.8398   -0.0345    0.0005 C   0  0  0

+    4.3664    0.0094   -0.0020 O   0  0  0

+    3.0412    2.1434    0.0000 H   0  0  0

+    0.8020    3.3922    0.0000 H   0  0  0

+    0.9144   -3.3859    0.0000 H   0  0  0

+   -1.7392    3.3264    0.0000 H   0  0  0

+   -3.8874    2.0317    0.0000 H   0  0  0

+   -1.4601   -3.4603    0.0000 H   0  0  0

+   -3.5751   -2.2088    0.0000 H   0  0  0

+   -4.8994   -0.0995    0.0000 H   0  0  0

+    5.4269   -0.0374    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117022-35-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 45                          1 V2000

+   -1.1539   -0.1812    0.0823 C   0  0  0

+   -1.9725   -1.3552    0.5207 C   0  0  1

+    0.2319   -0.2930   -0.1156 C   0  0  0

+   -1.7516    1.0201   -0.1790 C   0  0  0

+   -3.3998   -1.0871    0.9601 C   0  0  2

+   -3.0872   -1.6213   -0.3266 O   0  0  0

+    1.0049    0.8971   -0.1283 C   0  0  0

+    0.9019   -1.5071   -0.3803 C   0  0  0

+   -3.2482    1.1503   -0.1878 C   0  0  2

+   -0.9888    2.1699   -0.3784 C   0  0  0

+   -3.8678    0.3509    0.9412 C   0  0  1

+    2.4582    0.8028    0.0195 C   0  0  0

+    0.3709    2.1273   -0.3033 C   0  0  0

+    2.2474   -1.6073   -0.2669 C   0  0  0

+    0.1696   -2.7233   -0.8861 C   0  0  0

+   -3.7724    0.7290   -1.4457 O   0  0  0

+   -5.2931    0.3954    0.8450 O   0  0  0

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+    5.0864   -1.9539    0.2211 C   0  0  0

+   -1.3869   -2.2147    0.0000 H   0  0  0

+   -4.3486   -1.5131    0.0000 H   0  0  0

+   -3.5507    2.1454    0.0000 H   0  0  0

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+   -6.3326    0.4279    0.0000 H   0  0  0

+    2.8299    2.8821    0.0000 H   0  0  0

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+    4.1482   -2.4028    0.0000 H   0  0  0

+    5.5353   -2.8921    0.0000 H   0  0  0

+    6.0246   -1.5050    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+ 23 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7177-48-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 51                          1 V2000

+   -1.6248   -2.2618   -0.5468 N   0  0  0

+   -2.6131   -1.5922   -1.4044 C   0  0  1

+   -0.5245   -1.4481   -0.0497 C   0  0  2

+   -2.6162   -2.5939    0.3141 C   0  0  0

+   -3.6913   -1.7697   -0.3424 C   0  0  1

+   -2.0364    0.1498   -1.4565 S   0  0  0

+   -0.3308   -0.1211   -0.8142 C   0  0  0

+    0.7526   -2.2467   -0.0980 C   0  0  0

+   -2.6326   -3.3155    1.2887 O   0  0  0

+   -3.8626   -0.5148    0.3940 N   0  0  0

+    0.0899    1.0059    0.1312 C   0  0  0

+    0.6729   -0.2827   -1.9576 C   0  0  0

+    1.6972   -2.0590    0.8370 O   0  0  0

+    0.9262   -3.0559   -0.9783 O   0  0  0

+   -5.0640   -0.1989    0.9168 C   0  0  0

+   -5.2402    1.0919    1.6743 C   0  0  1

+   -6.0033   -0.9534    0.7776 O   0  0  0

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+   -6.8596    4.9590    0.0000 H   0  0  0

+   11.0340    0.0154    0.0000 H   0  0  0

+   12.8316    0.0154    0.0000 H   0  0  0

+   19.6513    0.8753    0.0000 H   0  0  0

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+   28.2686    1.7352    0.0000 H   0  0  0

+   30.0662    1.7352    0.0000 H   0  0  0

+  1  2  1  0

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+ 25 48  1  0

+ 26 49  1  0

+ 26 50  1  0

+ 27 51  1  0

+ 27 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+26227-73-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+    1.0100    0.1887   -0.3199 C   0  0  0

+   -0.3407    0.3680   -0.1915 N   0  0  0

+    1.7939    1.1731   -0.9254 C   0  0  0

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+   -1.1384   -0.6630   -0.1955 C   0  0  0

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+    2.9734   -1.1514    0.0264 C   0  0  0

+   -2.5900   -0.4703   -0.0575 C   0  0  0

+    3.7433   -0.1742   -0.5799 C   0  0  0

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+   -3.1166    0.8180    0.0841 C   0  0  0

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+    7.4491   -0.0130    0.3705 C   0  0  0

+   -6.6650    0.0707    0.3310 O   0  0  0

+    8.1576    0.5461    1.6059 C   0  0  0

+   -6.8855    1.4776    0.4493 C   0  0  0

+    1.4118    2.1277    0.0000 H   0  0  0

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+   -3.0601   -2.5275    0.0000 H   0  0  0

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+    4.8407   -1.3232    0.0000 H   0  0  0

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+   -5.4378   -2.2014    0.0000 H   0  0  0

+   -4.8700    1.9432    0.0000 H   0  0  0

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+    5.1179    0.8063    0.0000 H   0  0  0

+    7.0592   -0.9645    0.0000 H   0  0  0

+    8.2703   -0.6319    0.0000 H   0  0  0

+    8.7946   -0.2611    0.0000 H   0  0  0

+    8.9648    1.1831    0.0000 H   0  0  0

+    7.5206    1.3533    0.0000 H   0  0  0

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+   -7.0447    2.4935    0.0000 H   0  0  0

+   -7.9014    1.3184    0.0000 H   0  0  0

+  1  2  1  0

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+  7  9  1  0

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+ 19 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+594-70-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.7285    0.0000    0.0000 C   0  0  0

+   -0.7365    0.0000    0.0000 N   0  3  0

+    1.2386   -0.7212    1.2492 C   0  0  0

+    1.2385   -0.7212   -1.2493 C   0  0  0

+    1.2385    1.4425    0.0000 C   0  0  0

+   -1.3455   -1.0548    0.0000 O   0  0  0

+   -1.3455    1.0548    0.0000 O   0  5  0

+    0.4928   -1.2487    0.0000 H   0  0  0

+    1.7661   -1.4670    0.0000 H   0  0  0

+    1.9844   -0.1937    0.0000 H   0  0  0

+    0.4927   -1.2486    0.0000 H   0  0  0

+    1.7659   -1.4670    0.0000 H   0  0  0

+    1.9843   -0.1938    0.0000 H   0  0  0

+    2.0997    1.1380    0.0000 H   0  0  0

+    1.5430    2.3037    0.0000 H   0  0  0

+    0.3773    1.7470    0.0000 H   0  0  0

+  2  1  1  0

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+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57333-96-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 74 76                          1 V2000

+    0.8912   -1.7730   -0.0606 C   0  0  1

+   -0.1741   -1.7610    1.0721 C   0  0  2

+    2.1603   -1.3326    0.6524 C   0  0  2

+    0.8664   -3.1460   -0.6902 C   0  0  0

+    0.5164   -0.7337   -1.1190 C   0  0  0

+   -1.4964   -1.8816    0.3749 C   0  0  0

+    0.1235   -0.4199    1.7466 C   0  0  0

+    1.6777   -0.3960    1.7909 C   0  0  0

+    3.0742   -0.5718   -0.3103 C   0  0  1

+   -0.4737   -3.2920   -1.4307 C   0  0  0

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+   -4.7011   -0.2102   -0.0750 C   0  0  0

+    6.2771    1.4772    0.2968 C   0  0  2

+   -4.9180    0.5141    1.1948 C   0  0  0

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+   -4.8896   -0.1132    2.3706 C   0  0  0

+   -5.7084    1.6695   -1.3238 C   0  0  2

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+   -6.3018    3.1831    0.0000 H   0  0  0

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+  1  2  1  0

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+ 28 71  1  0

+ 28 72  1  0

+ 29 73  1  0

+ 30 74  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97467-07-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+   -8.6337   -0.3536    0.0479 Cl  0  0  0

+   -9.5853    0.6224    0.0820 O   0  0  0

+   -7.6506   -0.0615    0.9465 O   0  0  0

+   -9.2002   -1.5520    0.3675 O   0  0  0

+   -7.9981   -0.4364   -1.4399 O   0  0  0

+    5.6928    0.0643   -0.1026 C   0  0  0

+    4.6654    1.1181   -0.0658 C   0  0  0

+    6.8998    0.1412    0.7983 C   0  0  0

+    5.5650   -0.9884   -0.9401 C   0  0  0

+    3.3443    0.8001    0.2629 C   0  0  0

+    5.0072    2.4432   -0.3539 C   0  0  0

+    7.3139   -1.2685    1.2186 C   0  0  0

+    6.6049   -2.0175   -0.9517 C   0  0  0

+    2.3876    1.7929    0.2957 C   0  0  0

+    4.0395    3.4246   -0.3169 C   0  0  0

+    7.4161   -2.1384    0.0489 N   0  3  0

+    2.7325    3.1010    0.0043 C   0  0  0

+    8.4543   -3.1713    0.0113 C   0  0  0

+    7.8940    0.3549    0.0000 H   0  0  0

+    6.7603    1.1484    0.0000 H   0  0  0

+    4.6046   -1.3226    0.0000 H   0  0  0

+    3.0595   -0.1761    0.0000 H   0  0  0

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+    4.3155    4.4033    0.0000 H   0  0  0

+    2.0189    3.8254    0.0000 H   0  0  0

+    7.7371   -3.8922    0.0000 H   0  0  0

+    9.1752   -3.8885    0.0000 H   0  0  0

+    9.1715   -2.4504    0.0000 H   0  0  0

+   -6.9898   -0.5678    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  2  0

+  1  4  2  0

+  1  5  1  0

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+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+  5 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66-75-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+    0.7537   -0.3345    0.1465 C   0  0  0

+   -0.5800   -0.0810    0.5001 N   0  0  0

+    1.7543   -0.4011    1.1228 C   0  0  0

+    1.1125   -0.5309   -1.1785 C   0  0  0

+   -0.9991    1.1062   -0.2568 C   0  0  0

+   -1.3732   -1.2078   -0.0088 C   0  0  0

+    3.0035   -0.6429    0.7474 N   0  0  0

+    1.4515   -0.2209    2.4323 O   0  0  0

+    2.3826   -0.7681   -1.4754 N   0  0  0

+   -0.6500    2.3667    0.5371 C   0  0  0

+   -2.8466   -0.9949    0.3441 C   0  0  0

+    3.3040   -0.8190   -0.5292 C   0  0  0

+   -1.1644    3.8237   -0.3920 Cl  0  0  0

+   -3.8201   -2.3780   -0.2806 Cl  0  0  0

+    4.5916   -1.0638   -0.8755 O   0  0  0

+    0.7868   -1.4436    0.0000 H   0  0  0

+   -1.8040    1.6458    0.0000 H   0  0  0

+   -1.7648    0.5122    0.0000 H   0  0  0

+   -1.6597   -2.1335    0.0000 H   0  0  0

+   -0.5035   -1.6352    0.0000 H   0  0  0

+    0.6188    0.2747    0.0000 H   0  0  0

+    0.1549    1.8271    0.0000 H   0  0  0

+    0.1157    2.9607    0.0000 H   0  0  0

+   -2.5601   -0.0692    0.0000 H   0  0  0

+   -3.7163   -0.5676    0.0000 H   0  0  0

+    5.5436   -1.2448    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  1  0

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+  8 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2444-36-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.1379   -0.3279   -1.0379 C   0  0  0

+   -2.1078   -0.5158    0.1001 C   0  0  0

+    0.2707   -0.5021   -0.5314 C   0  0  0

+   -1.6973   -0.7655    1.2087 O   0  0  0

+   -3.4277   -0.4057   -0.1178 O   0  0  0

+    0.9750    0.5896   -0.0564 C   0  0  0

+    0.8572   -1.7539   -0.5361 C   0  0  0

+    0.2365    2.1607   -0.0435 Cl  0  0  0

+    2.2681    0.4288    0.4090 C   0  0  0

+    2.1489   -1.9139   -0.0712 C   0  0  0

+    2.8553   -0.8222    0.3989 C   0  0  0

+   -0.6339    0.5094    0.0000 H   0  0  0

+   -1.6979    0.4730    0.0000 H   0  0  0

+   -4.4016   -0.3245    0.0000 H   0  0  0

+    0.2831   -2.5448    0.0000 H   0  0  0

+    2.8422    1.2197    0.0000 H   0  0  0

+    2.5622   -2.7995    0.0000 H   0  0  0

+    3.8304   -0.8883    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  2  0

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+ 10  7  2  0

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+ 10 11  1  0

+  1 12  1  0

+  1 13  1  0

+  5 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6088-51-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+    0.6484   -2.5531   -0.7938 S   0  0  0

+   -0.6484   -2.5531    0.7939 S   0  0  0

+    1.7922   -1.3260   -0.2546 C   0  0  0

+   -1.7923   -1.3262    0.2545 C   0  0  0

+    2.8686   -0.9973   -1.0529 C   0  0  0

+    1.5967   -0.6889    0.9787 C   0  0  0

+   -2.8687   -0.9976    1.0528 C   0  0  0

+   -1.5969   -0.6892   -0.9788 C   0  0  0

+    3.7776   -0.0189   -0.6194 C   0  0  0

+    2.4630    0.2605    1.4184 C   0  0  0

+   -3.7776   -0.0190    0.6194 C   0  0  0

+   -2.4631    0.2604   -1.4184 C   0  0  0

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+    4.8866    0.3420   -1.4056 C   0  0  0

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+   -4.8867    0.3419    1.4055 C   0  0  0

+    4.4848    1.5940    1.0639 C   0  0  0

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+   -5.7498    1.2931    0.9582 C   0  0  0

+    5.5508    1.9206    0.2752 C   0  0  0

+   -5.5506    1.9208   -0.2751 C   0  0  0

+    6.4303    2.8682    0.6951 O   0  0  0

+   -6.4302    2.8682   -0.6951 O   0  0  0

+    3.3328   -1.7389    0.0000 H   0  0  0

+    0.7430   -0.4971    0.0000 H   0  0  0

+   -3.3329   -1.7392    0.0000 H   0  0  0

+   -0.7432   -0.4975    0.0000 H   0  0  0

+    1.9908    0.9971    0.0000 H   0  0  0

+   -1.9907    0.9968    0.0000 H   0  0  0

+    5.3618   -0.3926    0.0000 H   0  0  0

+   -5.3620   -0.3927    0.0000 H   0  0  0

+    4.0205    2.3356    0.0000 H   0  0  0

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+   -4.0202    2.3359    0.0000 H   0  0  0

+   -6.6046    1.1066    0.0000 H   0  0  0

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+  2  1  1  0

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+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+326-61-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -1.9992    0.6374    0.1077 C   0  0  0

+   -2.3596   -0.7020   -0.0169 C   0  0  0

+   -0.6853    1.0204   -0.1082 C   0  0  0

+   -3.1093    1.3588    0.4400 O   0  0  0

+   -1.4025   -1.6445   -0.3562 C   0  0  0

+   -3.6945   -0.8206    0.2424 O   0  0  0

+    0.2643    0.0746   -0.4465 C   0  0  0

+   -4.2286    0.5123    0.1177 C   0  0  0

+   -0.0935   -1.2551   -0.5703 C   0  0  0

+    1.6928    0.4938   -0.6808 C   0  0  0

+    2.5593   -0.1927    0.2606 O   0  0  0

+    3.8832    0.0272    0.2375 C   0  0  0

+    4.7825   -0.6853    1.2146 C   0  0  0

+    4.3539    0.7964   -0.5666 O   0  0  0

+   -0.4362    1.9966    0.0000 H   0  0  0

+   -1.6462   -2.6220    0.0000 H   0  0  0

+   -4.7626    1.3666    0.0000 H   0  0  0

+   -5.1268    0.0561    0.0000 H   0  0  0

+    0.6282   -1.9580    0.0000 H   0  0  0

+    2.4661    1.1395    0.0000 H   0  0  0

+    1.2182    1.3824    0.0000 H   0  0  0

+    4.1569   -1.4749    0.0000 H   0  0  0

+    5.5721   -1.3109    0.0000 H   0  0  0

+    5.4081    0.1043    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  3  7  2  0

+  4  8  1  0

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+  3 15  1  0

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+  8 17  1  0

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+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1066-33-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  8                          1 V2000

+   -1.8545    0.0363   -0.0242 C   0  0  0

+   -2.6428   -0.9683    0.3993 O   0  0  0

+   -0.7188   -0.2356   -0.6921 O   0  0  0

+   -2.1708    1.1887    0.1920 O   0  0  0

+    7.9080   -0.0138    0.1359 N   0  0  0

+   -3.1961   -1.6734    0.0000 H   0  0  0

+    0.1528   -0.4443    0.0000 H   0  0  0

+    7.4599    0.7624    0.0000 H   0  0  0

+    7.4599   -0.7900    0.0000 H   0  0  0

+    8.8043   -0.0138    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  5  9  1  0

+  5 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+117760-95-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -2.8772   -0.2896   -0.5474 C   0  0  0

+   -3.9283    0.4882   -0.0665 C   0  0  0

+   -1.9123   -1.2568    0.5653 S   0  0  0

+   -2.5951   -0.3045   -1.9120 C   0  0  0

+   -4.6812    1.2435   -0.9421 C   0  0  0

+   -4.2366    0.5046    1.3810 N   0  3  0

+   -0.4720   -2.3219   -0.0973 S   0  0  0

+   -3.3571    0.4501   -2.7797 C   0  0  0

+   -4.3937    1.2294   -2.2957 C   0  0  0

+   -5.1558    1.1850    1.8003 O   0  0  0

+   -3.4629   -0.2706    2.2785 O   0  5  0

+    1.1025   -1.6588   -0.2083 C   0  0  0

+    1.3341   -0.3368    0.1862 C   0  0  0

+    2.4116   -2.6269   -0.8106 Cl  0  0  0

+    2.6395    0.1614    0.2290 C   0  0  0

+    0.0003    0.6850    0.6227 Cl  0  0  0

+    2.8754    1.4765   -0.0342 C   0  0  0

+    3.9600   -0.8965    0.6175 Cl  0  0  0

+    4.4616    2.1391    0.2074 Cl  0  0  0

+    1.5898    2.4904   -0.6112 Cl  0  0  0

+   -1.6767   -0.7109    0.0000 H   0  0  0

+   -5.5991    1.6512    0.0000 H   0  0  0

+   -2.7005    1.2101    0.0000 H   0  0  0

+   -4.0523    2.1739    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 13 16  1  0

+ 15 17  2  0

+ 15 18  1  0

+ 17 19  1  0

+ 17 20  1  0

+  8  9  1  0

+  4 21  1  0

+  5 22  1  0

+  8 23  1  0

+  9 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-92-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    1.2253    0.2006   -0.0033 C   0  0  0

+    0.0069   -0.4818   -0.0026 C   0  0  0

+    1.2363    1.5967   -0.0014 C   0  0  0

+    2.4969   -0.5513    0.0002 C   0  0  0

+   -1.1765    0.2265   -0.0002 C   0  0  0

+    0.0450    2.2926    0.0011 C   0  0  0

+    3.6705    0.1100   -0.0004 O   0  0  0

+    2.4842   -1.7660    0.0036 O   0  0  0

+   -1.1584    1.6103    0.0017 C   0  0  0

+   -2.4689   -0.4950    0.0000 N   0  3  0

+   -3.5148    0.1291    0.0022 O   0  0  0

+   -2.4864   -1.7129   -0.0020 O   0  5  0

+   -0.0080   -1.5178    0.0000 H   0  0  0

+    2.1370    2.1089    0.0000 H   0  0  0

+    0.0517    3.3287    0.0000 H   0  0  0

+    4.5732    0.6186    0.0000 H   0  0  0

+   -2.0503    2.1377    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  9  2  0

+  2 13  1  0

+  3 14  1  0

+  6 15  1  0

+  7 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24777-14-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 47                          1 V2000

+   -5.3724   -1.2591   -0.9638 O   0  0  0

+   -4.5182   -2.1964   -1.6224 C   0  0  0

+   -4.5638   -0.3767   -0.3180 C   0  0  0

+   -3.1907   -0.5139   -0.3945 C   0  0  0

+   -5.1196    0.6693    0.4161 C   0  0  0

+   -2.3632    0.3943    0.2695 C   0  0  0

+   -6.4701    0.8057    0.4866 O   0  0  0

+   -4.2977    1.5711    1.0754 C   0  0  0

+   -0.8944    0.2524    0.1906 C   0  0  0

+   -2.9265    1.4366    1.0075 C   0  0  0

+   -0.0388    1.2423    0.0723 N   0  0  0

+   -0.2096   -0.9280    0.2349 N   0  0  0

+    1.2113    0.7534    0.0299 C   0  0  0

+    1.1291   -0.6249    0.1315 C   0  0  0

+    2.4557    1.5471   -0.0985 C   0  0  0

+    2.2543   -1.5800    0.1326 C   0  0  0

+    2.5593    2.5326   -1.0795 C   0  0  0

+    3.5262    1.3153    0.7651 C   0  0  0

+    2.3937   -2.4990    1.1752 C   0  0  0

+    3.1820   -1.5729   -0.9121 C   0  0  0

+    3.7209    3.2690   -1.1939 C   0  0  0

+    4.6823    2.0580    0.6409 C   0  0  0

+    3.4479   -3.3886    1.1697 C   0  0  0

+    4.2309   -2.4681   -0.9045 C   0  0  0

+    4.7810    3.0310   -0.3379 C   0  0  0

+    4.3660   -3.3721    0.1348 C   0  0  0

+   -5.2435   -2.8574    0.0000 H   0  0  0

+   -3.8572   -2.9217    0.0000 H   0  0  0

+   -3.7929   -1.5354    0.0000 H   0  0  0

+   -2.8394   -1.4302    0.0000 H   0  0  0

+   -7.4464    0.9043    0.0000 H   0  0  0

+   -4.6498    2.4871    0.0000 H   0  0  0

+   -2.3834    2.2539    0.0000 H   0  0  0

+   -0.6019   -1.8275    0.0000 H   0  0  0

+    1.7254    3.0499    0.0000 H   0  0  0

+    3.7008    0.3496    0.0000 H   0  0  0

+    1.5374   -2.9782    0.0000 H   0  0  0

+    3.5180   -0.6509    0.0000 H   0  0  0

+    3.5529    4.2358    0.0000 H   0  0  0

+    5.5187    1.5447    0.0000 H   0  0  0

+    3.1193   -4.3133    0.0000 H   0  0  0

+    5.0891   -1.9922    0.0000 H   0  0  0

+    5.5771    3.6047    0.0000 H   0  0  0

+    5.1151   -4.0060    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  1  0

+  8  5  2  0

+  9  6  1  0

+ 10  6  2  0

+ 11  9  2  0

+ 12  9  1  0

+ 13 11  1  0

+ 14 12  1  0

+ 15 13  1  0

+ 16 14  1  0

+ 17 15  2  0

+ 18 15  1  0

+ 19 16  2  0

+ 20 16  1  0

+ 21 17  1  0

+ 22 18  2  0

+ 23 19  1  0

+ 24 20  2  0

+ 25 21  2  0

+ 26 23  2  0

+  8 10  1  0

+ 13 14  2  0

+ 22 25  1  0

+ 24 26  1  0

+  2 27  1  0

+  2 28  1  0

+  2 29  1  0

+  4 30  1  0

+  7 31  1  0

+  8 32  1  0

+ 10 33  1  0

+ 12 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+ 25 43  1  0

+ 26 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+611-09-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.6369    0.2682    0.0041 C   0  0  0

+   -0.9013   -1.1110    0.0026 C   0  0  0

+    0.6779    0.7335    0.0030 C   0  0  0

+   -1.9455    0.9481    0.0007 C   0  0  0

+   -2.2780   -1.3234    0.0036 N   0  0  0

+    0.1650   -2.0008    0.0004 C   0  0  0

+    1.7224   -0.1684    0.0005 C   0  0  0

+   -2.9544   -0.1618   -0.0028 C   0  0  0

+   -2.1591    2.1427    0.0011 O   0  0  0

+    1.4643   -1.5292   -0.0002 C   0  0  0

+    3.1201    0.3190   -0.0012 N   0  3  0

+   -4.1608   -0.0344   -0.0058 O   0  0  0

+    4.0424   -0.4765   -0.0034 O   0  0  0

+    3.3478    1.5155   -0.0002 O   0  5  0

+    0.8701    1.7544    0.0000 H   0  0  0

+   -2.7254   -2.2609    0.0000 H   0  0  0

+   -0.0144   -3.0240    0.0000 H   0  0  0

+    2.2554   -2.2024    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  6 10  2  0

+  7 11  1  0

+  8 12  2  0

+ 11 13  2  0

+ 11 14  1  0

+  5  8  1  0

+  7 10  1  0

+  3 15  1  0

+  5 16  1  0

+  6 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64099-26-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.1754    0.2741   -0.0059 C   0  0  0

+   -1.1860    1.2630   -0.0122 C   0  0  0

+    1.1618    0.7280   -0.0396 C   0  0  0

+   -0.7098   -1.0772    0.0412 C   0  0  0

+   -2.6755    0.3040    0.0361 S   0  0  0

+   -0.8890    2.6090   -0.0493 C   0  0  0

+    1.4346    2.0599   -0.0760 C   0  0  0

+    2.2720   -0.2511   -0.0348 N   0  3  0

+   -1.9966   -1.2631    0.0721 N   0  0  0

+    0.1329   -2.1431    0.0525 O   0  0  0

+    0.4204    3.0100   -0.0813 C   0  0  0

+    3.2400   -0.0706    0.6821 O   0  0  0

+    2.2175   -1.2372   -0.7476 O   0  5  0

+   -0.6837   -3.3148    0.1006 C   0  0  0

+   -1.6549    3.3159    0.0000 H   0  0  0

+    2.4278    2.3759    0.0000 H   0  0  0

+    0.6558    4.0254    0.0000 H   0  0  0

+   -1.5388   -2.7189    0.0000 H   0  0  0

+   -1.2796   -4.1699    0.0000 H   0  0  0

+    0.1714   -3.9107    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  6 11  2  0

+  8 12  2  0

+  8 13  1  0

+ 10 14  1  0

+  5  9  1  0

+  7 11  1  0

+  6 15  1  0

+  7 16  1  0

+ 11 17  1  0

+ 14 18  1  0

+ 14 19  1  0

+ 14 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112725-15-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+   -0.1536    0.2275   -0.0635 C   0  0  0

+   -1.3231    1.1599    0.1210 C   0  0  0

+    1.2510    0.7286    0.1535 C   0  0  0

+   -0.3422   -0.9224   -0.3804 O   0  0  0

+   -2.5697    0.4383   -0.1465 N   0  0  0

+    2.1922   -0.3513   -0.0841 O   0  0  0

+   -3.1810   -0.1707    0.8124 N   0  0  0

+   -3.1221    0.4085   -1.5030 C   0  0  0

+    3.5100   -0.1348    0.0508 C   0  0  0

+   -4.2174   -0.7706    0.5900 O   0  0  0

+    4.4868   -1.2555   -0.1959 C   0  0  0

+    3.9131    0.9586    0.3700 O   0  0  0

+   -0.6064    1.8596    0.0000 H   0  0  0

+   -1.9285    1.9578    0.0000 H   0  0  0

+    2.0821    1.2876    0.0000 H   0  0  0

+    0.7997    1.6228    0.0000 H   0  0  0

+   -3.1761    1.4086    0.0000 H   0  0  0

+   -4.1222    0.3545    0.0000 H   0  0  0

+   -3.0681   -0.5916    0.0000 H   0  0  0

+    3.7317   -1.9136    0.0000 H   0  0  0

+    5.1449   -2.0106    0.0000 H   0  0  0

+    5.2419   -0.5974    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  5  8  1  0

+  6  9  1  0

+  7 10  2  0

+  9 11  1  0

+  9 12  2  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55-98-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+   -2.9758   -0.7328    0.0062 O   0  0  0

+   -4.2764    0.0575    0.0148 S   0  0  0

+   -1.9124    0.2216    0.0166 C   0  0  0

+   -4.6296    0.2915   -1.7490 C   0  0  0

+   -5.1914   -0.8481    0.6164 O   0  0  0

+   -3.8999    1.2770    0.6397 O   0  0  0

+   -0.5693   -0.5111    0.0086 C   0  0  0

+    0.5693    0.5108    0.0198 C   0  0  0

+    1.9124   -0.2220    0.0118 C   0  0  0

+    2.9758    0.7325    0.0222 O   0  0  0

+    4.2764   -0.0579    0.0136 S   0  0  0

+    4.6296   -0.2531   -1.7550 C   0  0  0

+    5.1914    0.8344    0.6348 O   0  0  0

+    3.8999   -1.2907    0.6115 O   0  0  0

+   -1.2961    1.0983    0.0000 H   0  0  0

+   -2.7138    0.9331    0.0000 H   0  0  0

+   -4.0377    1.1849    0.0000 H   0  0  0

+   -5.5230    0.8834    0.0000 H   0  0  0

+   -5.2215   -0.6019    0.0000 H   0  0  0

+   -1.1856   -1.3878    0.0000 H   0  0  0

+    0.2321   -1.2226    0.0000 H   0  0  0

+    1.1856    1.3875    0.0000 H   0  0  0

+   -0.2321    1.2223    0.0000 H   0  0  0

+    1.2961   -1.0987    0.0000 H   0  0  0

+    2.7138   -0.9335    0.0000 H   0  0  0

+    4.1112   -1.1910    0.0000 H   0  0  0

+    5.5675   -0.7715    0.0000 H   0  0  0

+    5.1480    0.6848    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  2  6  2  0

+  3  7  1  0

+  7  8  1  0

+  8  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+ 11 14  2  0

+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  4 18  1  0

+  4 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+  9 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+139953-97-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 38                          1 V2000

+   -0.0612   -0.3220   -0.2058 C   0  0  0

+   -1.2875    0.2474    0.1859 C   0  0  0

+    1.1065    0.3003    0.1036 C   0  0  0

+   -2.4568   -0.3757   -0.1240 C   0  0  0

+    2.3385   -0.2718   -0.2899 C   0  0  0

+   -3.6841    0.1941    0.2680 C   0  0  0

+    3.4943    0.3442    0.0163 C   0  0  0

+   -4.8500   -0.4273   -0.0410 C   0  0  0

+    4.6728   -0.2031   -0.3601 O   0  0  0

+   -6.1231    0.1639    0.3657 C   0  0  0

+    5.7019    0.6728    0.1044 C   0  0  0

+   -7.2709   -0.4478    0.0616 C   0  0  0

+    7.0683    0.1089   -0.2907 C   0  0  0

+   -8.5837    0.1619    0.4809 C   0  0  0

+    8.1702    1.0466    0.2067 C   0  0  0

+    7.2393   -1.1818    0.2985 O   0  0  0

+   -9.4318    0.4494   -0.7596 C   0  0  0

+   -0.0336   -1.3253    0.0000 H   0  0  0

+   -1.3150    1.2507    0.0000 H   0  0  0

+    1.0790    1.3036    0.0000 H   0  0  0

+   -2.4292   -1.3790    0.0000 H   0  0  0

+    2.3661   -1.2751    0.0000 H   0  0  0

+   -3.7117    1.1974    0.0000 H   0  0  0

+    3.4668    1.3475    0.0000 H   0  0  0

+   -4.8224   -1.4306    0.0000 H   0  0  0

+   -6.1506    1.1672    0.0000 H   0  0  0

+    6.2260    1.5287    0.0000 H   0  0  0

+    4.9392    1.3251    0.0000 H   0  0  0

+   -7.2434   -1.4511    0.0000 H   0  0  0

+    8.0051   -0.2512    0.0000 H   0  0  0

+   -7.7838    0.7680    0.0000 H   0  0  0

+   -8.7444    1.1526    0.0000 H   0  0  0

+    8.8206    0.2823    0.0000 H   0  0  0

+    8.9345    1.6970    0.0000 H   0  0  0

+    7.5198    1.8109    0.0000 H   0  0  0

+    7.3711   -2.1767    0.0000 H   0  0  0

+   -9.1096    1.3999    0.0000 H   0  0  0

+  -10.3823    0.7716    0.0000 H   0  0  0

+   -9.7540   -0.5011    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  3  5  1  0

+  4  6  1  0

+  5  7  2  0

+  6  8  2  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  2  0

+ 11 13  1  0

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+ 13 16  1  0

+ 14 17  1  0

+  1 18  1  0

+  2 19  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  7 24  1  0

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+ 15 34  1  0

+ 15 35  1  0

+ 16 36  1  0

+ 17 37  1  0

+ 17 38  1  0

+ 17 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1467-79-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.5242    0.0000   -0.0016 N   0  0  0

+   -0.8308    0.0000   -0.0004 C   0  0  0

+    1.2567    1.2687    0.0008 C   0  0  0

+    1.2567   -1.2687    0.0008 C   0  0  0

+   -1.9668    0.0000    0.0006 N   0  0  0

+    2.1725    0.7399    0.0000 H   0  0  0

+    1.7855    2.1845    0.0000 H   0  0  0

+    0.3409    1.7975    0.0000 H   0  0  0

+    0.3409   -1.7975    0.0000 H   0  0  0

+    1.7855   -2.1845    0.0000 H   0  0  0

+    2.1725   -0.7399    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  3  0

+  3  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6422-86-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 66 66                          1 V2000

+    1.3816    1.6950    0.1226 C   0  0  0

+    2.8553    1.6950    0.2529 C   0  0  0

+    0.6862    2.9041    0.0613 C   0  0  0

+    0.6870    0.4862    0.0552 C   0  0  0

+    3.5261    0.5285    0.3120 O   0  0  0

+    3.4601    2.7467    0.3065 O   0  0  0

+   -0.6863    2.9041   -0.0600 C   0  0  0

+   -0.6860    0.4862   -0.0662 C   0  0  0

+    4.9725    0.5285    0.4399 C   0  0  0

+   -1.3817    1.6950   -0.1216 C   0  0  0

+    5.4805   -0.9140    0.4847 C   0  0  0

+   -2.8553    1.6950   -0.2518 C   0  0  0

+    7.0045   -0.9140    0.6194 C   0  0  0

+    4.8625   -1.6353    1.6841 C   0  0  0

+   -3.5262    0.5286   -0.3112 O   0  0  0

+   -3.4602    2.7468   -0.3051 O   0  0  0

+    7.6239   -1.6064   -0.5963 C   0  0  0

+    4.1252   -2.8864    1.2023 C   0  0  0

+   -4.9725    0.5286   -0.4390 C   0  0  0

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+   -7.0046   -0.9138   -0.6187 C   0  0  0

+   -4.8626   -1.6349   -1.6837 C   0  0  0

+   -7.6240   -1.6065    0.5969 C   0  0  0

+   -4.1253   -2.8861   -1.2023 C   0  0  0

+   -9.1489   -1.5121    0.5156 C   0  0  0

+   -9.7682   -2.2047    1.7311 C   0  0  0

+    1.2100    3.8096    0.0000 H   0  0  0

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+   -5.0265   -3.4172    0.0000 H   0  0  0

+   -3.5942   -3.7873    0.0000 H   0  0  0

+   -3.2241   -2.3550    0.0000 H   0  0  0

+   -8.8554   -0.5081    0.0000 H   0  0  0

+  -10.0634   -1.0042    0.0000 H   0  0  0

+  -10.5480   -1.5074    0.0000 H   0  0  0

+  -10.4655   -2.9845    0.0000 H   0  0  0

+   -8.9884   -2.9020    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 24 26  1  0

+ 25 27  1  0

+ 27 28  1  0

+  8 10  2  0

+  3 29  1  0

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+  8 32  1  0

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+ 27 62  1  0

+ 27 63  1  0

+ 28 64  1  0

+ 28 65  1  0

+ 28 66  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103554-58-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+    0.4774    0.0254   -0.5057 N   0  0  0

+    1.0606   -1.2172   -0.3202 C   0  0  0

+    1.1936    1.1976   -0.3275 C   0  0  0

+   -0.8172    0.0956   -0.8739 C   0  0  0

+    2.2928   -1.3326    0.3443 C   0  0  0

+    0.4318   -2.3657   -0.7899 C   0  0  0

+    2.4308    1.1811    0.3376 C   0  0  0

+    0.6951    2.4052   -0.8052 C   0  0  0

+   -1.7827    0.1519    0.0647 N   0  0  0

+   -1.1139    0.1082   -2.0526 O   0  0  0

+    2.9576   -0.1072    0.8302 C   0  0  0

+    2.8726   -2.5873    0.5343 C   0  0  0

+    1.0167   -3.5991   -0.5977 C   0  0  0

+    3.1445    2.3657    0.5209 C   0  0  0

+    1.4117    3.5681   -0.6198 C   0  0  0

+   -3.1899    0.2282   -0.3356 C   0  0  0

+    3.8974   -0.1567    1.6023 O   0  0  0

+    2.2316   -3.7117    0.0626 C   0  0  0

+    2.6312    3.5508    0.0415 C   0  0  0

+   -4.0730    0.2809    0.9127 C   0  0  0

+   -5.4840    0.3574    0.5113 N   0  0  0

+   -5.8057   -0.9165   -0.1457 C   0  0  0

+   -6.2732    0.4049    1.7494 C   0  0  0

+   -0.5476   -2.3372    0.0000 H   0  0  0

+   -0.2816    2.4839    0.0000 H   0  0  0

+   -1.7277    1.1302    0.0000 H   0  0  0

+    3.8515   -2.6291    0.0000 H   0  0  0

+    0.4552   -4.4021    0.0000 H   0  0  0

+    4.1222    2.3003    0.0000 H   0  0  0

+    0.9401    4.4270    0.0000 H   0  0  0

+   -3.7280   -0.5906    0.0000 H   0  0  0

+   -2.7482   -0.6464    0.0000 H   0  0  0

+    2.6842   -4.5808    0.0000 H   0  0  0

+    3.1748    4.3660    0.0000 H   0  0  0

+   -3.5349    1.0997    0.0000 H   0  0  0

+   -4.5147    1.1555    0.0000 H   0  0  0

+   -6.7557   -0.6766    0.0000 H   0  0  0

+   -6.0456   -1.8665    0.0000 H   0  0  0

+   -4.8557   -1.1564    0.0000 H   0  0  0

+   -6.2143    1.3830    0.0000 H   0  0  0

+   -7.2513    0.4638    0.0000 H   0  0  0

+   -6.3321   -0.5732    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

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+ 11 17  2  0

+ 12 18  2  0

+ 14 19  2  0

+ 16 20  1  0

+ 20 21  1  0

+ 21 22  1  0

+ 21 23  1  0

+  7 11  1  0

+ 13 18  1  0

+ 15 19  1  0

+  6 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 12 27  1  0

+ 13 28  1  0

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+ 15 30  1  0

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+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

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+ 22 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-35-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.6747   -1.2065   -0.0035 C   0  0  0

+   -0.7073   -1.1877   -0.0026 C   0  0  0

+    1.3822   -0.0187   -0.0024 C   0  0  0

+    1.3973   -2.4983    0.0005 N   0  3  0

+   -1.3822    0.0189   -0.0005 C   0  0  0

+    0.7075    1.1876   -0.0003 C   0  0  0

+    2.6152   -2.5149   -0.0003 O   0  0  0

+    0.7740   -3.5448    0.0045 O   0  5  0

+   -0.6749    1.2064    0.0006 C   0  0  0

+   -2.8623    0.0391   -0.0001 N   0  3  0

+    1.4650    2.4593    0.0004 N   0  3  0

+   -3.4569    1.1021    0.0018 O   0  0  0

+   -3.4856   -1.0074   -0.0015 O   0  5  0

+    0.8704    3.5223    0.0023 O   0  0  0

+    2.6829    2.4427   -0.0008 O   0  5  0

+   -1.2378   -2.0783    0.0000 H   0  0  0

+    2.4187   -0.0328    0.0000 H   0  0  0

+   -1.1810    2.1111    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

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+  5 10  1  0

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+ 10 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 11 15  1  0

+  6  9  1  0

+  2 16  1  0

+  3 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-30-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    1.1243   -0.0976   -0.0017 C   0  0  0

+    0.0000   -0.8196   -0.0013 O   0  0  0

+    0.7712    1.3739   -0.0006 C   0  0  0

+    2.2453   -0.5482    0.0017 O   0  0  0

+   -1.1243   -0.0976    0.0001 C   0  0  0

+   -0.7712    1.3739    0.0007 C   0  0  0

+   -2.2453   -0.5482    0.0007 O   0  0  0

+    1.7610    1.5306    0.0000 H   0  0  0

+    0.6926    2.3729    0.0000 H   0  0  0

+   -0.6926    2.3729    0.0000 H   0  0  0

+   -1.7610    1.5306    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  2  0

+  5  6  1  0

+  3  8  1  0

+  3  9  1  0

+  6 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1571-08-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    2.1197    0.1975    0.0026 C   0  0  0

+    2.7866   -0.9727    0.0038 O   0  0  0

+    2.7327    1.2458   -0.0031 O   0  0  0

+    0.6401    0.2056    0.0020 C   0  0  0

+    4.2386   -0.9807   -0.0017 C   0  0  0

+   -0.0507    1.4187    0.0007 C   0  0  0

+   -0.0643   -1.0000   -0.0031 C   0  0  0

+   -1.4286    1.4274    0.0002 C   0  0  0

+   -1.4417   -0.9935   -0.0037 C   0  0  0

+   -2.1346    0.2210    0.0008 C   0  0  0

+   -3.6087    0.2291    0.0002 C   0  0  0

+   -4.2206   -0.8173    0.0008 O   0  0  0

+    4.2328   -2.0278    0.0000 H   0  0  0

+    5.2857   -0.9865    0.0000 H   0  0  0

+    4.2444    0.0664    0.0000 H   0  0  0

+    0.4784    2.3223    0.0000 H   0  0  0

+    0.4548   -1.9094    0.0000 H   0  0  0

+   -1.9466    2.3374    0.0000 H   0  0  0

+   -1.9697   -1.8977    0.0000 H   0  0  0

+   -4.1272    1.1388    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  1  0

+  6  4  2  0

+  7  4  1  0

+  8  6  1  0

+  9  7  2  0

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+  9 10  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3160-37-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -2.0240    0.6468    0.0639 C   0  0  0

+   -2.3341   -0.7147    0.0485 C   0  0  0

+   -0.7055    1.0547    0.0527 C   0  0  0

+   -3.1893    1.3581    0.0835 O   0  0  0

+   -1.3170   -1.6610    0.0216 C   0  0  0

+   -3.6907   -0.8513    0.0643 O   0  0  0

+    0.3199    0.1009    0.0257 C   0  0  0

+   -4.2107    0.4327   -0.3328 C   0  0  0

+    0.0007   -1.2629    0.0103 C   0  0  0

+    1.7238    0.5289    0.0140 C   0  0  0

+    2.7143   -0.3962   -0.0122 C   0  0  0

+    4.0609    0.0143   -0.0234 C   0  0  0

+    5.1620   -1.0142   -0.0525 C   0  0  0

+    4.3352    1.1975   -0.0096 O   0  0  0

+   -0.4741    2.0676    0.0000 H   0  0  0

+   -1.5518   -2.6731    0.0000 H   0  0  0

+   -4.8135    1.2789    0.0000 H   0  0  0

+   -5.1215   -0.0671    0.0000 H   0  0  0

+    0.7583   -1.9739    0.0000 H   0  0  0

+    1.9583    1.5411    0.0000 H   0  0  0

+    2.4798   -1.4084    0.0000 H   0  0  0

+    4.4528   -1.7735    0.0000 H   0  0  0

+    5.9213   -1.7234    0.0000 H   0  0  0

+    5.8712   -0.2549    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

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+ 10 11  2  0

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+  6  8  1  0

+  7  9  1  0

+  3 15  1  0

+  5 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+540-51-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    1.8068    0.4882    0.0000 C   0  0  0

+    0.8119   -0.6742    0.0000 C   0  0  0

+    3.1400   -0.0260    0.0000 O   0  0  0

+   -1.0224    0.0332    0.0000 Br  0  0  0

+    2.3381    1.5053    0.0000 H   0  0  0

+    0.8562    1.1311    0.0000 H   0  0  0

+    0.2806   -1.6913    0.0000 H   0  0  0

+    1.7625   -1.3170    0.0000 H   0  0  0

+    4.2107   -0.4389    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-27-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -1.3215   -0.2534    0.0753 C   0  0  0

+   -2.4798    0.6023    0.0156 C   0  0  0

+    0.0410    0.3003    0.1296 C   0  0  0

+   -1.5469   -1.6144    0.0851 C   0  0  0

+   -3.6847    0.0009   -0.0307 C   0  0  0

+    1.1031   -0.5276    0.1848 N   0  0  0

+    0.2085    1.5051    0.1247 O   0  0  0

+   -3.2732   -1.7314    0.0157 S   0  0  0

+   -5.0244    0.6273   -0.0959 N   0  3  0

+    2.3993   -0.0085    0.1033 C   0  0  0

+   -6.0219   -0.0706   -0.1322 O   0  0  0

+   -5.1291    1.8407   -0.1132 O   0  5  0

+    3.4877   -0.8664    0.0245 C   0  0  0

+    2.5987    1.3661    0.0954 C   0  0  0

+    4.7705   -0.3483   -0.0565 C   0  0  0

+    3.8791    1.8787    0.0144 C   0  0  0

+    4.9641    1.0263   -0.0588 C   0  0  0

+    5.8383   -1.1854   -0.1334 O   0  0  0

+    7.0042   -0.3622   -0.2044 C   0  0  0

+   -2.3899    1.6369    0.0000 H   0  0  0

+   -0.8488   -2.3833    0.0000 H   0  0  0

+    0.9576   -1.5559    0.0000 H   0  0  0

+    3.3409   -1.8945    0.0000 H   0  0  0

+    1.7828    2.0086    0.0000 H   0  0  0

+    4.0266    2.9067    0.0000 H   0  0  0

+    5.9276    1.4139    0.0000 H   0  0  0

+    7.6032   -1.2105    0.0000 H   0  0  0

+    7.8525    0.2368    0.0000 H   0  0  0

+    6.4052    0.4861    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+ 18 19  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 20  1  0

+  4 21  1  0

+  6 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+ 19 27  1  0

+ 19 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+555-03-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -2.2246    0.3166   -0.0018 N   0  3  0

+   -3.1445   -0.4818   -0.0026 O   0  5  0

+   -2.4561    1.5124    0.0040 O   0  0  0

+   -0.8256   -0.1663   -0.0019 C   0  0  0

+    0.2171    0.7395   -0.0010 C   0  0  0

+   -0.5634   -1.5241    0.0030 C   0  0  0

+    1.5284    0.2862   -0.0010 C   0  0  0

+    0.7422   -1.9784    0.0030 C   0  0  0

+    2.5561    1.1755    0.0002 O   0  0  0

+    1.7888   -1.0763   -0.0019 C   0  0  0

+    3.7636    0.4113   -0.0002 C   0  0  0

+    0.0201    1.7574    0.0000 H   0  0  0

+   -1.3474   -2.2025    0.0000 H   0  0  0

+    0.9362   -2.9969    0.0000 H   0  0  0

+    2.7679   -1.4174    0.0000 H   0  0  0

+    3.2092   -0.4648    0.0000 H   0  0  0

+    4.6397   -0.1431    0.0000 H   0  0  0

+    4.3180    1.2874    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  2  0

+  9  7  1  0

+ 10  7  2  0

+ 11  9  1  0

+  8 10  1  0

+  5 12  1  0

+  6 13  1  0

+  8 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119-26-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.7550    0.4369    0.0074 C   0  0  0

+   -1.1428   -0.8959   -0.0415 C   0  0  0

+    0.5868    0.7636    0.0344 C   0  0  0

+   -1.7785    1.5061    0.0245 N   0  3  0

+   -0.1788   -1.8962   -0.0632 C   0  0  0

+   -2.4987   -1.2298   -0.0694 N   0  0  0

+    1.5435   -0.2344    0.0127 C   0  0  0

+   -1.6250    2.5069   -0.6526 O   0  0  0

+   -2.7740    1.3852    0.7157 O   0  5  0

+    1.1608   -1.5626   -0.0360 C   0  0  0

+   -2.8784   -2.5411   -0.1175 N   0  0  0

+    2.9805    0.1195    0.0417 N   0  3  0

+    3.8244   -0.7586    0.0227 O   0  0  0

+    3.3190    1.2887    0.0847 O   0  5  0

+    0.8770    1.7583    0.0000 H   0  0  0

+   -0.4651   -2.8921    0.0000 H   0  0  0

+   -3.2165   -0.4824    0.0000 H   0  0  0

+    1.8800   -2.3086    0.0000 H   0  0  0

+   -3.8845   -2.7892    0.0000 H   0  0  0

+   -2.1605   -3.2884    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+  7 10  1  0

+  3 15  1  0

+  5 16  1  0

+  6 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2648-51-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.7964   -0.7907    0.0000 C   0  0  0

+   -0.3614   -0.1111    0.0000 C   0  0  0

+    2.0249   -0.0931    0.0000 C   0  0  0

+   -0.3489    1.6248    0.0000 Cl  0  0  0

+   -1.8710   -0.9683    0.0000 Cl  0  0  0

+    3.0719   -0.7077    0.0000 O   0  0  0

+    0.7888   -1.8502    0.0000 H   0  0  0

+    2.0325    0.9664    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  2  0

+  1  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+130796-74-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 59 63                          1 V2000

+    4.3108   -0.1150   -0.1417 N   0  0  0

+    3.2639    0.7460   -0.3542 C   0  0  0

+    5.7351    0.2057   -0.2625 C   0  0  2

+    3.7826   -1.3220    0.2081 C   0  0  0

+    2.0960    0.0004   -0.1221 C   0  0  0

+    3.1559    2.0241   -0.7028 N   0  0  0

+    6.4684   -0.9863   -0.6194 O   0  0  0

+    6.2906    0.6114    1.1207 C   0  0  1

+    2.4832   -1.2512    0.2223 N   0  0  0

+    0.8564    0.6458   -0.2708 C   0  0  0

+    1.9730    2.5871   -0.8298 C   0  0  0

+    7.8286   -0.7348   -0.2043 C   0  0  1

+    7.6996   -0.0215    1.1598 C   0  0  1

+    6.4056    2.0342    1.1891 O   0  0  0

+    0.8479    1.9271   -0.6230 N   0  0  0

+   -0.3278   -0.0371   -0.0551 N   0  0  0

+    8.5589   -2.0661   -0.0166 C   0  0  0

+    8.6832    1.0109    1.2524 O   0  0  0

+   -1.6105    0.6524   -0.2150 C   0  0  0

+    8.5994   -2.7668   -1.2614 O   0  0  0

+   -2.7531   -0.3215    0.0799 C   0  0  1

+   -4.0927    0.3985   -0.0870 C   0  0  0

+   -2.6874   -1.4221   -0.8291 O   0  0  0

+   -5.1599   -0.5111    0.1884 O   0  0  0

+   -6.3172    0.1806    0.0250 C   0  0  0

+   -7.5590   -0.4553    0.2291 C   0  0  0

+   -6.2860    1.4988   -0.3329 C   0  0  0

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+   -7.6337   -1.8067    0.6025 C   0  0  0

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+   -8.6794    1.6375   -0.3206 C   0  0  0

+   -9.9925   -0.3485    0.2565 C   0  0  0

+   -8.8505   -2.3875    0.7904 C   0  0  0

+  -10.0267   -1.6601    0.6185 C   0  0  0

+    5.3131    1.1353    0.0000 H   0  0  0

+    4.3179   -2.1913    0.0000 H   0  0  0

+    5.3998    1.1101    0.0000 H   0  0  0

+    1.9290    3.6071    0.0000 H   0  0  0

+    8.7910   -0.3940    0.0000 H   0  0  0

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+   -0.3126   -1.0579    0.0000 H   0  0  0

+    9.5287   -2.3852    0.0000 H   0  0  0

+    9.2115   -1.2810    0.0000 H   0  0  0

+    9.3874    1.7501    0.0000 H   0  0  0

+   -1.0197    1.4850    0.0000 H   0  0  0

+   -2.3637    1.3416    0.0000 H   0  0  0

+    8.6583   -3.7860    0.0000 H   0  0  0

+   -1.8138   -0.7216    0.0000 H   0  0  0

+   -3.5019    1.2311    0.0000 H   0  0  0

+   -4.8459    1.0877    0.0000 H   0  0  0

+   -2.6266   -2.4412    0.0000 H   0  0  0

+   -5.3892    1.9867    0.0000 H   0  0  0

+   -6.7856   -2.3750    0.0000 H   0  0  0

+   -7.4112    3.2413    0.0000 H   0  0  0

+   -9.5283    2.2047    0.0000 H   0  0  0

+  -10.8563    0.1956    0.0000 H   0  0  0

+   -8.9059   -3.4069    0.0000 H   0  0  0

+  -10.9249   -2.1455    0.0000 H   0  0  0

+  1  2  1  0

+  3  1  1  0

+  1  4  1  0

+  2  5  2  0

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+ 28 32  1  0

+ 29 33  2  0

+ 32 34  2  0

+  5  9  1  0

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+ 29 54  1  0

+ 30 55  1  0

+ 31 56  1  0

+ 32 57  1  0

+ 33 58  1  0

+ 34 59  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+491-59-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.0913    1.1150   -0.0044 C   0  0  0

+   -0.9149   -0.3398   -0.0028 C   0  0  0

+    0.0205    1.9571   -0.0038 C   0  0  0

+   -2.4013    1.6394   -0.0005 C   0  0  0

+    0.3703   -0.8924   -0.0007 C   0  0  0

+   -2.0633   -1.1637   -0.0029 C   0  0  0

+    1.3025    1.4088   -0.0017 C   0  0  0

+   -3.4647    0.7934    0.0045 C   0  0  0

+    1.4831   -0.0455   -0.0002 C   0  0  0

+    0.5356   -2.2385    0.0012 O   0  0  0

+   -3.3014   -0.5895   -0.0045 C   0  0  0

+   -1.9359   -2.5153   -0.0011 O   0  0  0

+    2.4473    2.2346   -0.0006 C   0  0  0

+   -4.8582    1.3671    0.0085 C   0  0  0

+    2.7972   -0.5673    0.0014 C   0  0  0

+    3.6833    1.6709    0.0018 C   0  0  0

+    3.8593    0.2891    0.0015 C   0  0  0

+    3.0004   -1.9096    0.0033 O   0  0  0

+   -0.1068    2.9952    0.0000 H   0  0  0

+   -2.5531    2.6742    0.0000 H   0  0  0

+    0.6631   -3.2766    0.0000 H   0  0  0

+   -4.1483   -1.2032    0.0000 H   0  0  0

+   -1.8378   -3.5566    0.0000 H   0  0  0

+    2.3444    3.2754    0.0000 H   0  0  0

+   -4.4600    2.3342    0.0000 H   0  0  0

+   -5.8253    1.7653    0.0000 H   0  0  0

+   -5.2564    0.4000    0.0000 H   0  0  0

+    4.5254    2.2911    0.0000 H   0  0  0

+    4.8295   -0.1015    0.0000 H   0  0  0

+    3.1569   -2.9437    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  7  9  1  0

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+ 10 21  1  0

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+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+519-73-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+   -0.0005   -0.0361   -0.9112 C   0  0  0

+   -1.2400   -0.7103   -0.3819 C   0  0  0

+    0.0177    1.4032   -0.4653 C   0  0  0

+    1.2207   -0.7419   -0.3806 C   0  0  0

+   -2.1335   -1.2992   -1.2567 C   0  0  0

+   -1.4806   -0.7447    0.9791 C   0  0  0

+    1.2217    2.0655   -0.3169 C   0  0  0

+   -1.1702    2.0630   -0.2100 C   0  0  0

+    2.0533   -1.4269   -1.2454 C   0  0  0

+    1.5112   -0.6996    0.9704 C   0  0  0

+   -3.2707   -1.9177   -0.7711 C   0  0  0

+   -2.6173   -1.3630    1.4646 C   0  0  0

+    1.2385    3.3860    0.0923 C   0  0  0

+   -1.1534    3.3831    0.1990 C   0  0  0

+    3.1737   -2.0744   -0.7586 C   0  0  0

+    2.6312   -1.3469    1.4571 C   0  0  0

+   -3.5140   -1.9471    0.5892 C   0  0  0

+    0.0512    4.0439    0.3530 C   0  0  0

+    3.4610   -2.0369    0.5928 C   0  0  0

+   -0.0131   -1.0066    0.0000 H   0  0  0

+   -1.6342   -2.1314    0.0000 H   0  0  0

+   -1.7860    0.1765    0.0000 H   0  0  0

+    2.0540    1.5663    0.0000 H   0  0  0

+   -2.0098    1.5761    0.0000 H   0  0  0

+    1.5003   -2.2245    0.0000 H   0  0  0

+    1.6942    0.2535    0.0000 H   0  0  0

+   -2.9754   -2.8422    0.0000 H   0  0  0

+   -3.1144   -0.5295    0.0000 H   0  0  0

+    2.0778    3.8733    0.0000 H   0  0  0

+   -1.9854    3.8828    0.0000 H   0  0  0

+    2.9836   -3.0261    0.0000 H   0  0  0

+    3.1863   -0.5508    0.0000 H   0  0  0

+   -4.4261   -2.2788    0.0000 H   0  0  0

+    0.0533    5.0144    0.0000 H   0  0  0

+    4.3932   -2.3069    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  2  0

+  6  2  1  0

+  7  3  2  0

+  8  3  1  0

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+ 11  5  1  0

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+ 16 10  2  0

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+ 18 13  2  0

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+  1 20  1  0

+  5 21  1  0

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+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1484-12-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.7372   -0.7053   -0.0012 C   0  0  0

+   -0.7372   -0.7053   -0.0006 C   0  0  0

+    1.1351    0.6398   -0.0009 C   0  0  0

+    1.6959   -1.7159    0.0031 C   0  0  0

+   -1.1351    0.6398    0.0000 C   0  0  0

+   -1.6959   -1.7159   -0.0010 C   0  0  0

+    0.0000    1.4306   -0.0001 N   0  0  0

+    2.4920    0.9493   -0.0009 C   0  0  0

+    3.0348   -1.3896    0.0010 C   0  0  0

+   -2.4920    0.9493    0.0007 C   0  0  0

+   -3.0348   -1.3896   -0.0007 C   0  0  0

+    0.0000    2.8956    0.0012 C   0  0  0

+    3.4298   -0.0605   -0.0012 C   0  0  0

+   -3.4298   -0.0605    0.0007 C   0  0  0

+    1.4016   -2.7153    0.0000 H   0  0  0

+   -1.4016   -2.7153    0.0000 H   0  0  0

+    2.7989    1.9449    0.0000 H   0  0  0

+    3.7529   -2.1444    0.0000 H   0  0  0

+   -2.7989    1.9449    0.0000 H   0  0  0

+   -3.7529   -2.1444    0.0000 H   0  0  0

+    1.0419    2.8956    0.0000 H   0  0  0

+    0.0000    3.9375    0.0000 H   0  0  0

+   -1.0419    2.8956    0.0000 H   0  0  0

+    4.4443    0.1768    0.0000 H   0  0  0

+   -4.4443    0.1768    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  2  0

+ 10 14  2  0

+  5  7  1  0

+  9 13  1  0

+ 11 14  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-55-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    1.8920    0.0677   -0.0265 C   0  0  0

+    0.4005    0.0080   -0.3623 C   0  0  0

+    2.5314    1.2525   -0.7534 C   0  0  0

+    2.0683    0.2404    1.4835 C   0  0  0

+    2.5232   -1.1444   -0.4442 O   0  0  0

+   -0.2405   -1.1798    0.3665 C   0  0  0

+   -0.2812    1.2927    0.1133 C   0  0  0

+   -1.6857   -1.3210   -0.1161 C   0  0  0

+   -1.7727    1.1430    0.0427 C   0  0  0

+   -2.3838    0.0059   -0.0527 C   0  0  0

+   -3.8899    0.0151   -0.1032 C   0  0  0

+   -0.6886    0.0118    0.0000 H   0  0  0

+    3.4898    0.7353    0.0000 H   0  0  0

+    3.0486    2.2109    0.0000 H   0  0  0

+    1.5730    1.7697    0.0000 H   0  0  0

+    2.8304   -0.5376    0.0000 H   0  0  0

+    2.8463    1.0025    0.0000 H   0  0  0

+    1.3062    1.0184    0.0000 H   0  0  0

+    3.0262   -2.1103    0.0000 H   0  0  0

+   -0.3493   -2.2634    0.0000 H   0  0  0

+    0.8007   -1.4990    0.0000 H   0  0  0

+    0.7386    1.6749    0.0000 H   0  0  0

+   -0.5287    2.3533    0.0000 H   0  0  0

+   -2.7067   -1.6999    0.0000 H   0  0  0

+   -1.4413   -2.3823    0.0000 H   0  0  0

+   -2.3776    2.0486    0.0000 H   0  0  0

+   -3.8832    1.1041    0.0000 H   0  0  0

+   -4.9789    0.0218    0.0000 H   0  0  0

+   -3.8966   -1.0739    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+ 10 11  1  0

+  9 10  2  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3290-92-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 49                          1 V2000

+    0.0000    0.9589    0.1192 C   0  0  0

+    0.0000   -0.3464    0.9173 C   0  0  0

+    1.2492    1.0177   -0.7622 C   0  0  0

+   -1.2492    1.0177   -0.7622 C   0  0  0

+    0.0000    2.1465    1.0837 C   0  0  0

+    0.0000   -1.4735    0.0019 O   0  0  0

+    2.4348    0.9619    0.0743 O   0  0  0

+   -2.4348    0.9618    0.0743 O   0  0  0

+    0.0000    3.4518    0.2855 C   0  0  0

+    0.0000   -2.7327    0.4831 C   0  0  0

+    3.6591    0.9994   -0.4885 C   0  0  0

+   -3.6591    0.9994   -0.4885 C   0  0  0

+    0.0000   -3.8733   -0.4433 C   0  0  0

+    0.0000   -2.9246    1.6832 O   0  0  0

+    4.8589    0.9430    0.3581 C   0  0  0

+    3.7706    1.0800   -1.6960 O   0  0  0

+   -4.8589    0.9429    0.3580 C   0  0  0

+   -3.7706    1.0800   -1.6960 O   0  0  0

+    0.0000   -3.6354   -1.9314 C   0  0  0

+    0.0000   -5.1165    0.0318 C   0  0  0

+    4.7206    0.8430    1.8554 C   0  0  0

+    6.0677    0.9800   -0.1975 C   0  0  0

+   -4.7206    0.8429    1.8554 C   0  0  0

+   -6.0677    0.9799   -0.1976 C   0  0  0

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+   -0.7802    1.6961    0.0000 H   0  0  0

+    0.9008    3.4518    0.0000 H   0  0  0

+    0.0000    4.3526    0.0000 H   0  0  0

+   -0.9008    3.4518    0.0000 H   0  0  0

+    0.9008   -3.6354    0.0000 H   0  0  0

+    0.0000   -2.7346    0.0000 H   0  0  0

+   -0.9008   -3.6354    0.0000 H   0  0  0

+   -0.7802   -5.5669    0.0000 H   0  0  0

+    0.7802   -5.5669    0.0000 H   0  0  0

+    4.1928    1.5730    0.0000 H   0  0  0

+    3.9906    0.3152    0.0000 H   0  0  0

+    5.2484    0.1130    0.0000 H   0  0  0

+    6.5418    0.2140    0.0000 H   0  0  0

+    6.4940    1.7736    0.0000 H   0  0  0

+   -5.2484    0.1129    0.0000 H   0  0  0

+   -3.9906    0.3151    0.0000 H   0  0  0

+   -4.1928    1.5729    0.0000 H   0  0  0

+   -6.4940    1.7735    0.0000 H   0  0  0

+   -6.5418    0.2139    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  1  1  0

+  6  2  1  0

+  7  3  1  0

+  8  4  1  0

+  9  5  1  0

+ 10  6  1  0

+ 11  7  1  0

+ 12  8  1  0

+ 13 10  1  0

+ 14 10  2  0

+ 15 11  1  0

+ 16 11  2  0

+ 17 12  1  0

+ 18 12  2  0

+ 19 13  1  0

+ 20 13  2  0

+ 21 15  1  0

+ 22 15  2  0

+ 23 17  1  0

+ 24 17  2  0

+  2 25  1  0

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+  3 27  1  0

+  3 28  1  0

+  4 29  1  0

+  4 30  1  0

+  5 31  1  0

+  5 32  1  0

+  9 33  1  0

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+ 19 36  1  0

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+ 21 43  1  0

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+ 22 45  1  0

+ 23 46  1  0

+ 23 47  1  0

+ 23 48  1  0

+ 24 49  1  0

+ 24 50  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60599-38-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -0.0620   -0.3397    0.1496 N   0  0  0

+   -1.0773    0.4843    0.8102 C   0  0  0

+    0.8501    0.2635   -0.8254 C   0  0  0

+    0.0325   -1.5952    0.4304 N   0  0  0

+   -2.3441    0.4706   -0.0059 C   0  0  0

+    2.0815    0.7665   -0.1170 C   0  0  0

+    0.8766   -2.2802   -0.1188 O   0  0  0

+   -3.5491    1.2465    0.4601 C   0  0  0

+   -2.3937   -0.1621   -1.0333 O   0  0  0

+    3.1819    1.4339   -0.9010 C   0  0  0

+    2.1864    0.6347    1.0788 O   0  0  0

+   -0.2935    1.0162    0.0000 H   0  0  0

+   -1.3604    1.3882    0.0000 H   0  0  0

+    0.9166    1.2084    0.0000 H   0  0  0

+    0.0321    0.7410    0.0000 H   0  0  0

+   -3.0363    2.0429    0.0000 H   0  0  0

+   -4.3455    1.7593    0.0000 H   0  0  0

+   -4.0619    0.4501    0.0000 H   0  0  0

+    3.6731    0.6240    0.0000 H   0  0  0

+    3.9918    1.9251    0.0000 H   0  0  0

+    2.6907    2.2438    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  6 11  2  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  3 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+229-87-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    0.7485   -0.4165   -0.0012 C   0  0  0

+   -0.7171   -0.4203   -0.0006 C   0  0  0

+    1.3993    0.8411   -0.0005 C   0  0  0

+    1.5022   -1.5879    0.0033 C   0  0  0

+   -1.3862    0.8255    0.0006 C   0  0  0

+   -1.4517   -1.6057   -0.0018 C   0  0  0

+    0.6156    2.0164    0.0007 C   0  0  0

+    2.7988    0.8858   -0.0014 C   0  0  0

+    2.8671   -1.5109    0.0030 C   0  0  0

+   -0.6864    1.9722    0.0008 N   0  0  0

+   -2.7888    0.8407    0.0011 C   0  0  0

+   -2.8170   -1.5555   -0.0017 C   0  0  0

+    3.5106   -0.2788   -0.0030 C   0  0  0

+   -3.4807   -0.3345    0.0004 C   0  0  0

+    1.0283   -2.5177    0.0000 H   0  0  0

+   -0.9609   -2.5267    0.0000 H   0  0  0

+    1.0923    2.9448    0.0000 H   0  0  0

+    3.2947    1.8041    0.0000 H   0  0  0

+    3.4328   -2.3879    0.0000 H   0  0  0

+   -3.3018    1.7495    0.0000 H   0  0  0

+   -3.3668   -2.4426    0.0000 H   0  0  0

+    4.5536   -0.2437    0.0000 H   0  0  0

+   -4.5242   -0.3166    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

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+  4 15  1  0

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+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+81840-15-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 57                          1 V2000

+    2.8379   -0.0703   -0.3325 C   0  0  0

+    1.4800   -0.4042   -0.3715 N   0  0  0

+    3.7653   -0.9875    0.1458 C   0  0  0

+    3.2597    1.1758   -0.7771 C   0  0  0

+    0.7750    0.7603   -0.9193 C   0  0  0

+    1.0452   -0.5656    1.0206 C   0  0  0

+    5.1048   -0.6575    0.1837 C   0  0  0

+    4.6002    1.5052   -0.7392 C   0  0  0

+   -0.7234    0.4554   -1.0142 C   0  0  0

+   -0.4354   -0.9580    1.0538 C   0  0  0

+    5.5262    0.5906   -0.2564 C   0  0  0

+    6.1134   -1.6492    0.7028 C   0  0  0

+   -1.2025    0.0616    0.3204 N   0  0  0

+    6.8866    0.9221   -0.2166 N   0  0  0

+    7.4261   -1.4932   -0.0657 C   0  0  0

+   -2.3088    0.6166    0.8538 C   0  0  0

+    7.8204   -0.0417   -0.1174 C   0  0  0

+   -3.6440    0.1247    0.4613 C   0  0  0

+   -2.2070    1.5226    1.6584 O   0  0  0

+    8.9935    0.2628   -0.0697 O   0  0  0

+   -4.6889    1.0285    0.2492 C   0  0  0

+   -3.8645   -1.2444    0.2955 C   0  0  0

+   -5.9363    0.5632   -0.1178 C   0  0  0

+   -5.1118   -1.7023   -0.0709 C   0  0  0

+   -6.1511   -0.8054   -0.2760 C   0  0  0

+   -6.9553    1.4399   -0.3246 O   0  0  0

+   -7.3783   -1.2615   -0.6366 O   0  0  0

+   -6.4298    2.7474   -0.0876 C   0  0  0

+   -7.2829   -2.6851   -0.7162 C   0  0  0

+    3.4955   -1.9655    0.0000 H   0  0  0

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+   -1.3177   -1.4589    0.0000 H   0  0  0

+   -0.0518   -1.8973    0.0000 H   0  0  0

+    5.2585   -2.1955    0.0000 H   0  0  0

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+    7.1680    1.8968    0.0000 H   0  0  0

+    7.4164   -2.5077    0.0000 H   0  0  0

+    8.4311   -1.6322    0.0000 H   0  0  0

+   -4.5092    2.0270    0.0000 H   0  0  0

+   -3.0816   -1.8897    0.0000 H   0  0  0

+   -5.2935   -2.7005    0.0000 H   0  0  0

+   -5.4884    2.3690    0.0000 H   0  0  0

+   -6.0514    3.6888    0.0000 H   0  0  0

+   -7.3712    3.1258    0.0000 H   0  0  0

+   -8.2952   -2.7529    0.0000 H   0  0  0

+   -7.2151   -3.6974    0.0000 H   0  0  0

+   -6.2706   -2.6173    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  8 11  2  0

+ 10 13  1  0

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+  3 30  1  0

+  4 31  1  0

+  5 32  1  0

+  5 33  1  0

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+  6 35  1  0

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+  9 37  1  0

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+ 10 39  1  0

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+ 14 43  1  0

+ 15 44  1  0

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+ 21 46  1  0

+ 22 47  1  0

+ 24 48  1  0

+ 28 49  1  0

+ 28 50  1  0

+ 28 51  1  0

+ 29 52  1  0

+ 29 53  1  0

+ 29 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+26196-04-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    1.0101    0.0725   -0.0478 C   0  0  0

+   -0.3708   -0.5676   -0.2039 C   0  0  0

+    0.4289   -0.7495    0.9664 O   0  0  0

+    2.1636   -0.5124   -0.8653 C   0  0  0

+    1.0726    1.5801    0.2054 C   0  0  0

+   -1.3807    0.4093    0.0564 O   0  0  0

+   -2.6074   -0.1196   -0.4511 C   0  0  0

+   -0.8478   -1.4487    0.0000 H   0  0  0

+    1.7105   -1.4060    0.0000 H   0  0  0

+    3.0572   -0.9655    0.0000 H   0  0  0

+    2.6167    0.3812    0.0000 H   0  0  0

+    2.0736    1.5386    0.0000 H   0  0  0

+    1.1141    2.5811    0.0000 H   0  0  0

+    0.0716    1.6216    0.0000 H   0  0  0

+   -3.0041    0.8004    0.0000 H   0  0  0

+   -3.5274   -0.5163    0.0000 H   0  0  0

+   -2.2107   -1.0396    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  2  3  1  0

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+  4  9  1  0

+  4 10  1  0

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+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-87-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.7075    0.6695   -0.3781 C   0  0  0

+   -0.5684    1.0285    0.3862 C   0  0  0

+    1.8195    1.6515   -0.0040 C   0  0  0

+    1.2152   -1.0059    0.0533 Cl  0  0  0

+   -1.8787   -0.1288   -0.0547 Cl  0  0  0

+    0.4376    1.8510    0.0000 H   0  0  0

+   -0.0246    2.1116    0.0000 H   0  0  0

+   -1.5285    1.7680    0.0000 H   0  0  0

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+    2.7279    2.4537    0.0000 H   0  0  0

+    1.0173    2.5599    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+76-06-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    0.1398    0.0000    0.0000 C   0  0  0

+   -1.3252    0.0000    0.0000 N   0  3  0

+    0.7408   -0.8499    1.4721 Cl  0  0  0

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+    0.7408    1.6999    0.0000 Cl  0  0  0

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+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+138580-44-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.8518    0.7201    0.0019 C   0  0  0

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+ 18 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110-30-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+118117                          1 V2000

+    1.8270   -0.3750   -0.0041 N   0  0  0

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+ 42118  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-33-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 50                          1 V2000

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+612-25-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

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+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1838-56-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.8813   -0.4741    0.0595 C   0  0  0

+   -2.3508   -0.3024   -0.0529 C   0  0  0

+   -0.2902    0.7574    0.3323 C   0  0  0

+   -0.0797   -1.6118   -0.0565 C   0  0  0

+   -2.6785    1.0353    0.1495 C   0  0  0

+   -3.3662   -1.2249   -0.3132 C   0  0  0

+   -1.3938    1.7845    0.4051 C   0  0  0

+    1.0762    0.8574    0.4827 C   0  0  0

+    1.2906   -1.5100    0.0933 C   0  0  0

+   -3.9942    1.4446    0.0936 C   0  0  0

+   -4.6792   -0.8064   -0.3676 C   0  0  0

+    1.8738   -0.2729    0.3626 C   0  0  0

+    2.0703   -2.6183   -0.0194 O   0  0  0

+   -4.9952    0.5251   -0.1643 C   0  0  0

+    3.2619   -0.1706    0.5150 N   0  0  0

+    3.9554    0.7273   -0.2126 C   0  0  0

+    5.4269    0.9285    0.0426 C   0  0  0

+    3.3951    1.3734   -1.0727 O   0  0  0

+   -0.5205   -2.5446    0.0000 H   0  0  0

+   -3.1466   -2.2330    0.0000 H   0  0  0

+   -0.6205    2.4675    0.0000 H   0  0  0

+   -1.9981    2.6208    0.0000 H   0  0  0

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+   -5.4358   -1.5079    0.0000 H   0  0  0

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+    6.4491    1.0683    0.0000 H   0  0  0

+    5.2871    1.9507    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 15 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1468-95-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    1.2044   -0.2549   -0.1508 C   0  0  0

+   -0.0001   -0.9487   -0.2539 C   0  0  0

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+    2.4425   -0.9262   -0.2461 C   0  0  0

+   -1.2043   -0.2553   -0.1493 C   0  0  0

+   -0.0001   -2.4391   -0.4767 C   0  0  0

+   -0.0002    1.8889    0.1702 C   0  0  0

+    2.4421    1.8663    0.1666 C   0  0  0

+    3.5970   -0.2200   -0.1408 C   0  0  0

+   -1.2043    1.1951    0.0680 C   0  0  0

+   -2.4425   -0.9259   -0.2494 C   0  0  0

+    0.0005   -3.1094    0.7854 O   0  0  0

+    3.5969    1.1607    0.0607 C   0  0  0

+   -2.4423    1.8660    0.1688 C   0  0  0

+   -3.5970   -0.2199   -0.1434 C   0  0  0

+   -3.5969    1.1601    0.0633 C   0  0  0

+    2.4697   -1.9682    0.0000 H   0  0  0

+   -0.9030   -1.9182    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57471-01-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 60                          1 V2000

+    0.3691   -0.6141   -0.3892 C   0  0  0

+   -0.7531   -1.4578   -0.3778 C   0  0  0

+    0.2110    0.7396   -0.6457 C   0  0  0

+    1.6037   -1.1206   -0.1445 O   0  0  0

+   -2.0231   -0.9235   -0.6259 C   0  0  0

+   -0.5956   -2.8921   -0.1077 C   0  0  0

+   -1.0445    1.2577   -0.8892 C   0  0  0

+    2.5217   -0.0285   -0.2258 C   0  0  0

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+   -1.8030   -3.7938   -0.0965 C   0  0  0

+    0.5064   -3.3515    0.1065 O   0  0  0

+    3.9408   -0.5342    0.0417 C   0  0  0

+   -3.4328    0.9656   -1.1290 N   0  0  0

+    4.9237    0.6351   -0.0454 C   0  0  0

+    4.0023   -1.1119    1.3473 O   0  0  0

+   -4.4293    0.7788   -0.2411 C   0  0  0

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+  1  2  2  0

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+ 27 58  1  0

+ 27 59  1  0

+ 27 60  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5326-87-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.9582   -1.1629    0.1128 N   0  0  0

+   -0.1854   -0.4506    0.0763 C   0  0  0

+    2.1929   -0.5078    0.0475 C   0  0  0

+   -1.5129   -1.1601    0.0032 C   0  0  0

+   -0.1460    0.7613    0.1022 O   0  0  0

+    3.3665   -1.2433   -0.0510 C   0  0  0

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+   -2.9635    0.1664   -0.0346 Br  0  0  0

+    4.5837   -0.5935   -0.1157 C   0  0  0

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+  6 15  1  0

+  7 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+943-93-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    2.1202    0.4274    0.6666 C   0  0  0

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+ 13 30  1  0

+ 13 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7696-12-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 51                          1 V2000

+   -3.5054    0.2377   -0.1054 C   0  0  0

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+ 13 40  1  0

+ 13 41  1  0

+ 21 42  1  0

+ 21 43  1  0

+ 22 44  1  0

+ 22 45  1  0

+ 23 46  1  0

+ 23 47  1  0

+ 24 48  1  0

+ 24 49  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-26-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    1.1831    0.0000    0.4282 C   0  0  0

+    1.8431   -1.2492   -0.1591 C   0  0  0

+    1.8430    1.2492   -0.1591 C   0  0  0

+   -0.7319    0.0000   -0.0165 Br  0  0  0

+    2.2427    0.0000    0.0000 H   0  0  0

+    0.9062   -1.7442    0.0000 H   0  0  0

+    2.3381   -2.1861    0.0000 H   0  0  0

+    2.7800   -0.7542    0.0000 H   0  0  0

+    2.7799    0.7543    0.0000 H   0  0  0

+    2.3379    2.1861    0.0000 H   0  0  0

+    0.9061    1.7441    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+621-42-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.1570    0.5904   -0.2925 C   0  0  0

+    0.5328   -0.6103   -0.3870 C   0  0  0

+    0.5139    1.7470    0.0831 C   0  0  0

+   -1.5254    0.6367   -0.5808 N   0  0  0

+    1.8892   -0.6511   -0.1062 C   0  0  0

+    1.8664    1.7024    0.3622 C   0  0  0

+   -2.3779   -0.1848    0.0633 C   0  0  0

+    2.5547    0.5080    0.2687 C   0  0  0

+    2.5675   -1.8252   -0.1974 O   0  0  0

+   -3.8305   -0.2265   -0.3358 C   0  0  0

+   -1.9761   -0.8904    0.9642 O   0  0  0

+    0.0102   -1.4827    0.0000 H   0  0  0

+    0.0209    2.6365    0.0000 H   0  0  0

+   -1.8899    1.5861    0.0000 H   0  0  0

+    2.3897    2.5744    0.0000 H   0  0  0

+    3.5717    0.5088    0.0000 H   0  0  0

+    3.0762   -2.7058    0.0000 H   0  0  0

+   -3.8597    0.7900    0.0000 H   0  0  0

+   -4.8470   -0.2557    0.0000 H   0  0  0

+   -3.8013   -1.2430    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  6  8  2  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+124-02-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.0000   -0.2948   -0.0033 N   0  0  0

+   -1.1595    0.5844   -0.2047 C   0  0  0

+    1.1595    0.5797    0.2178 C   0  0  0

+   -2.3903   -0.2531   -0.4384 C   0  0  0

+    2.3903   -0.2628    0.4326 C   0  0  0

+   -3.4125   -0.1564    0.3752 C   0  0  0

+    3.4125   -0.1480   -0.3786 C   0  0  0

+   -0.0014   -1.3851    0.0000 H   0  0  0

+   -0.4108    1.3770    0.0000 H   0  0  0

+   -1.8666    1.4143    0.0000 H   0  0  0

+    1.8688    1.4077    0.0000 H   0  0  0

+    0.4129    1.3742    0.0000 H   0  0  0

+   -2.1189   -1.3091    0.0000 H   0  0  0

+    2.1267   -1.3207    0.0000 H   0  0  0

+   -3.8663    0.8350    0.0000 H   0  0  0

+   -4.0441   -1.0451    0.0000 H   0  0  0

+    4.0596   -1.0255    0.0000 H   0  0  0

+    3.8489    0.8512    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146818-20-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -1.2946   -0.3620    0.0726 C   0  0  0

+   -2.3509    0.6187    0.0602 C   0  0  0

+    0.1179    0.0314    0.1986 C   0  0  0

+   -1.6670   -1.6862   -0.0331 C   0  0  0

+   -3.6122    0.1599   -0.0592 C   0  0  0

+    1.0816   -0.9107    0.2069 N   0  0  0

+    0.4155    1.2069    0.2953 O   0  0  0

+   -3.3930   -1.6055   -0.1457 S   0  0  0

+   -4.8734    0.9340   -0.0988 N   0  3  0

+    2.4284   -0.5335    0.1936 C   0  0  0

+   -5.9394    0.3559   -0.2121 O   0  0  0

+   -4.8450    2.1490   -0.0181 O   0  5  0

+    3.4201   -1.4979    0.0664 C   0  0  0

+    2.7769    0.8063    0.3018 C   0  0  0

+    4.7488   -1.1222    0.0536 C   0  0  0

+    4.1078    1.1755    0.2883 C   0  0  0

+    5.0927    0.2126    0.1673 C   0  0  0

+    6.5438    0.6190    0.1530 C   0  0  0

+    6.9827    0.8922   -1.2870 C   0  0  0

+   -2.1454    1.6338    0.0000 H   0  0  0

+   -1.0610   -2.5262    0.0000 H   0  0  0

+    0.8249   -1.9141    0.0000 H   0  0  0

+    3.1659   -2.5020    0.0000 H   0  0  0

+    2.0386    1.5327    0.0000 H   0  0  0

+    5.4897   -1.8460    0.0000 H   0  0  0

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+    6.3829   -0.4042    0.0000 H   0  0  0

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+    7.5300    0.0129    0.0000 H   0  0  0

+    7.8620    1.4395    0.0000 H   0  0  0

+    6.4354    1.7715    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  2  0

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+ 13 15  2  0

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+ 18 19  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 20  1  0

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+  6 22  1  0

+ 13 23  1  0

+ 14 24  1  0

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+ 16 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101328-75-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 54                          1 V2000

+   -0.0427   -0.4475   -0.6457 C   0  0  0

+   -1.1927   -1.2147   -0.4289 C   0  0  0

+   -0.0112    0.9879   -0.9290 C   0  0  0

+    1.2741   -0.9213   -0.6349 C   0  0  0

+   -2.4917   -0.4796   -0.5218 C   0  0  2

+   -0.9739   -2.5289   -0.1682 C   0  0  0

+   -1.3159    1.7477   -0.9726 C   0  0  0

+    1.2681    1.2919   -1.0793 C   0  0  0

+    2.0538    0.1619   -0.9080 N   0  0  0

+    1.4639   -2.2765   -0.3701 C   0  0  0

+   -2.3145    0.9799   -0.0988 C   0  0  1

+   -3.5491   -1.1175    0.3330 C   0  0  0

+    0.3249   -3.0354   -0.1370 C   0  0  0

+    3.5151    0.1363   -1.0089 C   0  0  0

+   -3.6236    1.6387   -0.1044 N   0  0  0

+   -4.3841   -0.3969    1.0261 C   0  0  0

+    4.1262    0.4094    0.3669 C   0  0  0

+   -4.3636    1.1028    1.0435 C   0  0  0

+   -3.3818    3.0604    0.1756 C   0  0  0

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+    4.5245    1.3642    0.0000 H   0  0  0

+    3.3856    1.1317    0.0000 H   0  0  0

+   -4.7791    2.0502    0.0000 H   0  0  0

+   -5.3775    0.8975    0.0000 H   0  0  0

+   -2.3619    2.8869    0.0000 H   0  0  0

+   -3.2083    4.0803    0.0000 H   0  0  0

+   -4.4017    3.2339    0.0000 H   0  0  0

+   -6.0078   -0.2521    0.0000 H   0  0  0

+   -6.2796   -1.6897    0.0000 H   0  0  0

+   -4.8420   -1.9615    0.0000 H   0  0  0

+    5.2541   -0.5721    0.0000 H   0  0  0

+    6.3930   -0.3396    0.0000 H   0  0  0

+    6.6616    1.6106    0.0000 H   0  0  0

+    5.5226    1.3781    0.0000 H   0  0  0

+    7.7713   -0.4054    0.0000 H   0  0  0

+    8.8239    0.6108    0.0000 H   0  0  0

+    7.8077    1.6634    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  3  7  1  0

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+  7 11  1  0

+  8  9  1  0

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+ 22 47  1  0

+ 22 48  1  0

+ 23 49  1  0

+ 23 50  1  0

+ 23 51  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1126-76-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    0.9503    0.0761    0.4481 C   0  0  0

+   -0.4554    0.2019    0.9764 C   0  0  0

+    1.6900    1.2115    0.1738 C   0  0  0

+    1.5022   -1.1744    0.2431 C   0  0  0

+   -1.4383    0.2487   -0.1953 C   0  0  0

+    2.9792    1.0961   -0.3108 C   0  0  0

+    2.7919   -1.2899   -0.2416 C   0  0  0

+   -2.8654    0.3764    0.3411 C   0  0  0

+    3.5292   -0.1548   -0.5213 C   0  0  0

+   -3.8483    0.4232   -0.8305 C   0  0  0

+   -3.6296   -0.7617   -0.0623 O   0  0  0

+    0.1173    1.0408    0.0000 H   0  0  0

+   -0.9083    1.1111    0.0000 H   0  0  0

+    1.2463    2.1252    0.0000 H   0  0  0

+    0.9102   -1.9998    0.0000 H   0  0  0

+   -2.0110   -0.5902    0.0000 H   0  0  0

+   -0.9854   -0.6605    0.0000 H   0  0  0

+    3.5718    1.9211    0.0000 H   0  0  0

+    3.2362   -2.2033    0.0000 H   0  0  0

+   -2.7960    1.3898    0.0000 H   0  0  0

+    4.5416   -0.2369    0.0000 H   0  0  0

+   -3.8779    1.4385    0.0000 H   0  0  0

+   -4.8584    0.3159    0.0000 H   0  0  0

+  1  2  1  0

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+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146177-61-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -0.6833    0.7627   -0.0032 C   0  0  0

+   -1.3709   -0.4536   -0.0026 C   0  0  0

+    0.7774    0.7436   -0.0019 C   0  0  0

+   -1.6066    1.7511    0.0005 N   0  0  0

+   -0.6698   -1.6621   -0.0005 C   0  0  0

+   -2.7174   -0.1326   -0.0041 N   0  0  0

+    1.4419   -0.5082   -0.0001 C   0  0  0

+    1.4874    1.8707   -0.0028 N   0  0  0

+   -2.8092    1.2279    0.0032 C   0  0  0

+    0.6867   -1.6963    0.0012 C   0  0  0

+   -1.4384   -2.9584    0.0006 C   0  0  0

+   -3.8359   -1.0787   -0.0042 C   0  0  0

+    2.7786   -0.5410    0.0012 N   0  0  0

+    2.8018    1.8135   -0.0020 C   0  0  0

+   -3.9879    1.9449    0.0076 N   0  0  0

+    1.3955   -3.0262    0.0040 C   0  0  0

+    3.4587    0.5840    0.0006 C   0  0  0

+    4.9652    0.5440    0.0020 C   0  0  0

+   -2.3346   -2.4271    0.0000 H   0  0  0

+   -1.9697   -3.8546    0.0000 H   0  0  0

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+   -3.1631   -1.8741    0.0000 H   0  0  0

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+    0.4761   -3.5162    0.0000 H   0  0  0

+    1.8855   -3.9456    0.0000 H   0  0  0

+    2.3149   -2.5362    0.0000 H   0  0  0

+    4.9375   -0.4975    0.0000 H   0  0  0

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+  1  2  2  0

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+ 16 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58-08-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.9156    0.2202   -0.0025 C   0  0  0

+   -0.4355   -1.0835   -0.0019 C   0  0  0

+    0.0035    1.2915   -0.0013 C   0  0  0

+   -2.2928    0.1248    0.0012 N   0  0  0

+    0.9342   -1.2917   -0.0006 N   0  0  0

+   -1.4957   -1.8956   -0.0029 N   0  0  0

+    1.3262    1.0248    0.0004 N   0  0  0

+   -0.3927    2.4432   -0.0021 O   0  0  0

+   -2.5965   -1.1879    0.0039 C   0  0  0

+   -3.2436    1.2393    0.0021 C   0  0  0

+    1.7768   -0.2416    0.0001 C   0  0  0

+    1.4665   -2.6565    0.0005 C   0  0  0

+    2.2855    2.1320    0.0017 C   0  0  0

+    2.9759   -0.4439    0.0017 O   0  0  0

+   -3.5340   -1.5689    0.0000 H   0  0  0

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+  1  2  2  0

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+  9 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2243-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.6028   -0.6373   -0.0097 C   0  0  0

+   -0.8780   -0.5524   -0.0118 C   0  0  0

+    1.3687    0.5271    0.0115 C   0  0  0

+    1.2307   -1.8822   -0.0232 C   0  0  0

+   -1.5696   -0.4463   -1.2178 C   0  0  0

+   -1.5806   -0.5841    1.1917 C   0  0  0

+    2.7452    0.4457    0.0138 C   0  0  0

+    0.7049    1.8500    0.0310 N   0  3  0

+    2.6071   -1.9588   -0.0208 C   0  0  0

+   -2.9458   -0.3674   -1.2174 C   0  0  0

+   -2.9572   -0.5050    1.1875 C   0  0  0

+    3.3690   -0.7961   -0.0050 C   0  0  0

+    1.3687    2.8661   -0.0718 O   0  0  0

+   -0.5051    1.9225    0.1499 O   0  5  0

+   -3.6442   -0.3935   -0.0156 C   0  0  0

+    4.7630   -0.8761   -0.0026 N   0  0  0

+   -5.0381   -0.3130   -0.0175 N   0  0  0

+    0.6643   -2.7475    0.0000 H   0  0  0

+   -1.4615    0.5822    0.0000 H   0  0  0

+   -1.5870   -1.6182    0.0000 H   0  0  0

+    3.3138    1.3095    0.0000 H   0  0  0

+    3.0732   -2.8820    0.0000 H   0  0  0

+   -2.9355    0.6667    0.0000 H   0  0  0

+   -3.0699   -1.5330    0.0000 H   0  0  0

+    5.2279   -1.7999    0.0000 H   0  0  0

+    5.3305   -0.0116    0.0000 H   0  0  0

+   -5.5027    0.6109    0.0000 H   0  0  0

+   -5.6060   -1.1773    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  7 12  2  0

+  8 13  2  0

+  8 14  1  0

+ 10 15  1  0

+ 12 16  1  0

+ 15 17  1  0

+  9 12  1  0

+ 11 15  2  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6287-38-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -3.2783   -0.6320    0.0003 C   0  0  0

+   -4.1913    0.1660    0.0012 O   0  0  0

+   -1.8862   -0.1568    0.0011 C   0  0  0

+   -0.8306   -1.0744    0.0002 C   0  0  0

+   -1.6120    1.2152   -0.0030 C   0  0  0

+    0.4723   -0.6213    0.0005 C   0  0  0

+   -0.3056    1.6538   -0.0027 C   0  0  0

+    1.7847   -1.7578   -0.0007 Cl  0  0  0

+    0.7359    0.7399    0.0012 C   0  0  0

+    2.3784    1.3019    0.0010 Cl  0  0  0

+   -3.4803   -1.6567    0.0000 H   0  0  0

+   -1.0283   -2.1000    0.0000 H   0  0  0

+   -2.3958    1.9055    0.0000 H   0  0  0

+   -0.1000    2.6778    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  1  0

+  9  6  2  0

+ 10  9  1  0

+  7  9  1  0

+  1 11  1  0

+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81486-22-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 46                          1 V2000

+   -1.1686   -0.5284   -0.1774 C   0  0  0

+   -2.0936   -1.5518   -0.1604 C   0  0  0

+    0.1934   -0.8407   -0.0749 C   0  0  0

+   -1.4926    0.7835   -0.2721 O   0  0  0

+   -3.5757   -1.2896   -0.2847 C   0  0  0

+   -1.6748   -2.8682   -0.0310 C   0  0  0

+    1.1180    0.1563   -0.0983 O   0  0  0

+    0.6043   -2.1539    0.0492 C   0  0  0

+   -2.7427    0.9441   -0.9256 C   0  0  0

+   -3.8252    0.2140   -0.1194 C   0  0  0

+   -0.3325   -3.1709    0.0738 C   0  0  0

+    2.3989   -0.4653    0.0233 C   0  0  0

+   -5.1131    0.5436   -0.6436 O   0  0  0

+    3.4901    0.6070    0.0037 C   0  0  0

+   -5.8619    1.0925    0.4255 N   0  3  0

+    4.8616   -0.0586    0.1338 C   0  0  0

+    3.4261    1.3292   -1.2277 O   0  0  0

+   -7.0085    1.4593    0.2407 O   0  0  0

+   -5.3593    1.1979    1.5300 O   0  5  0

+    5.9092    0.9710    0.1151 N   0  0  0

+    7.1933    0.2690    0.2430 C   0  0  0

+    8.2830    1.0633   -0.4799 C   0  0  0

+    7.5564    0.1358    1.7233 C   0  0  0

+   -4.6063   -1.3425    0.0000 H   0  0  0

+   -3.6396   -2.3196    0.0000 H   0  0  0

+   -2.3724   -3.6287    0.0000 H   0  0  0

+    1.6113   -2.3797    0.0000 H   0  0  0

+   -2.3304    1.8902    0.0000 H   0  0  0

+   -3.5359    1.6043    0.0000 H   0  0  0

+   -4.0012    1.2309    0.0000 H   0  0  0

+   -0.0252   -4.1561    0.0000 H   0  0  0

+    1.8456   -1.3364    0.0000 H   0  0  0

+    3.2013   -1.1142    0.0000 H   0  0  0

+    2.5217    0.9637    0.0000 H   0  0  0

+    4.3083   -0.9297    0.0000 H   0  0  0

+    5.6641   -0.7075    0.0000 H   0  0  0

+    3.3350    2.3572    0.0000 H   0  0  0

+    5.7670    1.9932    0.0000 H   0  0  0

+    6.7669   -0.6708    0.0000 H   0  0  0

+    8.8909    0.2293    0.0000 H   0  0  0

+    9.1170    1.6712    0.0000 H   0  0  0

+    7.6751    1.8973    0.0000 H   0  0  0

+    7.2010   -0.8331    0.0000 H   0  0  0

+    8.5253   -0.2196    0.0000 H   0  0  0

+    7.9118    1.1047    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+ 10 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+ 14 17  1  0

+ 15 18  2  0

+ 15 19  1  0

+ 16 20  1  0

+ 20 21  1  0

+ 21 22  1  0

+ 21 23  1  0

+  8 11  1  0

+  9 10  1  0

+  5 24  1  0

+  5 25  1  0

+  6 26  1  0

+  8 27  1  0

+  9 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 11 31  1  0

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+ 20 38  1  0

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+ 22 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+ 23 43  1  0

+ 23 44  1  0

+ 23 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16568-02-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.4350   -0.0802   -0.0011 N   0  0  0

+   -0.8501    0.4777    0.0006 N   0  0  0

+    1.5179    0.7221    0.0010 C   0  0  0

+    0.6016   -1.5357    0.0010 C   0  0  0

+   -1.8787   -0.2843   -0.0013 C   0  0  0

+    2.6306    0.2390   -0.0005 O   0  0  0

+   -3.2611    0.3158    0.0005 C   0  0  0

+    1.4006    1.7462    0.0000 H   0  0  0

+   -0.4225   -1.6529    0.0000 H   0  0  0

+    0.7188   -2.5598    0.0000 H   0  0  0

+    1.6257   -1.4185    0.0000 H   0  0  0

+   -1.7614   -1.3084    0.0000 H   0  0  0

+   -2.8507    1.2613    0.0000 H   0  0  0

+   -4.2066    0.7262    0.0000 H   0  0  0

+   -3.6715   -0.6297    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  3  6  2  0

+  5  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1204-72-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -1.1819    0.6530    0.0405 C   0  0  0

+   -1.4883   -0.7283   -0.0395 C   0  0  0

+    0.1630    1.0605    0.0606 C   0  0  0

+   -2.2288    1.5885    0.1041 C   0  0  0

+   -0.4413   -1.6639   -0.0977 C   0  0  0

+   -2.8332   -1.1356   -0.0586 C   0  0  0

+    1.1506    0.1260    0.0031 C   0  0  0

+   -3.5194    1.1569    0.0880 C   0  0  0

+    0.8493   -1.2325   -0.0765 C   0  0  0

+   -3.8208   -0.2010   -0.0002 C   0  0  0

+    2.5659    0.5588    0.0240 N   0  3  0

+    1.9694   -2.2388   -0.1385 C   0  0  0

+    3.2660    0.3055    0.9879 O   0  0  0

+    3.0304    1.1682   -0.9228 O   0  5  0

+    0.4027    2.0762    0.0000 H   0  0  0

+   -2.0181    2.6106    0.0000 H   0  0  0

+   -0.6521   -2.6860    0.0000 H   0  0  0

+   -3.0730   -2.1513    0.0000 H   0  0  0

+   -4.2948    1.8554    0.0000 H   0  0  0

+   -4.8187   -0.5067    0.0000 H   0  0  0

+    1.2719   -3.0151    0.0000 H   0  0  0

+    2.7457   -2.9363    0.0000 H   0  0  0

+    2.6669   -1.4625    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  9 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+  7  9  1  0

+  8 10  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+142438-58-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.0042    0.3120   -0.3405 C   0  0  0

+    0.7325   -1.0363   -0.1950 C   0  0  0

+    0.2257   -0.5658   -1.4457 O   0  0  0

+    1.0785    1.3644   -0.2311 C   0  0  0

+   -1.3751    0.5945    0.1972 C   0  0  0

+    2.2057   -0.6416   -0.0006 C   0  0  0

+    0.1731   -2.2608    0.5321 C   0  0  0

+    2.2729    0.8045   -0.0437 O   0  0  0

+    0.8828    2.5545   -0.3039 O   0  0  0

+   -2.4216   -0.1328   -0.2243 O   0  0  0

+   -1.5388    1.4755    1.0076 O   0  0  0

+    2.6898   -1.1341    1.3646 C   0  0  0

+   -0.9869   -2.8473   -0.2749 C   0  0  0

+   -3.7505    0.1393    0.2937 C   0  0  0

+    3.1298   -0.2883    0.0000 H   0  0  0

+    0.3397   -3.2360    0.0000 H   0  0  0

+    1.1541   -2.3887    0.0000 H   0  0  0

+    1.9842   -1.8276    0.0000 H   0  0  0

+    3.3833   -1.8397    0.0000 H   0  0  0

+    3.3954   -0.4406    0.0000 H   0  0  0

+   -1.4333   -1.9644    0.0000 H   0  0  0

+   -1.8698   -3.2937    0.0000 H   0  0  0

+   -0.5405   -3.7302    0.0000 H   0  0  0

+   -3.5520    1.1085    0.0000 H   0  0  0

+   -4.7197    0.3378    0.0000 H   0  0  0

+   -3.9490   -0.8299    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  1  0

+ 10 14  1  0

+  2  3  1  0

+  6  8  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5307-14-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.3287    0.1211    0.0093 C   0  0  0

+   -0.0856   -1.2412   -0.1041 C   0  0  0

+    0.7279    1.0063    0.0955 C   0  0  0

+   -1.7201    0.6251    0.0316 N   0  3  0

+    1.2201   -1.7137   -0.1303 C   0  0  0

+   -1.1567   -2.1385   -0.1915 N   0  0  0

+    2.0332    0.5339    0.0688 C   0  0  0

+   -2.0764    1.4653   -0.7750 O   0  0  0

+   -2.5088    0.1997    0.8564 O   0  5  0

+    2.2764   -0.8287   -0.0441 C   0  0  0

+    3.1043    1.4312    0.1567 N   0  0  0

+    0.5471    2.0285    0.0000 H   0  0  0

+    1.4009   -2.7359    0.0000 H   0  0  0

+   -2.1319   -1.7827    0.0000 H   0  0  0

+   -0.9773   -3.1610    0.0000 H   0  0  0

+    3.2521   -1.1831    0.0000 H   0  0  0

+    4.0795    1.0754    0.0000 H   0  0  0

+    2.9249    2.4537    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 75 76                          1 V2000

+   -3.5333    2.5099    0.2799 C   0  0  0

+   -2.9208    1.2032   -0.1541 C   0  0  0

+   -2.7141    3.6707   -0.2880 C   0  0  0

+   -4.9698    2.5974   -0.2395 C   0  0  0

+   -3.5378    2.5885    1.8079 C   0  0  0

+   -3.4924    0.0031    0.2423 C   0  0  0

+   -1.7928    1.1995   -0.9519 C   0  0  0

+   -2.9261   -1.1984   -0.1590 C   0  0  0

+   -4.6050    0.0041    1.0227 O   0  0  0

+   -1.2304    0.0011   -1.3503 C   0  0  0

+   -3.5448   -2.5040    0.2695 C   0  0  0

+   -1.7951   -1.1967   -0.9518 C   0  0  0

+    0.0000    0.0000   -2.2205 C   0  0  0

+   -2.7322   -3.6662   -0.3048 C   0  0  0

+   -3.5482   -2.5898    1.7971 C   0  0  0

+   -4.9823   -2.5816   -0.2488 C   0  0  0

+    1.2305   -0.0011   -1.3505 C   0  0  0

+    1.7928   -1.1995   -0.9521 C   0  0  0

+    1.7985    1.1967   -0.9567 C   0  0  0

+    2.9212   -1.2032   -0.1548 C   0  0  0

+    2.9265    1.1984   -0.1597 C   0  0  0

+    3.5341   -2.5099    0.2787 C   0  0  0

+    3.4898   -0.0031    0.2459 C   0  0  0

+    3.5453    2.5040    0.2687 C   0  0  0

+    2.7197   -3.6707   -0.2961 C   0  0  0

+    4.9731   -2.5934   -0.2342 C   0  0  0

+    3.5315   -2.5925    1.8065 C   0  0  0

+    4.5995   -0.0041    1.0304 O   0  0  0

+    2.7363    3.6662   -0.3107 C   0  0  0

+    3.5432    2.5925    1.7961 C   0  0  0

+    4.9848    2.5788   -0.2444 C   0  0  0

+   -1.9014    3.0971    0.0000 H   0  0  0

+   -2.1405    4.4834    0.0000 H   0  0  0

+   -3.5268    4.2443    0.0000 H   0  0  0

+   -4.9093    3.5903    0.0000 H   0  0  0

+   -5.9627    2.6579    0.0000 H   0  0  0

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+   -2.5447    2.6454    0.0000 H   0  0  0

+   -3.5947    3.5816    0.0000 H   0  0  0

+   -4.5309    2.5316    0.0000 H   0  0  0

+   -1.2580    2.0382    0.0000 H   0  0  0

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+   -1.2618   -2.0364    0.0000 H   0  0  0

+   -0.4981   -0.8610    0.0000 H   0  0  0

+    0.4966   -0.8619    0.0000 H   0  0  0

+   -3.5474   -4.2362    0.0000 H   0  0  0

+   -2.1622   -4.4814    0.0000 H   0  0  0

+   -1.9170   -3.0962    0.0000 H   0  0  0

+   -4.5422   -2.5504    0.0000 H   0  0  0

+   -3.5876   -3.5838    0.0000 H   0  0  0

+   -2.5542   -2.6292    0.0000 H   0  0  0

+   -5.0359   -1.5883    0.0000 H   0  0  0

+   -5.9756   -2.6352    0.0000 H   0  0  0

+   -4.9287   -3.5749    0.0000 H   0  0  0

+    1.2579   -2.0382    0.0000 H   0  0  0

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+    1.9054   -3.0994    0.0000 H   0  0  0

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+    2.5373   -2.5612    0.0000 H   0  0  0

+    3.5002   -3.5867    0.0000 H   0  0  0

+    4.5257   -2.6238    0.0000 H   0  0  0

+    5.5942   -0.0050    0.0000 H   0  0  0

+    3.5527    4.2345    0.0000 H   0  0  0

+    2.1680    4.4826    0.0000 H   0  0  0

+    1.9199    3.0979    0.0000 H   0  0  0

+    4.5377    2.6161    0.0000 H   0  0  0

+    3.5196    3.5870    0.0000 H   0  0  0

+    2.5487    2.5689    0.0000 H   0  0  0

+    5.0364    1.5854    0.0000 H   0  0  0

+    5.9782    2.6304    0.0000 H   0  0  0

+    4.9332    3.5722    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 12  1  0

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+ 30 72  1  0

+ 31 73  1  0

+ 31 74  1  0

+ 31 75  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92-54-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.7291    0.0796    0.2652 C   0  0  0

+   -0.6335    0.1891    0.5521 N   0  0  0

+    1.5628    1.1809    0.4149 C   0  0  0

+    1.2547   -1.1320   -0.1648 C   0  0  0

+   -1.2257   -1.1296    0.2965 C   0  0  0

+   -1.2007    1.1107   -0.4400 C   0  0  0

+    2.9095    1.0690    0.1308 C   0  0  0

+    2.6027   -1.2369   -0.4471 C   0  0  0

+   -2.7428   -1.0548    0.4726 C   0  0  0

+   -2.7178    1.1855   -0.2639 C   0  0  0

+    3.4286   -0.1376   -0.3022 C   0  0  0

+   -3.3101   -0.1333   -0.5195 N   0  0  0

+    1.1448    2.1171    0.0000 H   0  0  0

+    0.6594   -1.9667    0.0000 H   0  0  0

+   -1.4027   -2.1394    0.0000 H   0  0  0

+   -0.2456   -1.4304    0.0000 H   0  0  0

+   -0.2381    1.4636    0.0000 H   0  0  0

+   -1.3550    2.1243    0.0000 H   0  0  0

+    3.5083    1.9012    0.0000 H   0  0  0

+    3.0249   -2.1712    0.0000 H   0  0  0

+   -3.7054   -1.4078    0.0000 H   0  0  0

+   -2.5885   -2.0684    0.0000 H   0  0  0

+   -2.5408    2.1953    0.0000 H   0  0  0

+   -3.6979    1.4864    0.0000 H   0  0  0

+    4.4466   -0.2593    0.0000 H   0  0  0

+   -4.3332   -0.1997    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

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+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1513-65-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -2.3090    0.9030   -0.0001 F   0  0  0

+   -1.1533    0.2033   -0.0013 C   0  0  0

+   -0.0001    0.8471    0.0000 N   0  0  0

+   -1.1910   -1.1811    0.0019 C   0  0  0

+    1.1534    0.2032   -0.0007 C   0  0  0

+   -0.0001   -1.8898    0.0011 C   0  0  0

+    2.3091    0.9029    0.0012 F   0  0  0

+    1.1911   -1.1808   -0.0027 C   0  0  0

+   -2.0896   -1.6759    0.0000 H   0  0  0

+   -0.0001   -2.9156    0.0000 H   0  0  0

+    2.0897   -1.6756    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  4  2  0

+  7  5  1  0

+  8  5  2  0

+  6  8  1  0

+  4  9  1  0

+  6 10  1  0

+  8 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1874-22-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    1.6182    0.1672   -0.0030 C   0  0  0

+    0.6221   -0.7286   -0.0037 O   0  0  0

+    1.0920    1.4134   -0.0004 C   0  0  0

+    3.0631   -0.1550    0.0007 N   0  3  0

+   -0.5630   -0.0823   -0.0015 C   0  0  0

+   -0.3028    1.2750    0.0006 C   0  0  0

+    3.8871    0.7420    0.0010 O   0  0  0

+    3.4279   -1.3170    0.0034 O   0  5  0

+   -1.8401   -0.6853   -0.0018 C   0  0  0

+   -2.9600    0.0910    0.0006 C   0  0  0

+   -4.2280   -0.5077    0.0003 C   0  0  0

+   -5.2270    0.1847    0.0025 O   0  0  0

+    1.6122    2.2888    0.0000 H   0  0  0

+   -0.9895    2.0269    0.0000 H   0  0  0

+   -1.9240   -1.7001    0.0000 H   0  0  0

+   -2.8761    1.1058    0.0000 H   0  0  0

+   -4.3119   -1.5225    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

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+  5  6  2  0

+  3 13  1  0

+  6 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2876-23-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.8395    0.5646   -0.0046 C   0  0  0

+   -0.7178   -0.8994   -0.0018 C   0  0  0

+    0.2501    1.3265   -0.0042 N   0  0  0

+   -2.1260    1.1381   -0.0017 C   0  0  0

+    0.4808   -1.4699    0.0006 N   0  0  0

+   -1.8954   -1.6805   -0.0013 C   0  0  0

+    1.4501    0.7540   -0.0013 C   0  0  0

+   -3.2244    0.3282    0.0035 C   0  0  0

+    1.5705   -0.7084    0.0005 C   0  0  0

+   -3.1053   -1.0704   -0.0034 C   0  0  0

+    2.6276    1.5309   -0.0004 C   0  0  0

+   -4.4932    0.9029    0.0063 N   0  0  0

+    2.8595   -1.2820    0.0025 C   0  0  0

+    3.8376    0.9146    0.0031 C   0  0  0

+    3.9522   -0.4759    0.0018 C   0  0  0

+   -2.2386    2.1767    0.0000 H   0  0  0

+   -1.8335   -2.7233    0.0000 H   0  0  0

+   -3.9708   -1.6554    0.0000 H   0  0  0

+    2.5691    2.5739    0.0000 H   0  0  0

+   -4.5957    1.9425    0.0000 H   0  0  0

+   -5.3423    0.2943    0.0000 H   0  0  0

+    2.9726   -2.3205    0.0000 H   0  0  0

+    4.7051    1.4967    0.0000 H   0  0  0

+    4.9033   -0.9081    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+  7  9  1  0

+  8 10  1  0

+ 14 15  2  0

+  4 16  1  0

+  6 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+606-20-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    1.1971   -0.3646    0.0176 C   0  0  0

+   -0.0002    0.3267   -0.0006 C   0  0  0

+    2.4787    0.3756    0.0406 N   0  3  0

+    1.1971   -1.7467    0.0203 C   0  0  0

+   -1.1969   -0.3644   -0.0221 C   0  0  0

+   -0.0003    1.8337    0.0033 C   0  0  0

+    3.2254    0.3303   -0.9207 O   0  0  0

+    2.7867    1.0299    1.0206 O   0  5  0

+   -0.0001   -2.4380    0.0046 C   0  0  0

+   -2.4786    0.3756   -0.0411 N   0  3  0

+   -1.1968   -1.7470   -0.0252 C   0  0  0

+   -3.2240    0.3275    0.9210 O   0  0  0

+   -2.7880    1.0326   -1.0189 O   0  5  0

+    2.0948   -2.2650    0.0000 H   0  0  0

+    1.0363    1.8338    0.0000 H   0  0  0

+   -0.0004    2.8703    0.0000 H   0  0  0

+   -1.0369    1.8336    0.0000 H   0  0  0

+   -0.0001   -3.4746    0.0000 H   0  0  0

+   -2.0945   -2.2653    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  4 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+  9 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+79748-81-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 61                          1 V2000

+   -4.1375    0.2748   -0.0542 C   0  0  1

+   -5.3806    0.7801    0.6989 C   0  0  2

+   -4.5629   -0.2843    1.1900 O   0  0  0

+   -4.6608   -0.5055   -1.2329 C   0  0  0

+   -2.8545    1.0549   -0.1820 C   0  0  0

+   -6.5617    0.2465   -0.1280 C   0  0  1

+   -5.9989   -0.5033   -1.2497 N   0  0  0

+   -3.9632   -1.0601   -2.0554 O   0  0  0

+   -1.6380    0.4627    0.1710 C   0  0  0

+   -2.8772    2.1996   -0.5922 O   0  0  0

+   -7.4262   -0.6760    0.7337 C   0  0  0

+   -7.3480    1.3368   -0.6129 O   0  0  0

+   -0.5000    1.2345    0.2752 C   0  0  0

+   -1.5706   -1.0190    0.4374 C   0  0  0

+   -8.5979   -1.2010   -0.0984 C   0  0  0

+    0.7173    0.6419    0.6285 C   0  0  0

+   -9.4053   -2.0626    0.7064 O   0  0  0

+    1.8541    1.4129    0.7327 C   0  0  0

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+    4.1997    1.5832    1.1897 C   0  0  0

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+    7.6849    1.8750   -2.3479 C   0  0  0

+    6.9570   -3.5075    0.2747 C   0  0  0

+   -5.3998    1.7849    0.0000 H   0  0  0

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+    4.1448   -0.6167    0.0000 H   0  0  0

+    5.1897   -0.1996    0.0000 H   0  0  0

+    6.3030   -0.1371    0.0000 H   0  0  0

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+    7.2257   -4.4759    0.0000 H   0  0  0

+    7.9254   -3.2388    0.0000 H   0  0  0

+  1  2  1  0

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+ 30 55  1  0

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+ 30 57  1  0

+ 31 58  1  0

+ 31 59  1  0

+ 31 60  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+602-64-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.5188    0.4963    0.1030 C   0  0  0

+   -0.4275   -0.9123    0.1009 C   0  0  0

+    0.7062    1.3071    0.2146 C   0  0  0

+   -1.7683    1.1104   -0.0064 C   0  0  0

+    0.8960   -1.5582    0.2100 C   0  0  0

+   -1.5808   -1.6806   -0.0047 C   0  0  0

+    2.0221    0.6602    0.0143 C   0  0  0

+    0.6368    2.4942    0.4680 O   0  0  0

+   -2.9174    0.3250   -0.1171 C   0  0  0

+   -1.8652    2.4634   -0.0048 O   0  0  0

+    2.1150   -0.7435    0.0122 C   0  0  0

+    0.9828   -2.7447    0.4596 O   0  0  0

+   -2.8213   -1.0614   -0.1086 C   0  0  0

+    3.1668    1.4275   -0.1722 C   0  0  0

+   -4.1351    0.9183   -0.2237 O   0  0  0

+    3.3511   -1.3529   -0.1761 C   0  0  0

+   -3.9457   -1.8164   -0.2122 O   0  0  0

+    4.3892    0.8054   -0.3582 C   0  0  0

+    4.4806   -0.5746   -0.3604 C   0  0  0

+   -1.5160   -2.7179    0.0000 H   0  0  0

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+   -5.0694    1.3735    0.0000 H   0  0  0

+    3.4265   -2.3895    0.0000 H   0  0  0

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+    5.4162   -1.0273    0.0000 H   0  0  0

+  1  2  1  0

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+  5 12  2  0

+  6 13  1  0

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+  9 15  1  0

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+  7 11  2  0

+  9 13  2  0

+ 18 19  1  0

+  6 20  1  0

+ 10 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 19 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97461-42-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+   -2.0022   -0.0134   -0.0036 C   0  0  0

+   -3.2042   -0.6267   -0.0027 O   0  0  0

+   -2.2237    1.3482   -0.0012 C   0  0  0

+   -0.7390   -0.6533   -0.0012 C   0  0  0

+   -4.1759    0.2963    0.0002 C   0  0  0

+   -3.6155    1.5262    0.0012 C   0  0  0

+    0.3967    0.0881   -0.0025 C   0  0  0

+   -5.6291    0.0141    0.0013 N   0  3  0

+    1.6595   -0.5516   -0.0002 C   0  0  0

+   -6.4280    0.9335    0.0040 O   0  0  0

+   -6.0259   -1.1375   -0.0005 O   0  5  0

+    2.7881    0.1852   -0.0015 N   0  0  0

+    1.7261   -1.7675    0.0030 O   0  0  0

+    4.0950   -0.4768    0.0010 C   0  0  0

+    5.2017    0.5796   -0.0012 C   0  0  0

+    6.5666   -0.1118    0.0014 C   0  0  0

+    7.6734    0.9446   -0.0007 C   0  0  0

+    9.0383    0.2532    0.0018 C   0  0  0

+   -1.4985    2.0985    0.0000 H   0  0  0

+   -0.6819   -1.6952    0.0000 H   0  0  0

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+    4.8962   -1.1453    0.0000 H   0  0  0

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+    4.4005    1.2481    0.0000 H   0  0  0

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+    8.5668   -0.6777    0.0000 H   0  0  0

+    9.9692   -0.2183    0.0000 H   0  0  0

+    9.5098    1.1841    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-29-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.1104   -0.2330    0.2126 C   0  0  0

+   -1.5219    0.0990    0.6231 C   0  0  0

+    0.7786    0.6867    0.1769 N   0  0  0

+    0.2557   -1.6492   -0.1498 C   0  0  0

+   -2.3358    0.4829   -0.6142 C   0  0  0

+    2.1049    0.3748   -0.2088 O   0  0  0

+   -2.3188   -0.5407    0.0000 H   0  0  0

+   -1.2962   -0.8976    0.0000 H   0  0  0

+   -0.7336   -1.9050    0.0000 H   0  0  0

+    0.5115   -2.6385    0.0000 H   0  0  0

+    1.2450   -1.3934    0.0000 H   0  0  0

+   -1.8999    1.4071    0.0000 H   0  0  0

+   -3.2600    0.9188    0.0000 H   0  0  0

+   -2.7717   -0.4413    0.0000 H   0  0  0

+    3.0996    0.1409    0.0000 H   0  0  0

+  1  2  1  0

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+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7320-37-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 49                          1 V2000

+   -7.4323    0.4043   -0.3207 C   0  0  0

+   -8.6846   -0.4652   -0.1914 C   0  0  0

+   -8.2177    0.3667    0.8725 O   0  0  0

+   -6.1867   -0.4652   -0.1390 C   0  0  0

+   -4.9344    0.4043   -0.2683 C   0  0  0

+   -3.6887   -0.4653   -0.0866 C   0  0  0

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+    8.0430   -1.3163    0.0000 H   0  0  0

+    9.5564   -1.3182    0.0000 H   0  0  0

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+  1  2  1  0

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+ 17 48  1  0

+ 17 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+37574-47-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 38                          1 V2000

+   -0.1933    0.0798    0.0823 C   0  0  0

+   -1.6078   -0.3008    0.0781 C   0  0  0

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+   -3.2943   -2.0535   -0.0279 C   0  0  0

+   -1.6148    2.5290   -0.9027 O   0  0  0

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+   -4.2682   -1.1051    0.0632 C   0  0  0

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+   -0.4002    3.4823    0.0000 H   0  0  0

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+    1.1179   -3.0389    0.0000 H   0  0  0

+   -3.1572    2.7276    0.0000 H   0  0  0

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+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87185-24-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.7802    0.2926   -0.0196 C   0  0  0

+   -0.5478   -1.1043    0.0354 C   0  0  0

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+   -2.9090   -1.4850    0.0367 C   0  0  0

+    2.7321    1.6036   -0.0500 N   0  3  0

+   -4.5279    0.3968   -0.0274 N   0  3  0

+    3.1998   -1.2075    0.0593 N   0  3  0

+    2.8122    2.4995    0.7712 O   0  0  0

+    3.5992    1.4729   -0.8953 O   0  5  0

+   -5.4619   -0.3845    0.0024 O   0  0  0

+   -4.7379    1.5956   -0.0746 O   0  5  0

+    3.4133   -2.4037   -0.0241 O   0  0  0

+    4.1302   -0.4286    0.1649 O   0  5  0

+    0.1601    2.1937    0.0000 H   0  0  0

+   -2.2852    1.7872    0.0000 H   0  0  0

+    0.9574   -2.5985    0.0000 H   0  0  0

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+  3 20  1  0

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+  5 22  1  0

+  6 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3571-31-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -0.9018    0.4186    0.1720 C   0  0  0

+   -0.9582   -0.9716    0.2902 C   0  0  0

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+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75476-80-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -1.2310    0.6316   -0.0028 C   0  0  0

+   -1.6734   -0.6926   -0.0017 C   0  0  0

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+    0.6145   -1.4279    0.0008 C   0  0  0

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+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3697-24-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.4682    0.7208    0.0019 C   0  0  0

+   -0.3823   -0.4011    0.0008 C   0  0  0

+    1.9154    0.5004    0.0012 C   0  0  0

+   -0.0717    2.0190   -0.0022 C   0  0  0

+   -1.8297   -0.1803    0.0009 C   0  0  0

+    0.1577   -1.6987   -0.0008 C   0  0  0

+    2.4024   -0.8277   -0.0003 C   0  0  0

+    2.8168    1.5687    0.0024 C   0  0  0

+   -1.4081    2.2281   -0.0077 C   0  0  0

+   -2.3164    1.1479    0.0022 C   0  0  0

+   -2.7312   -1.2480    0.0001 C   0  0  0

+    1.4945   -1.9077   -0.0017 C   0  0  0

+   -0.7731   -2.8839   -0.0010 C   0  0  0

+    3.7886   -1.0474   -0.0011 C   0  0  0

+    4.1587    1.3204    0.0021 C   0  0  0

+   -3.7021    1.3681    0.0021 C   0  0  0

+   -4.0734   -0.9993    0.0006 C   0  0  0

+    4.6415    0.0157   -0.0003 C   0  0  0

+   -4.5557    0.3050    0.0009 C   0  0  0

+    0.5785    2.8466    0.0000 H   0  0  0

+    2.4624    2.5597    0.0000 H   0  0  0

+   -1.7771    3.2138    0.0000 H   0  0  0

+   -2.3770   -2.2391    0.0000 H   0  0  0

+    1.8636   -2.8933    0.0000 H   0  0  0

+   -1.6008   -2.2338    0.0000 H   0  0  0

+   -1.4232   -3.7116    0.0000 H   0  0  0

+    0.0546   -3.5340    0.0000 H   0  0  0

+    4.1680   -2.0291    0.0000 H   0  0  0

+    4.8365    2.1256    0.0000 H   0  0  0

+   -4.0811    2.3500    0.0000 H   0  0  0

+   -4.7514   -1.8043    0.0000 H   0  0  0

+    5.6804   -0.1529    0.0000 H   0  0  0

+   -5.5945    0.4739    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  2  0

+ 10 16  2  0

+ 11 17  1  0

+ 14 18  2  0

+ 16 19  1  0

+  7 12  2  0

+  9 10  1  0

+ 15 18  1  0

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+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-62-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  5  4                          1 V2000

+   -0.4699    0.0000    0.0000 C   0  0  0

+   -1.0709   -1.6995    0.0350 Cl  0  0  0

+   -1.0709    0.8194   -1.4893 Cl  0  0  0

+   -1.0709    0.8801    1.4543 Cl  0  0  0

+    1.4961    0.0000    0.0000 Br  0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101043-65-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.8806   -0.3263   -0.0144 C   0  0  0

+   -0.4215    0.3607    0.0110 C   0  0  0

+    2.1069    0.4914    0.0050 C   0  0  0

+    0.9372   -1.6365   -0.0480 C   0  0  0

+   -1.5357   -0.3316   -0.0046 C   0  0  0

+   -0.4377    1.8340    0.0547 C   0  0  0

+    3.2782   -0.1063   -0.0171 C   0  0  0

+    1.9960    1.9570    0.0491 C   0  0  0

+   -0.3108   -2.4184   -0.0599 C   0  0  0

+    2.2505   -2.3026   -0.0727 C   0  0  0

+   -2.8268    0.3764    0.0214 C   0  0  0

+   -1.4774   -1.8026   -0.0485 C   0  0  0

+    0.8357    2.5693    0.0709 C   0  0  0

+   -1.5922    2.4635    0.0779 C   0  0  0

+    3.3505   -1.5778   -0.0607 C   0  0  0

+    4.4161    0.6292    0.0008 N   0  0  0

+   -2.8487    1.6931    0.0601 C   0  0  0

+   -3.9870   -0.3233    0.0053 N   0  3  0

+    5.5002    0.0744   -0.0197 O   0  0  0

+   -4.8596   -0.0373   -0.7950 O   0  0  0

+   -4.1575   -1.2381    0.7911 O   0  5  0

+    2.8458    2.5142    0.0000 H   0  0  0

+   -0.2732   -3.4339    0.0000 H   0  0  0

+    2.3080   -3.3171    0.0000 H   0  0  0

+   -2.3371   -2.3444    0.0000 H   0  0  0

+    0.8163    3.5853    0.0000 H   0  0  0

+   -1.6180    3.4793    0.0000 H   0  0  0

+    4.2567   -2.0376    0.0000 H   0  0  0

+   -3.7395    2.1821    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  8 13  2  0

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+ 10 15  2  0

+ 14 17  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105427-02-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    3.0925    0.2294   -0.8178 C   0  0  0

+    2.0418   -0.5580   -0.0783 C   0  0  0

+    3.0585    1.6869   -0.3535 C   0  0  0

+    4.0371    0.7572    0.1156 O   0  0  0

+    0.7431   -0.2131   -0.1830 N   0  0  0

+    2.3648   -1.5021    0.6112 O   0  0  0

+   -0.2784   -0.9786    0.5359 C   0  0  0

+   -1.6375   -0.3926    0.2523 C   0  0  0

+   -2.3784   -0.8525   -0.8206 C   0  0  0

+   -2.1457    0.6006    1.0681 C   0  0  0

+   -3.6249   -0.3150   -1.0807 C   0  0  0

+   -3.3926    1.1382    0.8079 C   0  0  0

+   -4.1309    0.6825   -0.2680 C   0  0  0

+    3.6217   -0.5848    0.0000 H   0  0  0

+    3.5230    2.5397    0.0000 H   0  0  0

+    2.1147    1.9156    0.0000 H   0  0  0

+    0.5580    0.7402    0.0000 H   0  0  0

+   -0.8111   -1.7905    0.0000 H   0  0  0

+    0.4294   -1.6435    0.0000 H   0  0  0

+   -2.3064   -1.8209    0.0000 H   0  0  0

+   -1.4820    1.3095    0.0000 H   0  0  0

+   -4.2898   -1.0227    0.0000 H   0  0  0

+   -3.4634    2.1067    0.0000 H   0  0  0

+   -5.0657    0.9454    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90-94-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 41                          1 V2000

+   -0.0016   -1.6902   -0.0024 C   0  0  0

+   -1.2777   -0.9517   -0.0231 C   0  0  0

+    1.2759   -0.9541    0.0199 C   0  0  0

+   -0.0029   -2.9066    0.0012 O   0  0  0

+   -2.3298   -1.3466    0.8100 C   0  0  0

+   -1.4370    0.1490   -0.8716 C   0  0  0

+    2.3038   -1.3072   -0.8607 C   0  0  0

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+   -3.5183   -0.6530    0.7864 C   0  0  0

+   -2.6190    0.8329   -0.8899 C   0  0  0

+    3.4937   -0.6160   -0.8352 C   0  0  0

+    2.6437    0.7842    0.9378 C   0  0  0

+   -3.6696    0.4383   -0.0654 C   0  0  0

+    3.6704    0.4311    0.0657 C   0  0  0

+   -4.8701    1.1385   -0.0887 N   0  0  0

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+   -5.0311    2.2868   -0.9842 C   0  0  0

+   -5.9745    0.7283    0.7821 C   0  0  0

+    5.0600    2.2306    1.0381 C   0  0  0

+    5.9516    0.7623   -0.8295 C   0  0  0

+   -2.4033   -2.2131    0.0000 H   0  0  0

+   -0.7168    0.6364    0.0000 H   0  0  0

+    2.3886   -2.1727    0.0000 H   0  0  0

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+   -4.2409   -1.1369    0.0000 H   0  0  0

+   -2.5472    1.6996    0.0000 H   0  0  0

+    4.2086   -1.1112    0.0000 H   0  0  0

+    2.5606    1.6499    0.0000 H   0  0  0

+   -4.1699    2.4075    0.0000 H   0  0  0

+   -5.1518    3.1480    0.0000 H   0  0  0

+   -5.8923    2.1661    0.0000 H   0  0  0

+   -6.2773    1.5435    0.0000 H   0  0  0

+   -6.7897    0.4255    0.0000 H   0  0  0

+   -5.6717   -0.0869    0.0000 H   0  0  0

+    5.9173    2.0846    0.0000 H   0  0  0

+    5.2060    3.0879    0.0000 H   0  0  0

+    4.2027    2.3766    0.0000 H   0  0  0

+    5.6720   -0.0612    0.0000 H   0  0  0

+    6.7751    0.4827    0.0000 H   0  0  0

+    6.2312    1.5858    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  2  0

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+ 19 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.5080    0.5707    0.0029 C   0  0  0

+   -0.9418   -0.7441    0.0008 C   0  0  0

+    0.8464    0.8515    0.0028 C   0  0  0

+   -1.6635    1.8663   -0.0014 Cl  0  0  0

+   -0.0206   -1.7762   -0.0016 C   0  0  0

+   -2.6415   -1.0975    0.0003 Cl  0  0  0

+    1.7666   -0.1812    0.0005 C   0  0  0

+    1.3324   -1.4951   -0.0017 C   0  0  0

+    3.4665    0.1711   -0.0002 Cl  0  0  0

+    1.1721    1.8369    0.0000 H   0  0  0

+   -0.3457   -2.7618    0.0000 H   0  0  0

+    2.0231   -2.2697    0.0000 H   0  0  0

+  1  2  2  0

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+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  5 11  1  0

+  8 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-85-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.7153   -1.1792    0.2699 C   0  0  0

+   -0.7153   -1.1792   -0.2699 C   0  0  0

+    1.4320    0.0000   -0.2312 N   0  0  0

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+    0.7153    1.1792    0.2699 C   0  0  0

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+    0.5279   -2.1970    0.0000 H   0  0  0

+    1.6824   -1.5477    0.0000 H   0  0  0

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+   -0.5279   -2.1970    0.0000 H   0  0  0

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+  1  2  1  0

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+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15503-86-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 57                          1 V2000

+   -2.9416    2.2195   -0.6166 C   0  0  1

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+  8 36  1  0

+ 10 37  1  0

+ 11 38  1  0

+ 11 39  1  0

+ 17 40  1  0

+ 17 41  1  0

+ 18 42  1  0

+ 21 43  1  0

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+ 26 53  1  0

+ 27 54  1  0

+ 27 55  1  0

+ 28 56  1  0

+ 28 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99152-10-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    1.3181   -0.4609   -0.2285 C   0  0  1

+    0.0553   -0.0311    0.4725 C   0  0  0

+    2.4445    0.3374    0.2615 N   0  0  0

+    1.5805   -1.9413    0.0554 C   0  0  0

+   -1.1155   -0.6312    0.1800 N   0  0  0

+    0.0924    0.8514    1.2968 O   0  0  0

+    2.7041    1.5424   -0.2836 C   0  0  0

+    2.8128   -2.4000   -0.7268 C   0  0  0

+    1.8248   -2.1378    1.5530 C   0  0  0

+   -2.3432   -0.2133    0.8615 C   0  0  0

+   -1.1552   -1.5735   -0.7001 N   0  0  0

+    3.9295    2.3117    0.1377 C   0  0  0

+    1.9514    2.0076   -1.1130 O   0  0  0

+   -3.0024    0.8914    0.0766 C   0  0  0

+   -2.2132   -2.1158   -0.9645 O   0  0  0

+   -4.1494    1.4337    0.5146 O   0  0  0

+   -2.4984    1.2888   -0.9471 O   0  0  0

+    1.1804    0.4873    0.0000 H   0  0  0

+    3.2443   -0.1903    0.0000 H   0  0  0

+    0.7559   -2.4293    0.0000 H   0  0  0

+    2.4785   -3.2980    0.0000 H   0  0  0

+    3.7108   -2.7343    0.0000 H   0  0  0

+    3.1471   -1.5020    0.0000 H   0  0  0

+    1.2243   -2.8844    0.0000 H   0  0  0

+    2.5714   -2.7383    0.0000 H   0  0  0

+    2.4253   -1.3912    0.0000 H   0  0  0

+   -3.2718   -0.4497    0.0000 H   0  0  0

+   -2.3809   -1.1707    0.0000 H   0  0  0

+    4.4390    1.5002    0.0000 H   0  0  0

+    4.7410    2.8212    0.0000 H   0  0  0

+    3.4200    3.1232    0.0000 H   0  0  0

+   -5.0156    1.8433    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  7 12  1  0

+  7 13  2  0

+ 10 14  1  0

+ 11 15  2  0

+ 14 16  1  0

+ 14 17  2  0

+  1 18  1  0

+  3 19  1  0

+  4 20  1  0

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+ 10 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-49-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.3143    0.9698    0.0017 C   0  0  0

+   -0.2950   -0.2720    0.0001 C   0  0  0

+    1.6936    1.0626    0.0019 C   0  0  0

+   -0.5252    2.2213   -0.0029 C   0  0  0

+    0.4765   -1.4207   -0.0014 C   0  0  0

+   -2.0271   -0.3894    0.0005 Cl  0  0  0

+    2.4638   -0.0851    0.0004 C   0  0  0

+    1.8553   -1.3266   -0.0012 C   0  0  0

+    2.1506    1.9937    0.0000 H   0  0  0

+    0.3361    2.7991    0.0000 H   0  0  0

+   -1.1030    3.0826    0.0000 H   0  0  0

+   -1.3865    1.6435    0.0000 H   0  0  0

+    0.0201   -2.3521    0.0000 H   0  0  0

+    3.4986   -0.0150    0.0000 H   0  0  0

+    2.4337   -2.1875    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16354-52-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 45                          1 V2000

+   -0.5330    0.0483   -0.0232 C   0  0  0

+    0.0567   -1.2764    0.1781 C   0  0  0

+    0.2759    1.1641   -0.1583 C   0  0  0

+   -1.9976    0.1671   -0.0722 C   0  0  0

+    1.4378   -1.4243    0.2358 C   0  0  0

+   -0.8231   -2.4358    0.3173 C   0  0  0

+    1.6657    1.0215   -0.1017 C   0  0  0

+   -0.3383    2.5245   -0.3658 C   0  0  0

+   -2.7885   -0.9916    0.0751 C   0  0  0

+   -2.6112    1.4064   -0.2614 C   0  0  0

+    2.2591   -0.3022    0.1007 C   0  0  0

+    2.0458   -2.7875    0.4435 C   0  0  0

+   -2.1610   -2.2959    0.2624 C   0  0  0

+    2.5192    2.1347   -0.2351 C   0  0  0

+   -0.3265    3.2962    0.9553 C   0  0  0

+   -4.1850   -0.8763    0.0281 C   0  0  0

+   -3.9848    1.4872   -0.3026 C   0  0  0

+    3.6634   -0.4146    0.1536 C   0  0  0

+    2.2924   -3.4481   -0.9143 C   0  0  0

+    3.8653    1.9582   -0.1748 C   0  0  0

+   -4.7628    0.3457   -0.1583 C   0  0  0

+    4.4304    0.6986    0.0178 C   0  0  0

+   -0.4086   -3.3928    0.0000 H   0  0  0

+   -1.3019    2.9233    0.0000 H   0  0  0

+   -1.0640    1.7755    0.0000 H   0  0  0

+   -2.0354    2.2759    0.0000 H   0  0  0

+    3.0777   -2.9388    0.0000 H   0  0  0

+    2.6756   -1.9563    0.0000 H   0  0  0

+   -2.7613   -3.1488    0.0000 H   0  0  0

+    2.1197    3.0980    0.0000 H   0  0  0

+    0.7163    3.2803    0.0000 H   0  0  0

+   -0.3106    4.3390    0.0000 H   0  0  0

+   -1.3693    3.3121    0.0000 H   0  0  0

+   -4.7788   -1.7337    0.0000 H   0  0  0

+   -4.4449    2.4231    0.0000 H   0  0  0

+    4.1112   -1.3565    0.0000 H   0  0  0

+    1.3153   -3.8128    0.0000 H   0  0  0

+    2.6571   -4.4252    0.0000 H   0  0  0

+    3.2695   -3.0834    0.0000 H   0  0  0

+    4.4879    2.7949    0.0000 H   0  0  0

+   -5.8025    0.4273    0.0000 H   0  0  0

+    5.4690    0.6040    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

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+  7 14  1  0

+  8 15  1  0

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+ 10 17  2  0

+ 11 18  1  0

+ 12 19  1  0

+ 14 20  2  0

+ 16 21  2  0

+ 18 22  2  0

+  7 11  2  0

+  9 13  1  0

+ 17 21  1  0

+ 20 22  1  0

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+  8 24  1  0

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+ 19 37  1  0

+ 19 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+ 21 41  1  0

+ 22 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+867-27-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    1.7837   -0.0749   -0.0847 P   0  0  0

+    0.4173   -0.5235   -0.8085 O   0  0  0

+    2.0266   -0.9900    1.2175 O   0  0  0

+    3.0159   -0.2556   -1.1051 O   0  0  0

+    1.6578    1.7126    0.4269 S   0  0  0

+   -0.6567   -0.0131   -0.0161 C   0  0  0

+    1.9994   -2.3494    0.7779 C   0  0  0

+    4.1458    0.3809   -0.5050 C   0  0  0

+   -1.9915   -0.4063   -0.6522 C   0  0  0

+   -3.3549    0.2415    0.3538 S   0  0  0

+   -4.7699   -0.3585   -0.6096 C   0  0  0

+   -6.0702    0.0801    0.0670 C   0  0  0

+    0.0249    0.7580    0.0000 H   0  0  0

+   -1.2092    0.8552    0.0000 H   0  0  0

+    0.9704   -2.3288    0.0000 H   0  0  0

+    1.9788   -3.3784    0.0000 H   0  0  0

+    3.0284   -2.3700    0.0000 H   0  0  0

+    4.6509   -0.5158    0.0000 H   0  0  0

+    5.0425    0.8860    0.0000 H   0  0  0

+    3.6407    1.2776    0.0000 H   0  0  0

+   -2.6731   -1.1775    0.0000 H   0  0  0

+   -1.4389   -1.2746    0.0000 H   0  0  0

+   -5.3568   -1.2040    0.0000 H   0  0  0

+   -4.1207   -1.1571    0.0000 H   0  0  0

+   -5.7413    1.0553    0.0000 H   0  0  0

+   -7.0454    0.4090    0.0000 H   0  0  0

+   -6.3991   -0.8951    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+194-03-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 28                          1 V2000

+    0.7522    0.0892   -0.0020 C   0  0  0

+   -0.7199    0.1045   -0.0014 C   0  0  0

+    1.4376    1.2032   -0.0011 C   0  0  0

+    1.4103   -1.2316    0.0025 C   0  0  0

+   -1.3629    1.2465    0.0006 C   0  0  0

+   -1.4241   -1.1904   -0.0021 C   0  0  0

+    0.7196    2.4890    0.0009 C   0  0  0

+    2.9085    1.1350   -0.0015 C   0  0  0

+    0.5498   -2.4247    0.0069 C   0  0  0

+    2.7203   -1.2900    0.0019 C   0  0  0

+   -0.6013    2.5070    0.0025 C   0  0  0

+   -2.8355    1.2383    0.0014 C   0  0  0

+   -0.7213   -2.3427   -0.0038 N   0  0  0

+   -2.7417   -1.1896   -0.0013 C   0  0  0

+    3.5058   -0.0407   -0.0029 C   0  0  0

+   -3.4773    0.0871    0.0000 C   0  0  0

+    1.2845    3.4367    0.0000 H   0  0  0

+    3.5071    2.0617    0.0000 H   0  0  0

+    1.0205   -3.4225    0.0000 H   0  0  0

+    3.2322   -2.2673    0.0000 H   0  0  0

+   -1.1368    3.4716    0.0000 H   0  0  0

+   -3.3969    2.1880    0.0000 H   0  0  0

+   -3.2941   -2.1447    0.0000 H   0  0  0

+    4.6079   -0.0910    0.0000 H   0  0  0

+   -4.5805    0.0793    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  4  9  1  0

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+  5 11  1  0

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+  7 11  2  0

+  9 13  2  0

+ 10 15  1  0

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+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1888-89-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+    1.8707    0.3641   -0.4547 C   0  0  0

+    0.6277    0.3641    0.4373 C   0  0  0

+    3.1261    0.3641    0.4199 C   0  0  0

+    2.6326   -0.8199   -0.2100 O   0  0  0

+   -0.6277    0.3641   -0.4373 C   0  0  0

+   -1.8707    0.3641    0.4547 C   0  0  0

+   -3.1261    0.3641   -0.4199 C   0  0  0

+   -2.6326   -0.8199    0.2100 O   0  0  0

+    1.8707    1.3056    0.0000 H   0  0  0

+    1.0985    1.1795    0.0000 H   0  0  0

+    0.1569    1.1795    0.0000 H   0  0  0

+    4.0352    0.1191    0.0000 H   0  0  0

+    3.2497    1.2975    0.0000 H   0  0  0

+   -0.1569    1.1795    0.0000 H   0  0  0

+   -1.0985    1.1795    0.0000 H   0  0  0

+   -1.8707    1.3056    0.0000 H   0  0  0

+   -3.2497    1.2975    0.0000 H   0  0  0

+   -4.0352    0.1191    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  6  8  1  0

+  3  4  1  0

+  7  8  1  0

+  1  9  1  0

+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-20-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    1.2278   -0.0108   -0.4652 C   0  0  0

+    0.0872   -0.8083    0.1128 C   0  0  0

+    2.1834    0.2610    0.2213 O   0  0  0

+   -1.4310    0.1597    0.0195 Cl  0  0  0

+    0.7798    0.9320    0.0000 H   0  0  0

+   -0.5841   -1.6076    0.0000 H   0  0  0

+    0.7919   -1.5783    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54-88-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -0.5579   -0.2145    0.0001 C   0  0  0

+   -1.4348   -1.3046   -0.0010 C   0  0  0

+    0.7907   -0.4216   -0.0007 N   0  0  0

+   -1.0675    1.0888   -0.0038 C   0  0  0

+   -2.7947   -1.0916   -0.0001 C   0  0  0

+   -0.8912   -2.7102   -0.0036 C   0  0  0

+    1.5977    0.5848    0.0004 N   0  0  0

+   -2.4283    1.2934   -0.0087 C   0  0  0

+   -3.2977    0.2061    0.0018 C   0  0  0

+    2.9491    0.3773   -0.0004 C   0  0  0

+   -4.6740    0.4174    0.0027 N   0  0  0

+    3.8263    1.4649    0.0007 C   0  0  0

+    3.4598   -0.9237    0.0035 C   0  0  0

+   -5.2055    1.7826    0.0048 C   0  0  0

+   -5.5905   -0.7255    0.0015 C   0  0  0

+    5.1884    1.2479    0.0004 C   0  0  0

+    4.8239   -1.1252    0.0031 C   0  0  0

+    5.6867   -0.0430   -0.0011 C   0  0  0

+   -0.4163    1.9046    0.0000 H   0  0  0

+   -3.4496   -1.9044    0.0000 H   0  0  0

+   -1.8648   -3.0867    0.0000 H   0  0  0

+   -0.5147   -3.6838    0.0000 H   0  0  0

+    0.0824   -2.3337    0.0000 H   0  0  0

+   -2.8092    2.2653    0.0000 H   0  0  0

+    3.4517    2.4392    0.0000 H   0  0  0

+    2.8102   -1.7408    0.0000 H   0  0  0

+   -4.2328    2.1613    0.0000 H   0  0  0

+   -5.5842    2.7553    0.0000 H   0  0  0

+   -6.1782    1.4039    0.0000 H   0  0  0

+   -6.4048   -0.0725    0.0000 H   0  0  0

+   -6.2435   -1.5398    0.0000 H   0  0  0

+   -4.7762   -1.3785    0.0000 H   0  0  0

+    5.8449    2.0594    0.0000 H   0  0  0

+    5.2067   -2.0963    0.0000 H   0  0  0

+    6.7184   -0.2014    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+  9 11  1  0

+ 10 12  2  0

+ 10 13  1  0

+ 11 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 13 17  2  0

+ 16 18  2  0

+  8  9  1  0

+ 17 18  1  0

+  4 19  1  0

+  5 20  1  0

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+ 14 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1576-35-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.5406    0.3368   -0.2387 S   0  0  0

+   -0.2101    0.1723   -0.1255 C   0  0  0

+    2.1989   -0.4893    1.0367 N   0  0  0

+    1.9215   -0.3834   -1.4030 O   0  0  0

+    1.8162    1.7090    0.0065 O   0  0  0

+   -0.9466    1.0997    0.5871 C   0  0  0

+   -0.8475   -0.8812   -0.7541 C   0  0  0

+    1.9710   -1.8292    1.1734 N   0  0  0

+   -2.3203    0.9707    0.6759 C   0  0  0

+   -2.2207   -1.0102   -0.6653 C   0  0  0

+   -2.9569   -0.0857    0.0522 C   0  0  0

+   -4.4542   -0.2263    0.1491 C   0  0  0

+    3.1403   -0.2467    0.0000 H   0  0  0

+   -0.5653    1.9940    0.0000 H   0  0  0

+   -0.3309   -1.7048    0.0000 H   0  0  0

+    1.0595   -2.1672    0.0000 H   0  0  0

+    2.7195   -2.4496    0.0000 H   0  0  0

+   -2.8376    1.7939    0.0000 H   0  0  0

+   -2.6014   -1.9048    0.0000 H   0  0  0

+   -4.5451    0.7416    0.0000 H   0  0  0

+   -5.4221   -0.3172    0.0000 H   0  0  0

+   -4.3633   -1.1942    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  2  0

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+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+609-15-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.8244   -0.0658   -0.6517 C   0  0  0

+   -0.4770    0.6517   -0.4014 C   0  0  0

+    1.8844    0.4804    0.2698 C   0  0  0

+    0.6082   -1.8286   -0.3409 Cl  0  0  0

+   -1.5594   -0.0386   -0.0092 O   0  0  0

+   -0.5462    1.8483   -0.5537 O   0  0  0

+    2.7340    1.6462   -0.1663 C   0  0  0

+    2.0529   -0.0160    1.3576 O   0  0  0

+   -2.8133    0.6527    0.2320 C   0  0  0

+   -3.8775   -0.3576    0.6650 C   0  0  0

+    1.7055   -0.6797    0.0000 H   0  0  0

+    3.6019    1.0137    0.0000 H   0  0  0

+    3.3665    2.5141    0.0000 H   0  0  0

+    1.8661    2.2787    0.0000 H   0  0  0

+   -2.2013    1.5351    0.0000 H   0  0  0

+   -3.6285    1.3518    0.0000 H   0  0  0

+   -4.6169    0.4212    0.0000 H   0  0  0

+   -4.6563   -1.0970    0.0000 H   0  0  0

+   -3.1381   -1.1364    0.0000 H   0  0  0

+  2  1  1  0

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+  1 11  1  0

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+  7 14  1  0

+  9 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57817-89-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+116122                          1 V2000

+    1.3751   -2.4117    0.0000 C   0  0  1

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+ 56116  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98033-22-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.2447   -0.5468   -0.0664 C   0  0  0

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+ 18 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111901-45-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -1.2019   -0.1594   -0.2923 C   0  0  0

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+  5  6  1  0

+  9 11  1  0

+ 10 13  2  0

+ 14 17  1  0

+ 21 22  1  0

+  2 23  1  0

+  5 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97389-17-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.5722   -0.6252   -0.0017 C   0  0  0

+   -0.8854   -0.5273   -0.0010 C   0  0  0

+    1.3243    0.5524   -0.0012 C   0  0  0

+    1.4412   -1.6616    0.0025 N   0  0  0

+   -1.4813    0.7586    0.0002 C   0  0  0

+   -1.6556   -1.6142   -0.0020 N   0  0  0

+    0.6895    1.7969    0.0000 C   0  0  0

+    2.6516    0.1596   -0.0016 N   0  0  0

+    2.6702   -1.2039   -0.0002 C   0  0  0

+   -0.6632    1.9043    0.0012 C   0  0  0

+   -2.8142    0.8639    0.0009 N   0  0  0

+   -2.9650   -1.4857   -0.0017 C   0  0  0

+    1.5269    3.0499    0.0006 C   0  0  0

+    3.8194    1.0443   -0.0013 C   0  0  0

+    3.8087   -1.9832    0.0028 N   0  0  0

+   -3.5544   -0.2225    0.0004 C   0  0  0

+   -5.0565   -0.1009    0.0017 C   0  0  0

+   -1.1014    2.8454    0.0000 H   0  0  0

+   -3.5648   -2.3330    0.0000 H   0  0  0

+    2.3900    2.4731    0.0000 H   0  0  0

+    2.1037    3.9130    0.0000 H   0  0  0

+    0.6638    3.6267    0.0000 H   0  0  0

+    4.4463    0.2168    0.0000 H   0  0  0

+    4.6469    1.6712    0.0000 H   0  0  0

+    3.1925    1.8718    0.0000 H   0  0  0

+    3.7292   -3.0183    0.0000 H   0  0  0

+    4.7449   -1.5345    0.0000 H   0  0  0

+   -4.9727    0.9339    0.0000 H   0  0  0

+   -6.0913   -0.0171    0.0000 H   0  0  0

+   -5.1403   -1.1357    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  2  0

+ 16 17  1  0

+  7 10  2  0

+  8  9  1  0

+ 12 16  1  0

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+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+484-08-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -0.0140   -0.4256   -0.1012 C   0  0  0

+   -1.2840   -1.0341   -0.1660 C   0  0  0

+    0.0698    0.9858    0.0070 C   0  0  0

+    1.1613   -1.1955   -0.1363 C   0  0  0

+   -2.4018   -0.2052   -0.1197 C   0  0  0

+   -1.4124   -2.3795   -0.2703 O   0  0  0

+   -1.0394    1.7310    0.0467 N   0  0  0

+    1.3380    1.5910    0.0716 C   0  0  0

+    2.3751   -0.5776   -0.0713 C   0  0  0

+   -2.2438    1.1929   -0.0114 C   0  0  0

+   -3.8515   -0.4379   -0.1582 C   0  0  0

+   -1.6035   -2.8801    1.0544 C   0  0  0

+    2.4621    0.8193    0.0297 C   0  0  0

+    3.5126   -1.3224   -0.1053 O   0  0  0

+   -3.4833    1.7271    0.0112 O   0  0  0

+   -4.4241    0.7688   -0.0750 C   0  0  0

+    3.6835    1.4114    0.0921 O   0  0  0

+    3.1084   -2.6890   -0.2102 C   0  0  0

+    3.4557    2.8184    0.1949 C   0  0  0

+    1.1056   -2.2166    0.0000 H   0  0  0

+    1.4179    2.6105    0.0000 H   0  0  0

+   -4.3276   -1.3429    0.0000 H   0  0  0

+   -2.5589   -2.5154    0.0000 H   0  0  0

+   -1.9682   -3.8355    0.0000 H   0  0  0

+   -0.6481   -3.2448    0.0000 H   0  0  0

+   -5.4326    0.9383    0.0000 H   0  0  0

+    2.1278   -2.3990    0.0000 H   0  0  0

+    2.8184   -3.6696    0.0000 H   0  0  0

+    4.0890   -2.9790    0.0000 H   0  0  0

+    4.4652    2.9818    0.0000 H   0  0  0

+    3.2923    3.8279    0.0000 H   0  0  0

+    2.4462    2.6550    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 18 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-64-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 59                          1 V2000

+   -6.3094    0.4645    0.5940 C   0  0  0

+   -7.3223    1.5134    0.1804 C   0  0  1

+   -5.1795    1.1157    1.0706 C   0  0  0

+   -6.3595   -0.9140    0.5561 C   0  0  0

+   -6.4664    2.8107    0.1159 C   0  0  1

+   -7.7325    1.2403   -1.2809 C   0  0  0

+   -8.5077    1.6173    1.1421 C   0  0  0

+   -5.3452    2.5071    1.0263 N   0  0  0

+   -4.0929    0.3600    1.5088 C   0  0  0

+   -5.2771   -1.6610    0.9969 C   0  0  0

+   -5.9551    2.8477   -1.2757 N   0  0  0

+   -7.0999    2.3844   -2.1008 C   0  0  0

+   -4.1341    3.0568    0.4024 C   0  0  0

+   -4.1442   -1.0173    1.4729 C   0  0  0

+   -5.3254   -3.0198    0.9603 O   0  0  0

+   -5.7398    4.2622   -1.6088 C   0  0  0

+   -4.9744   -3.6760   -0.1619 C   0  0  0

+   -5.1273   -5.0130   -0.2365 N   0  0  0

+   -4.5199   -3.0627   -1.1074 O   0  0  0

+   -4.7455   -5.7269   -1.4575 C   0  0  0

+   11.2154   -0.0388    0.0386 C   0  0  0

+   10.3093    0.9396   -0.3950 C   0  0  0

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+   10.8896   -1.4687   -0.1095 C   0  0  0

+   10.6241    2.2818   -0.2454 C   0  0  0

+    9.1306    0.5749   -0.9584 O   0  0  0

+   12.7226    1.6882    0.7577 C   0  0  0

+   11.8115   -2.4045    0.1909 O   0  0  0

+    9.7896   -1.8037   -0.5024 O   0  0  0

+   11.8247    2.6516    0.3281 C   0  0  0

+   -7.2405   -1.3562    0.0000 H   0  0  0

+   -6.9647    3.6613    0.0000 H   0  0  0

+   -8.7085    1.3788    0.0000 H   0  0  0

+   -7.5143    0.2790    0.0000 H   0  0  0

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+   -3.3016   -1.5289    0.0000 H   0  0  0

+   -4.7652    4.1139    0.0000 H   0  0  0

+   -5.5915    5.2368    0.0000 H   0  0  0

+   -6.7144    4.4105    0.0000 H   0  0  0

+   -6.0956   -5.1978    0.0000 H   0  0  0

+   -5.6148   -6.1918    0.0000 H   0  0  0

+   -4.2806   -6.5962    0.0000 H   0  0  0

+   -3.8762   -5.2620    0.0000 H   0  0  0

+   13.1552   -0.3142    0.0000 H   0  0  0

+    9.9036    2.9546    0.0000 H   0  0  0

+    8.1889    0.2835    0.0000 H   0  0  0

+   13.6736    1.9476    0.0000 H   0  0  0

+   12.5033   -3.1068    0.0000 H   0  0  0

+   12.0790    3.6040    0.0000 H   0  0  0

+  1  2  1  0

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+ 21 22  1  0

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+ 21 24  1  0

+ 22 25  2  0

+ 22 26  1  0

+ 23 27  1  0

+ 24 28  1  0

+ 24 29  2  0

+ 25 30  1  0

+  5  8  1  0

+ 10 14  1  0

+ 11 12  1  0

+ 27 30  2  0

+  4 31  1  0

+  5 32  1  0

+  6 33  1  0

+  6 34  1  0

+  7 35  1  0

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+  9 38  1  0

+ 12 39  1  0

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+ 23 52  1  0

+ 25 53  1  0

+ 26 54  1  0

+ 27 55  1  0

+ 28 56  1  0

+ 30 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-40-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -2.7262    0.0001    0.0018 C   0  0  0

+   -2.0302   -1.2022    0.0013 C   0  0  0

+   -2.0304    1.2021    0.0014 C   0  0  0

+   -4.1234    0.0001   -0.0032 N   0  0  0

+   -0.6494   -1.1991    0.0005 C   0  0  0

+   -0.6491    1.1989    0.0006 C   0  0  0

+    0.0412    0.0001    0.0002 C   0  0  0

+    1.9322    0.0000   -0.0003 Br  0  0  0

+   -2.5486   -2.1035    0.0000 H   0  0  0

+   -2.5487    2.1035    0.0000 H   0  0  0

+   -4.6433    0.9006    0.0000 H   0  0  0

+   -4.6433   -0.9004    0.0000 H   0  0  0

+   -0.1280   -2.0987    0.0000 H   0  0  0

+   -0.1277    2.0985    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

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+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80984-66-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 35                          1 V2000

+    0.7424    0.0001   -0.0026 C   0  0  0

+   -0.7427   -0.0002   -0.0020 C   0  0  0

+    1.4691    1.1789    0.1784 C   0  0  0

+    1.4693   -1.1789   -0.1785 C   0  0  0

+   -1.4696    1.1780    0.1788 C   0  0  0

+   -1.4693   -1.1793   -0.1817 C   0  0  0

+    0.7656    2.4998    0.3820 C   0  0  0

+    2.8495    1.1772    0.1770 C   0  0  0

+    0.7666   -2.5014   -0.3739 C   0  0  0

+    2.8501   -1.1761   -0.1802 C   0  0  0

+   -0.7669    2.4994    0.3819 C   0  0  0

+   -2.8504    1.1755    0.1786 C   0  0  0

+   -0.7659   -2.5005   -0.3837 C   0  0  0

+   -2.8497   -1.1774   -0.1813 C   0  0  0

+   -0.0007    2.8324   -0.8263 N   0  0  0

+    3.5503    0.0009   -0.0046 C   0  0  0

+    0.0024   -2.8281    0.8375 N   0  0  0

+   -3.5506   -0.0010   -0.0012 C   0  0  0

+    1.4681    3.2607    0.0000 H   0  0  0

+    3.3617    2.0773    0.0000 H   0  0  0

+    1.4673   -3.2639    0.0000 H   0  0  0

+    3.3629   -2.0758    0.0000 H   0  0  0

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+   -1.4660   -3.2636    0.0000 H   0  0  0

+   -3.3620   -2.0774    0.0000 H   0  0  0

+   -0.0010    3.8680    0.0000 H   0  0  0

+    4.5859    0.0012    0.0000 H   0  0  0

+    0.0029   -3.8637    0.0000 H   0  0  0

+   -4.5862   -0.0012    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

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+  6 13  1  0

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+  7 15  1  0

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+  7 11  1  0

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+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+27108-42-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 12                          1 V2000

+   -3.1755   -0.0492    0.0285 C   0  0  0

+   -4.0769    0.9188    0.2870 N   0  0  0

+   -2.0392   -0.1203    0.7473 O   0  0  0

+   -3.3905   -0.8608   -0.8499 O   0  0  0

+   -5.3133    0.9962   -0.4950 C   0  0  0

+   -1.1671   -1.0569    0.4972 N   0  0  0

+    7.3990    0.1766   -0.1056 Cl  0  0  0

+   -3.6797    1.7587    0.0000 H   0  0  0

+   -5.2552    1.9235    0.0000 H   0  0  0

+   -6.2406    1.0543    0.0000 H   0  0  0

+   -5.3714    0.0689    0.0000 H   0  0  0

+   -1.4394   -1.9452    0.0000 H   0  0  0

+   -0.2616   -0.8486    0.0000 H   0  0  0

+    8.3281    0.1766    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+123-77-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    1.7425    0.0057   -0.0014 C   0  0  0

+    0.4590    0.4168   -0.0004 N   0  0  0

+    2.7403    0.9117   -0.0006 N   0  0  0

+    2.0001   -1.1813    0.0020 O   0  0  0

+   -0.4590   -0.4168   -0.0011 N   0  0  0

+   -1.7425   -0.0057   -0.0001 C   0  0  0

+   -2.7403   -0.9117   -0.0009 N   0  0  0

+   -2.0001    1.1813    0.0016 O   0  0  0

+    3.7029    0.6034    0.0000 H   0  0  0

+    2.5260    1.8995    0.0000 H   0  0  0

+   -3.7029   -0.6034    0.0000 H   0  0  0

+   -2.5260   -1.8995    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  5  6  1  0

+  6  7  1  0

+  6  8  2  0

+  3  9  1  0

+  3 10  1  0

+  7 11  1  0

+  7 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+294-93-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    1.0174   -2.1251   -0.4072 C   0  0  0

+   -0.2590   -2.3393    0.4086 C   0  0  0

+    1.9649   -1.3942    0.3739 O   0  0  0

+   -1.3936   -1.9630   -0.3744 O   0  0  0

+    2.3534   -0.2597   -0.4033 C   0  0  0

+   -2.1378   -1.0223    0.4022 C   0  0  0

+    2.1246    1.0170    0.4083 C   0  0  0

+   -2.3427    0.2592   -0.4082 C   0  0  0

+    1.3882    1.9557   -0.3781 O   0  0  0

+   -1.9551    1.3874    0.3786 O   0  0  0

+    0.2599    2.3538    0.4032 C   0  0  0

+   -1.0217    2.1352   -0.4035 C   0  0  0

+    0.8444   -3.0067    0.0000 H   0  0  0

+    1.7816   -2.5976    0.0000 H   0  0  0

+   -0.8251   -3.0370    0.0000 H   0  0  0

+    0.1934   -3.1155    0.0000 H   0  0  0

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+   -3.0192   -0.8484    0.0000 H   0  0  0

+   -2.6060   -1.7891    0.0000 H   0  0  0

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+    2.5901    1.7855    0.0000 H   0  0  0

+   -3.0348    0.8320    0.0000 H   0  0  0

+   -3.1228   -0.1864    0.0000 H   0  0  0

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+ 12 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+207-08-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -1.9852   -0.0002    0.0025 C   0  0  0

+   -1.2040   -1.1603    0.0032 C   0  0  0

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+ 17 29  1  0

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+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+36167-69-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 51                          1 V2000

+   -5.8502   -1.3429   -0.4549 C   0  0  0

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+ 28 52  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92339-11-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+106107                          1 V2000

+   -1.9140   -2.6604   -0.0644 C   0  0  0

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+ 62106  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122587-22-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.0107   -0.3491    0.0037 C   0  0  0

+   -0.0856   -1.3326    0.0031 O   0  0  0

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+   -1.0584    2.4389    0.0017 Cl  0  0  0

+   -2.9862   -1.7746   -0.0030 O   0  0  0

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+    2.3357    1.6966   -0.0032 Cl  0  0  0

+   -4.4072   -1.6240   -0.0054 C   0  0  0

+    2.3966   -2.7673    0.0019 O   0  0  0

+    3.4750   -0.9541   -0.0011 O   0  5  0

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+  5  6  2  0

+ 12 15  1  0

+ 12 16  1  0

+ 12 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105-60-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -1.1476    0.0152   -0.0688 C   0  0  0

+   -0.3927   -1.1333   -0.7044 C   0  0  0

+   -0.5790    1.2173    0.0333 N   0  0  0

+   -2.2749   -0.1572    0.3441 O   0  0  0

+    0.7246   -1.5660    0.2481 C   0  0  0

+    0.7838    1.4430   -0.4751 C   0  0  0

+    1.9623   -0.7101    0.0489 C   0  0  0

+    1.7757    0.7406    0.4541 C   0  0  0

+   -1.3715   -1.3984    0.0000 H   0  0  0

+   -0.4459   -2.1460    0.0000 H   0  0  0

+   -1.1899    2.0267    0.0000 H   0  0  0

+    0.1789   -2.4207    0.0000 H   0  0  0

+    1.4547   -2.2698    0.0000 H   0  0  0

+    1.5652    2.0894    0.0000 H   0  0  0

+    0.3633    2.3658    0.0000 H   0  0  0

+    2.3997   -1.6250    0.0000 H   0  0  0

+    2.9349   -0.4231    0.0000 H   0  0  0

+    2.7825    0.6191    0.0000 H   0  0  0

+    2.1406    1.6867    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+879-39-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.2011    0.8745    0.0031 C   0  0  0

+   -1.0021   -0.4942    0.0020 C   0  0  0

+   -0.1163    1.7314    0.0028 C   0  0  0

+   -2.5762    1.4221   -0.0017 N   0  3  0

+    0.2842   -1.0069    0.0007 C   0  0  0

+   -2.3650   -1.5695    0.0029 Cl  0  0  0

+    1.1692    1.2210    0.0015 C   0  0  0

+   -2.7518    2.6274   -0.0008 O   0  0  0

+   -3.5322    0.6674   -0.0065 O   0  5  0

+    1.3702   -0.1490    0.0004 C   0  0  0

+    0.5344   -2.7248   -0.0012 Cl  0  0  0

+    2.5308    2.2979    0.0005 Cl  0  0  0

+    2.9834   -0.7902   -0.0018 Cl  0  0  0

+   -0.2667    2.7590    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+ 10 13  1  0

+  7 10  1  0

+  3 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21846-26-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.4038   -0.6277    0.0098 C   0  0  0

+   -1.0799   -0.6076    0.0007 C   0  0  0

+    0.8861    0.6637   -0.1833 C   0  0  0

+    1.3074   -1.6787    0.1776 C   0  0  0

+   -1.5248    0.6963   -0.1981 C   0  0  0

+   -2.0137   -1.6346    0.1520 C   0  0  0

+   -0.3063    1.5774   -0.3262 C   0  0  0

+    2.2442    0.9010   -0.2132 C   0  0  0

+    2.6641   -1.4323    0.1446 C   0  0  0

+   -2.8754    0.9702   -0.2450 C   0  0  0

+   -3.3626   -1.3513    0.1037 C   0  0  0

+   -0.2994    2.6059    0.8065 C   0  0  0

+    3.1340   -0.1459   -0.0510 C   0  0  0

+   -3.7952   -0.0523   -0.0943 C   0  0  0

+    4.6177    0.1160   -0.0840 C   0  0  0

+    0.9621   -2.6532    0.0000 H   0  0  0

+   -1.6954   -2.6183    0.0000 H   0  0  0

+    0.6223    2.0319    0.0000 H   0  0  0

+    2.5955    1.8734    0.0000 H   0  0  0

+    3.3302   -2.2230    0.0000 H   0  0  0

+   -3.1997    1.9519    0.0000 H   0  0  0

+   -4.0507   -2.1230    0.0000 H   0  0  0

+    0.7345    2.5990    0.0000 H   0  0  0

+   -0.2925    3.6398    0.0000 H   0  0  0

+   -1.3333    2.6128    0.0000 H   0  0  0

+   -4.8073    0.1587    0.0000 H   0  0  0

+    4.7974   -0.9022    0.0000 H   0  0  0

+    5.6359    0.2957    0.0000 H   0  0  0

+    4.4380    1.1342    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  2  0

+ 10 14  2  0

+ 13 15  1  0

+  5  7  1  0

+  9 13  1  0

+ 11 14  1  0

+  4 16  1  0

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+ 10 21  1  0

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+ 12 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+39638-73-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    0.7259    0.5650   -0.3710 C   0  0  1

+   -0.7049    0.2788   -0.2396 N   0  0  0

+    1.3227    0.8679    1.0271 C   0  0  1

+    1.4205   -0.6324   -0.7814 O   0  0  0

+   -1.6031    1.0488   -0.8804 C   0  0  0

+   -1.1200   -0.7719    0.5284 C   0  0  0

+    2.8061    0.4666    0.8403 C   0  0  1

+    1.2378    2.2704    1.2875 O   0  0  0

+    2.7905   -0.4838   -0.3726 C   0  0  1

+   -2.9097    0.8125   -0.7795 N   0  0  0

+   -1.2136    1.9802   -1.5656 O   0  0  0

+   -2.4481   -1.0253    0.6411 C   0  0  0

+    3.5777    1.6275    0.5258 O   0  0  0

+    3.3501   -1.8467    0.0401 C   0  0  0

+   -3.3628   -0.1920   -0.0419 C   0  0  0

+   -2.8923   -2.0655    1.3992 O   0  0  0

+    3.3172   -2.7340   -1.0795 O   0  0  0

+   -4.7162   -0.4252    0.0538 N   0  0  0

+    0.3999    1.5060    0.0000 H   0  0  0

+    1.4248   -0.1227    0.0000 H   0  0  0

+   -0.4849   -1.5390    0.0000 H   0  0  0

+    3.7570    0.1709    0.0000 H   0  0  0

+    1.1776    3.2644    0.0000 H   0  0  0

+    3.7691   -0.2991    0.0000 H   0  0  0

+    4.1289    2.4569    0.0000 H   0  0  0

+    4.2600   -2.2513    0.0000 H   0  0  0

+    4.0643   -1.1528    0.0000 H   0  0  0

+   -3.2834   -2.9813    0.0000 H   0  0  0

+    3.2803   -3.7292    0.0000 H   0  0  0

+   -5.3533    0.3402    0.0000 H   0  0  0

+   -5.0604   -1.3597    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+ 14 17  1  0

+ 15 18  1  0

+  7  9  1  0

+ 12 15  1  0

+  1 19  1  0

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+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-97-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.6008    0.0019   -0.4509 C   0  0  0

+    1.2465   -1.1965   -0.2091 C   0  0  0

+    1.2485    1.1978   -0.2048 C   0  0  0

+   -0.8070    0.0042   -0.9886 C   0  0  0

+    2.5397   -1.1986    0.2786 C   0  0  0

+    2.5421    1.1957    0.2831 C   0  0  0

+   -1.7981   -0.0005    0.1770 C   0  0  0

+    3.1876   -0.0023    0.5247 C   0  0  0

+   -3.2274    0.0018   -0.3689 C   0  0  0

+   -4.1531   -0.0026    0.7197 O   0  0  0

+    0.7228   -2.0720    0.0000 H   0  0  0

+    0.7271    2.0747    0.0000 H   0  0  0

+   -0.2973    0.8880    0.0000 H   0  0  0

+   -1.3194    0.8864    0.0000 H   0  0  0

+    3.0611   -2.0755    0.0000 H   0  0  0

+    3.0658    2.0712    0.0000 H   0  0  0

+   -2.3077   -0.8843    0.0000 H   0  0  0

+   -1.2857   -0.8827    0.0000 H   0  0  0

+    4.2078   -0.0034    0.0000 H   0  0  0

+   -2.7178    0.8856    0.0000 H   0  0  0

+   -3.7398    0.8840    0.0000 H   0  0  0

+   -5.1733   -0.0074    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

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+  9 10  1  0

+  6  8  2  0

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+  5 15  1  0

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+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+41840-28-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+    3.9655    0.0614    0.0347 C   0  0  0

+    2.7759   -0.7638   -0.0763 O   0  0  0

+    3.9040    0.8729    1.3303 C   0  0  0

+    5.2068   -0.8329    0.0515 C   0  0  0

+    4.0390    1.0136   -1.1606 C   0  0  0

+    1.5564   -0.1928   -0.0601 C   0  0  0

+    0.1117   -1.2012   -0.0341 S   0  0  0

+    1.4523    1.0179   -0.0635 O   0  0  0

+   -1.4839   -0.4541   -0.0129 C   0  0  0

+   -2.5591   -1.2270    0.0066 N   0  0  0

+   -1.5791    0.8670   -0.0114 N   0  0  0

+   -3.7717   -0.6985    0.0233 C   0  0  0

+   -2.7612    1.4597    0.0047 C   0  0  0

+   -3.9080    0.6807    0.0202 C   0  0  0

+   -4.9899   -1.5853    0.0449 C   0  0  0

+   -2.8605    2.9635    0.0068 C   0  0  0

+    4.9257    0.9503    0.0000 H   0  0  0

+    3.8266    1.8946    0.0000 H   0  0  0

+    2.8823    0.7955    0.0000 H   0  0  0

+    4.6078   -1.6643    0.0000 H   0  0  0

+    6.0382   -1.4319    0.0000 H   0  0  0

+    5.8058   -0.0015    0.0000 H   0  0  0

+    5.0606    0.9347    0.0000 H   0  0  0

+    4.1179    2.0352    0.0000 H   0  0  0

+    3.0174    1.0925    0.0000 H   0  0  0

+   -4.8360    1.1151    0.0000 H   0  0  0

+   -5.5930   -0.7569    0.0000 H   0  0  0

+   -5.8183   -2.1884    0.0000 H   0  0  0

+   -4.3868   -2.4137    0.0000 H   0  0  0

+   -1.8380    3.0310    0.0000 H   0  0  0

+   -2.9280    3.9860    0.0000 H   0  0  0

+   -3.8830    2.8960    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  6  8  2  0

+  7  9  1  0

+  9 10  2  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  2  0

+ 12 14  2  0

+ 12 15  1  0

+ 13 16  1  0

+ 13 14  1  0

+  3 17  1  0

+  3 18  1  0

+  3 19  1  0

+  4 20  1  0

+  4 21  1  0

+  4 22  1  0

+  5 23  1  0

+  5 24  1  0

+  5 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+32740-01-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+    0.5054    0.0295    0.0033 C   0  0  0

+    0.1662   -1.3484    0.0003 C   0  0  0

+    1.9279    0.4066    0.0024 C   0  0  0

+   -0.4256    0.9708    0.0013 N   0  0  0

+   -1.1745   -1.7363    0.0010 C   0  0  0

+    1.2193   -2.3612   -0.0038 C   0  0  0

+    2.9130   -0.6023   -0.0013 C   0  0  0

+    2.3120    1.7493    0.0046 C   0  0  0

+   -1.7213    0.6702   -0.0032 C   0  0  0

+   -2.1480   -0.7318    0.0045 C   0  0  0

+   -1.5614   -3.1928   -0.0026 C   0  0  0

+    2.5196   -2.0085   -0.0046 C   0  0  0

+    4.2667   -0.2403   -0.0022 C   0  0  0

+    3.6496    2.0740    0.0032 C   0  0  0

+   -2.7098    1.6734   -0.0058 C   0  0  0

+   -3.5232   -1.0291    0.0058 C   0  0  0

+    4.6184    1.0784    0.0005 C   0  0  0

+   -4.0228    1.3217   -0.0109 C   0  0  0

+   -2.3144    3.1275   -0.0025 C   0  0  0

+   -4.4262   -0.0123    0.0098 C   0  0  0

+    0.9592   -3.3776    0.0000 H   0  0  0

+    1.5853    2.5060    0.0000 H   0  0  0

+   -2.5754   -2.9235    0.0000 H   0  0  0

+   -1.8307   -4.2068    0.0000 H   0  0  0

+   -0.5474   -3.4621    0.0000 H   0  0  0

+    3.2585   -2.7533    0.0000 H   0  0  0

+    5.0088   -0.9819    0.0000 H   0  0  0

+    3.9400    3.0821    0.0000 H   0  0  0

+   -3.8491   -2.0263    0.0000 H   0  0  0

+    5.6334    1.3436    0.0000 H   0  0  0

+   -4.7527    2.0753    0.0000 H   0  0  0

+   -1.3020    2.8522    0.0000 H   0  0  0

+   -2.0391    4.1399    0.0000 H   0  0  0

+   -3.3268    3.4028    0.0000 H   0  0  0

+   -5.4509   -0.2374    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+ 15 18  2  0

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+ 16 20  2  0

+  7 12  1  0

+  9 10  1  0

+ 14 17  1  0

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+  6 21  1  0

+  8 22  1  0

+ 11 23  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+140-10-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.9624    0.2664   -0.0009 C   0  0  0

+   -0.4700    0.6046    0.0001 C   0  0  0

+    1.9242    1.2815    0.0004 C   0  0  0

+    1.3687   -1.0720    0.0028 C   0  0  0

+   -1.3950   -0.3775   -0.0011 C   0  0  0

+    3.2644    0.9564   -0.0005 C   0  0  0

+    2.7123   -1.3807    0.0019 C   0  0  0

+   -2.8182   -0.0415   -0.0002 C   0  0  0

+    3.6584   -0.3702   -0.0027 C   0  0  0

+   -3.7431   -1.0235   -0.0014 O   0  0  0

+   -3.1680    1.1234    0.0016 O   0  0  0

+   -0.7685    1.5986    0.0000 H   0  0  0

+    1.6302    2.2769    0.0000 H   0  0  0

+    0.6605   -1.8307    0.0000 H   0  0  0

+   -1.0965   -1.3715    0.0000 H   0  0  0

+    3.9795    1.7087    0.0000 H   0  0  0

+    3.0153   -2.3734    0.0000 H   0  0  0

+    4.6685   -0.6087    0.0000 H   0  0  0

+   -4.4547   -1.7790    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  7  9  1  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+32306-29-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+   -2.0666   -0.1577   -0.0360 C   0  0  0

+   -3.5436   -0.1050    0.0093 C   0  0  0

+   -1.2314   -0.5977    0.9521 C   0  0  0

+   -1.2769    0.2124   -1.0603 O   0  0  0

+   -4.2232    0.9832   -0.5404 C   0  0  0

+   -4.2642   -1.1455    0.5967 C   0  0  0

+    0.0621   -0.4363    0.3994 C   0  0  0

+   -0.1070    0.0529   -0.8007 N   0  0  0

+   -5.6012    1.0263   -0.4948 C   0  0  0

+   -5.6424   -1.0901    0.6357 C   0  0  0

+    1.2440   -0.7347    0.9963 O   0  0  0

+   -6.3096   -0.0061    0.0942 C   0  0  0

+    2.4039   -0.3643   -0.0571 P   0  0  0

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+ 20 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+116355-83-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+109108                          1 V2000

+   -1.8810   -1.4859    1.5632 C   0  0  0

+   -3.2477   -1.4189    0.8787 C   0  0  0

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+ 50109  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-85-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.1591    0.8032    0.0018 C   0  0  0

+   -1.6781   -0.4896    0.0004 C   0  0  0

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+   -0.8205   -1.5770   -0.0011 C   0  0  0

+   -3.0246   -0.6835    0.0009 O   0  0  0

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+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+114460-41-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.1580   -0.8861    0.0157 C   0  0  0

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+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1330-20-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 54                          1 V2000

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+   15.4910   -0.8039    0.0000 H   0  0  0

+   13.0547   -3.2959    0.0000 H   0  0  0

+   14.3047   -3.9995    0.0000 H   0  0  0

+   15.0083   -2.7495    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  9 10  2  0

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+ 11 15  2  0

+ 13 16  2  0

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+ 19 22  2  0

+ 21 23  2  0

+ 23 24  1  0

+  6  8  2  0

+ 15 16  1  0

+ 22 23  1  0

+  1 25  1  0

+  4 26  1  0

+  5 27  1  0

+  5 28  1  0

+  5 29  1  0

+  6 30  1  0

+  7 31  1  0

+  7 32  1  0

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+ 21 50  1  0

+ 22 51  1  0

+ 24 52  1  0

+ 24 53  1  0

+ 24 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2523-37-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.7419   -0.6099   -0.0005 C   0  0  0

+   -0.7420   -0.6096    0.0004 C   0  0  0

+    1.2057    0.6881   -0.1977 C   0  0  0

+    1.6605   -1.6481    0.1619 C   0  0  0

+   -1.2055    0.6882   -0.1963 C   0  0  0

+   -1.6611   -1.6486    0.1582 C   0  0  0

+    0.0001    1.5855   -0.3332 C   0  0  0

+    2.5597    0.9437   -0.2369 C   0  0  0

+    3.0139   -1.3832    0.1205 C   0  0  0

+   -2.5599    0.9441   -0.2351 C   0  0  0

+   -3.0140   -1.3833    0.1183 C   0  0  0

+    0.0008    2.6149    0.7987 C   0  0  0

+    3.4650   -0.0913   -0.0800 C   0  0  0

+   -3.4651   -0.0904   -0.0782 C   0  0  0

+    1.3289   -2.6272    0.0000 H   0  0  0

+   -1.3296   -2.6278    0.0000 H   0  0  0

+   -0.9235    2.0498    0.0000 H   0  0  0

+    2.8974    1.9208    0.0000 H   0  0  0

+    3.6909   -2.1644    0.0000 H   0  0  0

+   -2.8974    1.9212    0.0000 H   0  0  0

+   -3.6913   -2.1643    0.0000 H   0  0  0

+    1.0346    2.6142    0.0000 H   0  0  0

+    0.0015    3.6487    0.0000 H   0  0  0

+   -1.0330    2.6156    0.0000 H   0  0  0

+    4.4799    0.1053    0.0000 H   0  0  0

+   -4.4800    0.1064    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

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+  5  7  1  0

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+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-33-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    2.7831   -0.1918   -0.2275 C   0  0  0

+    3.7853    0.4496    0.4893 C   0  0  0

+    1.4956    0.3526   -0.2726 N   0  0  0

+    3.0638   -1.3717   -0.9038 C   0  0  0

+    5.0556   -0.0903    0.5314 C   0  0  0

+    3.4868    1.7335    1.2197 C   0  0  0

+    0.4291   -0.4131    0.0321 C   0  0  0

+    4.3378   -1.9037   -0.8619 C   0  0  0

+    5.3305   -1.2684   -0.1390 C   0  0  0

+    3.5993    2.9106    0.2487 C   0  0  0

+   -0.9316    0.1270   -0.1185 C   0  0  0

+    0.5912   -1.5506    0.4314 O   0  0  0

+   -2.0945   -0.6636    0.1979 C   0  0  0

+   -1.1505    1.4145   -0.5633 C   0  0  0

+   -3.2972   -0.0806    0.0273 C   0  0  0

+   -2.8770    1.5472   -0.5608 S   0  0  0

+   -4.6405   -0.6528    0.2715 N   0  3  0

+   -5.6354    0.0183    0.0632 O   0  0  0

+   -4.7508   -1.7947    0.6808 O   0  5  0

+    1.3860    1.3331    0.0000 H   0  0  0

+    2.3120   -2.0106    0.0000 H   0  0  0

+    5.8108    0.5446    0.0000 H   0  0  0

+    2.6262    2.2160    0.0000 H   0  0  0

+    2.6979    1.1410    0.0000 H   0  0  0

+    4.4234   -2.8866    0.0000 H   0  0  0

+    6.2445   -1.6400    0.0000 H   0  0  0

+    4.5815    2.8167    0.0000 H   0  0  0

+    3.6932    3.8928    0.0000 H   0  0  0

+    2.6171    3.0045    0.0000 H   0  0  0

+   -2.0227   -1.6476    0.0000 H   0  0  0

+   -0.4855    2.1434    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  8  9  2  0

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+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

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+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+616-72-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.1970   -0.0717   -0.0198 C   0  0  0

+   -0.0002   -0.7630   -0.0027 C   0  0  0

+    1.1970    1.3104   -0.0183 C   0  0  0

+    2.4788   -0.8118   -0.0336 N   0  3  0

+   -1.1970   -0.0720    0.0160 C   0  0  0

+   -0.0002    2.0017    0.0004 C   0  0  0

+    2.5020    2.0639   -0.0366 C   0  0  0

+    2.7926   -1.4682   -1.0104 O   0  0  0

+    3.2199   -0.7643    0.9318 O   0  5  0

+   -1.1970    1.3106    0.0176 C   0  0  0

+   -2.4787   -0.8121    0.0339 N   0  3  0

+   -2.5020    2.0640    0.0379 C   0  0  0

+   -2.7895   -1.4683    1.0119 O   0  0  0

+   -3.2227   -0.7650   -0.9293 O   0  5  0

+   -0.0002   -1.7997    0.0000 H   0  0  0

+   -0.0002    3.0384    0.0000 H   0  0  0

+    3.0204    1.1661    0.0000 H   0  0  0

+    3.3998    2.5823    0.0000 H   0  0  0

+    1.9836    2.9617    0.0000 H   0  0  0

+   -1.9837    2.9618    0.0000 H   0  0  0

+   -3.3998    2.5823    0.0000 H   0  0  0

+   -3.0203    1.1662    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  2  5  2  0

+  3  6  1  0

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+  6 10  2  0

+  2 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  7 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+119-32-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.3374    0.0923   -0.0005 C   0  0  0

+   -0.0783   -1.2628    0.0909 C   0  0  0

+    0.7070    0.9933   -0.0737 C   0  0  0

+   -1.7354    0.5775   -0.0260 N   0  3  0

+    1.2266   -1.7209    0.1093 C   0  0  0

+   -1.2203   -2.2428    0.1711 C   0  0  0

+    2.0186    0.5366   -0.0555 C   0  0  0

+   -2.4493    0.3280   -0.9808 O   0  0  0

+   -2.1720    1.2263    0.9078 O   0  5  0

+    2.2753   -0.8256    0.0364 C   0  0  0

+    3.0770    1.4450   -0.1289 N   0  0  0

+    0.5128    2.0122    0.0000 H   0  0  0

+    1.4169   -2.7405    0.0000 H   0  0  0

+   -1.8958   -1.4557    0.0000 H   0  0  0

+   -2.0074   -2.9183    0.0000 H   0  0  0

+   -0.5448   -3.0299    0.0000 H   0  0  0

+    3.2535   -1.1705    0.0000 H   0  0  0

+    4.0556    1.1011    0.0000 H   0  0  0

+    2.8855    2.4644    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91642-47-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+   -2.0051    0.0505   -0.0042 C   0  0  0

+   -3.1607   -0.6466   -0.0035 O   0  0  0

+   -2.3229    1.3934   -0.0012 C   0  0  0

+   -0.7004   -0.4979   -0.0022 C   0  0  0

+   -4.1952    0.2052   -0.0001 C   0  0  0

+   -3.7235    1.4720    0.0014 C   0  0  0

+    0.3809    0.3230   -0.0032 C   0  0  0

+   -5.6248   -0.1793    0.0021 N   0  3  0

+    1.6834   -0.2244   -0.0012 C   0  0  0

+   -6.4869    0.6811    0.0052 O   0  0  0

+   -5.9389   -1.3561    0.0009 O   0  5  0

+    2.7587    0.5918   -0.0023 O   0  0  0

+    1.8361   -1.4319    0.0014 O   0  0  0

+    3.9148   -0.2480    0.0002 C   0  0  0

+    5.1752    0.6194   -0.0008 C   0  0  0

+    6.4131   -0.2799    0.0019 C   0  0  0

+    7.6735    0.5875    0.0009 C   0  0  0

+    8.9113   -0.3117    0.0036 C   0  0  0

+   -1.6528    2.1934    0.0000 H   0  0  0

+   -0.5695   -1.5332    0.0000 H   0  0  0

+   -4.2946    2.3454    0.0000 H   0  0  0

+    0.2500    1.3583    0.0000 H   0  0  0

+    3.2100   -1.0176    0.0000 H   0  0  0

+    4.5998   -1.0353    0.0000 H   0  0  0

+    5.8800    1.3890    0.0000 H   0  0  0

+    4.4902    1.4067    0.0000 H   0  0  0

+    5.7083   -1.0495    0.0000 H   0  0  0

+    7.0981   -1.0672    0.0000 H   0  0  0

+    8.3783    1.3571    0.0000 H   0  0  0

+    6.9885    1.3748    0.0000 H   0  0  0

+    8.2980   -1.1560    0.0000 H   0  0  0

+    9.7556   -0.9250    0.0000 H   0  0  0

+    9.5246    0.5326    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+921-14-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    0.0221   -0.3418   -0.4439 N   0  0  0

+   -1.1032    0.5486   -0.1293 C   0  0  0

+    1.2014    0.2125    0.2344 C   0  0  0

+   -0.2643   -1.6177    0.1917 N   0  0  0

+   -2.3566    0.0644   -0.8610 C   0  0  0

+   -1.3568    0.5364    1.3795 C   0  0  0

+    2.4092   -0.6907   -0.0231 C   0  0  0

+    1.4886    1.6146   -0.3062 C   0  0  0

+   -0.7951    1.5081    0.0000 H   0  0  0

+    0.4095    0.8357    0.0000 H   0  0  0

+   -1.2262   -1.9182    0.0000 H   0  0  0

+    0.4769   -2.3005    0.0000 H   0  0  0

+   -2.7197    1.0045    0.0000 H   0  0  0

+   -3.2967   -0.2987    0.0000 H   0  0  0

+   -1.9935   -0.8757    0.0000 H   0  0  0

+   -1.4052    1.5430    0.0000 H   0  0  0

+   -2.3634    0.4880    0.0000 H   0  0  0

+   -1.3084   -0.4702    0.0000 H   0  0  0

+    1.8057   -1.4978    0.0000 H   0  0  0

+    3.2163   -1.2942    0.0000 H   0  0  0

+    3.0127    0.1164    0.0000 H   0  0  0

+    2.4759    1.4124    0.0000 H   0  0  0

+    1.6908    2.6019    0.0000 H   0  0  0

+    0.5013    1.8168    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  8 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64-19-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+   -0.0528   -0.0008   -0.0015 C   0  0  0

+   -1.2410    0.9262    0.0004 C   0  0  0

+    1.1914    0.5028    0.0004 O   0  0  0

+   -0.2202   -1.1974    0.0004 O   0  0  0

+   -0.6218    1.7199    0.0000 H   0  0  0

+   -2.0347    1.5454    0.0000 H   0  0  0

+   -1.8602    0.1325    0.0000 H   0  0  0

+    2.1246    0.8805    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105052-39-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.4502   -0.2907   -0.0018 C   0  0  0

+   -1.8262   -0.5827   -0.0018 C   0  0  0

+    0.0020    1.1039   -0.0004 C   0  0  0

+    0.5154   -1.3073    0.0027 C   0  0  0

+   -2.7759    0.5270    0.0000 C   0  0  0

+   -2.2250   -1.9219   -0.0032 C   0  0  0

+    1.3800    1.3075    0.0000 C   0  0  0

+   -0.9970    2.1722    0.0001 C   0  0  0

+    1.8096   -0.9638    0.0033 O   0  0  0

+    0.0769   -2.6445    0.0069 C   0  0  0

+   -2.3171    1.8610    0.0018 C   0  0  0

+   -4.0974    0.2752   -0.0005 O   0  0  0

+   -1.2594   -2.9279   -0.0044 C   0  0  0

+    2.2074    0.1864   -0.0010 C   0  0  0

+   -5.0459    1.3745    0.0014 C   0  0  0

+    3.6708    0.4097   -0.0011 N   0  3  0

+    4.4319   -0.5412   -0.0019 O   0  0  0

+    4.1857    1.7287   -0.0002 O   0  5  0

+   -3.2453   -2.1691    0.0000 H   0  0  0

+    1.7831    2.2768    0.0000 H   0  0  0

+   -0.6931    3.1770    0.0000 H   0  0  0

+    0.7781   -3.4258    0.0000 H   0  0  0

+   -3.0215    2.6394    0.0000 H   0  0  0

+   -1.5681   -3.9313    0.0000 H   0  0  0

+   -4.2511    2.0603    0.0000 H   0  0  0

+   -5.7317    2.1693    0.0000 H   0  0  0

+   -5.8407    0.6887    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

+  3  8  2  0

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+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

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+  8 11  1  0

+  9 14  1  0

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+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+140-29-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.0352    0.0024   -0.5092 C   0  0  0

+    0.6074   -1.1962   -0.2602 C   0  0  0

+    0.6097    1.1981   -0.2549 C   0  0  0

+   -1.4364    0.0050   -1.0638 C   0  0  0

+    1.8947   -1.1986    0.2431 C   0  0  0

+    1.8974    1.1957    0.2485 C   0  0  0

+   -2.4033    0.0002    0.0461 C   0  0  0

+    2.5398   -0.0025    0.4974 C   0  0  0

+   -3.1495   -0.0035    0.9027 N   0  0  0

+    0.0833   -2.0700    0.0000 H   0  0  0

+    0.0883    2.0735    0.0000 H   0  0  0

+   -0.9273    0.8876    0.0000 H   0  0  0

+   -1.9482    0.8860    0.0000 H   0  0  0

+    2.4161   -2.0740    0.0000 H   0  0  0

+    2.4215    2.0695    0.0000 H   0  0  0

+    3.5587   -0.0038    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  3  0

+  6  8  2  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+111574-85-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 40                          1 V2000

+   -0.0498    1.0459   -0.0203 C   0  0  1

+   -0.9370    0.0560   -0.6362 N   0  0  0

+    1.4062    0.6770   -0.3118 C   0  0  0

+   -0.3462    2.4093   -0.5898 C   0  0  0

+   -2.1320   -0.2184   -0.0767 C   0  0  0

+    1.7630   -0.9642    0.3736 S   0  0  0

+   -0.1527    3.5105    0.1628 N   0  0  0

+   -0.7589    2.5156   -1.7252 O   0  0  0

+   -3.0446   -1.2367   -0.7103 C   0  0  0

+   -2.4729    0.3540    0.9367 O   0  0  0

+    3.4540   -1.1297   -0.0932 C   0  0  0

+   -0.4409    4.8359   -0.3908 C   0  0  0

+   -4.3260   -1.3577    0.1170 C   0  0  0

+    4.1240   -2.2258    0.2248 C   0  0  0

+    4.2411    0.1451   -0.9701 Cl  0  0  0

+   -0.1428    5.8887    0.6455 C   0  0  0

+   -5.2525   -2.3915   -0.5263 C   0  0  1

+    5.7900   -2.3888   -0.2351 Cl  0  0  0

+    3.3368   -3.5005    1.1017 Cl  0  0  0

+   -0.3338    7.1860    0.3585 O   0  0  0

+    0.2682    5.5651    1.7346 O   0  0  0

+   -6.5146   -2.5107    0.2885 C   0  0  0

+   -5.5892   -1.9651   -1.8911 N   0  0  0

+   -6.5852   -3.4017    1.2900 O   0  0  0

+   -7.4629   -1.8044    0.0403 O   0  0  0

+   -0.9919    1.2948    0.0000 H   0  0  0

+   -0.4420   -0.7833    0.0000 H   0  0  0

+    2.3788    0.7354    0.0000 H   0  0  0

+    1.4977    1.6471    0.0000 H   0  0  0

+    0.8215    3.5301    0.0000 H   0  0  0

+   -3.2198   -2.1952    0.0000 H   0  0  0

+   -2.1697   -1.6656    0.0000 H   0  0  0

+   -1.2247    5.4148    0.0000 H   0  0  0

+   -1.2589    4.3065    0.0000 H   0  0  0

+   -4.1508   -0.3992    0.0000 H   0  0  0

+   -5.2009   -0.9288    0.0000 H   0  0  0

+   -4.8137   -3.2615    0.0000 H   0  0  0

+   -0.4757    8.1500    0.0000 H   0  0  0

+   -5.2289   -1.0598    0.0000 H   0  0  0

+   -6.5534   -2.1057    0.0000 H   0  0  0

+   -6.6622   -4.3730    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 11 14  2  0

+ 11 15  1  0

+ 12 16  1  0

+ 13 17  1  0

+ 14 18  1  0

+ 14 19  1  0

+ 16 20  1  0

+ 16 21  2  0

+ 17 22  1  0

+ 17 23  1  0

+ 22 24  1  0

+ 22 25  2  0

+  1 26  1  0

+  2 27  1  0

+  3 28  1  0

+  3 29  1  0

+  7 30  1  0

+  9 31  1  0

+  9 32  1  0

+ 12 33  1  0

+ 12 34  1  0

+ 13 35  1  0

+ 13 36  1  0

+ 17 37  1  0

+ 20 38  1  0

+ 23 39  1  0

+ 23 40  1  0

+ 24 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-24-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.0001    0.7339   -0.0051 C   0  0  0

+   -0.0001   -0.7356   -0.0011 C   0  0  0

+    1.2138    1.4342   -0.0056 C   0  0  0

+   -1.2135    1.4342   -0.0026 C   0  0  0

+    1.2142   -1.4352    0.0022 C   0  0  0

+   -1.2139   -1.4352   -0.0010 C   0  0  0

+    2.4141    0.7339   -0.0023 C   0  0  0

+   -2.4143    0.7339    0.0038 C   0  0  0

+    2.4143   -0.7344    0.0017 C   0  0  0

+   -2.4146   -0.7343   -0.0047 C   0  0  0

+    3.6536    1.4125   -0.0032 C   0  0  0

+   -3.6533    1.4123    0.0065 C   0  0  0

+    3.6544   -1.4118    0.0055 C   0  0  0

+   -3.6542   -1.4117   -0.0043 C   0  0  0

+    4.8073    0.6990   -0.0003 C   0  0  0

+   -4.8074    0.6988    0.0128 C   0  0  0

+    4.8076   -0.6975    0.0053 C   0  0  0

+   -4.8078   -0.6972   -0.0075 C   0  0  0

+    1.2164    2.4849    0.0000 H   0  0  0

+   -1.2159    2.4849    0.0000 H   0  0  0

+    1.2173   -2.4859    0.0000 H   0  0  0

+   -1.2168   -2.4859    0.0000 H   0  0  0

+    3.6814    2.4629    0.0000 H   0  0  0

+   -3.6810    2.4627    0.0000 H   0  0  0

+    3.6831   -2.4621    0.0000 H   0  0  0

+   -3.6828   -2.4620    0.0000 H   0  0  0

+    5.7251    1.2106    0.0000 H   0  0  0

+   -5.7251    1.2105    0.0000 H   0  0  0

+    5.7256   -1.2086    0.0000 H   0  0  0

+   -5.7259   -1.2083    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  8 12  2  0

+  9 13  1  0

+ 10 14  2  0

+ 11 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+ 14 18  1  0

+  7  9  1  0

+  8 10  1  0

+ 15 17  1  0

+ 16 18  2  0

+  3 19  1  0

+  4 20  1  0

+  5 21  1  0

+  6 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118-52-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.6996   -1.2057   -0.0001 C   0  0  0

+   -0.8150   -1.1436    0.0003 C   0  0  0

+    1.1041    0.2108   -0.0003 N   0  0  0

+    1.2097   -1.9111    1.2581 C   0  0  0

+    1.2091   -1.9112   -1.2585 C   0  0  0

+   -1.1259    0.1677    0.0003 N   0  0  0

+   -1.5862   -2.0790   -0.0001 O   0  0  0

+   -0.0297    0.9348    0.0000 C   0  0  0

+    2.7032    0.8166    0.0002 Cl  0  0  0

+   -2.7240    0.7761    0.0001 Cl  0  0  0

+   -0.0554    2.1499   -0.0005 O   0  0  0

+    0.3921   -2.5023    0.0000 H   0  0  0

+    1.8009   -2.7287    0.0000 H   0  0  0

+    2.0273   -1.3199    0.0000 H   0  0  0

+    0.3912   -2.5019    0.0000 H   0  0  0

+    1.7998   -2.7291    0.0000 H   0  0  0

+    2.0270   -1.3205    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

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+  6 10  1  0

+  8 11  2  0

+  6  8  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1565-94-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 73 74                          1 V2000

+    0.0459    4.4997   -0.1967 C   0  0  0

+   -1.0156    3.5421    0.2799 C   0  0  0

+    1.3649    3.7777   -0.2980 C   0  0  0

+   -0.3420    5.0483   -1.5712 C   0  0  0

+    0.1726    5.6563    0.7969 C   0  0  0

+   -1.1869    3.3197    1.6335 C   0  0  0

+   -1.8206    2.8917   -0.6374 C   0  0  0

+    2.4963    4.4611   -0.7029 C   0  0  0

+    1.4424    2.4341    0.0197 C   0  0  0

+   -2.1598    2.4425    2.0730 C   0  0  0

+   -2.7945    2.0138   -0.2032 C   0  0  0

+    3.7068    3.8016   -0.7961 C   0  0  0

+    2.6502    1.7702   -0.0719 C   0  0  0

+   -2.9649    1.7849    1.1547 C   0  0  0

+    3.7862    2.4526   -0.4831 C   0  0  0

+   -3.9223    0.9213    1.5845 O   0  0  0

+    4.9756    1.8015   -0.5744 O   0  0  0

+   -4.5731    0.4125    0.4185 C   0  0  0

+    4.7347    0.4458   -0.1923 C   0  0  0

+   -5.6685   -0.5714    0.8342 C   0  0  0

+    6.0410   -0.3467   -0.2736 C   0  0  0

+   -6.3653   -1.1162   -0.4142 C   0  0  0

+   -5.0854   -1.6526    1.5643 O   0  0  0

+    5.7831   -1.7983    0.1355 C   0  0  0

+    6.5375   -0.3104   -1.6130 O   0  0  0

+   -7.4048   -2.0500   -0.0197 O   0  0  0

+    7.0227   -2.5504    0.0584 O   0  0  0

+   -8.1558   -2.6589   -0.9590 C   0  0  0

+    7.0371   -3.8604    0.3756 C   0  0  0

+   -9.2079   -3.6040   -0.5597 C   0  0  0

+   -7.9627   -2.4263   -2.1361 O   0  0  0

+    8.2917   -4.6216    0.2975 C   0  0  0

+    6.0124   -4.4121    0.7261 O   0  0  0

+   -9.4472   -3.8924    0.9000 C   0  0  0

+   -9.9493   -4.2051   -1.4870 C   0  0  0

+    9.5622   -3.9376   -0.1372 C   0  0  0

+    8.3058   -5.9150    0.6106 C   0  0  0

+    0.4606    5.6158    0.0000 H   0  0  0

+   -0.9095    5.8509    0.0000 H   0  0  0

+   -1.1446    4.4808    0.0000 H   0  0  0

+    1.1497    5.5493    0.0000 H   0  0  0

+    0.2796    6.6334    0.0000 H   0  0  0

+   -0.8045    5.7633    0.0000 H   0  0  0

+   -0.4655    2.6520    0.0000 H   0  0  0

+   -2.4588    3.6393    0.0000 H   0  0  0

+    2.4744    5.4438    0.0000 H   0  0  0

+    0.6111    1.9095    0.0000 H   0  0  0

+   -1.5196    1.6966    0.0000 H   0  0  0

+   -3.5213    2.6756    0.0000 H   0  0  0

+    4.5368    4.3282    0.0000 H   0  0  0

+    2.6690    0.7874    0.0000 H   0  0  0

+   -4.7323    1.3825    0.0000 H   0  0  0

+   -5.5004    0.7386    0.0000 H   0  0  0

+    3.7953    0.7354    0.0000 H   0  0  0

+    4.3319   -0.4509    0.0000 H   0  0  0

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+    6.2710    0.6090    0.0000 H   0  0  0

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+    7.5179   -0.2387    0.0000 H   0  0  0

+  -10.2037   -3.2647    0.0000 H   0  0  0

+  -10.0749   -4.6489    0.0000 H   0  0  0

+   -8.6907   -4.5201    0.0000 H   0  0  0

+  -10.8672   -3.8534    0.0000 H   0  0  0

+   -9.7950   -5.1759    0.0000 H   0  0  0

+   10.0282   -4.8031    0.0000 H   0  0  0

+   10.4277   -3.4716    0.0000 H   0  0  0

+    9.0962   -3.0721    0.0000 H   0  0  0

+    7.4599   -6.4157    0.0000 H   0  0  0

+    9.1624   -6.3972    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

+  3  9  1  0

+  6 10  1  0

+  7 11  2  0

+  8 12  1  0

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+ 10 14  2  0

+ 12 15  2  0

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+ 24 27  1  0

+ 26 28  1  0

+ 27 29  1  0

+ 28 30  1  0

+ 28 31  2  0

+ 29 32  1  0

+ 29 33  2  0

+ 30 34  1  0

+ 30 35  2  0

+ 32 36  1  0

+ 32 37  2  0

+ 11 14  1  0

+ 13 15  1  0

+  4 38  1  0

+  4 39  1  0

+  4 40  1  0

+  5 41  1  0

+  5 42  1  0

+  5 43  1  0

+  6 44  1  0

+  7 45  1  0

+  8 46  1  0

+  9 47  1  0

+ 10 48  1  0

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+ 12 50  1  0

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+ 18 52  1  0

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+ 19 54  1  0

+ 19 55  1  0

+ 20 56  1  0

+ 21 57  1  0

+ 22 58  1  0

+ 22 59  1  0

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+ 24 62  1  0

+ 25 63  1  0

+ 34 64  1  0

+ 34 65  1  0

+ 34 66  1  0

+ 35 67  1  0

+ 35 68  1  0

+ 36 69  1  0

+ 36 70  1  0

+ 36 71  1  0

+ 37 72  1  0

+ 37 73  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-93-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.4666    0.0259   -0.0013 C   0  0  0

+   -0.7721    0.8843    0.0012 C   0  0  0

+    1.8292    0.6695   -0.0001 C   0  0  0

+    0.3672   -1.1776    0.0007 O   0  0  0

+   -2.0129   -0.0109   -0.0007 C   0  0  0

+   -0.0274    1.7346    0.0000 H   0  0  0

+   -1.5328    1.7203    0.0000 H   0  0  0

+    2.3119   -0.3525    0.0000 H   0  0  0

+    2.8512    1.1522    0.0000 H   0  0  0

+    1.3465    1.6915    0.0000 H   0  0  0

+   -2.6742    0.9057    0.0000 H   0  0  0

+   -2.9295   -0.6722    0.0000 H   0  0  0

+   -1.3516   -0.9275    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+608-71-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.0001   -1.8338   -0.0001 C   0  0  0

+   -1.2013   -1.1389    0.0000 C   0  0  0

+    1.2011   -1.1393   -0.0001 C   0  0  0

+    0.0000   -3.1933    0.0053 O   0  0  0

+   -1.1992    0.2441    0.0002 C   0  0  0

+   -2.8400   -2.0826   -0.0007 Br  0  0  0

+    1.1991    0.2442    0.0001 C   0  0  0

+    2.8398   -2.0830   -0.0010 Br  0  0  0

+    0.0002    0.9353   -0.0002 C   0  0  0

+   -2.8358    1.1914    0.0004 Br  0  0  0

+    2.8358    1.1914    0.0007 Br  0  0  0

+    0.0002    2.8263   -0.0006 Br  0  0  0

+   -0.0001   -4.2340    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+  7  9  2  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-44-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -0.7459    0.4633    0.0901 C   0  0  0

+   -1.1051   -0.8747   -0.1604 C   0  0  0

+    0.5950    0.8091    0.1472 C   0  0  0

+   -1.7068    1.3933    0.2774 O   0  0  0

+   -0.1124   -1.8440   -0.3492 C   0  0  0

+   -2.5242   -1.2287   -0.2186 C   0  0  0

+    1.5660   -0.1635   -0.0424 C   0  0  0

+   -3.0097    1.0738    0.2308 C   0  0  0

+    1.2029   -1.4884   -0.2896 C   0  0  0

+   -3.4403   -0.2434   -0.0268 C   0  0  0

+   -2.9577   -2.6473   -0.4844 C   0  0  0

+    2.9122    0.1844    0.0146 N   0  0  0

+   -3.8413    1.9464    0.4057 O   0  0  0

+    3.6881    0.3147   -1.2213 C   0  0  0

+    3.5535    0.4205    1.3104 C   0  0  0

+    3.3854    1.6652   -1.8735 C   0  0  0

+    3.8986   -0.9209    1.9605 C   0  0  0

+    0.8678    1.8068    0.0000 H   0  0  0

+   -0.3730   -2.8450    0.0000 H   0  0  0

+    1.9331   -2.2211    0.0000 H   0  0  0

+   -4.4505   -0.4656    0.0000 H   0  0  0

+   -3.9469   -2.3450    0.0000 H   0  0  0

+   -3.2600   -3.6365    0.0000 H   0  0  0

+   -1.9685   -2.9496    0.0000 H   0  0  0

+    3.8778   -0.7021    0.0000 H   0  0  0

+    4.7014    0.5227    0.0000 H   0  0  0

+    4.5460    0.7118    0.0000 H   0  0  0

+    3.2290    1.4027    0.0000 H   0  0  0

+    4.3947    1.8914    0.0000 H   0  0  0

+    3.1592    2.6745    0.0000 H   0  0  0

+    2.3761    1.4390    0.0000 H   0  0  0

+    2.8968   -1.1786    0.0000 H   0  0  0

+    4.1563   -1.9227    0.0000 H   0  0  0

+    4.9004   -0.6632    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+  8 13  2  0

+ 12 14  1  0

+ 12 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+  7  9  1  0

+  8 10  1  0

+  3 18  1  0

+  5 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56-18-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.0000   -0.4161    0.0000 N   0  0  0

+   -1.1786    0.4608    0.0000 C   0  0  0

+    1.1786    0.4608    0.0000 C   0  0  0

+   -2.4488   -0.3921    0.0000 C   0  0  0

+    2.4488   -0.3921    0.0000 C   0  0  0

+   -3.6763    0.5212    0.0000 C   0  0  0

+    3.6763    0.5212    0.0000 C   0  0  0

+   -4.8959   -0.2977    0.0000 N   0  0  0

+    4.8959   -0.2977    0.0000 N   0  0  0

+    0.0000   -1.5407    0.0000 H   0  0  0

+   -0.4096    1.2814    0.0000 H   0  0  0

+   -1.9070    1.3176    0.0000 H   0  0  0

+    1.9070    1.3176    0.0000 H   0  0  0

+    0.4096    1.2814    0.0000 H   0  0  0

+   -3.2178   -1.2127    0.0000 H   0  0  0

+   -1.7204   -1.2489    0.0000 H   0  0  0

+    1.7204   -1.2489    0.0000 H   0  0  0

+    3.2178   -1.2127    0.0000 H   0  0  0

+   -2.9073    1.3418    0.0000 H   0  0  0

+   -4.4047    1.3780    0.0000 H   0  0  0

+    4.4047    1.3780    0.0000 H   0  0  0

+    2.9073    1.3418    0.0000 H   0  0  0

+   -5.9057    0.1974    0.0000 H   0  0  0

+   -4.8198   -1.4198    0.0000 H   0  0  0

+    4.8198   -1.4198    0.0000 H   0  0  0

+    5.9057    0.1974    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+121-32-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.8315    0.1791   -0.0038 C   0  0  0

+   -0.1698   -0.7710   -0.0039 C   0  0  0

+    0.5064    1.5356   -0.0005 C   0  0  0

+    2.1354   -0.2075   -0.0012 O   0  0  0

+   -1.5113   -0.3691   -0.0007 C   0  0  0

+   -0.8241    1.9352    0.0027 C   0  0  0

+    1.4931    2.4679    0.0000 O   0  0  0

+    2.1425   -1.6364    0.0009 C   0  0  0

+   -1.8293    0.9944    0.0026 C   0  0  0

+   -2.5814   -1.3749   -0.0013 C   0  0  0

+    3.5876   -2.1392    0.0038 C   0  0  0

+   -3.7427   -1.0248    0.0015 O   0  0  0

+    0.0723   -1.7866    0.0000 H   0  0  0

+   -1.0624    2.9517    0.0000 H   0  0  0

+    2.2520    3.1849    0.0000 H   0  0  0

+    1.1046   -1.5236    0.0000 H   0  0  0

+    1.9131   -2.6549    0.0000 H   0  0  0

+   -2.8283    1.2976    0.0000 H   0  0  0

+   -2.3426   -2.3913    0.0000 H   0  0  0

+    3.2445   -3.1253    0.0000 H   0  0  0

+    4.5737   -2.4823    0.0000 H   0  0  0

+    3.9307   -1.1531    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+  8 11  1  0

+ 10 12  2  0

+  6  9  2  0

+  2 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60-80-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.4223   -0.1453   -0.0026 N   0  0  0

+   -0.9672    0.0126   -0.0013 C   0  0  0

+    1.3716    0.8853    0.0009 N   0  0  0

+    1.0901   -1.3171   -0.0015 C   0  0  0

+   -1.6599    0.0922   -1.2027 C   0  0  0

+   -1.6582    0.0846    1.2012 C   0  0  0

+    2.6150    0.3192   -0.0011 C   0  0  0

+    1.0812    2.3212    0.0054 C   0  0  0

+    2.4733   -1.0217   -0.0027 C   0  0  0

+    0.5921   -2.4285    0.0007 O   0  0  0

+   -3.0319    0.2482   -1.1979 C   0  0  0

+   -3.0307    0.2407    1.1990 C   0  0  0

+    3.9234    1.0669    0.0013 C   0  0  0

+   -3.7165    0.3253    0.0014 C   0  0  0

+   -1.5435    1.1102    0.0000 H   0  0  0

+   -1.7692   -0.9340    0.0000 H   0  0  0

+    2.0855    2.5243    0.0000 H   0  0  0

+    0.8781    3.3255    0.0000 H   0  0  0

+    0.0769    2.1181    0.0000 H   0  0  0

+    3.2349   -1.7072    0.0000 H   0  0  0

+   -2.9167    1.2664    0.0000 H   0  0  0

+   -3.1513   -0.7768    0.0000 H   0  0  0

+    4.4318    0.1773    0.0000 H   0  0  0

+    4.8130    1.5753    0.0000 H   0  0  0

+    3.4150    1.9565    0.0000 H   0  0  0

+   -4.7341    0.4454    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  6 12  1  0

+  7 13  1  0

+ 11 14  1  0

+  7  9  2  0

+ 12 14  2  0

+  5 15  1  0

+  6 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6923-22-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    1.6317    0.1719   -0.1096 P   0  0  0

+    0.7173   -0.9196   -0.8610 O   0  0  0

+    1.4369    0.0308    1.4823 O   0  0  0

+    3.1780   -0.0737   -0.4848 O   0  0  0

+    1.2301    1.5306   -0.5373 O   0  0  0

+   -0.6261   -0.8071   -0.8340 C   0  0  0

+    1.6470   -1.3457    1.8038 C   0  0  0

+    3.9071    1.0504    0.0119 C   0  0  0

+   -1.1993    0.2671   -0.2646 C   0  0  0

+   -1.4850   -1.8858   -1.4422 C   0  0  0

+   -2.5330    0.1906    0.2108 C   0  0  0

+   -3.4624    1.0522   -0.2478 N   0  0  0

+   -2.8385   -0.6533    1.0333 O   0  0  0

+   -4.8403    0.9732    0.2434 C   0  0  0

+    0.6475   -1.4983    0.0000 H   0  0  0

+    1.7996   -2.3452    0.0000 H   0  0  0

+    2.6465   -1.1931    0.0000 H   0  0  0

+    4.7554    0.5002    0.0000 H   0  0  0

+    4.4573    1.8987    0.0000 H   0  0  0

+    3.0588    1.6006    0.0000 H   0  0  0

+   -0.7042    1.1487    0.0000 H   0  0  0

+   -2.2760   -1.2560    0.0000 H   0  0  0

+   -2.1148   -2.6768    0.0000 H   0  0  0

+   -0.6940   -2.5156    0.0000 H   0  0  0

+   -3.1203    2.0036    0.0000 H   0  0  0

+   -4.8982    1.9826    0.0000 H   0  0  0

+   -5.8497    0.9153    0.0000 H   0  0  0

+   -4.7824   -0.0362    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  2  0

+  6 10  1  0

+  9 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+ 12 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+154028-32-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -1.5293   -0.1519   -0.0013 C   0  0  0

+   -2.5175    0.8354    0.0007 C   0  0  0

+   -0.1050    0.2270    0.0001 C   0  0  0

+   -1.8967   -1.5002    0.0012 C   0  0  0

+   -3.8528    0.4713   -0.0006 C   0  0  0

+    0.8428   -0.7244   -0.0018 C   0  0  0

+   -3.2311   -1.8504    0.0056 C   0  0  0

+   -4.2076   -0.8715   -0.0040 C   0  0  0

+   -4.8176    1.4285    0.0018 O   0  0  0

+    2.2664   -0.3457   -0.0004 C   0  0  0

+   -6.0743    0.7483   -0.0005 C   0  0  0

+    3.2546   -1.3346   -0.0025 C   0  0  0

+    2.6328    1.0037   -0.0029 C   0  0  0

+    4.5848   -0.9765   -0.0011 C   0  0  0

+    3.9648    1.3537   -0.0015 C   0  0  0

+    4.9452    0.3667    0.0023 C   0  0  0

+    6.2932    0.7253    0.0037 N   0  0  0

+   -2.2499    1.8437    0.0000 H   0  0  0

+    0.1669    1.2342    0.0000 H   0  0  0

+   -1.1625   -2.2413    0.0000 H   0  0  0

+    0.5709   -1.7316    0.0000 H   0  0  0

+   -3.5043   -2.8572    0.0000 H   0  0  0

+   -5.2150   -1.1426    0.0000 H   0  0  0

+   -6.5709    1.6657    0.0000 H   0  0  0

+   -6.9917    0.2517    0.0000 H   0  0  0

+   -5.5777   -0.1691    0.0000 H   0  0  0

+    2.9850   -2.3424    0.0000 H   0  0  0

+    1.8982    1.7444    0.0000 H   0  0  0

+    5.3228   -1.7139    0.0000 H   0  0  0

+    4.2389    2.3602    0.0000 H   0  0  0

+    7.0295   -0.0137    0.0000 H   0  0  0

+    6.5650    1.7325    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  1  0

+ 10 12  2  0

+ 10 13  1  0

+ 12 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+ 16 17  1  0

+  7  8  2  0

+ 15 16  1  0

+  2 18  1  0

+  3 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+618-87-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.1985   -0.0597   -0.0036 C   0  0  0

+    0.0002   -0.7495   -0.0029 C   0  0  0

+    1.2020    1.3216   -0.0020 C   0  0  0

+    2.4789   -0.8022    0.0002 N   0  3  0

+   -1.1985   -0.0595   -0.0006 C   0  0  0

+    0.0001    2.0175    0.0002 C   0  0  0

+    3.5349   -0.1952   -0.0004 O   0  0  0

+    2.4765   -2.0202    0.0040 O   0  5  0

+   -1.2022    1.3213    0.0005 C   0  0  0

+   -2.4789   -0.8022    0.0001 N   0  3  0

+    0.0000    3.4143    0.0018 N   0  0  0

+   -3.5349   -0.1953    0.0021 O   0  0  0

+   -2.4765   -2.0202   -0.0013 O   0  5  0

+    0.0002   -1.7865    0.0000 H   0  0  0

+    2.1010    1.8384    0.0000 H   0  0  0

+   -2.1013    1.8380    0.0000 H   0  0  0

+    0.8980    3.9329    0.0000 H   0  0  0

+   -0.8981    3.9327    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+ 10 12  2  0

+ 10 13  1  0

+  6  9  1  0

+  2 14  1  0

+  3 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4460-86-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -1.2073   -0.4509    0.1080 C   0  0  0

+   -1.1230    0.9398    0.2925 C   0  0  0

+   -0.0326   -1.2124    0.0162 C   0  0  0

+   -2.5157   -1.1032    0.0182 C   0  0  0

+    0.1171    1.5483    0.3822 C   0  0  0

+   -2.2539    1.6838    0.3828 O   0  0  0

+    1.1949   -0.5939    0.1071 C   0  0  0

+   -2.5853   -2.3041   -0.1411 O   0  0  0

+    1.2729    0.7887    0.2904 C   0  0  0

+   -2.6179    2.0456   -0.9509 C   0  0  0

+    2.3346   -1.3318    0.0181 O   0  0  0

+    2.4861    1.3911    0.3791 O   0  0  0

+    1.9333   -2.6911   -0.1645 C   0  0  0

+    3.0030    1.4765   -0.9504 C   0  0  0

+   -0.0886   -2.2443    0.0000 H   0  0  0

+   -3.3784   -0.5342    0.0000 H   0  0  0

+    0.1818    2.5797    0.0000 H   0  0  0

+   -1.8894    2.7786    0.0000 H   0  0  0

+   -3.3509    2.7741    0.0000 H   0  0  0

+   -3.3464    1.3126    0.0000 H   0  0  0

+    0.9421   -2.3985    0.0000 H   0  0  0

+    1.6407   -3.6823    0.0000 H   0  0  0

+    2.9245   -2.9837    0.0000 H   0  0  0

+    3.1715    0.4569    0.0000 H   0  0  0

+    4.0226    1.6450    0.0000 H   0  0  0

+    2.8345    2.4961    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  9 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+  7  9  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94-20-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    1.0470   -0.8720   -0.0109 C   0  0  0

+   -0.2600   -2.0533   -0.0450 S   0  0  0

+    1.8700   -0.7842    1.0960 C   0  0  0

+    1.2524   -0.0373   -1.0938 C   0  0  0

+   -1.6045   -1.3224    0.5877 N   0  0  0

+   -0.5489   -2.2698   -1.4194 O   0  0  0

+    0.1062   -3.0613    0.8872 O   0  0  0

+    2.8959    0.1420    1.1232 C   0  0  0

+    2.2776    0.8890   -1.0678 C   0  0  0

+   -2.1087   -0.2174    0.0035 C   0  0  0

+    3.0986    0.9811    0.0422 C   0  0  0

+   -3.2030    0.3775    0.5184 N   0  0  0

+   -1.5764    0.2428   -0.9881 O   0  0  0

+    4.3866    2.1445    0.0756 Cl  0  0  0

+   -3.7511    1.5785   -0.1166 C   0  0  0

+   -4.9827    2.0490    0.6598 C   0  0  0

+   -5.5551    3.3034   -0.0034 C   0  0  0

+    2.2512   -1.6371    0.0000 H   0  0  0

+    0.4505    0.4419    0.0000 H   0  0  0

+   -2.2877   -1.9595    0.0000 H   0  0  0

+    3.6987   -0.3357    0.0000 H   0  0  0

+    1.8939    1.7407    0.0000 H   0  0  0

+   -3.8862   -0.2596    0.0000 H   0  0  0

+   -2.8294    1.7308    0.0000 H   0  0  0

+   -3.6573    2.5079    0.0000 H   0  0  0

+   -5.9044    1.8967    0.0000 H   0  0  0

+   -5.0765    1.1196    0.0000 H   0  0  0

+   -4.7052    3.6912    0.0000 H   0  0  0

+   -5.9429    4.1533    0.0000 H   0  0  0

+   -6.4050    2.9156    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  2  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  8 11  2  0

+ 10 12  1  0

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+ 15 16  1  0

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+  9 11  1  0

+  3 18  1  0

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+  5 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 12 23  1  0

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+ 15 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50648-96-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -1.4747    0.2202    0.0083 C   0  0  0

+   -2.6269    0.9853   -0.1089 C   0  0  0

+   -0.2548    0.8199   -0.0090 O   0  0  0

+   -1.5700   -1.1563    0.1490 C   0  0  0

+   -3.8665    0.3732   -0.0905 C   0  0  0

+   -2.5117    2.7092   -0.2779 Cl  0  0  0

+    0.7176   -0.2181    0.1293 C   0  0  0

+   -2.8107   -1.7634    0.1722 C   0  0  0

+   -3.9582   -1.0006    0.0447 C   0  0  0

+    2.0994    0.3833    0.1174 C   0  0  0

+   -5.5157   -1.7672    0.0676 Cl  0  0  0

+    3.1813   -0.4116    0.2352 N   0  0  0

+    2.2378    1.5826    0.0019 O   0  0  0

+    4.5246    0.1730    0.2236 C   0  0  2

+    5.4992   -0.8190   -0.3570 C   0  0  0

+    4.9419    0.5204    1.6540 C   0  0  0

+    6.7979   -0.4983   -0.4670 O   0  0  0

+    5.1115   -1.9031   -0.7236 O   0  0  0

+   -0.7110   -1.7344    0.0000 H   0  0  0

+   -4.7272    0.9487    0.0000 H   0  0  0

+   -0.1137   -0.8353    0.0000 H   0  0  0

+    1.2362   -1.1143    0.0000 H   0  0  0

+   -2.8788   -2.7966    0.0000 H   0  0  0

+    3.0660   -1.4406    0.0000 H   0  0  0

+    3.9813    1.0544    0.0000 H   0  0  0

+    5.6044   -0.2753    0.0000 H   0  0  0

+    5.7376    1.1829    0.0000 H   0  0  0

+    4.2794    1.3161    0.0000 H   0  0  0

+    7.8031   -0.2501    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  8  9  1  0

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+ 12 24  1  0

+ 14 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+147151-67-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 81 85                          1 V2000

+    6.4940    0.6600   -0.0832 C   0  0  2

+    5.5436   -0.5293    0.0681 C   0  0  1

+    7.7399    0.4197    0.7692 C   0  0  1

+    5.7808    1.9176    0.4269 C   0  0  0

+    4.2969   -0.3346   -0.7792 C   0  0  2

+    6.2455   -1.8231   -0.3484 C   0  0  0

+    8.4407   -0.8536    0.2965 C   0  0  2

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+    4.4849    2.0866   -0.3109 C   0  0  0

+    3.8334    1.0906   -0.8358 C   0  0  0

+    3.1624   -1.2188   -0.2535 C   0  0  0

+    4.6132   -0.7902   -2.2052 C   0  0  0

+    7.5017   -2.0416    0.4990 C   0  0  0

+    9.6948   -1.0341    1.0093 N   0  0  0

+    8.7362   -0.7279   -1.1994 C   0  0  0

+    9.8448    1.3797    1.6625 C   0  0  0

+    2.5228    1.3830   -1.5469 C   0  0  0

+    1.9119   -1.0000   -1.1075 C   0  0  0

+   10.3539   -0.0306    1.5962 C   0  0  0

+    1.4471    0.4517   -0.9798 C   0  0  2

+   11.4270   -0.2742    2.1061 O   0  0  0

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+   -0.7785    0.3678   -0.8536 C   0  0  0

+   -2.1652    0.4641   -1.3078 C   0  0  0

+   -0.5355    0.0528    0.2957 O   0  0  0

+   -3.1750    0.2034   -0.4520 C   0  0  0

+   -4.5707    0.3003   -0.9091 C   0  0  0

+   -5.6190    0.0309   -0.0248 C   0  0  0

+   -4.8535    0.6679   -2.2286 C   0  0  0

+   -6.9299    0.1245   -0.4638 C   0  0  0

+   -6.1629    0.7576   -2.6535 C   0  0  0

+   -7.9817   -0.1436    0.4158 N   0  0  0

+   -7.1990    0.4849   -1.7798 C   0  0  0

+   -8.6519   -1.4459    0.3808 C   0  0  0

+   -8.4144    0.8774    1.3732 C   0  0  0

+   -7.7231   -2.5133    0.9628 C   0  0  0

+   -9.3821    1.8431    0.6863 C   0  0  0

+   -8.5480   -4.1159    0.9198 Cl  0  0  0

+   -9.9146    3.0996    1.8645 Cl  0  0  0

+    7.0657    1.4562    0.0000 H   0  0  0

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+    5.1722   -1.5953    0.0000 H   0  0  0

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+  1  2  1  0

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+ 36 78  1  0

+ 36 79  1  0

+ 37 80  1  0

+ 37 81  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68-11-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.9555    0.0007   -0.0012 C   0  0  0

+   -0.2162    0.9484    0.0016 C   0  0  0

+    2.2084    0.4823   -0.0004 O   0  0  0

+    0.7671   -1.1928    0.0008 O   0  0  0

+   -1.7619   -0.0010   -0.0004 S   0  0  0

+    0.5453    1.6979    0.0000 H   0  0  0

+   -0.8748    1.7898    0.0000 H   0  0  0

+    3.2057    0.8657    0.0000 H   0  0  0

+   -2.6723   -0.5602    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  5  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+42308-20-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.8203    0.2388    0.0205 C   0  0  0

+    0.4232    0.1630    0.0425 N   0  0  0

+    2.5328   -0.3505   -1.0154 C   0  0  0

+    2.4969    0.9087    1.0317 C   0  0  0

+   -0.1876   -1.0368   -0.0203 C   0  0  0

+    3.9119   -0.2739   -1.0342 C   0  0  0

+    3.8756    0.9818    1.0071 C   0  0  0

+   -1.6889   -1.1134   -0.1258 C   0  0  0

+    0.4711   -2.0549    0.0080 O   0  0  0

+    4.5827    0.3888   -0.0231 C   0  0  0

+   -2.2460   -1.8808    1.0749 C   0  0  0

+   -2.4379    0.7042   -0.1466 Br  0  0  0

+   -0.1003    0.9672    0.0000 H   0  0  0

+    2.2330   -1.2621    0.0000 H   0  0  0

+    2.1085    1.7862    0.0000 H   0  0  0

+    4.3009   -1.1511    0.0000 H   0  0  0

+    4.1797    1.8919    0.0000 H   0  0  0

+   -1.2314   -1.9569    0.0000 H   0  0  0

+    5.5415    0.4279    0.0000 H   0  0  0

+   -3.0225   -1.3171    0.0000 H   0  0  0

+   -2.8097   -2.6573    0.0000 H   0  0  0

+   -1.4695   -2.4445    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  7 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+157730-37-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.8881    0.5234    0.0039 C   0  0  0

+   -0.7665   -0.8889    0.0031 C   0  0  0

+    0.2377    1.3125    0.0029 C   0  0  0

+   -2.2483    0.7929    0.0000 N   0  0  0

+    0.4272   -1.4634    0.0015 N   0  0  0

+   -2.0219   -1.3894    0.0044 N   0  0  0

+    1.4944    0.6763    0.0011 C   0  0  0

+   -2.8944   -0.4104   -0.0028 C   0  0  0

+   -2.8739    2.1176   -0.0004 C   0  0  0

+    1.5476   -0.7405    0.0005 C   0  0  0

+    2.6239    1.3900   -0.0003 N   0  0  0

+   -4.2594   -0.5717   -0.0064 N   0  0  0

+    2.8108   -1.3685   -0.0017 C   0  0  0

+    3.7982    0.8075   -0.0024 C   0  0  0

+    3.9250   -0.5805   -0.0032 C   0  0  0

+    0.1642    2.3407    0.0000 H   0  0  0

+   -1.9417    2.5578    0.0000 H   0  0  0

+   -3.3141    3.0498    0.0000 H   0  0  0

+   -3.8061    1.6774    0.0000 H   0  0  0

+   -4.8760    0.2544    0.0000 H   0  0  0

+   -4.6665   -1.5188    0.0000 H   0  0  0

+    2.8902   -2.3963    0.0000 H   0  0  0

+    4.6486    1.3902    0.0000 H   0  0  0

+    4.8611   -1.0122    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

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+  9 17  1  0

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+  9 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+85-48-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -1.9236    0.2795   -0.0744 S   0  0  0

+   -2.8390   -0.5603   -0.7643 O   0  0  0

+   -1.5869    1.6092   -0.4458 O   0  0  0

+   -2.4394    0.3675    1.3548 O   0  0  0

+   -0.4007   -0.6057   -0.0313 C   0  0  0

+    0.8200    0.0908   -0.0173 C   0  0  0

+   -0.4021   -1.9666   -0.0058 C   0  0  0

+    2.0317   -0.6432    0.0174 C   0  0  0

+    0.8521    1.4272   -0.0357 N   0  0  0

+    0.7903   -2.6861    0.0284 C   0  0  0

+    1.9924   -2.0464    0.0366 C   0  0  0

+    3.2533    0.0564    0.0313 C   0  0  0

+    1.9878    2.0817   -0.0223 C   0  0  0

+    3.2143    1.4214    0.0107 C   0  0  0

+   -3.4535    0.5405    0.0000 H   0  0  0

+   -1.2982   -2.4719    0.0000 H   0  0  0

+    0.7626   -3.7145    0.0000 H   0  0  0

+    2.8668   -2.5884    0.0000 H   0  0  0

+    4.1506   -0.4468    0.0000 H   0  0  0

+    1.9729    3.1103    0.0000 H   0  0  0

+    4.0899    1.9615    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  2  0

+  4  1  1  0

+  5  1  1  0

+  6  5  2  0

+  7  5  1  0

+  8  6  1  0

+  9  6  1  0

+ 10  7  2  0

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+ 12  8  1  0

+ 13  9  2  0

+ 14 12  2  0

+ 10 11  1  0

+ 13 14  1  0

+  4 15  1  0

+  7 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+ 14 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+631-64-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.1050    1.7257   -0.0702 C   0  0  0

+    0.0346    0.3193   -0.6070 C   0  0  0

+    1.1727    2.4937   -0.3382 O   0  0  0

+   -0.8020    2.1636    0.5973 O   0  0  0

+    1.5534   -0.7218    0.0818 Br  0  0  0

+   -1.6486   -0.5182   -0.0319 Br  0  0  0

+    0.9810    0.7881    0.0000 H   0  0  0

+    2.0301    3.1104    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25799-70-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 50                          1 V2000

+    1.1083    0.4947   -0.2393 C   0  0  0

+    0.2257   -0.5619   -0.5371 C   0  0  0

+    2.4226    0.2003    0.2076 C   0  0  0

+    0.7066    1.8347   -0.3845 C   0  0  0

+    0.6995   -1.8785   -0.3737 C   0  0  0

+   -1.0590   -0.3158   -0.9743 N   0  0  0

+    2.8283   -1.0600    0.3473 N   0  0  0

+    3.2986    1.2712    0.5030 C   0  0  0

+    1.5780    2.8372   -0.0908 C   0  0  0

+   -0.6653    2.1544   -0.8576 N   0  3  0

+    2.0288   -2.0903    0.0782 C   0  0  0

+   -0.1241   -2.9829   -0.6517 C   0  0  0

+   -1.9244   -0.3601    0.2120 C   0  0  0

+    2.8692    2.5567    0.3547 C   0  0  0

+    4.5631    1.0195    0.9324 O   0  0  0

+   -0.9744    1.9432   -2.0166 O   0  0  0

+   -1.4806    2.6277   -0.0864 O   0  5  0

+    2.4909   -3.4131    0.2376 C   0  0  0

+    0.3601   -4.2434   -0.4854 C   0  0  0

+   -3.3879   -0.2497   -0.2201 C   0  0  0

+    5.1880    2.2874    1.1424 C   0  0  0

+    1.6652   -4.4559   -0.0408 C   0  0  0

+   -4.2892   -0.2958    1.0154 C   0  0  0

+   -5.6945   -0.1899    0.6006 N   0  0  0

+   -6.5016   -0.2403    1.8269 C   0  0  0

+   -5.8677    1.1553    0.0362 C   0  0  0

+   -0.9893    0.6916    0.0000 H   0  0  0

+    1.2597    3.7956    0.0000 H   0  0  0

+   -1.1245   -2.8450    0.0000 H   0  0  0

+   -2.4580   -1.2174    0.0000 H   0  0  0

+   -1.4116   -1.2301    0.0000 H   0  0  0

+    3.5435    3.3084    0.0000 H   0  0  0

+    3.4867   -3.5808    0.0000 H   0  0  0

+   -0.2770   -5.0269    0.0000 H   0  0  0

+   -2.8543    0.6076    0.0000 H   0  0  0

+   -3.9007    0.6203    0.0000 H   0  0  0

+    6.0938    1.8410    0.0000 H   0  0  0

+    5.6344    3.1932    0.0000 H   0  0  0

+    4.2822    2.7338    0.0000 H   0  0  0

+    2.0302   -5.3975    0.0000 H   0  0  0

+   -4.8228   -1.1532    0.0000 H   0  0  0

+   -3.7764   -1.1658    0.0000 H   0  0  0

+   -6.5645    0.7676    0.0000 H   0  0  0

+   -7.5095   -0.3032    0.0000 H   0  0  0

+   -6.4387   -1.2482    0.0000 H   0  0  0

+   -4.8661    1.2843    0.0000 H   0  0  0

+   -5.9967    2.1569    0.0000 H   0  0  0

+   -6.8693    1.0263    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  8 14  2  0

+  8 15  1  0

+ 10 16  2  0

+ 10 17  1  0

+ 11 18  1  0

+ 12 19  2  0

+ 13 20  1  0

+ 15 21  1  0

+ 18 22  2  0

+ 20 23  1  0

+ 23 24  1  0

+ 24 25  1  0

+ 24 26  1  0

+  7 11  1  0

+  9 14  1  0

+ 19 22  1  0

+  6 27  1  0

+  9 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+ 14 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+ 25 43  1  0

+ 25 44  1  0

+ 25 45  1  0

+ 26 46  1  0

+ 26 47  1  0

+ 26 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50285-71-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.6056    0.0065   -0.2295 N   0  0  0

+   -0.6134    0.5808   -0.2042 C   0  0  0

+    1.7953    0.8237   -0.4808 C   0  0  0

+    0.7254   -1.2619   -0.0271 N   0  0  0

+   -1.6923   -0.1436    0.1531 N   0  0  0

+   -0.7397    1.7515   -0.5034 O   0  0  0

+    2.3486    1.3413    0.8484 C   0  0  0

+    1.8270   -1.7809   -0.0499 O   0  0  0

+   -2.0971   -0.2100    1.5595 C   0  0  0

+   -2.4603   -0.8646   -0.8650 C   0  0  0

+    1.9122   -0.0821    0.0000 H   0  0  0

+    2.6547    0.5147    0.0000 H   0  0  0

+    2.9725    0.6743    0.0000 H   0  0  0

+    3.0156    1.9652    0.0000 H   0  0  0

+    1.7247    2.0083    0.0000 H   0  0  0

+   -2.2449    0.6913    0.0000 H   0  0  0

+   -2.9984   -0.3578    0.0000 H   0  0  0

+   -1.9493   -1.1113    0.0000 H   0  0  0

+   -3.0854   -0.1987    0.0000 H   0  0  0

+   -3.1262   -1.4897    0.0000 H   0  0  0

+   -1.8352   -1.5305    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  3 11  1  0

+  3 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5275-46-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.2339   -0.3730    0.0000 C   0  0  0

+   -1.1069    0.2175    0.0000 N   0  3  0

+    1.2375    0.6942    0.0000 N   0  0  0

+    0.4099   -1.2386    1.2493 C   0  0  0

+    0.4099   -1.2387   -1.2492 C   0  0  0

+   -1.2390    1.4283    0.0000 O   0  0  0

+   -2.0894   -0.5023    0.0000 O   0  5  0

+    2.4231    0.4152    0.0000 O   0  0  0

+   -0.4853   -1.4206    0.0000 H   0  0  0

+    0.5919   -2.1338    0.0000 H   0  0  0

+    1.3051   -1.0566    0.0000 H   0  0  0

+   -0.4853   -1.4207    0.0000 H   0  0  0

+    0.5919   -2.1339    0.0000 H   0  0  0

+    1.3051   -1.0567    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+28564-83-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.6416   -0.8970   -0.1732 C   0  0  0

+   -0.7349   -0.6255    0.0095 C   0  0  0

+    1.5619    0.2904   -0.3710 C   0  0  0

+    1.0686   -2.0344   -0.1666 O   0  0  0

+   -1.1664    0.6478    0.0766 C   0  0  0

+   -1.6237   -1.6527    0.1171 O   0  0  0

+    0.7043    1.4473   -0.9017 C   0  0  0

+    2.1379    0.6607    0.8833 O   0  0  0

+   -0.3521    1.7091    0.0184 O   0  0  0

+   -2.6461    0.8920    0.2247 C   0  0  0

+    2.2464   -0.4571    0.0000 H   0  0  0

+   -2.2869   -2.4192    0.0000 H   0  0  0

+    1.6584    1.7894    0.0000 H   0  0  0

+    0.6530    2.4595    0.0000 H   0  0  0

+    2.9905    1.2088    0.0000 H   0  0  0

+   -2.4811    1.8920    0.0000 H   0  0  0

+   -3.6461    1.0570    0.0000 H   0  0  0

+   -2.8111   -0.1080    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7  9  1  0

+  3 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4081-23-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.0885    0.4669    0.2353 P   0  0  0

+   -1.2600    1.1948    0.7039 O   0  0  0

+    1.4046    1.2740    0.6918 O   0  0  0

+   -0.1449   -0.8604    1.1140 O   0  0  0

+    0.0942    0.1834   -1.2173 O   0  0  0

+   -2.3255    0.4978    0.2430 C   0  0  0

+    2.4746    0.5670    0.2421 C   0  0  0

+   -1.0552   -1.6726    0.3723 C   0  0  0

+   -2.2947   -0.8728    0.0579 C   0  0  0

+   -3.4919    1.2004   -0.0521 C   0  0  0

+    2.9985    0.8249   -1.0161 C   0  0  0

+    3.0484   -0.4100    1.0431 C   0  0  0

+   -3.4123   -1.5347   -0.4197 C   0  0  0

+   -4.6039    0.5366   -0.5269 C   0  0  0

+    4.0864    0.1048   -1.4710 C   0  0  0

+    4.1358   -1.1271    0.5837 C   0  0  0

+   -4.5661   -0.8329   -0.7118 C   0  0  0

+    4.6527   -0.8721   -0.6733 C   0  0  0

+   -1.6555   -2.4416    0.0000 H   0  0  0

+   -0.3431   -2.3394    0.0000 H   0  0  0

+   -3.4900    2.1759    0.0000 H   0  0  0

+    3.0605    1.7985    0.0000 H   0  0  0

+    2.3409   -1.0817    0.0000 H   0  0  0

+   -3.4180   -2.5102    0.0000 H   0  0  0

+   -5.4588    1.0065    0.0000 H   0  0  0

+    4.7964    0.7738    0.0000 H   0  0  0

+    4.0750   -2.1008    0.0000 H   0  0  0

+   -5.4098   -1.3227    0.0000 H   0  0  0

+    5.5865   -1.1544    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  6 10  2  0

+  7 11  2  0

+  7 12  1  0

+  9 13  2  0

+ 10 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 13 17  1  0

+ 15 18  2  0

+  8  9  1  0

+ 14 17  2  0

+ 16 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142438-64-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.0054    0.2181   -0.0971 C   0  0  0

+    0.8156   -0.8444    0.0317 C   0  0  0

+    0.8048    1.4424   -0.2026 C   0  0  0

+   -1.4795    0.1614   -0.1328 C   0  0  0

+    2.2277   -0.3076    0.0112 C   0  0  0

+    0.4040   -2.2876    0.1688 C   0  0  0

+    2.1123    1.1345   -0.1391 O   0  0  0

+    0.3583    2.5652   -0.3290 O   0  0  0

+   -2.1734   -0.0456    1.0032 O   0  0  0

+   -2.0674    0.3015   -1.1868 O   0  0  0

+    2.9146   -0.6284    1.3402 C   0  0  0

+    0.3002   -2.9224   -1.2194 C   0  0  0

+   -3.6239   -0.1013    0.9681 C   0  0  0

+    2.1906   -1.3144    0.0000 H   0  0  0

+   -0.3243   -1.5915    0.0000 H   0  0  0

+   -0.5514   -2.6073    0.0000 H   0  0  0

+    2.4883   -1.5412    0.0000 H   0  0  0

+    3.8274   -1.0547    0.0000 H   0  0  0

+    3.3409    0.2844    0.0000 H   0  0  0

+   -0.6940   -2.7598    0.0000 H   0  0  0

+    0.1376   -3.9166    0.0000 H   0  0  0

+    1.2944   -3.0850    0.0000 H   0  0  0

+   -3.6626    0.9054    0.0000 H   0  0  0

+   -4.6306   -0.1400    0.0000 H   0  0  0

+   -3.5852   -1.1080    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  1  0

+  9 13  1  0

+  5  7  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+36274-29-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.7230    0.7269   -0.0600 C   0  0  0

+    0.4793   -0.6355   -0.0699 C   0  0  0

+    2.2108    0.9830   -0.1101 C   0  0  0

+   -0.3571    1.5932   -0.0038 C   0  0  0

+   -0.7733   -1.0641   -0.0305 N   0  0  0

+    1.7896   -1.3873   -0.1281 C   0  0  0

+    2.8648   -0.3590    0.2846 C   0  0  0

+   -1.5811    1.0917    0.0384 N   0  0  0

+   -1.7769   -0.2117    0.0174 C   0  0  0

+   -3.1870   -0.7416    0.0606 C   0  0  0

+    3.1830    1.3480    0.0000 H   0  0  0

+    1.9390    1.9852    0.0000 H   0  0  0

+   -0.2085    2.6210    0.0000 H   0  0  0

+    1.1892   -2.2346    0.0000 H   0  0  0

+    2.5757   -2.0658    0.0000 H   0  0  0

+    3.5014   -1.1794    0.0000 H   0  0  0

+    3.7465    0.1897    0.0000 H   0  0  0

+   -3.5523    0.2305    0.0000 H   0  0  0

+   -4.1591   -1.1069    0.0000 H   0  0  0

+   -2.8217   -1.7137    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  9 10  1  0

+  6  7  1  0

+  8  9  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+63-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.0889    0.3448    0.0137 C   0  0  0

+    0.7204   -0.9168    0.0996 C   0  0  0

+    0.4641    1.5443   -0.0529 C   0  0  0

+   -1.5547    0.2423   -0.0030 C   0  0  0

+    2.0885   -0.6869   -0.3750 N   0  0  0

+    1.9583    1.7274   -0.0499 C   0  0  0

+   -2.1465   -0.9673    0.0582 O   0  0  0

+   -2.2334    1.2481   -0.0720 O   0  0  0

+    2.6262    0.4305    0.4147 C   0  0  0

+    2.8681   -1.8767   -0.0081 C   0  0  0

+   -3.5949   -1.0686    0.0416 C   0  0  0

+   -0.2468   -1.3671    0.0000 H   0  0  0

+    1.0368   -1.9356    0.0000 H   0  0  0

+   -0.1647    2.4061    0.0000 H   0  0  0

+    2.9576    2.1009    0.0000 H   0  0  0

+    1.7049    2.7637    0.0000 H   0  0  0

+    3.4663   -0.2270    0.0000 H   0  0  0

+    3.4482    1.1105    0.0000 H   0  0  0

+    1.9757   -2.4614    0.0000 H   0  0  0

+    3.4528   -2.7691    0.0000 H   0  0  0

+    3.7604   -1.2920    0.0000 H   0  0  0

+   -3.6693   -0.0044    0.0000 H   0  0  0

+   -4.6591   -1.1430    0.0000 H   0  0  0

+   -3.5205   -2.1328    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+  6  9  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  6 15  1  0

+  6 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17096-47-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+   -0.8203    1.4410   -0.8798 C   0  0  0

+   -1.7720    0.6978   -0.0502 N   0  0  0

+    0.5864    1.2969   -0.2957 C   0  0  0

+   -1.7482   -0.7030   -0.0408 N   0  3  0

+   -2.7484    1.4194    0.7696 C   0  0  0

+    1.0158   -0.0607   -0.4167 O   0  0  0

+   -2.5394   -1.3208    0.6490 O   0  0  0

+   -0.9364   -1.3029   -0.7223 O   0  5  0

+    2.3167   -0.1295    0.1381 N   0  3  0

+    2.9147   -1.1904    0.1587 O   0  0  0

+    2.8378    0.8722    0.5949 O   0  5  0

+   -0.4900    2.2910    0.0000 H   0  0  0

+   -1.5522    1.9851    0.0000 H   0  0  0

+    1.4852    1.4514    0.0000 H   0  0  0

+    0.5553    2.2083    0.0000 H   0  0  0

+   -2.2064    2.1528    0.0000 H   0  0  0

+   -3.4818    1.9614    0.0000 H   0  0  0

+   -3.2904    0.6860    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

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+  6  9  1  0

+  9 10  2  0

+  9 11  1  0

+  1 12  1  0

+  1 13  1  0

+  3 14  1  0

+  3 15  1  0

+  5 16  1  0

+  5 17  1  0

+  5 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94500-44-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    0.3637   -0.8750   -0.0430 C   0  0  0

+   -1.0079   -1.1756   -0.1200 C   0  0  0

+    0.7992    0.4512   -0.2126 C   0  0  0

+    1.3277   -1.9447    0.2192 C   0  0  0

+   -1.9341   -0.1367   -0.3677 C   0  0  0

+   -1.4530   -2.5058    0.0497 C   0  0  0

+    2.2315    0.7292   -0.1265 C   0  0  0

+   -0.1419    1.4687   -0.4578 C   0  0  0

+    2.6785   -1.6485    0.2946 C   0  0  0

+    0.8338   -3.3108    0.3958 C   0  0  0

+   -1.4667    1.1862   -0.5333 C   0  0  0

+   -3.2974   -0.4479   -0.4423 C   0  0  0

+   -0.4883   -3.5723    0.3061 C   0  0  0

+   -2.8207   -2.7742   -0.0321 C   0  0  0

+    3.1374   -0.3322    0.1230 C   0  0  0

+    2.7204    2.0314   -0.2884 C   0  0  0

+   -2.4510    2.2963   -0.7975 C   0  0  0

+   -3.7186   -1.7502   -0.2753 C   0  0  0

+    4.5154   -0.0481    0.2022 C   0  0  0

+    4.0601    2.2684   -0.2052 C   0  0  0

+   -2.9957    3.0021    0.7696 Cl  0  0  0

+    4.9544    1.2292    0.0397 C   0  0  0

+    0.1742    2.4652    0.0000 H   0  0  0

+    3.3722   -2.4306    0.0000 H   0  0  0

+    1.5149   -4.1039    0.0000 H   0  0  0

+   -4.0032    0.3233    0.0000 H   0  0  0

+   -0.8173   -4.5646    0.0000 H   0  0  0

+   -3.1580   -3.7637    0.0000 H   0  0  0

+    2.0522    2.8354    0.0000 H   0  0  0

+   -3.4837    2.1335    0.0000 H   0  0  0

+   -2.8041    1.3123    0.0000 H   0  0  0

+   -4.7424   -1.9615    0.0000 H   0  0  0

+    5.2059   -0.8330    0.0000 H   0  0  0

+    4.4112    3.2531    0.0000 H   0  0  0

+    5.9811    1.4264    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84-68-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.7409   -0.6845   -0.0311 C   0  0  0

+   -0.7409   -0.6845    0.0313 C   0  0  0

+    1.4644    0.3611    0.5427 C   0  0  0

+    1.4133   -1.7324   -0.6584 C   0  0  0

+   -1.4644    0.3613   -0.5424 C   0  0  0

+   -1.4134   -1.7325    0.6584 C   0  0  0

+    2.8433    0.3581    0.4834 C   0  0  0

+    0.6313    1.6649    1.3300 Cl  0  0  0

+    2.7907   -1.7308   -0.7150 C   0  0  0

+   -2.8432    0.3583   -0.4831 C   0  0  0

+   -0.6313    1.6646   -1.3304 Cl  0  0  0

+   -2.7908   -1.7308    0.7149 C   0  0  0

+    3.5101   -0.6852   -0.1472 C   0  0  0

+   -3.5101   -0.6851    0.1473 C   0  0  0

+    4.9052   -0.6861   -0.2064 N   0  0  0

+   -4.9052   -0.6859    0.2066 N   0  0  0

+    0.9184   -2.6392    0.0000 H   0  0  0

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+   -3.2722   -2.6448    0.0000 H   0  0  0

+    5.4211   -1.5811    0.0000 H   0  0  0

+    5.4223    0.2082    0.0000 H   0  0  0

+   -5.4222    0.2085    0.0000 H   0  0  0

+   -5.4212   -1.5808    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108612-45-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 61                          1 V2000

+    2.7270    0.8854    0.7977 N   0  0  0

+    1.4969    1.2058    0.2990 C   0  0  0

+    3.6237    1.8237    0.3136 C   0  0  0

+    3.0391   -0.2379    1.6849 C   0  0  0

+    0.3339    0.5092    0.5510 N   0  0  0

+    1.5863    2.2736   -0.4541 N   0  0  0

+    2.8752    2.7035   -0.4853 C   0  0  0

+    4.9877    2.0194    0.4681 C   0  0  0

+    3.3951   -1.4468    0.8586 C   0  0  0

+   -0.5906    1.4502    1.1923 C   0  0  0

+   -0.2372    0.1565   -0.7532 C   0  0  0

+    3.5158    3.7715   -1.1184 C   0  0  0

+    5.6055    3.0787   -0.1641 C   0  0  0

+    4.6888   -1.6136    0.4002 C   0  0  0

+    2.4293   -2.3908    0.5641 C   0  0  0

+   -1.9149    0.7477    1.4980 C   0  0  0

+   -1.5421   -0.6173   -0.5547 C   0  0  0

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+   -3.6055   -2.6639    0.0000 H   0  0  0

+   -2.7237   -1.6495    0.0000 H   0  0  0

+   -5.9645   -1.7549    0.0000 H   0  0  0

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+ 26 52  1  0

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+ 26 54  1  0

+ 27 55  1  0

+ 30 56  1  0

+ 31 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67604-48-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -1.9696    0.5685    0.1103 C   0  0  0

+   -1.3275   -0.6811    0.1062 C   0  0  0

+   -1.1626    1.7932    0.2071 C   0  0  0

+   -3.3681    0.6541    0.0137 C   0  0  0

+    0.0078   -0.8161    0.2425 O   0  0  0

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+   -1.6449    2.9006    0.0877 O   0  0  0

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+   -3.9816    1.8630    0.0485 O   0  0  0

+    0.6985    0.2979   -0.3014 C   0  0  0

+   -3.4795   -1.7371   -0.1441 C   0  0  0

+    2.1841    0.0689   -0.1945 C   0  0  0

+   -4.2161   -2.8680   -0.2820 O   0  0  0

+    3.0368    0.6215   -1.1319 C   0  0  0

+    2.6927   -0.6890    0.8444 C   0  0  0

+    4.3993    0.4134   -1.0358 C   0  0  0

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+    4.9115   -0.3508    0.0023 C   0  0  0

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+   -1.6484   -2.7468    0.0000 H   0  0  0

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+    4.2655   -1.9026    0.0000 H   0  0  0

+    7.2639   -0.7132    0.0000 H   0  0  0

+  1  2  2  0

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+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+73870-33-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.6541   -0.3234   -0.0540 N   0  0  0

+    0.2320   -1.4702    0.0520 C   0  0  0

+   -0.0223    0.9710   -0.3905 C   0  0  0

+   -1.9264   -0.4298    0.1304 N   0  0  0

+    1.7278   -1.1479   -0.1863 C   0  0  0

+    1.7194    0.6704    0.1463 S   0  0  0

+   -2.6400    0.5526    0.0338 O   0  0  0

+   -0.7170   -2.0002    0.0000 H   0  0  0

+    0.6157   -2.4872    0.0000 H   0  0  0

+    0.2627    2.0199    0.0000 H   0  0  0

+   -1.0397    1.3536    0.0000 H   0  0  0

+    1.8827   -2.2237    0.0000 H   0  0  0

+    2.8118   -1.0677    0.0000 H   0  0  0

+  1  2  1  0

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+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+147293-13-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.3473   -0.4006    0.0018 C   0  0  0

+   -1.1133   -0.3869    0.0011 C   0  0  0

+    1.0314    0.8175    0.0009 C   0  0  0

+    1.2742   -1.3868   -0.0022 N   0  0  0

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+    0.3285    2.0254    0.0002 C   0  0  0

+    2.4748   -0.8600    0.0003 C   0  0  0

+   -1.0282    2.0553   -0.0018 C   0  0  0

+   -3.1832    0.8855   -0.0012 C   0  0  0

+   -3.1314   -1.5021    0.0004 C   0  0  0

+    3.4943    1.4501    0.0007 C   0  0  0

+    3.6561   -1.5736   -0.0018 N   0  0  0

+   -3.8477   -0.3091   -0.0003 C   0  0  0

+    0.8559    2.9195    0.0000 H   0  0  0

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+ 13 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+579-07-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.9784    0.6661   -0.0714 C   0  0  0

+   -2.0568   -0.3585   -0.0034 C   0  0  0

+   -1.2636    1.8414   -0.1736 O   0  0  0

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+   -3.0702   -0.3130    1.1110 C   0  0  0

+   -2.1192   -1.2261   -0.8415 O   0  0  0

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+    0.7683   -1.0997    0.1209 C   0  0  0

+    2.7715    0.8189   -0.0126 C   0  0  0

+    2.0925   -1.4775    0.1790 C   0  0  0

+    3.0925   -0.5222    0.1096 C   0  0  0

+   -3.0238    0.7202    0.0000 H   0  0  0

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+  2  1  1  0

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+  7  4  2  0

+  8  4  1  0

+  9  7  1  0

+ 10  8  2  0

+ 11  9  2  0

+ 10 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146-39-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 51                          1 V2000

+    1.5526    0.6469   -0.1888 C   0  0  0

+    0.3328    1.2446   -0.5576 C   0  0  0

+    2.5309    1.4322    0.4710 C   0  0  0

+    1.8172   -0.7032   -0.4666 C   0  0  0

+   -0.7377    0.4500   -1.2603 C   0  0  1

+    0.1460    2.5648   -0.2605 C   0  0  0

+    3.7511    0.8384    0.8410 C   0  0  0

+    2.2845    2.7197    0.7317 N   0  0  0

+    3.0134   -1.2467   -0.0929 C   0  0  0

+   -2.1091    0.8386   -0.7042 C   0  0  2

+   -0.6954    0.7286   -2.6612 O   0  0  0

+    1.1493    3.2794    0.3900 C   0  0  0

+    3.9763   -0.4735    0.5633 C   0  0  0

+    3.2705   -2.5538   -0.3615 O   0  0  0

+   -2.0438    0.8658    0.7512 N   0  0  0

+   -3.1509   -0.1669   -1.1934 C   0  0  0

+    4.5796   -2.8290    0.1411 C   0  0  0

+   -1.6716   -0.4503    1.2518 C   0  0  0

+   -3.3375    1.2564    1.2944 C   0  0  0

+   -3.8045   -0.8347    0.0247 C   0  0  1

+   -2.6969   -1.5090    0.8466 C   0  0  1

+   -4.4309    0.2677    0.8904 C   0  0  0

+   -2.0234   -2.5661    0.0099 C   0  0  0

+   -2.0170   -3.8132    0.4110 C   0  0  0

+    1.0340   -1.3223    0.0000 H   0  0  0

+   -0.5578   -0.5320    0.0000 H   0  0  0

+   -0.7713    2.9588    0.0000 H   0  0  0

+    4.5495    1.4377    0.0000 H   0  0  0

+   -2.6572    1.6730    0.0000 H   0  0  0

+   -0.5455    1.7156    0.0000 H   0  0  0

+    1.0691    4.2745    0.0000 H   0  0  0

+    4.9099   -0.8272    0.0000 H   0  0  0

+   -3.4013    0.7995    0.0000 H   0  0  0

+   -4.1155    0.0903    0.0000 H   0  0  0

+    4.3742   -3.8060    0.0000 H   0  0  0

+    5.5566   -3.0344    0.0000 H   0  0  0

+    4.7850   -1.8520    0.0000 H   0  0  0

+   -1.0866   -1.2592    0.0000 H   0  0  0

+   -0.7731   -0.0153    0.0000 H   0  0  0

+   -2.8818    2.1446    0.0000 H   0  0  0

+   -4.1293    1.8644    0.0000 H   0  0  0

+   -4.5210   -1.5299    0.0000 H   0  0  0

+   -3.3956   -2.2221    0.0000 H   0  0  0

+   -5.0448    1.0549    0.0000 H   0  0  0

+   -5.2607   -0.2873    0.0000 H   0  0  0

+   -1.0657   -2.2843    0.0000 H   0  0  0

+   -2.8790   -4.3168    0.0000 H   0  0  0

+   -1.1499   -4.3079    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  9 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 14 17  1  0

+ 15 18  1  0

+ 15 19  1  0

+ 16 20  1  0

+ 18 21  1  0

+ 19 22  1  0

+ 21 23  1  0

+ 23 24  2  0

+  8 12  1  0

+  9 13  1  0

+ 20 21  1  0

+ 20 22  1  0

+  4 25  1  0

+  5 26  1  0

+  6 27  1  0

+  7 28  1  0

+ 10 29  1  0

+ 11 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 16 33  1  0

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+ 17 35  1  0

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+ 19 40  1  0

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+ 21 43  1  0

+ 22 44  1  0

+ 22 45  1  0

+ 23 46  1  0

+ 24 47  1  0

+ 24 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5589-96-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    1.3157    0.9288   -0.0698 C   0  0  0

+    0.4548   -0.2094   -0.5538 C   0  0  0

+    2.6357    0.9224   -0.3132 O   0  0  0

+    0.8170    1.8495    0.5332 O   0  0  0

+    1.0265   -1.7517    0.1848 Cl  0  0  0

+   -1.4130    0.1140   -0.0323 Br  0  0  0

+    1.5137   -0.3654    0.0000 H   0  0  0

+    3.7060    0.9172    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+119584-53-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    2.5713    0.5661    0.3810 C   0  0  0

+    1.8062   -0.5792    0.5239 N   0  0  0

+    3.8673    0.3764   -0.1208 C   0  0  0

+    2.2006    1.8892    0.6734 C   0  0  0

+    2.3056   -1.7858    0.1917 C   0  0  0

+    0.4393   -0.4778    1.0412 C   0  0  0

+    3.9525   -1.3809   -0.3668 S   0  0  0

+    4.7447    1.4145   -0.3187 C   0  0  0

+    3.0787    2.9279    0.4762 C   0  0  0

+    1.7694   -2.8766    0.2561 O   0  0  0

+   -0.5185   -0.2815   -0.1056 C   0  0  0

+    4.3536    2.7075   -0.0168 C   0  0  0

+   -1.8342   -0.1623    0.1318 O   0  0  0

+   -0.1020   -0.2313   -1.2387 O   0  0  0

+   -2.7571    0.0269   -0.9732 C   0  0  0

+   -4.1631    0.1311   -0.4410 C   0  0  0

+   -4.9055    1.2744   -0.6695 C   0  0  0

+   -4.7125   -0.9191    0.2708 C   0  0  0

+   -6.1954    1.3700   -0.1812 C   0  0  0

+   -6.0021   -0.8235    0.7588 C   0  0  0

+   -6.7426    0.3224    0.5352 C   0  0  0

+    1.2325    2.0999    0.0000 H   0  0  0

+   -0.1861   -1.2463    0.0000 H   0  0  0

+    0.8314   -1.3877    0.0000 H   0  0  0

+    5.7150    1.2138    0.0000 H   0  0  0

+    2.7400    3.8590    0.0000 H   0  0  0

+    5.0100    3.4497    0.0000 H   0  0  0

+   -2.1317    0.7954    0.0000 H   0  0  0

+   -3.1492    0.9368    0.0000 H   0  0  0

+   -4.4008    2.1271    0.0000 H   0  0  0

+   -4.2311   -1.7851    0.0000 H   0  0  0

+   -6.6771    2.2358    0.0000 H   0  0  0

+   -6.5077   -1.6756    0.0000 H   0  0  0

+   -7.7324    0.2767    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+ 11 13  1  0

+ 11 14  2  0

+ 13 15  1  0

+ 15 16  1  0

+ 16 17  2  0

+ 16 18  1  0

+ 17 19  1  0

+ 18 20  2  0

+ 19 21  2  0

+  5  7  1  0

+  9 12  1  0

+ 20 21  1  0

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+ 15 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+77-47-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    0.0000   -1.0524    0.0000 C   0  0  0

+   -1.2007   -0.1330    0.0002 C   0  0  0

+    1.2007   -0.1329   -0.0002 C   0  0  0

+    0.0002   -2.0820    1.4802 Cl  0  0  0

+   -0.0002   -2.0820   -1.4802 Cl  0  0  0

+   -0.7327    1.1121    0.0001 C   0  0  0

+   -2.8697   -0.6109   -0.0001 Cl  0  0  0

+    0.7327    1.1121   -0.0001 C   0  0  0

+    2.8697   -0.6108    0.0001 Cl  0  0  0

+   -1.7210    2.5393    0.0003 Cl  0  0  0

+    1.7210    2.5394   -0.0003 Cl  0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

+  3  9  1  0

+  6 10  1  0

+  8 11  1  0

+  6  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+70-11-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.2054    0.3582    0.0043 C   0  0  0

+    0.7586   -0.8002    0.0069 C   0  0  0

+    0.2140    1.4959   -0.0018 O   0  0  0

+   -1.6557    0.1085    0.0030 C   0  0  0

+    2.6025   -0.1182   -0.0009 Br  0  0  0

+   -2.5534    1.1807    0.0006 C   0  0  0

+   -2.1433   -1.2025   -0.0016 C   0  0  0

+   -3.9110    0.9385   -0.0010 C   0  0  0

+   -3.5034   -1.4281   -0.0032 C   0  0  0

+   -4.3856   -0.3614   -0.0003 C   0  0  0

+   -0.1138   -1.3727    0.0000 H   0  0  0

+    1.2289   -1.7317    0.0000 H   0  0  0

+   -2.1970    2.1614    0.0000 H   0  0  0

+   -1.4794   -2.0076    0.0000 H   0  0  0

+   -4.5821    1.7375    0.0000 H   0  0  0

+   -3.8688   -2.4055    0.0000 H   0  0  0

+   -5.4140   -0.5384    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  1  0

+  6  4  2  0

+  7  4  1  0

+  8  6  1  0

+  9  7  2  0

+ 10  8  2  0

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+  2 11  1  0

+  2 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7467-29-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -1.1529   -0.4065    0.0012 C   0  0  0

+   -2.0679   -1.4753   -0.0005 C   0  0  0

+    0.1857   -0.6527   -0.0005 N   0  0  0

+   -1.6252    0.9111   -0.0013 C   0  0  0

+   -3.4282   -1.2118    0.0013 C   0  0  0

+   -1.6096   -2.7886   -0.0043 N   0  0  0

+    1.0222    0.3293    0.0011 N   0  0  0

+   -2.9681    1.1572   -0.0054 C   0  0  0

+   -3.8787    0.1020    0.0046 C   0  0  0

+    2.3671    0.0819   -0.0006 C   0  0  0

+   -3.4689    2.5786   -0.0076 C   0  0  0

+   -5.2457    0.3660    0.0063 N   0  0  0

+    3.2759    1.1430    0.0011 C   0  0  0

+    2.8390   -1.2335    0.0019 C   0  0  0

+    4.6311    0.8858   -0.0001 C   0  0  0

+    2.7770    2.5650    0.0046 C   0  0  0

+    4.1966   -1.4753    0.0007 C   0  0  0

+    5.0911   -0.4191   -0.0029 C   0  0  0

+   -0.9510    1.7052    0.0000 H   0  0  0

+   -4.1118   -1.9977    0.0000 H   0  0  0

+   -2.2897   -3.5776    0.0000 H   0  0  0

+   -0.5863   -2.9831    0.0000 H   0  0  0

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+   -5.5860    1.3505    0.0000 H   0  0  0

+   -5.9281   -0.4210    0.0000 H   0  0  0

+    2.1669   -2.0293    0.0000 H   0  0  0

+    5.3099    1.6760    0.0000 H   0  0  0

+    3.7599    2.9099    0.0000 H   0  0  0

+    2.4321    3.5479    0.0000 H   0  0  0

+    1.7941    2.2201    0.0000 H   0  0  0

+    4.5498   -2.4553    0.0000 H   0  0  0

+    6.1156   -0.6075    0.0000 H   0  0  0

+  1  2  2  0

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+  1  4  1  0

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+ 16 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6344-66-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    1.0205   -0.3858   -0.0012 C   0  0  0

+   -0.4469   -0.1640   -0.0004 C   0  0  0

+    1.6751    0.8426   -0.0009 C   0  0  0

+    1.7718   -1.5626    0.0030 C   0  0  0

+   -0.7091    1.2040    0.0004 C   0  0  0

+   -1.5104   -1.0663   -0.0008 C   0  0  0

+    0.6193    1.9206    0.0002 C   0  0  0

+    3.0531    0.8956   -0.0011 C   0  0  0

+    3.1496   -1.5000    0.0016 C   0  0  0

+   -2.0090    1.6652    0.0013 C   0  0  0

+   -2.8149   -0.5967   -0.0004 C   0  0  0

+    3.7914   -0.2744   -0.0016 C   0  0  0

+   -3.0630    0.7706    0.0013 C   0  0  0

+   -3.8812   -1.4992   -0.0013 N   0  0  0

+    1.2914   -2.4885    0.0000 H   0  0  0

+   -1.3247   -2.0927    0.0000 H   0  0  0

+    1.4293    2.5778    0.0000 H   0  0  0

+    0.0406    2.7884    0.0000 H   0  0  0

+    3.5391    1.8185    0.0000 H   0  0  0

+    3.7098   -2.3799    0.0000 H   0  0  0

+   -2.1972    2.6912    0.0000 H   0  0  0

+    4.8336   -0.2324    0.0000 H   0  0  0

+   -4.0451    1.1221    0.0000 H   0  0  0

+   -4.8629   -1.1466    0.0000 H   0  0  0

+   -3.6957   -2.5257    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7230-71-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+   -0.5736    0.0560   -0.0023 C   0  0  0

+   -1.9647   -0.4237   -0.0014 C   0  0  0

+   -0.3362    1.4553    0.0002 C   0  0  0

+    0.4245   -0.8139    0.0001 N   0  0  0

+   -3.0209    0.5110    0.0020 C   0  0  0

+   -2.2510   -1.7907   -0.0042 C   0  0  0

+    0.9723    1.9410   -0.0006 C   0  0  0

+   -1.4601    2.3886    0.0030 C   0  0  0

+    1.6946   -0.4186   -0.0005 C   0  0  0

+   -2.7313    1.9418    0.0040 C   0  0  0

+   -4.3449    0.0519    0.0029 C   0  0  0

+   -3.5615   -2.2113   -0.0037 C   0  0  0

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+    2.7547   -1.3459    0.0029 C   0  0  0

+   -4.6001   -1.2888    0.0006 C   0  0  0

+    3.3666    1.4090   -0.0037 C   0  0  0

+    4.0381   -0.8983    0.0028 C   0  0  0

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+   -1.4722   -2.4924    0.0000 H   0  0  0

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+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55557-02-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.5740    0.3884    0.0650 C   0  0  0

+    0.3053   -0.7720    0.4406 C   0  0  0

+   -0.1155    1.6028   -0.1547 C   0  0  0

+   -2.0183    0.1535   -0.0697 C   0  0  0

+    1.7126   -0.3903    0.2551 N   0  0  0

+    1.3325    1.9865   -0.0782 C   0  0  0

+   -2.5236   -1.0781    0.1422 O   0  0  0

+   -2.7573    1.0698   -0.3721 O   0  0  0

+    2.1188    0.9460    0.7232 C   0  0  0

+    2.5585   -1.1939   -0.2953 N   0  0  0

+   -3.9507   -1.3101    0.0091 C   0  0  0

+    3.7191   -0.8527   -0.4370 O   0  0  0

+   -0.5822   -1.2808    0.0000 H   0  0  0

+    0.6968   -1.7171    0.0000 H   0  0  0

+   -0.8010    2.3621    0.0000 H   0  0  0

+    2.2214    2.4928    0.0000 H   0  0  0

+    0.9451    2.9333    0.0000 H   0  0  0

+    3.0143    0.4514    0.0000 H   0  0  0

+    2.7888    1.7190    0.0000 H   0  0  0

+   -4.1148   -0.3004    0.0000 H   0  0  0

+   -4.9604   -1.4742    0.0000 H   0  0  0

+   -3.7866   -2.3198    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

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+ 10 12  2  0

+  6  9  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  6 16  1  0

+  6 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+554-84-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.4799    0.1583    0.0033 C   0  0  0

+    0.5070   -0.8080    0.0031 C   0  0  0

+   -0.1374    1.4981    0.0009 C   0  0  0

+   -1.9052   -0.2404    0.0000 N   0  3  0

+    1.8430   -0.4335    0.0004 C   0  0  0

+    1.1930    1.8739   -0.0018 C   0  0  0

+   -2.7759    0.6113    0.0002 O   0  0  0

+   -2.2074   -1.4203   -0.0029 O   0  5  0

+    2.1840    0.9111   -0.0021 C   0  0  0

+    2.8159   -1.3824   -0.0003 O   0  0  0

+    0.2498   -1.8121    0.0000 H   0  0  0

+   -0.8795    2.2218    0.0000 H   0  0  0

+    1.4473    2.8788    0.0000 H   0  0  0

+    3.1814    1.1933    0.0000 H   0  0  0

+    3.5580   -2.1061    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

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+  6  9  1  0

+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  9 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+301-12-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    2.3816   -0.2014    0.0493 P   0  0  0

+    0.7571    0.6919   -0.9789 S   0  0  0

+    3.7112   -0.0948   -0.8523 O   0  0  0

+    2.6179    0.5629    1.4465 O   0  0  0

+    2.0763   -1.6256    0.3116 O   0  0  0

+   -0.6287    0.0335   -0.0110 C   0  0  0

+    4.6837   -0.9566   -0.2576 C   0  0  0

+    2.7027    1.9572    1.1454 C   0  0  0

+   -1.9464    0.5580   -0.5850 C   0  0  0

+   -3.3321   -0.1004    0.3829 S   0  0  0

+   -4.7222    0.6639   -0.4969 C   0  0  0

+   -3.3909   -1.5116    0.2264 O   0  0  0

+   -6.0370    0.2400    0.1607 C   0  0  0

+   -1.2526   -0.8253    0.0000 H   0  0  0

+    0.0495   -0.7831    0.0000 H   0  0  0

+    3.9797   -1.7510    0.0000 H   0  0  0

+    5.4781   -1.6606    0.0000 H   0  0  0

+    5.3877   -0.1622    0.0000 H   0  0  0

+    3.7622    1.8928    0.0000 H   0  0  0

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+    1.6432    2.0216    0.0000 H   0  0  0

+   -1.3225    1.4168    0.0000 H   0  0  0

+   -2.6246    1.3746    0.0000 H   0  0  0

+   -3.9949    1.4371    0.0000 H   0  0  0

+   -5.2896    1.5610    0.0000 H   0  0  0

+   -6.3627    1.2503    0.0000 H   0  0  0

+   -7.0473   -0.0857    0.0000 H   0  0  0

+   -5.7113   -0.7703    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  9 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-71-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    0.7411   -0.5406   -0.0287 C   0  0  0

+   -0.5240    0.2736    0.2495 C   0  0  0

+    1.9678    0.3657    0.0926 C   0  0  0

+   -1.7507   -0.6327    0.1283 C   0  0  0

+    3.2330   -0.4485   -0.1857 C   0  0  0

+   -2.9968    0.1692    0.4023 C   0  0  0

+    4.4597    0.4579   -0.0644 C   0  0  0

+   -3.8508    0.2667   -0.4459 O   0  0  0

+    0.0205   -1.4089    0.0000 H   0  0  0

+    1.5162   -1.3607    0.0000 H   0  0  0

+    0.1966    1.1419    0.0000 H   0  0  0

+   -1.2991    1.0937    0.0000 H   0  0  0

+    2.6884    1.2340    0.0000 H   0  0  0

+    1.1927    1.1858    0.0000 H   0  0  0

+   -2.4713   -1.5010    0.0000 H   0  0  0

+   -0.9756   -1.4528    0.0000 H   0  0  0

+    2.5124   -1.3168    0.0000 H   0  0  0

+    4.0081   -1.2686    0.0000 H   0  0  0

+   -2.6176    1.2320    0.0000 H   0  0  0

+    5.1303   -0.4496    0.0000 H   0  0  0

+    5.3672    1.1285    0.0000 H   0  0  0

+    3.7891    1.3654    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

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+  1  9  1  0

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+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  7 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+93673-34-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 38                          1 V2000

+    2.0109    0.1169    0.1259 C   0  0  0

+    1.8760   -1.3214    0.2055 C   0  0  0

+    3.3279    0.5505    0.1467 C   0  0  0

+    0.9256    0.9962    0.0419 C   0  0  0

+    3.2765   -1.8854    0.2869 C   0  0  0

+    0.6475   -1.8799    0.1961 C   0  0  0

+    4.2162   -0.6639    0.2504 C   0  0  0

+    3.5626    1.8955    0.0745 C   0  0  0

+   -0.4245    0.4192    0.0381 C   0  0  0

+    1.1875    2.3646   -0.0322 C   0  0  0

+    4.0042   -1.5071   -0.8834 O   0  0  0

+   -0.5499   -1.0408    0.1081 C   0  0  0

+    2.5007    2.7900   -0.0166 C   0  0  0

+   -1.5499    1.2202   -0.0396 C   0  0  0

+   -1.8116   -1.6278    0.1009 C   0  0  0

+   -2.8188    0.6333   -0.0399 C   0  0  0

+   -2.9505   -0.8247    0.0187 C   0  0  0

+   -3.9865    1.4181   -0.1162 C   0  0  0

+   -4.2428   -1.3889    0.0108 C   0  0  0

+   -5.2028    0.8119   -0.1140 C   0  0  0

+   -5.3285   -0.5760   -0.0690 C   0  0  0

+    3.3269   -2.9294    0.0000 H   0  0  0

+    0.5512   -2.9206    0.0000 H   0  0  0

+    5.2421   -0.4638    0.0000 H   0  0  0

+    4.5448    2.2529    0.0000 H   0  0  0

+    0.4040    3.0564    0.0000 H   0  0  0

+    2.7016    3.8157    0.0000 H   0  0  0

+   -1.4532    2.2609    0.0000 H   0  0  0

+   -1.9049   -2.6688    0.0000 H   0  0  0

+   -3.9189    2.4611    0.0000 H   0  0  0

+   -4.3633   -2.4271    0.0000 H   0  0  0

+   -6.0658    1.4015    0.0000 H   0  0  0

+   -6.2833   -1.0011    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+ 15 17  2  0

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+  5  7  1  0

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+ 16 17  1  0

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+ 14 28  1  0

+ 15 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+393-52-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.1797    0.1278   -0.0026 C   0  0  0

+   -1.2624   -0.7605   -0.0013 C   0  0  0

+   -0.4166    1.5065   -0.0014 C   0  0  0

+    1.1990   -0.3860    0.0009 C   0  0  0

+   -2.5545   -0.2678    0.0012 C   0  0  0

+   -1.0453   -2.0940   -0.0028 F   0  0  0

+   -1.7105    1.9802    0.0011 C   0  0  0

+    1.4005   -1.5824    0.0049 O   0  0  0

+    2.5374    0.7196   -0.0008 Cl  0  0  0

+   -2.7770    1.0964    0.0024 C   0  0  0

+    0.3806    2.1712    0.0000 H   0  0  0

+   -3.3589   -0.9238    0.0000 H   0  0  0

+   -1.8866    3.0031    0.0000 H   0  0  0

+   -3.7490    1.4607    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

+  4  8  2  0

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+  5 10  2  0

+  7 10  1  0

+  3 11  1  0

+  5 12  1  0

+  7 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+132-64-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 23                          1 V2000

+    0.7377   -0.5167   -0.0014 C   0  0  0

+   -0.7377   -0.5165   -0.0008 C   0  0  0

+    1.1173    0.8331   -0.0008 C   0  0  0

+    1.7042   -1.5162    0.0026 C   0  0  0

+   -1.1170    0.8329    0.0001 C   0  0  0

+   -1.7046   -1.5163   -0.0014 C   0  0  0

+    0.0001    1.5930    0.0001 O   0  0  0

+    2.4685    1.1568   -0.0005 C   0  0  0

+    3.0410   -1.1755    0.0011 C   0  0  0

+   -2.4687    1.1568    0.0013 C   0  0  0

+   -3.0409   -1.1756   -0.0011 C   0  0  0

+    3.4191    0.1573   -0.0008 C   0  0  0

+   -3.4190    0.1577    0.0015 C   0  0  0

+    1.4206   -2.5162    0.0000 H   0  0  0

+   -1.4211   -2.5163    0.0000 H   0  0  0

+    2.7634    2.1535    0.0000 H   0  0  0

+    3.7660   -1.9203    0.0000 H   0  0  0

+   -2.7635    2.1535    0.0000 H   0  0  0

+   -3.7660   -1.9203    0.0000 H   0  0  0

+    4.4282    0.4063    0.0000 H   0  0  0

+   -4.4281    0.4068    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+36355-01-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    0.7417    0.0026    0.0001 C   0  0  0

+   -0.7417    0.0028    0.0006 C   0  0  0

+    1.4418    0.8552    0.8524 C   0  0  0

+    1.4411   -0.8547   -0.8489 C   0  0  0

+   -1.4417    0.8557   -0.8522 C   0  0  0

+   -1.4412   -0.8538    0.8495 C   0  0  0

+    2.8229    0.8508    0.8477 C   0  0  0

+    0.5021    2.0160    2.0123 Br  0  0  0

+    2.8218   -0.8507   -0.8452 C   0  0  0

+    0.5003   -2.0200   -2.0033 Br  0  0  0

+   -2.8224    0.8514   -0.8479 C   0  0  0

+   -0.5017    2.0165   -2.0119 Br  0  0  0

+   -2.8223   -0.8497    0.8454 C   0  0  0

+   -0.5007   -2.0195    2.0038 Br  0  0  0

+    3.5118    0.0022   -0.0010 C   0  0  0

+   -3.5118    0.0026    0.0008 C   0  0  0

+    5.4028    0.0024   -0.0021 Br  0  0  0

+   -5.4028    0.0024    0.0010 Br  0  0  0

+    3.2696    1.7850    0.0000 H   0  0  0

+    3.2692   -1.7846    0.0000 H   0  0  0

+   -3.2690    1.7857    0.0000 H   0  0  0

+   -3.2697   -1.7836    0.0000 H   0  0  0

+  1  2  1  0

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+  9 15  1  0

+ 13 16  2  0

+  7 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+130005-62-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+    0.5192   -0.2049    0.0025 C   0  0  0

+   -0.9501   -0.0779    0.0017 C   0  0  0

+    1.0326    1.1000    0.0004 C   0  0  0

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+    2.4108    1.2931    0.0011 C   0  0  0

+   -0.0318    1.9877   -0.0017 N   0  0  0

+    2.7533   -1.0870    0.0011 C   0  0  0

+    0.8345   -2.6991   -0.0050 C   0  0  0

+   -2.5568    1.7217   -0.0023 C   0  0  0

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+    2.9742    2.6909   -0.0017 C   0  0  0

+    3.6276   -2.1802   -0.0016 N   0  0  0

+   -3.5797    0.7987   -0.0011 C   0  0  0

+   -4.3198   -1.4648    0.0010 O   0  0  0

+   -1.7818   -2.0269    0.0000 H   0  0  0

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+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3697-30-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+    0.5590    0.3504   -0.0258 C   0  0  0

+   -0.0037   -0.9943   -0.1615 C   0  0  0

+    2.0208    0.5011    0.0166 C   0  0  0

+   -0.2725    1.4548    0.0547 C   0  0  0

+   -1.3815   -1.1733   -0.2054 C   0  0  0

+    0.8997   -2.1404   -0.2501 C   0  0  0

+    2.8352   -0.6470   -0.0740 C   0  0  0

+    2.6090    1.7605    0.1444 C   0  0  0

+   -1.6591    1.2814    0.0058 C   0  0  0

+   -2.2256   -0.0634   -0.1194 C   0  0  0

+   -1.9616   -2.5571   -0.3455 C   0  0  0

+    2.2347   -1.9704   -0.2083 C   0  0  0

+    4.2290   -0.5012   -0.0333 C   0  0  0

+    3.9807    1.8711    0.1809 C   0  0  0

+   -2.5351    2.3823    0.0849 C   0  0  0

+   -3.6275   -0.2073   -0.1602 C   0  0  0

+   -2.1891   -3.1577    1.0432 C   0  0  0

+    4.7818    0.7399    0.0925 C   0  0  0

+   -3.8773    2.1758    0.0340 C   0  0  0

+   -4.4171    0.8950   -0.0734 C   0  0  0

+    0.1353    2.4178    0.0000 H   0  0  0

+    0.5037   -3.1084    0.0000 H   0  0  0

+    2.0123    2.6194    0.0000 H   0  0  0

+   -2.6043   -1.7321    0.0000 H   0  0  0

+   -2.9957   -2.7133    0.0000 H   0  0  0

+    2.8557   -2.8119    0.0000 H   0  0  0

+    4.8434   -1.3475    0.0000 H   0  0  0

+    4.4234    2.8186    0.0000 H   0  0  0

+   -2.1540    3.3562    0.0000 H   0  0  0

+   -4.0572   -1.1607    0.0000 H   0  0  0

+   -3.1671   -2.7872    0.0000 H   0  0  0

+   -2.5596   -4.1357    0.0000 H   0  0  0

+   -1.2111   -3.5282    0.0000 H   0  0  0

+    5.8225    0.8428    0.0000 H   0  0  0

+   -4.5204    3.0005    0.0000 H   0  0  0

+   -5.4564    0.7788    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+  3  7  2  0

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+ 16 20  2  0

+  7 12  1  0

+  9 10  2  0

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+ 17 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14918-69-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -1.1578    0.7047   -0.0024 C   0  0  0

+   -1.1579   -0.7047   -0.0018 C   0  0  0

+    0.1261    1.4278   -0.0019 C   0  0  0

+   -2.3694    1.3967    0.0023 C   0  0  0

+    0.1261   -1.4278   -0.0006 C   0  0  0

+   -2.3694   -1.3967   -0.0018 C   0  0  0

+    1.3913    0.6720   -0.0007 C   0  0  0

+    0.1417    2.6437   -0.0029 O   0  0  0

+   -3.5737    0.6873    0.0076 C   0  0  0

+   -2.3785    2.7520    0.0013 O   0  0  0

+    1.3913   -0.6720   -0.0001 C   0  0  0

+    0.1417   -2.6437    0.0003 O   0  0  0

+   -3.5737   -0.6873   -0.0024 C   0  0  0

+   -2.3786   -2.7520   -0.0016 O   0  0  0

+    2.9012    1.5287    0.0000 Cl  0  0  0

+    2.9012   -1.5287    0.0019 Cl  0  0  0

+   -4.4838    1.2075    0.0000 H   0  0  0

+   -2.3855    3.8003    0.0000 H   0  0  0

+   -4.4838   -1.2075    0.0000 H   0  0  0

+   -2.3857   -3.8003    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  2  0

+  6 14  1  0

+  7 15  1  0

+ 11 16  1  0

+  7 11  2  0

+  9 13  1  0

+  9 17  1  0

+ 10 18  1  0

+ 13 19  1  0

+ 14 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+620-02-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.5904   -0.1540   -0.0019 C   0  0  0

+   -0.5492   -0.8782   -0.0011 O   0  0  0

+    0.2407    1.1817   -0.0008 C   0  0  0

+    1.9057   -0.6707    0.0016 C   0  0  0

+   -1.6019   -0.0517    0.0004 C   0  0  0

+   -1.1598    1.2269    0.0007 C   0  0  0

+    2.8554    0.0862    0.0004 O   0  0  0

+   -3.0476   -0.4771    0.0010 C   0  0  0

+    0.8801    1.9830    0.0000 H   0  0  0

+    2.0582   -1.6844    0.0000 H   0  0  0

+   -1.7410    2.0713    0.0000 H   0  0  0

+   -3.3370    0.5063    0.0000 H   0  0  0

+   -4.0310   -0.7665    0.0000 H   0  0  0

+   -2.7582   -1.4605    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  6  2  0

+  3  9  1  0

+  4 10  1  0

+  6 11  1  0

+  8 12  1  0

+  8 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+286-62-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    1.1737    0.7994   -0.4444 C   0  0  0

+    1.2571   -0.7469   -0.5398 C   0  0  0

+    2.2775    0.0459    0.0662 O   0  0  0

+    0.2351    1.1466    0.7216 C   0  0  0

+    0.3246   -1.3145    0.5178 C   0  0  0

+   -1.0898    1.6759    0.1749 C   0  0  0

+   -1.0338   -1.6413   -0.0291 C   0  0  0

+   -1.7981    0.6265   -0.6782 C   0  0  0

+   -2.1030   -0.6069    0.1889 C   0  0  0

+    1.6260    1.6753    0.0000 H   0  0  0

+    1.8167   -1.5584    0.0000 H   0  0  0

+   -0.5340    0.5301    0.0000 H   0  0  0

+    0.3928    0.1736    0.0000 H   0  0  0

+    0.1443   -2.2836    0.0000 H   0  0  0

+    1.1359   -1.8743    0.0000 H   0  0  0

+   -0.6599    2.5630    0.0000 H   0  0  0

+   -1.9440    2.1678    0.0000 H   0  0  0

+   -1.8399   -2.2087    0.0000 H   0  0  0

+   -0.6276   -2.5395    0.0000 H   0  0  0

+   -2.3305    1.4561    0.0000 H   0  0  0

+   -2.7706    0.4654    0.0000 H   0  0  0

+   -3.0039   -0.2069    0.0000 H   0  0  0

+   -2.6542   -1.4242    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

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+  2  3  1  0

+  8  9  1  0

+  1 10  1  0

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+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-91-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.7409   -1.1783    0.2627 C   0  0  0

+   -0.6878   -1.1487   -0.2817 C   0  0  0

+    1.4743   -0.0001   -0.2185 N   0  0  0

+   -1.3708    0.0001    0.2196 O   0  0  0

+    0.7411    1.1782    0.2628 C   0  0  0

+   -0.6877    1.1488   -0.2816 C   0  0  0

+    0.5347   -2.1985    0.0000 H   0  0  0

+    1.7082   -1.5625    0.0000 H   0  0  0

+   -1.6653   -1.5063    0.0000 H   0  0  0

+   -0.5169   -2.1754    0.0000 H   0  0  0

+    2.5152   -0.0002    0.0000 H   0  0  0

+    1.7085    1.5623    0.0000 H   0  0  0

+    0.5351    2.1985    0.0000 H   0  0  0

+   -0.5166    2.1755    0.0000 H   0  0  0

+   -1.6652    1.5065    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  6  1  0

+  1  7  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+53499-68-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+   -3.4433   -0.2107   -0.3443 C   0  0  0

+   -4.8335   -0.1082   -0.4265 N   0  0  0

+   -2.8463   -1.4607   -0.2191 C   0  0  0

+   -2.6590    0.9373   -0.3937 C   0  0  0

+   -5.5495    0.2343    0.6627 C   0  0  0

+   -5.5136   -0.3731   -1.6968 C   0  0  0

+   -1.4756   -1.5661   -0.1382 C   0  0  0

+   -1.2880    0.8405   -0.3134 C   0  0  0

+   -5.5615   -0.6668    1.8706 C   0  0  0

+   -6.1842    1.2678    0.6708 O   0  0  0

+   -0.6838   -0.4143   -0.1821 C   0  0  0

+    0.6756   -0.5145   -0.1021 N   0  0  0

+    1.4043    0.5491   -0.1428 N   0  0  0

+    2.7631    0.4489   -0.0629 C   0  0  0

+    3.5549    1.6011   -0.1068 C   0  0  0

+    3.3672   -0.8062    0.0689 C   0  0  0

+    4.9253    1.4959   -0.0260 C   0  0  0

+    4.7378   -0.9031    0.1491 C   0  0  0

+    5.5227    0.2454    0.0993 C   0  0  0

+    6.9095    0.1431    0.1803 N   0  0  0

+    7.5404   -1.1725    0.3122 C   0  0  0

+   -3.4315   -2.3143    0.0000 H   0  0  0

+   -3.1096    1.8690    0.0000 H   0  0  0

+   -5.8892    0.5913    0.0000 H   0  0  0

+   -6.4780   -0.7487    0.0000 H   0  0  0

+   -5.1380   -1.3375    0.0000 H   0  0  0

+   -1.0292   -2.4999    0.0000 H   0  0  0

+   -0.7068    1.6969    0.0000 H   0  0  0

+   -6.5964   -0.6530    0.0000 H   0  0  0

+   -5.5753   -1.7017    0.0000 H   0  0  0

+   -4.5266   -0.6806    0.0000 H   0  0  0

+    3.1084    2.5348    0.0000 H   0  0  0

+    2.7859   -1.6625    0.0000 H   0  0  0

+    5.5104    2.3496    0.0000 H   0  0  0

+    5.1883   -1.8349    0.0000 H   0  0  0

+    7.4927    0.9981    0.0000 H   0  0  0

+    6.6072   -1.6200    0.0000 H   0  0  0

+    7.9879   -2.1057    0.0000 H   0  0  0

+    8.4736   -0.7250    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+ 11 12  1  0

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+ 20 21  1  0

+  8 11  1  0

+ 18 19  1  0

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+ 15 32  1  0

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+ 17 34  1  0

+ 18 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+491-35-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.3465    0.8854   -0.0026 C   0  0  0

+    0.0022   -0.4882   -0.0015 C   0  0  0

+    0.6134    1.8153   -0.0014 N   0  0  0

+   -1.7057    1.2454    0.0010 C   0  0  0

+    1.3631   -0.8465    0.0004 C   0  0  0

+   -1.0104   -1.4612   -0.0017 C   0  0  0

+    1.8822    1.4850    0.0007 C   0  0  0

+   -2.6608    0.2762    0.0054 C   0  0  0

+    2.2931    0.1541    0.0010 C   0  0  0

+    1.7828   -2.2939    0.0021 C   0  0  0

+   -2.3155   -1.0739   -0.0031 C   0  0  0

+   -1.9813    2.2533    0.0000 H   0  0  0

+   -0.7636   -2.4765    0.0000 H   0  0  0

+    2.6043    2.2402    0.0000 H   0  0  0

+   -3.6696    0.5487    0.0000 H   0  0  0

+    3.3117   -0.0787    0.0000 H   0  0  0

+    0.7792   -2.5849    0.0000 H   0  0  0

+    2.0738   -3.2975    0.0000 H   0  0  0

+    2.7864   -2.0029    0.0000 H   0  0  0

+   -3.0683   -1.7986    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

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+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-87-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    1.1742    0.1824   -0.0035 C   0  0  0

+    0.1168   -0.7085   -0.0029 C   0  0  0

+    0.9351    1.5445   -0.0019 C   0  0  0

+    2.5653   -0.3230    0.0002 N   0  3  0

+   -1.1834   -0.2398   -0.0006 C   0  0  0

+   -0.3616    2.0200    0.0003 C   0  0  0

+    3.4979    0.4605   -0.0003 O   0  0  0

+    2.7776   -1.5223    0.0039 O   0  5  0

+   -1.4267    1.1287    0.0010 C   0  0  0

+   -2.5108   -1.3586   -0.0004 Cl  0  0  0

+   -2.7399    1.6066    0.0032 N   0  0  0

+    0.2995   -1.7295    0.0000 H   0  0  0

+    1.7307    2.2099    0.0000 H   0  0  0

+   -0.5398    3.0418    0.0000 H   0  0  0

+   -2.9201    2.6280    0.0000 H   0  0  0

+   -3.5344    0.9399    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  9 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+ 11 15  1  0

+ 11 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89-40-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.6657    0.5292   -0.0030 C   0  0  0

+   -1.0897   -0.8150   -0.0013 C   0  0  0

+    0.6881    0.8247   -0.0023 C   0  0  0

+   -1.8999    1.3426    0.0005 C   0  0  0

+   -2.5672   -0.7730   -0.0018 C   0  0  0

+   -0.1504   -1.8338    0.0004 C   0  0  0

+    1.6162   -0.2048    0.0001 C   0  0  0

+   -2.9595    0.5138    0.0041 N   0  0  0

+   -1.9491    2.5561    0.0009 O   0  0  0

+   -3.3038   -1.7386   -0.0007 O   0  0  0

+    1.2004   -1.5231    0.0004 C   0  0  0

+    3.0626    0.1096    0.0004 N   0  3  0

+    3.8818   -0.7918    0.0025 O   0  0  0

+    3.4337    1.2697   -0.0015 O   0  5  0

+    1.0062    1.8141    0.0000 H   0  0  0

+   -0.4575   -2.8267    0.0000 H   0  0  0

+   -3.9506    0.8264    0.0000 H   0  0  0

+    1.9055   -2.2866    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+  5  8  1  0

+  7 11  1  0

+  3 15  1  0

+  6 16  1  0

+  8 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+59-49-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+   -0.2491    0.7170   -0.0027 C   0  0  0

+   -0.2294   -0.6775   -0.0003 C   0  0  0

+    1.0816    1.1343   -0.0022 N   0  0  0

+   -1.4588    1.3937    0.0001 C   0  0  0

+    1.0705   -1.0618    0.0015 O   0  0  0

+   -1.4234   -1.3818   -0.0005 C   0  0  0

+    1.8528    0.0290    0.0004 C   0  0  0

+   -2.6434    0.6834    0.0053 C   0  0  0

+   -2.6249   -0.7006   -0.0032 C   0  0  0

+    3.0688    0.0211    0.0011 O   0  0  0

+    1.4162    2.1147    0.0000 H   0  0  0

+   -1.4744    2.4295    0.0000 H   0  0  0

+   -1.4145   -2.4177    0.0000 H   0  0  0

+   -3.5482    1.1879    0.0000 H   0  0  0

+   -3.5165   -1.2280    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  6  9  2  0

+  7 10  2  0

+  5  7  1  0

+  8  9  1  0

+  3 11  1  0

+  4 12  1  0

+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+85-84-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+    1.7214    0.3753    0.1359 C   0  0  0

+    0.8909   -0.8287    0.1192 C   0  0  0

+    3.1183    0.2464   -0.0555 C   0  0  0

+    1.1635    1.6438    0.3305 C   0  0  0

+   -0.4523   -0.7480    0.2985 N   0  0  0

+    1.5126   -2.0662   -0.0862 C   0  0  0

+    3.6775   -1.0289   -0.2573 C   0  0  0

+    3.9214    1.3991   -0.0405 C   0  0  0

+    1.9722    2.7420    0.3390 C   0  0  0

+   -1.1447    0.0979   -0.3865 N   0  0  0

+    2.8950   -2.1389   -0.2700 C   0  0  0

+    0.7511   -3.2269   -0.1068 N   0  0  0

+    3.3469    2.6183    0.1571 C   0  0  0

+   -2.4970    0.1791   -0.2061 C   0  0  0

+   -3.2504    1.0942   -0.9463 C   0  0  0

+   -3.1341   -0.6568    0.7156 C   0  0  0

+   -4.6148    1.1702   -0.7591 C   0  0  0

+   -4.4988   -0.5694    0.8918 C   0  0  0

+   -5.2377    0.3431    0.1589 C   0  0  0

+    0.1448    1.7565    0.0000 H   0  0  0

+    4.6972   -1.1316    0.0000 H   0  0  0

+    4.9427    1.3130    0.0000 H   0  0  0

+    1.5513    3.6765    0.0000 H   0  0  0

+    3.3427   -3.0608    0.0000 H   0  0  0

+   -0.2721   -3.1685    0.0000 H   0  0  0

+    1.2121   -4.1422    0.0000 H   0  0  0

+    3.9341    3.4583    0.0000 H   0  0  0

+   -2.7873    2.0085    0.0000 H   0  0  0

+   -2.7089   -1.5893    0.0000 H   0  0  0

+   -5.0465    2.0997    0.0000 H   0  0  0

+   -4.9694   -1.4799    0.0000 H   0  0  0

+   -6.2624    0.3251    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 14 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 16 18  2  0

+ 17 19  2  0

+  7 11  1  0

+  9 13  1  0

+ 18 19  1  0

+  4 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75-87-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+   -0.0515    0.0000    0.1311 C   0  0  0

+    0.7651    0.0000    1.3977 C   0  0  0

+    1.0515    0.0000   -1.2951 Cl  0  0  0

+   -1.0915   -1.4722    0.0866 Cl  0  0  0

+   -1.0915    1.4721    0.0866 Cl  0  0  0

+    1.9713    0.0000    1.3384 O   0  0  0

+    0.7651    0.9047    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94-75-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.2215    0.0151    0.0034 C   0  0  0

+    0.7147   -1.0097    0.0015 C   0  0  0

+    0.1998    1.3366    0.0034 C   0  0  0

+   -1.5494   -0.2760   -0.0003 O   0  0  0

+    2.0646   -0.7111   -0.0004 C   0  0  0

+    0.1910   -2.6648    0.0009 Cl  0  0  0

+    1.5497    1.6306    0.0015 C   0  0  0

+   -2.2458    0.9718    0.0029 C   0  0  0

+    2.4819    0.6080   -0.0004 C   0  0  0

+   -3.7312    0.7180   -0.0011 C   0  0  0

+    4.1774    0.9807   -0.0022 Cl  0  0  0

+   -4.5886    1.7509    0.0010 O   0  0  0

+   -4.1505   -0.4151   -0.0062 O   0  0  0

+   -0.4987    2.1042    0.0000 H   0  0  0

+    2.7652   -1.4767    0.0000 H   0  0  0

+    1.8649    2.6194    0.0000 H   0  0  0

+   -1.2882    1.3719    0.0000 H   0  0  0

+   -2.5351    1.9685    0.0000 H   0  0  0

+   -5.2515    2.5494    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 10 13  2  0

+  7  9  1  0

+  3 14  1  0

+  5 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103-70-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.1204   -0.0094   -0.4985 C   0  0  0

+    0.5400   -1.2067   -0.2544 C   0  0  0

+    0.5337    1.1967   -0.2857 C   0  0  0

+   -1.4401   -0.0188   -0.9634 N   0  0  0

+    1.8443   -1.1941    0.1990 C   0  0  0

+    1.8384    1.2025    0.1679 C   0  0  0

+   -2.4636   -0.0124   -0.0865 C   0  0  0

+    2.4930    0.0090    0.4099 C   0  0  0

+   -2.2409    0.0272    1.1051 O   0  0  0

+    0.0409   -2.0614    0.0000 H   0  0  0

+    0.0255    2.0461    0.0000 H   0  0  0

+   -1.4397   -1.0086    0.0000 H   0  0  0

+    2.3557   -2.0415    0.0000 H   0  0  0

+    2.3408    2.0553    0.0000 H   0  0  0

+   -3.4498   -0.0963    0.0000 H   0  0  0

+    3.4828    0.0125    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  2  0

+  6  8  2  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+640-15-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    2.0192   -0.0108    0.0030 P   0  0  0

+    0.3154   -0.8716   -0.9194 S   0  0  0

+    2.2206   -0.6545    1.4650 O   0  0  0

+    3.3219   -0.3037   -0.8965 O   0  0  0

+    1.7757    1.8298    0.1628 S   0  0  0

+   -1.0008   -0.0120   -0.0143 C   0  0  0

+    2.1641   -2.0731    1.3030 C   0  0  0

+    4.3934    0.4539   -0.3307 C   0  0  0

+   -2.3634   -0.4856   -0.5240 C   0  0  0

+   -3.6797    0.3740    0.3810 S   0  0  0

+   -5.1375   -0.3626   -0.4082 C   0  0  0

+   -6.4058    0.2277    0.2114 C   0  0  0

+   -0.2263    0.7435    0.0000 H   0  0  0

+   -1.5698    0.9082    0.0000 H   0  0  0

+    1.0830   -2.0300    0.0000 H   0  0  0

+    2.1210   -3.1542    0.0000 H   0  0  0

+    3.2452   -2.1162    0.0000 H   0  0  0

+    5.0180   -0.4295    0.0000 H   0  0  0

+    5.2768    1.0785    0.0000 H   0  0  0

+    3.7688    1.3373    0.0000 H   0  0  0

+   -3.1378   -1.2411    0.0000 H   0  0  0

+   -1.7944   -1.4058    0.0000 H   0  0  0

+   -5.7992   -1.2186    0.0000 H   0  0  0

+   -4.4486   -1.1968    0.0000 H   0  0  0

+   -5.9493    1.2086    0.0000 H   0  0  0

+   -7.3867    0.6842    0.0000 H   0  0  0

+   -6.8623   -0.7532    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+30560-19-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -0.2398   -0.0229    0.2263 P   0  0  0

+    1.0475   -0.5444   -0.6458 N   0  0  0

+   -0.1731    1.5787    0.3762 O   0  0  0

+   -2.0326   -0.5657   -0.7665 S   0  0  0

+   -0.2112   -0.6456    1.5686 O   0  0  0

+    2.2995   -0.3105   -0.2050 C   0  0  0

+   -0.5388    2.1278   -0.8914 C   0  0  0

+   -3.2048   -0.4471    0.6128 C   0  0  0

+    3.4823   -0.7897   -1.0063 C   0  0  0

+    2.4741    0.2857    0.8367 O   0  0  0

+    0.9520   -1.4949    0.0000 H   0  0  0

+    0.2563    2.6573    0.0000 H   0  0  0

+   -1.0683    2.9229    0.0000 H   0  0  0

+   -1.3339    1.5983    0.0000 H   0  0  0

+   -3.1086    0.5033    0.0000 H   0  0  0

+   -4.1552   -0.3509    0.0000 H   0  0  0

+   -3.3010   -1.3975    0.0000 H   0  0  0

+    3.1236   -1.6750    0.0000 H   0  0  0

+    4.3676   -1.1484    0.0000 H   0  0  0

+    3.8410    0.0956    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  6 10  2  0

+  2 11  1  0

+  7 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-63-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 53                          1 V2000

+    1.4891   -1.2202   -0.4111 C   0  0  0

+    0.0286   -0.7645   -0.4111 C   0  0  0

+    2.3300   -0.1244   -0.0447 O   0  0  0

+    1.6681   -2.3590    0.5949 C   0  0  0

+    1.8705   -1.7104   -1.8094 C   0  0  0

+   -0.0286    0.7645   -0.4111 C   0  0  0

+    3.7112   -0.6244   -0.0630 O   0  0  0

+   -1.4891    1.2202   -0.4111 C   0  0  0

+    4.5406    0.4357    0.4167 C   0  0  0

+   -2.3300    0.1244   -0.0447 O   0  0  0

+   -1.6681    2.3590    0.5948 C   0  0  0

+   -1.8704    1.7102   -1.8094 C   0  0  0

+    6.0006   -0.0219    0.4229 C   0  0  0

+    4.3918    1.6534   -0.4977 C   0  0  0

+    4.1177    0.8108    1.8384 C   0  0  0

+   -3.7112    0.6244   -0.0631 O   0  0  0

+   -4.5407   -0.4357    0.4167 C   0  0  0

+   -4.1177   -0.8107    1.8384 C   0  0  0

+   -6.0006    0.0220    0.4228 C   0  0  0

+   -4.3918   -1.6534   -0.4976 C   0  0  0

+   -0.9780   -0.6880    0.0000 H   0  0  0

+   -0.1612   -1.7560    0.0000 H   0  0  0

+    0.6708   -2.5158    0.0000 H   0  0  0

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+    2.4904   -2.5072    0.0000 H   0  0  0

+    2.6673   -1.0905    0.0000 H   0  0  0

+    0.9780    0.6880    0.0000 H   0  0  0

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+   -1.8249    3.3563    0.0000 H   0  0  0

+   -2.6654    2.2022    0.0000 H   0  0  0

+   -1.0737    2.3302    0.0000 H   0  0  0

+   -2.4904    2.5069    0.0000 H   0  0  0

+   -2.6671    1.0902    0.0000 H   0  0  0

+    5.6987   -0.9852    0.0000 H   0  0  0

+    6.9639   -0.3238    0.0000 H   0  0  0

+    6.3025    0.9414    0.0000 H   0  0  0

+    5.3939    1.7759    0.0000 H   0  0  0

+    4.2693    2.6555    0.0000 H   0  0  0

+    3.3897    1.5309    0.0000 H   0  0  0

+    4.7876    1.5661    0.0000 H   0  0  0

+    3.3624    1.4807    0.0000 H   0  0  0

+    3.4478    0.0555    0.0000 H   0  0  0

+   -4.7874   -1.5661    0.0000 H   0  0  0

+   -3.3623   -1.4804    0.0000 H   0  0  0

+   -3.4480   -0.0553    0.0000 H   0  0  0

+   -5.6986    0.9853    0.0000 H   0  0  0

+   -6.9639    0.3240    0.0000 H   0  0  0

+   -6.3026   -0.9413    0.0000 H   0  0  0

+   -5.3939   -1.7759    0.0000 H   0  0  0

+   -4.2693   -2.6555    0.0000 H   0  0  0

+   -3.3897   -1.5309    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  6  8  1  0

+  7  9  1  0

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+ 10 16  1  0

+ 16 17  1  0

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+ 17 20  1  0

+  2 21  1  0

+  2 22  1  0

+  4 23  1  0

+  4 24  1  0

+  4 25  1  0

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+  5 27  1  0

+  5 28  1  0

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+ 11 31  1  0

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+ 11 33  1  0

+ 12 34  1  0

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+ 18 46  1  0

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+ 19 49  1  0

+ 19 50  1  0

+ 19 51  1  0

+ 20 52  1  0

+ 20 53  1  0

+ 20 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24279-91-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+    0.0088    1.3999   -0.0233 C   0  0  0

+    0.0726    0.2152   -0.6788 C   0  0  0

+    1.0692    2.2723   -0.0761 N   0  0  0

+   -1.2119    1.7584    0.7485 C   0  0  0

+   -1.0215   -0.6846   -0.6246 C   0  0  0

+    1.3067   -0.1457   -1.4647 C   0  0  0

+    1.7529    3.3674   -0.7687 C   0  0  0

+    2.3106    2.7678    0.5237 C   0  0  0

+   -2.3080    0.8610    0.7982 C   0  0  0

+   -1.2689    2.8207    1.3366 O   0  0  0

+   -2.2401   -0.3283    0.1514 C   0  0  0

+   -0.9640   -1.7473   -1.2118 O   0  0  0

+    2.0867   -1.2307   -0.7195 C   0  0  0

+    0.9256   -0.6327   -2.7529 O   0  0  0

+   -3.5441    1.2239    1.5802 C   0  0  0

+   -3.3009   -1.2003    0.2035 N   0  0  0

+    2.3709   -0.7810    0.6315 O   0  0  0

+    1.0173    0.4713   -3.6556 C   0  0  0

+   -3.9675   -2.3181    0.8762 C   0  0  0

+   -4.5662   -1.6643   -0.3708 C   0  0  0

+    3.0524   -1.5773    1.4766 C   0  0  0

+    3.3163   -1.1599    2.7307 N   0  0  0

+    3.4297   -2.6722    1.1087 O   0  0  0

+    1.8569    0.6315    0.0000 H   0  0  0

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+    1.3908   -1.8806    0.0000 H   0  0  0

+    2.8201   -1.8380    0.0000 H   0  0  0

+   -3.2759    2.1376    0.0000 H   0  0  0

+   -4.4578    1.4921    0.0000 H   0  0  0

+   -3.8123    0.3102    0.0000 H   0  0  0

+    1.9662    0.3925    0.0000 H   0  0  0

+    1.0961    1.4202    0.0000 H   0  0  0

+    0.0684    0.5501    0.0000 H   0  0  0

+   -4.6040   -3.0263    0.0000 H   0  0  0

+   -3.2009   -2.8829    0.0000 H   0  0  0

+   -5.0072   -0.8203    0.0000 H   0  0  0

+   -5.3459   -2.2109    0.0000 H   0  0  0

+    4.2677   -1.1982    0.0000 H   0  0  0

+    2.8737   -0.3168    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 13 17  1  0

+ 14 18  1  0

+ 16 19  1  0

+ 16 20  1  0

+ 17 21  1  0

+ 21 22  1  0

+ 21 23  2  0

+  7  8  1  0

+  9 11  2  0

+ 19 20  1  0

+  6 24  1  0

+  7 25  1  0

+  7 26  1  0

+  8 27  1  0

+  8 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89-59-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    2.0497   -0.8371   -0.0251 N   0  3  0

+    2.7884   -0.7723   -0.9913 O   0  5  0

+    2.3405   -1.5523    0.9169 O   0  0  0

+    0.8018   -0.0419    0.0070 C   0  0  0

+    0.8628    1.3371    0.0783 C   0  0  0

+   -0.4245   -0.6783   -0.0399 C   0  0  0

+    2.2001    2.0305    0.1232 C   0  0  0

+   -0.3025    2.0806    0.1078 C   0  0  0

+   -1.5907    0.0650   -0.0099 C   0  0  0

+   -1.5290    1.4453    0.0667 C   0  0  0

+   -3.1311   -0.7334   -0.0694 Cl  0  0  0

+   -0.4705   -1.7135    0.0000 H   0  0  0

+    2.6771    1.1106    0.0000 H   0  0  0

+    3.1200    2.5075    0.0000 H   0  0  0

+    1.7231    2.9504    0.0000 H   0  0  0

+   -0.2559    3.1158    0.0000 H   0  0  0

+   -2.4021    2.0034    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  5  1  0

+  9  6  2  0

+ 10  8  2  0

+ 11  9  1  0

+  9 10  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25917-89-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.6327    0.1439    0.0112 C   0  0  0

+   -0.2181   -1.1768   -0.0956 C   0  0  0

+    0.3026    1.1564    0.0985 C   0  0  0

+   -2.0769    0.4674    0.0255 N   0  3  0

+    1.1370   -1.4799   -0.1143 C   0  0  0

+   -1.1663   -2.2031   -0.1840 N   0  0  0

+    1.6574    0.8534    0.0793 C   0  0  0

+   -2.5331    1.2528   -0.7860 O   0  0  0

+   -2.8092   -0.0519    0.8487 O   0  5  0

+    2.0721   -0.4678   -0.0271 C   0  0  0

+    2.6055    1.8796    0.1682 N   0  0  0

+    3.5426   -0.7967   -0.0469 C   0  0  0

+   -0.0072    2.1491    0.0000 H   0  0  0

+    1.4467   -2.4726    0.0000 H   0  0  0

+   -2.1806   -1.9739    0.0000 H   0  0  0

+   -0.8577   -3.1961    0.0000 H   0  0  0

+    3.6198    1.6504    0.0000 H   0  0  0

+    2.2969    2.8726    0.0000 H   0  0  0

+    3.3156   -1.8115    0.0000 H   0  0  0

+    4.5574   -1.0237    0.0000 H   0  0  0

+    3.7696    0.2181    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 11  1  0

+ 10 12  1  0

+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77-83-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.9745   -1.4511   -0.5174 C   0  0  0

+   -0.4367   -1.9749   -0.2437 C   0  0  0

+    1.2493    0.0045   -0.2401 C   0  0  0

+    0.6745   -2.2958    0.5954 O   0  0  0

+    1.7466   -2.0609   -1.6891 C   0  0  0

+   -1.2584   -0.8902    0.4038 C   0  0  0

+    2.0925    0.3637    0.7945 C   0  0  0

+    0.6624    0.9804   -1.0241 C   0  0  0

+   -2.0594   -0.1169   -0.3460 O   0  0  0

+   -1.1961   -0.7165    1.5979 O   0  0  0

+    2.3445    1.6991    1.0490 C   0  0  0

+    0.9145    2.3153   -0.7698 C   0  0  0

+   -2.9486    0.8388    0.2899 C   0  0  0

+    1.7534    2.6748    0.2688 C   0  0  0

+   -3.6557    1.6694   -0.7829 C   0  0  0

+   -0.9207   -2.6796    0.0000 H   0  0  0

+    1.2168   -2.7317    0.0000 H   0  0  0

+    2.4174   -2.5907    0.0000 H   0  0  0

+    2.2764   -1.3901    0.0000 H   0  0  0

+    2.7586   -0.1720    0.0000 H   0  0  0

+   -0.1790    0.8296    0.0000 H   0  0  0

+    3.1857    1.8514    0.0000 H   0  0  0

+    0.2478    2.8503    0.0000 H   0  0  0

+   -3.7870    0.6720    0.0000 H   0  0  0

+   -3.2114    0.0254    0.0000 H   0  0  0

+    2.0147    3.4887    0.0000 H   0  0  0

+   -3.0048    2.2235    0.0000 H   0  0  0

+   -4.2098    2.3203    0.0000 H   0  0  0

+   -4.3066    1.1153    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  6  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  2  0

+  9 13  1  0

+ 11 14  2  0

+ 13 15  1  0

+  2  4  1  0

+ 12 14  1  0

+  2 16  1  0

+  5 17  1  0

+  5 18  1  0

+  5 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-65-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    1.9025   -0.0732   -0.0010 C   0  0  0

+    0.5308    0.5509    0.0001 C   0  0  0

+    2.9948    0.7070   -0.0001 O   0  0  0

+    2.0191   -1.2758    0.0024 O   0  0  0

+   -0.5308   -0.5509   -0.0012 C   0  0  0

+    4.3164    0.1057   -0.0012 C   0  0  0

+   -1.9025    0.0732   -0.0002 C   0  0  0

+   -2.9948   -0.7070   -0.0010 O   0  0  0

+   -2.0191    1.2758    0.0015 O   0  0  0

+   -4.3164   -0.1057    0.0000 C   0  0  0

+    1.0909    1.4848    0.0000 H   0  0  0

+   -0.3338    1.2130    0.0000 H   0  0  0

+   -1.0909   -1.4848    0.0000 H   0  0  0

+    0.3338   -1.2130    0.0000 H   0  0  0

+    3.8654   -0.8855    0.0000 H   0  0  0

+    5.3076   -0.3453    0.0000 H   0  0  0

+    4.7674    1.0969    0.0000 H   0  0  0

+   -3.8654    0.8855    0.0000 H   0  0  0

+   -5.3076    0.3453    0.0000 H   0  0  0

+   -4.7674   -1.0969    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

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+  2 11  1  0

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+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7597-18-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -1.1900    0.5948   -0.0027 C   0  0  0

+   -1.6021   -0.7517   -0.0014 C   0  0  0

+    0.1703    0.8941   -0.0019 C   0  0  0

+   -2.3295    1.3561    0.0009 N   0  0  0

+   -0.6416   -1.7695   -0.0002 C   0  0  0

+   -3.0612   -0.7340   -0.0022 C   0  0  0

+    1.0888   -0.1168    0.0001 C   0  0  0

+   -3.4440    0.5109    0.0043 N   0  0  0

+    0.6842   -1.4463   -0.0002 C   0  0  0

+    2.5329    0.2077    0.0005 N   0  3  0

+    3.3583   -0.6879    0.0023 O   0  0  0

+    2.8958    1.3704   -0.0010 O   0  5  0

+    0.4866    1.8872    0.0000 H   0  0  0

+   -2.3607    2.3979    0.0000 H   0  0  0

+   -0.9373   -2.7690    0.0000 H   0  0  0

+   -3.6856   -1.5686    0.0000 H   0  0  0

+    1.4002   -2.2038    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  8  2  0

+  7  9  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90-34-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 41                          1 V2000

+   -0.1086   -0.1582    0.0592 C   0  0  0

+   -1.3534   -0.8036    0.2347 C   0  0  0

+   -0.0685    1.2024   -0.1431 C   0  0  0

+    1.0738   -0.8956    0.0967 N   0  0  0

+   -2.5421   -0.0347    0.1989 C   0  0  0

+   -1.4204   -2.1229    0.4323 N   0  0  0

+   -1.2447    1.9551   -0.1774 C   0  0  0

+    1.9175   -0.9882   -1.0974 C   0  0  0

+   -2.4704    1.3517   -0.0097 C   0  0  0

+   -3.7797   -0.6836    0.3744 C   0  0  0

+   -2.5702   -2.7309    0.5956 C   0  0  0

+   -1.1781    3.2974   -0.3783 O   0  0  0

+    3.3847   -1.0981   -0.6779 C   0  0  0

+    1.5239   -2.2266   -1.9051 C   0  0  0

+   -3.7768   -2.0347    0.5725 C   0  0  0

+   -2.5215    3.7844   -0.3628 C   0  0  0

+    3.7783    0.1403    0.1299 C   0  0  0

+    5.2455    0.0305    0.5494 C   0  0  0

+    5.6234    1.2195    1.3250 N   0  0  0

+    0.8448    1.6849    0.0000 H   0  0  0

+    0.7357   -1.8716    0.0000 H   0  0  0

+    2.0124    0.0403    0.0000 H   0  0  0

+   -3.3330    1.9199    0.0000 H   0  0  0

+   -4.6641   -0.1500    0.0000 H   0  0  0

+   -2.5893   -3.7636    0.0000 H   0  0  0

+    3.2279   -2.1190    0.0000 H   0  0  0

+    4.3904   -1.3337    0.0000 H   0  0  0

+    0.5395   -1.9137    0.0000 H   0  0  0

+    1.2110   -3.2110    0.0000 H   0  0  0

+    2.5083   -2.5395    0.0000 H   0  0  0

+   -4.6707   -2.5522    0.0000 H   0  0  0

+   -2.1695    4.7555    0.0000 H   0  0  0

+   -3.4926    4.1364    0.0000 H   0  0  0

+   -2.8735    2.8133    0.0000 H   0  0  0

+    3.9351    1.1612    0.0000 H   0  0  0

+    2.7726    0.3758    0.0000 H   0  0  0

+    5.0887   -0.9904    0.0000 H   0  0  0

+    6.2512   -0.2050    0.0000 H   0  0  0

+    6.6323    1.4407    0.0000 H   0  0  0

+    4.9273    1.9826    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  5  9  1  0

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+  7  9  2  0

+ 11 15  1  0

+  3 20  1  0

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+  8 22  1  0

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+ 16 32  1  0

+ 16 33  1  0

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+ 17 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+156-43-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.5321   -0.3824    0.0027 C   0  0  0

+    0.3885   -1.4195    0.0014 C   0  0  0

+   -0.0949    0.9341    0.0025 C   0  0  0

+   -1.8642   -0.6561   -0.0014 O   0  0  0

+    1.7417   -1.1424   -0.0002 C   0  0  0

+    1.2576    1.2130    0.0009 C   0  0  0

+   -2.5442    0.6008    0.0013 C   0  0  0

+    2.1802    0.1749   -0.0005 C   0  0  0

+   -4.0556    0.3630   -0.0031 C   0  0  0

+    3.5509    0.4566   -0.0026 N   0  0  0

+    0.0597   -2.4070    0.0000 H   0  0  0

+   -0.7865    1.7119    0.0000 H   0  0  0

+    2.4325   -1.9210    0.0000 H   0  0  0

+    1.5854    2.2009    0.0000 H   0  0  0

+   -1.5786    0.9894    0.0000 H   0  0  0

+   -2.8212    1.6041    0.0000 H   0  0  0

+   -4.2174    1.3912    0.0000 H   0  0  0

+   -5.0838    0.2012    0.0000 H   0  0  0

+   -3.8938   -0.6652    0.0000 H   0  0  0

+    4.2421   -0.3216    0.0000 H   0  0  0

+    3.8792    1.4443    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  7  9  1  0

+  8 10  1  0

+  6  8  1  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104010-37-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 54                          1 V2000

+   -0.0258    2.6337    0.1886 N   0  0  0

+   -1.0862    2.7013    1.2087 C   0  0  1

+    1.2654    2.0905    0.2792 C   0  0  0

+   -0.8904    3.0626   -0.7310 C   0  0  0

+   -2.1242    2.8429    0.1141 C   0  0  1

+   -1.1026    1.1031    2.0615 S   0  0  0

+    1.5562    1.2953    1.3148 C   0  0  0

+    2.2421    2.3787   -0.7081 C   0  0  0

+   -0.7391    3.4838   -1.8583 O   0  0  0

+   -2.6963    1.5287   -0.1893 N   0  0  0

+    0.6581    0.9542    2.4539 C   0  0  0

+    2.9324    0.6813    1.3308 C   0  0  0

+    2.3641    1.5863   -1.7808 O   0  0  0

+    3.0425    3.4435   -0.5675 O   0  0  0

+   -3.9675    1.4318   -0.6265 C   0  0  0

+    2.8745   -0.9498    0.5483 S   0  0  0

+   -4.5461    0.1025   -0.9334 C   0  0  0

+   -4.6391    2.4343   -0.7689 O   0  0  0

+    4.3416   -1.9169    0.4179 C   0  0  0

+   -5.3507   -0.6066    0.0846 C   0  0  0

+   -4.3459   -0.4414   -2.1002 N   0  0  0

+    4.2947   -3.2386   -0.2162 C   0  0  0

+    5.3942   -1.4880    0.8541 O   0  0  0

+   -5.4893   -0.0869    1.3440 C   0  0  0

+   -5.9543   -1.7563   -0.2135 N   0  0  0

+   -3.4965    0.1913   -3.0400 O   0  0  0

+    5.3515   -4.0869   -0.3816 C   0  0  0

+    3.1986   -3.8315   -0.7328 O   0  0  0

+   -6.5268   -1.3283    2.1048 S   0  0  0

+   -6.6757   -2.4014    0.6835 C   0  0  0

+   -3.4798   -0.6365   -4.2047 C   0  0  0

+    4.8550   -5.2285   -1.0306 C   0  0  0

+    3.5329   -5.0308   -1.2268 C   0  0  0

+   -7.3674   -3.5942    0.5564 N   0  0  0

+   16.8819    1.3989    0.3405 Na  0  3  0

+   -0.9933    3.6304    0.0000 H   0  0  0

+   -2.7028    3.5758    0.0000 H   0  0  0

+   -2.1552    0.7677    0.0000 H   0  0  0

+    0.2445    0.1170    0.0000 H   0  0  0

+    1.2860    0.2630    0.0000 H   0  0  0

+    3.8537    0.5293    0.0000 H   0  0  0

+    3.2008    1.5756    0.0000 H   0  0  0

+   -5.2876    0.8248    0.0000 H   0  0  0

+    6.2580   -3.8631    0.0000 H   0  0  0

+   -4.4134   -0.6553    0.0000 H   0  0  0

+   -3.4610   -1.5701    0.0000 H   0  0  0

+   -2.5462   -0.6177    0.0000 H   0  0  0

+    5.3076   -6.0452    0.0000 H   0  0  0

+    2.9146   -5.7305    0.0000 H   0  0  0

+   -8.3012   -3.5924    0.0000 H   0  0  0

+   -6.9021   -4.4038    0.0000 H   0  0  0

+    3.6036    4.1899    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 25 30  2  0

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+  4  5  1  0

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+ 29 30  1  0

+ 32 33  2  0

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+ 31 45  1  0

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+ 31 47  1  0

+ 32 48  1  0

+ 33 49  1  0

+ 34 50  1  0

+ 34 51  1  0

+ 14 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78448-07-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    0.2704   -0.9475    0.0021 C   0  0  0

+   -1.1632   -0.6542    0.0015 C   0  0  0

+    1.4754   -0.1252    0.0013 C   0  0  0

+    0.3950   -2.3395   -0.0030 C   0  0  0

+   -1.9481    0.5749    0.0004 C   0  0  0

+   -1.8253   -1.8851    0.0027 C   0  0  0

+    2.7370   -0.7684    0.0024 C   0  0  0

+    1.4094    1.2729   -0.0009 C   0  0  0

+   -0.8737   -2.8847   -0.0067 N   0  0  0

+    1.6691   -2.9248   -0.0032 C   0  0  0

+   -3.3610    0.4803    0.0005 C   0  0  0

+   -1.3401    1.8355   -0.0004 C   0  0  0

+   -3.2271   -1.9219    0.0028 C   0  0  0

+    2.7980   -2.1755    0.0037 C   0  0  0

+    3.9052    0.0098    0.0017 C   0  0  0

+    2.5569    2.0073   -0.0020 C   0  0  0

+   -3.9705   -0.7892    0.0022 C   0  0  0

+   -4.1269    1.6570   -0.0006 C   0  0  0

+   -2.1141    2.9582   -0.0009 C   0  0  0

+    3.8063    1.3829    0.0000 C   0  0  0

+   -3.5032    2.8681   -0.0017 C   0  0  0

+    4.9360    2.1388   -0.0006 O   0  0  0

+    0.4776    1.7546    0.0000 H   0  0  0

+   -1.0842   -3.9123    0.0000 H   0  0  0

+    1.7505   -3.9706    0.0000 H   0  0  0

+   -0.2943    1.9163    0.0000 H   0  0  0

+   -3.7132   -2.8514    0.0000 H   0  0  0

+    3.7329   -2.6513    0.0000 H   0  0  0

+    4.8472   -0.4518    0.0000 H   0  0  0

+    2.5014    3.0548    0.0000 H   0  0  0

+   -5.0171   -0.8590    0.0000 H   0  0  0

+   -5.1745    1.6038    0.0000 H   0  0  0

+   -1.6567    3.9022    0.0000 H   0  0  0

+   -4.0781    3.7455    0.0000 H   0  0  0

+    5.8078    2.7221    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  1  0

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+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2435-76-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.8816    0.3554    0.0030 C   0  0  0

+   -0.2360   -0.9667    0.0011 C   0  0  0

+   -0.0584    1.4846    0.0028 C   0  0  0

+   -2.1267    0.4651   -0.0004 N   0  3  0

+    1.1143   -1.0138   -0.0007 N   0  0  0

+   -0.8983   -1.9871    0.0008 O   0  0  0

+    1.2498    1.3348    0.0010 N   0  0  0

+   -3.2464    0.5637   -0.0035 N   0  5  0

+    1.8285    0.1251   -0.0007 C   0  0  0

+    3.0434    0.0559   -0.0023 O   0  0  0

+   -0.4588    2.3973    0.0000 H   0  0  0

+    1.5815   -1.8942    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  2  0

+  5  9  1  0

+  9 10  2  0

+  7  9  1  0

+  3 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2385-85-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 26                          1 V2000

+    0.6485    0.4744    0.0000 C   0  0  1

+    1.2941    1.4142    0.0000 C   0  0  2

+   -1.0299    0.4834    0.0000 C   0  0  2

+    0.6636   -1.0569    0.0000 C   0  0  1

+    1.7084    0.4894    0.0000 Cl  0  0  0

+   -0.5375    1.4142    0.0000 C   0  0  2

+    1.2851   -0.2582    0.0000 C   0  0  1

+    1.7174    2.0117    0.0000 Cl  0  0  0

+   -1.0299   -1.0479    0.0000 C   0  0  2

+   -2.0958    1.7625    0.0000 C   0  0  0

+   -2.3450    0.4744    0.0000 Cl  0  0  0

+    1.9096   -1.5643    0.0000 C   0  0  0

+    0.1231   -1.8736    0.0000 Cl  0  0  0

+   -0.5375   -0.2642    0.0000 C   0  0  1

+   -0.0601    2.0687    0.0000 Cl  0  0  0

+    2.2009   -0.0300    0.0000 Cl  0  0  0

+   -1.4172   -1.7445    0.0000 Cl  0  0  0

+   -2.0958    2.4411    0.0000 Cl  0  0  0

+   -2.9695    1.7685    0.0000 Cl  0  0  0

+    2.7893   -1.5583    0.0000 Cl  0  0  0

+    1.9096   -2.3570    0.0000 Cl  0  0  0

+   -1.5133   -0.0150    0.0000 Cl  0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  1

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+  2  7  1  0

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+  3  9  1  0

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+ 14 22  1  6

+  4  9  1  0

+  6 10  1  0

+  7 12  1  0

+  7 14  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2425-79-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -5.4495   -0.2064   -0.4317 C   0  0  0

+   -6.6738   -0.2051    0.4859 C   0  0  0

+   -6.2024    0.9779   -0.1623 O   0  0  0

+   -4.1763   -0.2052    0.4167 C   0  0  0

+   -3.0328   -0.2064   -0.4404 O   0  0  0

+   -1.8818   -0.2052    0.4065 C   0  0  0

+   -0.6162   -0.2064   -0.4531 C   0  0  0

+    0.6162   -0.2052    0.4537 C   0  0  0

+    1.8818   -0.2063   -0.4060 C   0  0  0

+    3.0328   -0.2052    0.4410 O   0  0  0

+    4.1763   -0.2064   -0.4161 C   0  0  0

+    5.4495   -0.2052    0.4323 C   0  0  0

+    6.6738   -0.2064   -0.4854 C   0  0  0

+    6.2024    0.9784    0.1597 O   0  0  0

+   -5.4496   -1.1556    0.0000 H   0  0  0

+   -7.5927    0.0326    0.0000 H   0  0  0

+   -6.7941   -1.1466    0.0000 H   0  0  0

+   -3.7014    0.6166    0.0000 H   0  0  0

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+   -2.3567    0.6167    0.0000 H   0  0  0

+   -1.0911   -1.0283    0.0000 H   0  0  0

+   -0.1413   -1.0283    0.0000 H   0  0  0

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+    1.4070   -1.0282    0.0000 H   0  0  0

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+    4.6511   -1.0283    0.0000 H   0  0  0

+    5.4495   -1.1544    0.0000 H   0  0  0

+    6.7927   -1.1481    0.0000 H   0  0  0

+    7.5930    0.0304    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+156243-44-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -0.4414    0.2903   -0.0035 C   0  0  0

+   -0.5436   -1.1246   -0.0016 C   0  0  0

+    0.8280    0.8897   -0.0025 C   0  0  0

+   -1.5546    1.0329   -0.0007 N   0  0  0

+    0.6275   -1.9042    0.0013 C   0  0  0

+   -1.7514   -1.6980   -0.0021 N   0  0  0

+    1.9543    0.0966    0.0004 C   0  0  0

+    0.9577    2.3911   -0.0050 C   0  0  0

+   -2.7295    0.4449    0.0038 C   0  0  0

+    1.8444   -1.3005    0.0022 C   0  0  0

+   -2.8295   -0.9474   -0.0044 C   0  0  0

+    3.2164    0.6898    0.0009 N   0  0  0

+   -3.9824    1.2823    0.0074 C   0  0  0

+    4.4190   -0.1469    0.0040 C   0  0  0

+    0.5612   -2.9490    0.0000 H   0  0  0

+    2.0007    2.3010    0.0000 H   0  0  0

+    1.0478    3.4341    0.0000 H   0  0  0

+   -0.0853    2.4812    0.0000 H   0  0  0

+    2.7118   -1.8868    0.0000 H   0  0  0

+   -3.7743   -1.3985    0.0000 H   0  0  0

+    3.3045    1.7330    0.0000 H   0  0  0

+   -3.4007    2.1527    0.0000 H   0  0  0

+   -4.8528    1.8640    0.0000 H   0  0  0

+   -4.5641    0.4119    0.0000 H   0  0  0

+    3.8211   -1.0063    0.0000 H   0  0  0

+    5.2784   -0.7448    0.0000 H   0  0  0

+    5.0169    0.7125    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+481-74-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -1.1426    0.8628    0.0742 C   0  0  0

+   -0.9712   -0.5354    0.0792 C   0  0  0

+    0.0377    1.7446    0.2041 C   0  0  0

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+    0.3830   -1.1061    0.2141 C   0  0  0

+   -2.0851   -1.3684   -0.0442 C   0  0  0

+    1.3891    1.1692    0.0309 C   0  0  0

+   -0.1012    2.9266    0.4495 O   0  0  0

+   -3.5132    0.5624   -0.1850 C   0  0  0

+    1.5565   -0.2291    0.0366 C   0  0  0

+    0.5303   -2.2861    0.4684 O   0  0  0

+   -3.3538   -0.8077   -0.1712 C   0  0  0

+   -1.9325   -2.7157   -0.0407 O   0  0  0

+    2.4937    1.9960   -0.1367 C   0  0  0

+   -4.8924    1.1526   -0.3288 C   0  0  0

+    2.8327   -0.7729   -0.1270 C   0  0  0

+    3.7543    1.4427   -0.2979 C   0  0  0

+    3.9257    0.0736   -0.2935 C   0  0  0

+    3.0062   -2.1177   -0.1241 O   0  0  0

+   -2.5475    2.4304    0.0000 H   0  0  0

+   -4.1888   -1.4232    0.0000 H   0  0  0

+   -1.8158   -3.7465    0.0000 H   0  0  0

+    2.3752    3.0266    0.0000 H   0  0  0

+   -4.4843    2.1063    0.0000 H   0  0  0

+   -5.8461    1.5607    0.0000 H   0  0  0

+   -5.3005    0.1989    0.0000 H   0  0  0

+    4.5858    2.0629    0.0000 H   0  0  0

+    4.8837   -0.3243    0.0000 H   0  0  0

+    3.1389   -3.1465    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55792-21-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 62 62                          1 V2000

+    0.0069    0.5697    1.2152 C   0  0  0

+   -1.2480    1.1708    1.1530 C   0  0  0

+    1.0704    1.2517    1.7840 C   0  0  0

+    0.1866   -0.6855    0.7240 O   0  0  0

+   -2.3277    0.4854    0.5792 N   0  0  0

+   -1.4267    2.4491    1.6608 C   0  0  0

+    0.8849    2.5256    2.2881 C   0  0  0

+    1.5609   -1.0175    0.9317 C   0  0  0

+   -3.0346    1.0549   -0.4170 C   0  0  0

+   -0.3607    3.1228    2.2266 C   0  0  0

+    1.8316   -2.4257    0.3982 C   0  0  0

+   -4.1440    0.4522   -0.8852 O   0  0  0

+   -2.6708    2.1123   -0.8927 O   0  0  0

+    3.3030   -2.7811    0.6205 C   0  0  0

+   -4.9056    1.0658   -1.9585 C   0  0  0

+    3.5737   -4.1893    0.0870 C   0  0  0

+   -6.1086    0.1838   -2.2990 C   0  0  0

+    5.0451   -4.5448    0.3093 C   0  0  0

+   -6.9625    0.0410   -1.1122 N   0  0  0

+    5.3158   -5.9530   -0.2242 C   0  0  0

+   -8.0904   -0.8107   -1.5046 C   0  0  0

+   -7.5025    1.3727   -0.8187 C   0  0  0

+    6.7873   -6.3084   -0.0018 C   0  0  0

+   -9.0337   -1.0008   -0.3152 C   0  0  0

+   -8.4134    1.3029    0.4085 C   0  0  0

+   -9.5858    0.3625    0.1128 C   0  0  0

+   16.9387    3.2122   -1.2301 Cl  0  0  0

+    2.0130    0.8217    0.0000 H   0  0  0

+   -2.3860   -0.5490    0.0000 H   0  0  0

+   -2.3666    2.8849    0.0000 H   0  0  0

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+    2.5957   -0.9682    0.0000 H   0  0  0

+    1.6589    0.0139    0.0000 H   0  0  0

+   -0.4210    4.1571    0.0000 H   0  0  0

+    0.7968   -2.4750    0.0000 H   0  0  0

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+    3.4010   -1.7497    0.0000 H   0  0  0

+   -4.1882    1.8133    0.0000 H   0  0  0

+   -5.5882    1.8452    0.0000 H   0  0  0

+    2.5388   -4.2386    0.0000 H   0  0  0

+    3.4757   -5.2207    0.0000 H   0  0  0

+   -6.3167   -0.8311    0.0000 H   0  0  0

+   -5.2365   -0.3754    0.0000 H   0  0  0

+    6.0800   -4.4955    0.0000 H   0  0  0

+    5.1431   -3.5134    0.0000 H   0  0  0

+    4.2810   -6.0023    0.0000 H   0  0  0

+    5.2179   -6.9844    0.0000 H   0  0  0

+   -8.2712   -1.8308    0.0000 H   0  0  0

+   -7.2070   -1.3520    0.0000 H   0  0  0

+   -6.5075    1.6613    0.0000 H   0  0  0

+   -7.6874    2.3921    0.0000 H   0  0  0

+    6.5441   -7.3155    0.0000 H   0  0  0

+    7.7944   -6.5516    0.0000 H   0  0  0

+    7.0305   -5.3013    0.0000 H   0  0  0

+  -10.0162   -1.3295    0.0000 H   0  0  0

+   -8.7665   -2.0018    0.0000 H   0  0  0

+   -8.1598    2.3074    0.0000 H   0  0  0

+   -9.2851    1.8629    0.0000 H   0  0  0

+  -10.1527    1.2297    0.0000 H   0  0  0

+  -10.5039   -0.1176    0.0000 H   0  0  0

+   17.9747    3.2122    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  8 11  1  0

+  9 12  1  0

+  9 13  2  0

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+ 14 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+ 18 20  1  0

+ 19 21  1  0

+ 19 22  1  0

+ 20 23  1  0

+ 21 24  1  0

+ 22 25  1  0

+ 24 26  1  0

+  7 10  1  0

+ 25 26  1  0

+  3 28  1  0

+  5 29  1  0

+  6 30  1  0

+  7 31  1  0

+  8 32  1  0

+  8 33  1  0

+ 10 34  1  0

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+ 14 37  1  0

+ 14 38  1  0

+ 15 39  1  0

+ 15 40  1  0

+ 16 41  1  0

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+ 24 57  1  0

+ 25 58  1  0

+ 25 59  1  0

+ 26 60  1  0

+ 26 61  1  0

+ 27 62  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+490-91-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.8985    0.0224    0.0032 C   0  0  0

+   -0.2861   -1.3218    0.0014 C   0  0  0

+   -0.1202    1.1133    0.0031 C   0  0  0

+   -2.3985    0.1670   -0.0011 C   0  0  0

+    1.1842   -1.4635   -0.0006 C   0  0  0

+   -0.9914   -2.3104    0.0019 O   0  0  0

+    1.3501    0.9715    0.0012 C   0  0  0

+   -2.8403    0.9362    1.2455 C   0  0  0

+   -2.8336    0.9315   -1.2529 C   0  0  0

+    1.9625   -0.3726   -0.0007 C   0  0  0

+    2.0555    1.9601    0.0006 O   0  0  0

+    3.4626   -0.5172   -0.0026 C   0  0  0

+   -0.5582    2.0747    0.0000 H   0  0  0

+   -2.9710   -0.7208    0.0000 H   0  0  0

+    1.6222   -2.4248    0.0000 H   0  0  0

+   -1.9242    1.4624    0.0000 H   0  0  0

+   -3.3665    1.8523    0.0000 H   0  0  0

+   -3.7564    0.4100    0.0000 H   0  0  0

+   -1.9155    1.4540    0.0000 H   0  0  0

+   -3.3561    1.8496    0.0000 H   0  0  0

+   -3.7517    0.4090    0.0000 H   0  0  0

+    3.3612   -1.5687    0.0000 H   0  0  0

+    4.5141   -0.6186    0.0000 H   0  0  0

+    3.5640    0.5343    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  2  0

+  7 11  2  0

+ 10 12  1  0

+  7 10  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16452-01-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.7383    0.2212    0.0018 C   0  0  0

+   -0.6998   -1.1660    0.0005 C   0  0  0

+    0.4429    0.9465    0.0017 C   0  0  0

+   -1.9334    0.8681   -0.0024 O   0  0  0

+    0.5149   -1.8256   -0.0010 C   0  0  0

+   -1.9841   -1.9544    0.0011 C   0  0  0

+    1.6618    0.2827    0.0003 C   0  0  0

+   -1.6453    2.2678    0.0003 C   0  0  0

+    1.6941   -1.1067   -0.0011 C   0  0  0

+    2.8542    1.0099   -0.0003 N   0  0  0

+    0.4158    1.9870    0.0000 H   0  0  0

+    0.5409   -2.8661    0.0000 H   0  0  0

+   -2.5286   -1.0673    0.0000 H   0  0  0

+   -2.8712   -2.4989    0.0000 H   0  0  0

+   -1.4396   -2.8415    0.0000 H   0  0  0

+   -0.6258    2.0580    0.0000 H   0  0  0

+   -1.4355    3.2873    0.0000 H   0  0  0

+   -2.6648    2.4776    0.0000 H   0  0  0

+    2.6075   -1.6058    0.0000 H   0  0  0

+    3.7679    0.5113    0.0000 H   0  0  0

+    2.8292    2.0505    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+  7  9  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+271-89-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+    0.1758    0.7492   -0.0026 C   0  0  0

+    0.2390   -0.6543   -0.0005 C   0  0  0

+    1.5713    1.2043   -0.0014 C   0  0  0

+   -1.0600    1.3942   -0.0001 C   0  0  0

+    1.5429   -0.9965    0.0017 O   0  0  0

+   -0.9419   -1.3865   -0.0006 C   0  0  0

+    2.3255    0.0968    0.0011 C   0  0  0

+   -2.2104    0.6551    0.0044 C   0  0  0

+   -2.1547   -0.7312   -0.0027 C   0  0  0

+    1.9063    2.1859    0.0000 H   0  0  0

+   -1.1067    2.4304    0.0000 H   0  0  0

+   -0.9110   -2.4233    0.0000 H   0  0  0

+    3.3627    0.0847    0.0000 H   0  0  0

+   -3.1305    1.1339    0.0000 H   0  0  0

+   -3.0347   -1.2802    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  6  9  2  0

+  5  7  1  0

+  8  9  1  0

+  3 10  1  0

+  4 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3102-70-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.0002   -1.1038   -0.0014 C   0  0  0

+   -1.2009   -0.4084   -0.0007 C   0  0  0

+    1.2010   -0.4083   -0.0010 C   0  0  0

+   -0.0002   -2.6108    0.0037 C   0  0  0

+   -1.1973    0.9815    0.0004 C   0  0  0

+   -2.4118   -1.1044   -0.0015 N   0  0  0

+    1.1974    0.9812    0.0001 C   0  0  0

+    2.4118   -1.1044   -0.0012 N   0  0  0

+   -0.0001    1.6706    0.0008 C   0  0  0

+   -2.5009    1.7376    0.0006 C   0  0  0

+    2.5011    1.7372    0.0005 C   0  0  0

+   -1.0426   -2.6108    0.0000 H   0  0  0

+   -0.0002   -3.6532    0.0000 H   0  0  0

+    1.0422   -2.6108    0.0000 H   0  0  0

+   -3.3136   -0.5814    0.0000 H   0  0  0

+   -2.4138   -2.1468    0.0000 H   0  0  0

+    2.4137   -2.1468    0.0000 H   0  0  0

+    3.3136   -0.5815    0.0000 H   0  0  0

+   -0.0001    2.7130    0.0000 H   0  0  0

+   -1.9779    2.6393    0.0000 H   0  0  0

+   -3.4026    2.2606    0.0000 H   0  0  0

+   -3.0239    0.8359    0.0000 H   0  0  0

+    3.0240    0.8354    0.0000 H   0  0  0

+    3.4029    2.2601    0.0000 H   0  0  0

+    1.9782    2.6390    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  5 10  1  0

+  7 11  1  0

+  7  9  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4637-56-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.0583   -0.6537    0.0020 C   0  0  0

+   -1.0798    0.1798    0.0015 C   0  0  0

+    1.3811   -0.0281    0.0007 C   0  0  0

+   -0.0960   -2.0443   -0.0020 C   0  0  0

+   -0.9198    1.5375   -0.0006 N   0  3  0

+   -2.3484   -0.4001    0.0026 C   0  0  0

+    1.4398    1.3677   -0.0010 C   0  0  0

+    2.5268   -0.7879    0.0016 N   0  0  0

+   -1.3509   -2.5811   -0.0064 C   0  0  0

+    0.2921    2.0999   -0.0018 C   0  0  0

+   -2.0666    2.3681   -0.0011 O   0  5  0

+   -2.4728   -1.7600    0.0043 C   0  0  0

+    3.7946   -0.1572    0.0003 O   0  0  0

+    0.7426   -2.6668    0.0000 H   0  0  0

+   -3.2005    0.2039    0.0000 H   0  0  0

+    2.3660    1.8504    0.0000 H   0  0  0

+    2.4621   -1.8303    0.0000 H   0  0  0

+   -1.4695   -3.6188    0.0000 H   0  0  0

+    0.3617    3.1420    0.0000 H   0  0  0

+   -3.4248   -2.1896    0.0000 H   0  0  0

+    4.7297    0.3080    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  6 12  2  0

+  8 13  1  0

+  7 10  2  0

+  9 12  1  0

+  4 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-86-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.2008    0.0103    0.0033 C   0  0  0

+    0.5009   -1.1996    0.0029 C   0  0  0

+    0.5032    1.2185    0.0009 C   0  0  0

+   -1.6725    0.0118    0.0001 C   0  0  0

+    1.8796   -1.1926    0.0002 C   0  0  0

+    1.8822    1.2088   -0.0018 C   0  0  0

+   -2.4247    1.3177    0.0005 C   0  0  0

+   -2.2798   -1.0377   -0.0029 O   0  0  0

+    2.5693    0.0076   -0.0022 C   0  0  0

+   -0.0150   -2.1005    0.0000 H   0  0  0

+   -0.0109    2.1204    0.0000 H   0  0  0

+    2.4019   -2.0899    0.0000 H   0  0  0

+    2.4063    2.1050    0.0000 H   0  0  0

+   -1.5251    1.8359    0.0000 H   0  0  0

+   -2.9429    2.2173    0.0000 H   0  0  0

+   -3.3243    0.7995    0.0000 H   0  0  0

+    3.6075    0.0066    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6  9  2  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3343-64-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+   -1.3484   -0.3262    0.1154 C   0  0  0

+   -2.5211    0.4437   -0.4952 C   0  0  0

+   -0.0312    0.3044   -0.3412 C   0  0  0

+   -3.8184   -0.1774   -0.0456 C   0  0  0

+   -2.4700    1.8441   -0.0544 N   0  0  0

+    1.3591   -0.6084    0.3828 S   0  0  0

+   -4.3784   -1.1596   -0.7690 O   0  0  0

+   -4.3543    0.2087    0.9661 O   0  0  0

+    2.7476    0.3319   -0.3090 C   0  0  0

+    4.0660   -0.2727    0.1781 C   0  0  0

+    5.2371    0.5204   -0.4053 C   0  0  0

+    6.5555   -0.0842    0.0818 C   0  0  0

+   -2.0932   -1.1066    0.0000 H   0  0  0

+   -0.7149   -1.1994    0.0000 H   0  0  0

+   -1.5626    0.9387    0.0000 H   0  0  0

+    0.7136    1.0848    0.0000 H   0  0  0

+   -0.6646    1.1776    0.0000 H   0  0  0

+   -1.5167    2.3490    0.0000 H   0  0  0

+   -3.3839    2.4172    0.0000 H   0  0  0

+   -4.9127   -2.0967    0.0000 H   0  0  0

+    3.3672    1.2150    0.0000 H   0  0  0

+    1.9912    1.1010    0.0000 H   0  0  0

+    3.4464   -1.1558    0.0000 H   0  0  0

+    4.8224   -1.0418    0.0000 H   0  0  0

+    5.8567    1.4035    0.0000 H   0  0  0

+    4.4807    1.2895    0.0000 H   0  0  0

+    6.1058   -1.0647    0.0000 H   0  0  0

+    7.5360   -0.5339    0.0000 H   0  0  0

+    7.0052    0.8963    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  6  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+  1 13  1  0

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+  3 16  1  0

+  3 17  1  0

+  5 18  1  0

+  5 19  1  0

+  7 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+619-73-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.9638   -0.0218    0.0460 C   0  0  0

+   -0.3454   -1.2578    0.0081 C   0  0  0

+   -0.2074    1.1251    0.1966 C   0  0  0

+   -2.4355    0.0736   -0.0809 N   0  3  0

+    1.0292   -1.3465    0.1208 C   0  0  0

+    1.1677    1.0364    0.3094 C   0  0  0

+   -2.9803    1.1625   -0.0475 O   0  0  0

+   -3.1017   -0.9367   -0.2186 O   0  5  0

+    1.7859   -0.1992    0.2714 C   0  0  0

+    3.2848   -0.2958    0.3938 C   0  0  0

+    3.8977    0.4301   -0.6736 O   0  0  0

+   -0.9164   -2.1187    0.0000 H   0  0  0

+   -0.6676    2.0500    0.0000 H   0  0  0

+    1.4894   -2.2714    0.0000 H   0  0  0

+    1.7387    1.8973    0.0000 H   0  0  0

+    3.0026   -1.2896    0.0000 H   0  0  0

+    4.1969   -0.7810    0.0000 H   0  0  0

+    4.5642    1.2195    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  1  0

+  6  9  2  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+52-68-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.1140   -0.6332    0.7933 C   0  0  0

+   -1.4596   -0.1009    0.0425 P   0  0  0

+    1.2824   -0.0835   -0.0275 C   0  0  0

+    0.1959   -0.1361    2.1306 O   0  0  0

+   -2.6872   -0.7895    0.8241 O   0  0  0

+   -1.5887    1.5006    0.1453 O   0  0  0

+   -1.4900   -0.5079   -1.3801 O   0  0  0

+    2.8387   -0.6100    0.7151 Cl  0  0  0

+    1.1790   -0.7107   -1.7148 Cl  0  0  0

+    1.2061    1.7177   -0.0501 Cl  0  0  0

+   -2.7764   -2.1345    0.3497 C   0  0  0

+   -2.8548    1.8499   -0.4176 C   0  0  0

+    0.1714   -1.6425    0.0000 H   0  0  0

+    0.3602    0.8614    0.0000 H   0  0  0

+   -3.7852   -2.0676    0.0000 H   0  0  0

+   -2.8433   -3.1432    0.0000 H   0  0  0

+   -1.7677   -2.2014    0.0000 H   0  0  0

+   -2.5859    2.8245    0.0000 H   0  0  0

+   -3.8294    2.1188    0.0000 H   0  0  0

+   -3.1237    0.8753    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  6 12  1  0

+  1 13  1  0

+  4 14  1  0

+ 11 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-41-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.1378   -0.0573    0.2971 N   0  0  0

+   -1.1659    0.4217   -0.1815 C   0  0  0

+    1.1420    0.9010   -0.1836 C   0  0  0

+   -2.2640   -0.5356    0.2861 C   0  0  0

+    2.5313    0.4603    0.2818 C   0  0  0

+   -3.5676   -0.0565   -0.1924 N   0  0  0

+    2.8205   -0.8367   -0.2439 O   0  0  0

+    0.3498   -1.0772    0.0000 H   0  0  0

+   -0.6489    1.3260    0.0000 H   0  0  0

+   -1.9716    1.0820    0.0000 H   0  0  0

+    1.6178    1.8276    0.0000 H   0  0  0

+    0.3075    1.5244    0.0000 H   0  0  0

+   -2.7810   -1.4399    0.0000 H   0  0  0

+   -1.4584   -1.1959    0.0000 H   0  0  0

+    3.5720    0.5060    0.0000 H   0  0  0

+    2.6680    1.4929    0.0000 H   0  0  0

+   -3.7453    0.9699    0.0000 H   0  0  0

+   -4.3677   -0.7236    0.0000 H   0  0  0

+    3.0472   -1.8534    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  1  8  1  0

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+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58632-95-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+    1.4084    0.6633    0.0071 C   0  0  0

+    0.2967   -0.0155    0.0257 N   0  0  0

+    1.3732    2.0949    0.0043 C   0  0  0

+    2.7095   -0.0460   -0.0051 C   0  0  0

+   -0.7726    0.5675    0.0408 O   0  0  0

+    1.3454    3.2305    0.0021 N   0  0  0

+    3.9011    0.6779   -0.0251 C   0  0  0

+    2.7471   -1.4402    0.0092 C   0  0  0

+   -1.9209   -0.1337    0.0601 C   0  0  0

+    5.1097    0.0117   -0.0359 C   0  0  0

+    3.9614   -2.0948   -0.0018 C   0  0  0

+   -3.1022    0.5103    0.0767 O   0  0  0

+   -1.8911   -1.3477    0.0624 O   0  0  0

+    5.1405   -1.3711   -0.0269 C   0  0  0

+   -4.3400   -0.2404   -0.0351 C   0  0  0

+   -4.4718   -1.1874    1.1594 C   0  0  0

+   -5.5242    0.7281   -0.0511 C   0  0  0

+   -4.3282   -1.0531   -1.3314 C   0  0  0

+    3.8793    1.7125    0.0000 H   0  0  0

+    1.8658   -1.9826    0.0000 H   0  0  0

+    5.9948    0.5479    0.0000 H   0  0  0

+    3.9904   -3.1292    0.0000 H   0  0  0

+    6.0491   -1.8663    0.0000 H   0  0  0

+   -5.4968   -1.0448    0.0000 H   0  0  0

+   -4.6144   -2.2124    0.0000 H   0  0  0

+   -3.4468   -1.3300    0.0000 H   0  0  0

+   -4.8691    1.5291    0.0000 H   0  0  0

+   -6.3252    1.3832    0.0000 H   0  0  0

+   -6.1793   -0.0729    0.0000 H   0  0  0

+   -5.3629   -1.0681    0.0000 H   0  0  0

+   -4.3132   -2.0878    0.0000 H   0  0  0

+   -3.2935   -1.0381    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  3  3  0

+  7  4  2  0

+  8  4  1  0

+  9  5  1  0

+ 10  7  1  0

+ 11  8  2  0

+ 12  9  1  0

+ 13  9  2  0

+ 14 10  2  0

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+ 11 14  1  0

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+ 17 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24903-46-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -1.2302    0.2368   -0.0028 C   0  0  0

+   -2.5053   -0.4916   -0.0022 C   0  0  0

+   -1.2455    1.6546    0.0010 C   0  0  0

+   -0.0216   -0.4499   -0.0013 C   0  0  0

+   -3.7152    0.2349    0.0023 C   0  0  0

+   -2.5373   -1.8878   -0.0055 C   0  0  0

+   -0.0445    2.3624    0.0008 C   0  0  0

+   -2.5213    2.3664    0.0055 C   0  0  0

+    1.1760    0.2560   -0.0020 C   0  0  0

+   -3.6897    1.6938    0.0057 C   0  0  0

+   -4.9317   -0.4611    0.0030 C   0  0  0

+   -3.7388   -2.5382   -0.0043 C   0  0  0

+    1.1685    1.6743   -0.0030 C   0  0  0

+    2.4626   -0.4485    0.0004 C   0  0  0

+   -4.9316   -1.8259   -0.0007 C   0  0  0

+    2.4317    2.4083   -0.0033 C   0  0  0

+    3.6606    0.3012    0.0002 C   0  0  0

+    2.5390   -1.8416    0.0023 C   0  0  0

+    3.6133    1.7566   -0.0068 C   0  0  0

+    4.8777   -0.3968    0.0021 C   0  0  0

+    3.7132   -2.4362    0.0040 N   0  0  0

+    4.8517   -1.7621    0.0039 C   0  0  0

+   -0.0133   -1.4968    0.0000 H   0  0  0

+   -1.6441   -2.4339    0.0000 H   0  0  0

+   -0.0532    3.4093    0.0000 H   0  0  0

+   -2.5283    3.4133    0.0000 H   0  0  0

+   -4.5914    2.2257    0.0000 H   0  0  0

+   -5.8373    0.0641    0.0000 H   0  0  0

+   -3.7609   -3.5849    0.0000 H   0  0  0

+   -5.8421   -2.3427    0.0000 H   0  0  0

+    2.4200    3.4551    0.0000 H   0  0  0

+    1.6624   -2.4139    0.0000 H   0  0  0

+    4.5060    2.3035    0.0000 H   0  0  0

+    5.7885    0.1193    0.0000 H   0  0  0

+    5.7562   -2.2892    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+ 20 22  2  0

+  8 10  2  0

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+ 21 22  1  0

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+  8 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2210-28-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -0.7642   -0.3782   -0.0013 C   0  0  0

+   -2.0620    0.3112   -0.0005 C   0  0  0

+    0.3787    0.3366   -0.0002 O   0  0  0

+   -0.7213   -1.5928    0.0021 O   0  0  0

+   -2.1152    1.8172    0.0016 C   0  0  0

+   -3.1903   -0.3945   -0.0016 C   0  0  0

+    1.6610   -0.3446   -0.0010 C   0  0  0

+    2.7880    0.6901    0.0005 C   0  0  0

+    4.1392   -0.0276   -0.0003 C   0  0  0

+   -1.0203    1.8559    0.0000 H   0  0  0

+   -2.1539    2.9121    0.0000 H   0  0  0

+   -3.2101    1.7785    0.0000 H   0  0  0

+   -4.1579    0.1194    0.0000 H   0  0  0

+   -3.1516   -1.4894    0.0000 H   0  0  0

+    1.0410   -1.2478    0.0000 H   0  0  0

+    2.4884   -1.0627    0.0000 H   0  0  0

+    3.4080    1.5934    0.0000 H   0  0  0

+    1.9606    1.4082    0.0000 H   0  0  0

+    3.6253   -0.9952    0.0000 H   0  0  0

+    5.1068   -0.5415    0.0000 H   0  0  0

+    4.6531    0.9400    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

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+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7151-65-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.3247   -0.3850    0.3313 C   0  0  0

+   -2.8043   -0.2956    0.2679 C   0  0  0

+   -0.7666    0.5260   -0.5623 C   0  0  0

+   -0.4862   -1.1895    1.1068 C   0  0  0

+   -3.1712    0.6706   -0.6648 C   0  0  0

+   -3.7974   -0.9917    0.9602 C   0  0  0

+   -1.9031    1.2473   -1.2449 C   0  0  0

+    0.6014    0.6310   -0.6854 C   0  0  0

+    0.8815   -1.0833    0.9809 C   0  0  0

+   -4.5032    0.9366   -0.9025 C   0  0  0

+   -5.1270   -0.7184    0.7164 C   0  0  0

+    1.4321   -0.1746    0.0846 C   0  0  0

+   -5.4819    0.2425   -0.2136 C   0  0  0

+    2.8208   -0.0689   -0.0401 N   0  0  0

+    3.4921    0.8606    0.6683 C   0  0  0

+    3.6673   -1.1188   -1.0914 Cl  0  0  0

+    4.9652    1.0711    0.4297 C   0  0  0

+    2.9108    1.5276    1.4979 O   0  0  0

+   -0.8095   -2.0930    0.0000 H   0  0  0

+   -3.6027   -1.9313    0.0000 H   0  0  0

+   -1.2432    1.9439    0.0000 H   0  0  0

+   -2.4604    2.0285    0.0000 H   0  0  0

+    0.9275    1.5335    0.0000 H   0  0  0

+    1.3845   -1.9005    0.0000 H   0  0  0

+   -4.7031    1.8751    0.0000 H   0  0  0

+   -5.7524   -1.4462    0.0000 H   0  0  0

+   -6.3986    0.5261    0.0000 H   0  0  0

+    5.1009    0.1212    0.0000 H   0  0  0

+    5.9151    1.2068    0.0000 H   0  0  0

+    4.8295    2.0210    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+  4  9  2  0

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+  5  7  1  0

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+ 10 25  1  0

+ 11 26  1  0

+ 13 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+789-07-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -0.2845    0.0694   -0.0012 C   0  0  0

+   -1.7569    0.0687   -0.0012 C   0  0  0

+    0.3769    1.2023    0.0000 C   0  0  0

+    0.4187   -1.2261    0.0037 C   0  0  0

+   -2.4194    1.2010    0.0004 C   0  0  0

+   -2.4590   -1.2274   -0.0025 C   0  0  0

+    1.8495    1.1795    0.0000 C   0  0  0

+   -0.3622    2.4762    0.0006 C   0  0  0

+    1.7338   -1.2433    0.0039 C   0  0  0

+   -0.3635   -2.4713    0.0077 C   0  0  0

+   -1.6814    2.4756    0.0025 C   0  0  0

+   -3.8919    1.1768    0.0006 C   0  0  0

+   -1.6756   -2.4719   -0.0044 C   0  0  0

+   -3.7740   -1.2459   -0.0024 C   0  0  0

+    2.4845    0.0252   -0.0010 C   0  0  0

+   -4.5259    0.0219   -0.0010 C   0  0  0

+    3.8393    0.0039   -0.0014 N   0  3  0

+    4.4317   -1.0604   -0.0024 O   0  0  0

+    4.4648    1.0490   -0.0007 O   0  5  0

+    2.3958    2.0874    0.0000 H   0  0  0

+    0.1664    3.3945    0.0000 H   0  0  0

+    2.2526   -2.1671    0.0000 H   0  0  0

+    0.1493   -3.3985    0.0000 H   0  0  0

+   -2.2108    3.3934    0.0000 H   0  0  0

+   -4.4390    2.0842    0.0000 H   0  0  0

+   -2.1875   -3.3996    0.0000 H   0  0  0

+   -4.2919   -2.1702    0.0000 H   0  0  0

+   -5.5853    0.0043    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+ 14 16  1  0

+  7 20  1  0

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+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+161696-99-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -0.6937    0.8102   -0.0043 C   0  0  0

+   -0.3278   -0.5603   -0.0024 C   0  0  0

+    0.3102    1.7958   -0.0038 C   0  0  0

+   -1.9877    1.1467   -0.0010 N   0  0  0

+    1.0316   -0.9108    0.0000 C   0  0  0

+   -1.2818   -1.4987   -0.0024 N   0  0  0

+    1.6187    1.4312   -0.0014 C   0  0  0

+   -2.9057    0.2071    0.0039 C   0  0  0

+    1.9890    0.0796    0.0005 C   0  0  0

+    1.4409   -2.3612    0.0016 C   0  0  0

+   -2.5462   -1.1417   -0.0043 C   0  0  0

+   -4.3634    0.5896    0.0076 C   0  0  0

+    3.3400   -0.2661    0.0028 N   0  0  0

+    4.3642    0.7814    0.0033 C   0  0  0

+    0.0489    2.8096    0.0000 H   0  0  0

+    2.3606    2.1699    0.0000 H   0  0  0

+    0.4333   -2.6455    0.0000 H   0  0  0

+    1.7252   -3.3688    0.0000 H   0  0  0

+    2.4485   -2.0769    0.0000 H   0  0  0

+   -3.2919   -1.8765    0.0000 H   0  0  0

+   -4.0977    1.6022    0.0000 H   0  0  0

+   -5.3760    0.8553    0.0000 H   0  0  0

+   -4.6291   -0.4230    0.0000 H   0  0  0

+    3.6223   -1.2742    0.0000 H   0  0  0

+    5.1128    0.0495    0.0000 H   0  0  0

+    5.0961    1.5300    0.0000 H   0  0  0

+    3.6156    1.5133    0.0000 H   0  0  0

+  1  2  2  0

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+  1  4  1  0

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+  4  8  2  0

+  5  9  2  0

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+  7  9  1  0

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+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1147-55-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.5388   -0.1423   -0.1858 C   0  0  0

+   -2.0128   -0.1019   -0.0267 C   0  0  0

+   -0.0313    1.1538   -0.1322 C   0  0  0

+    0.3367   -1.2169   -0.3618 C   0  0  0

+   -2.4276    1.2174    0.1262 C   0  0  0

+   -2.9668   -1.1279   -0.0111 C   0  0  0

+   -1.1978    2.0901    0.0684 C   0  0  0

+    1.3224    1.3767   -0.2564 C   0  0  0

+    1.6898   -0.9908   -0.4874 C   0  0  0

+   -3.7649    1.5115    0.2922 C   0  0  0

+   -4.3063   -0.8204    0.1554 C   0  0  0

+   -2.5783   -2.4213   -0.1595 O   0  0  0

+    2.1894    0.3052   -0.4362 C   0  0  0

+   -4.7037    0.4949    0.3078 C   0  0  0

+    3.5639    0.5308   -0.5624 N   0  0  0

+    4.4292   -0.1096    0.2485 C   0  0  0

+    5.9133    0.0293    0.0269 C   0  0  0

+    4.0134   -0.7977    1.1567 O   0  0  0

+   -0.0296   -2.1876    0.0000 H   0  0  0

+   -0.4764    2.8358    0.0000 H   0  0  0

+   -1.8738    2.8772    0.0000 H   0  0  0

+    1.6914    2.3464    0.0000 H   0  0  0

+    2.3456   -1.7948    0.0000 H   0  0  0

+   -4.0758    2.5013    0.0000 H   0  0  0

+   -5.0147   -1.5785    0.0000 H   0  0  0

+   -2.2798   -3.4150    0.0000 H   0  0  0

+   -5.7148    0.7275    0.0000 H   0  0  0

+    3.8077    1.5393    0.0000 H   0  0  0

+    6.0100   -1.0037    0.0000 H   0  0  0

+    6.9463    0.1260    0.0000 H   0  0  0

+    5.8166    1.0623    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  2  0

+ 13 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 16 18  2  0

+  5  7  1  0

+  9 13  1  0

+ 11 14  1  0

+  4 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2466-76-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.0071    0.0066   -0.0012 N   0  0  0

+   -1.3546   -0.0164   -0.0004 C   0  0  0

+    0.7933    1.1256   -0.0001 C   0  0  0

+    0.8240   -1.0752    0.0027 C   0  0  0

+   -2.0857   -1.3342   -0.0017 C   0  0  0

+   -1.9765    1.0194    0.0015 O   0  0  0

+    2.0661    0.6928   -0.0015 C   0  0  0

+    2.0558   -0.6501    0.0003 N   0  0  0

+    0.4843    2.0867    0.0000 H   0  0  0

+    0.5337   -2.0421    0.0000 H   0  0  0

+   -2.9685   -0.8444    0.0000 H   0  0  0

+   -2.5755   -2.2170    0.0000 H   0  0  0

+   -1.2029   -1.8240    0.0000 H   0  0  0

+    2.8891    1.2775    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  2  0

+  7  8  1  0

+  3  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+138835-35-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+    0.5689   -0.5761   -0.0072 C   0  0  0

+   -0.8204   -0.7779   -0.0175 C   0  0  0

+    1.0873    0.7335    0.0157 C   0  0  0

+    1.4803   -1.7201   -0.0140 C   0  0  0

+   -1.6837    0.3420   -0.0047 C   0  0  0

+   -1.3432   -2.0900   -0.0395 C   0  0  0

+    2.5426    0.8701    0.0254 C   0  0  0

+    0.2121    1.8307    0.0286 C   0  0  0

+    2.7881   -1.5226   -0.0038 N   0  0  0

+    0.9058   -3.0654   -0.0317 C   0  0  0

+   -3.0672    0.1268   -0.0153 C   0  0  0

+   -1.1337    1.6433    0.0177 C   0  0  0

+   -0.4355   -3.2336   -0.0518 C   0  0  0

+   -2.7294   -2.2607   -0.0493 C   0  0  0

+    3.3386   -0.3040    0.0114 C   0  0  0

+    3.1544    2.1270    0.0474 C   0  0  0

+   -3.5660   -1.1593   -0.0377 C   0  0  0

+   -3.9953    1.2801   -0.0018 N   0  3  0

+    4.7410   -0.1675    0.0208 C   0  0  0

+    4.5152    2.2184    0.0555 C   0  0  0

+   -4.9447    1.2888    0.7611 O   0  0  0

+   -3.8095    2.2201   -0.7536 O   0  5  0

+    5.3037    1.0709    0.0428 C   0  0  0

+    0.6012    2.8061    0.0000 H   0  0  0

+    1.5379   -3.9039    0.0000 H   0  0  0

+   -1.7731    2.4763    0.0000 H   0  0  0

+   -0.8324   -4.2058    0.0000 H   0  0  0

+   -3.1377   -3.2282    0.0000 H   0  0  0

+    2.5680    2.9981    0.0000 H   0  0  0

+   -4.6059   -1.3056    0.0000 H   0  0  0

+    5.3517   -1.0217    0.0000 H   0  0  0

+    4.9728    3.1636    0.0000 H   0  0  0

+    6.3498    1.1630    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

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+ 11 17  1  0

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+ 15 19  1  0

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+  8 12  2  0

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+ 20 23  1  0

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+ 12 26  1  0

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+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 23 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+59-00-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -0.7745    0.5013   -0.0026 C   0  0  0

+   -1.1400   -0.8686   -0.0012 C   0  0  0

+    0.5109    0.8502   -0.0021 N   0  0  0

+   -1.7928    1.4813    0.0015 C   0  0  0

+   -0.1241   -1.8509    0.0007 C   0  0  0

+   -2.4964   -1.2252   -0.0022 C   0  0  0

+    1.4734   -0.0537   -0.0004 C   0  0  0

+   -3.1022    1.0941    0.0066 C   0  0  0

+   -1.4708    2.8006    0.0008 O   0  0  0

+    1.1909   -1.4252    0.0011 C   0  0  0

+   -0.4304   -3.1721    0.0016 O   0  0  0

+   -3.4516   -0.2536   -0.0045 C   0  0  0

+    2.8856    0.3937    0.0000 C   0  0  0

+    3.1753    1.7089   -0.0013 O   0  0  0

+    3.7819   -0.4254    0.0016 O   0  0  0

+   -2.7697   -2.2187    0.0000 H   0  0  0

+   -3.8430    1.8102    0.0000 H   0  0  0

+   -1.2265    3.8016    0.0000 H   0  0  0

+    1.9584   -2.1126    0.0000 H   0  0  0

+   -0.6631   -4.1758    0.0000 H   0  0  0

+   -4.4469   -0.5201    0.0000 H   0  0  0

+    3.3969    2.7151    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

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+  7 13  1  0

+ 13 14  1  0

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+  7 10  2  0

+  8 12  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+557-30-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.6658   -0.3104    0.0000 C   0  0  0

+   -0.6658    0.3104    0.0000 C   0  0  0

+    1.7266    0.4325    0.0000 N   0  0  0

+   -1.7266   -0.4325    0.0000 N   0  0  0

+    3.0100   -0.1658    0.0000 O   0  0  0

+   -3.0100    0.1658    0.0000 O   0  0  0

+    0.7584   -1.3684    0.0000 H   0  0  0

+   -0.7584    1.3684    0.0000 H   0  0  0

+    3.9725   -0.6145    0.0000 H   0  0  0

+   -3.9725    0.6145    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  3  5  1  0

+  4  6  1  0

+  1  7  1  0

+  2  8  1  0

+  5  9  1  0

+  6 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-61-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.4601    0.6112    0.0000 C   0  0  0

+   -0.4601   -0.6112    0.0000 C   0  0  0

+    1.8639    0.1685    0.0000 C   0  0  0

+   -1.8639   -0.1685    0.0000 C   0  0  0

+    2.9474   -0.1731    0.0000 N   0  0  0

+   -2.9474    0.1731    0.0000 N   0  0  0

+    0.9090    1.6198    0.0000 H   0  0  0

+   -0.4913    1.1712    0.0000 H   0  0  0

+   -0.9090   -1.6198    0.0000 H   0  0  0

+    0.4913   -1.1712    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  3  0

+  4  6  3  0

+  1  7  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-64-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    0.4498   -0.3378   -0.2382 C   0  0  0

+   -0.6133   -1.4065   -0.3641 C   0  0  0

+    0.0651    1.0949   -0.5342 C   0  0  0

+    1.6427   -0.6373    0.1149 N   0  0  0

+   -1.8409   -0.9698    0.4422 C   0  0  0

+   -1.1871    1.4408    0.2782 C   0  0  0

+    2.6237    0.3776    0.2272 O   0  0  0

+   -2.2852    0.4188   -0.0206 C   0  0  0

+   -1.1186   -2.3566    0.0000 H   0  0  0

+    0.2525   -2.0455    0.0000 H   0  0  0

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+    0.1642    2.1664    0.0000 H   0  0  0

+   -2.9123   -1.0692    0.0000 H   0  0  0

+   -1.9747   -2.0375    0.0000 H   0  0  0

+   -0.7157    2.4081    0.0000 H   0  0  0

+   -2.0519    2.0811    0.0000 H   0  0  0

+    3.3716    1.1513    0.0000 H   0  0  0

+   -2.8954    1.3051    0.0000 H   0  0  0

+   -3.2512   -0.0553    0.0000 H   0  0  0

+  1  2  1  0

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+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75888-03-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -0.9980   -0.0606   -0.0228 C   0  0  0

+   -2.1433    0.6599   -0.0516 O   0  0  0

+    0.2887    0.4367   -0.0673 C   0  0  0

+   -1.3903   -1.4809    0.0720 C   0  0  0

+   -3.1907   -0.1668    0.0103 C   0  0  0

+    1.3321   -0.4016   -0.0303 N   0  0  0

+   -2.7532   -1.4913    0.0922 C   0  0  0

+   -4.6137    0.2604    0.0023 N   0  3  0

+    2.5347    0.0633   -0.0719 N   0  0  0

+   -5.5000   -0.5729    0.0626 O   0  0  0

+   -4.9394    1.6362   -0.0755 O   0  5  0

+    3.5701   -0.7887   -0.0341 C   0  0  0

+    2.7417    1.5093   -0.1656 C   0  0  0

+    4.8464   -0.3769   -0.0622 N   0  0  0

+    3.3430   -1.9803    0.0286 O   0  0  0

+    4.0727    1.8710    0.5021 C   0  0  0

+    5.1861    1.0443   -0.1497 C   0  0  0

+    0.4464    1.4529    0.0000 H   0  0  0

+   -0.7643   -2.2967    0.0000 H   0  0  0

+   -3.3524   -2.3270    0.0000 H   0  0  0

+    2.6089    2.5290    0.0000 H   0  0  0

+    1.7134    1.5158    0.0000 H   0  0  0

+    5.6012   -1.0753    0.0000 H   0  0  0

+    4.8526    2.5412    0.0000 H   0  0  0

+    3.5909    2.7795    0.0000 H   0  0  0

+    6.1451    0.6731    0.0000 H   0  0  0

+    5.6827    1.9448    0.0000 H   0  0  0

+  1  2  1  0

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+  5  7  2  0

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+  3 18  1  0

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+  7 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 16 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2429-71-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 81                          1 V2000

+    9.7331   -1.9106    0.6015 S   0  0  0

+   10.5290   -1.5442    1.7202 O   0  0  0

+   10.2153   -2.5278   -0.5842 O   0  0  0

+    8.6594   -2.8423    1.1453 O   0  0  0

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+    5.5521    0.8545   -0.3358 N   0  0  0

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+    2.3959   -3.3210    1.2179 C   0  0  0

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+   -9.6990   -0.6756   -0.3332 C   0  0  0

+   -9.8237   -2.9638   -1.1615 C   0  0  0

+   -9.7333    1.9062    0.6130 S   0  0  0

+  -11.1023   -0.6213   -0.3348 C   0  0  0

+  -11.1825   -2.8748   -1.1499 C   0  0  0

+  -10.4866    2.3584   -0.5039 O   0  0  0

+  -10.2626    1.6179    1.8998 O   0  0  0

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+  -11.8197   -1.7067   -0.7376 C   0  0  0

+    7.8974   -3.5035    0.0000 H   0  0  0

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+   -3.0837    4.0601    0.0000 H   0  0  0

+   -7.0471    1.2190    0.0000 H   0  0  0

+   -6.5087   -3.9296    0.0000 H   0  0  0

+   -9.3881   -3.8738    0.0000 H   0  0  0

+  -11.5628    0.2764    0.0000 H   0  0  0

+  -11.7256   -3.7251    0.0000 H   0  0  0

+   -7.9301    3.6588    0.0000 H   0  0  0

+  -12.8277   -1.6640    0.0000 H   0  0  0

+  2  1  2  0

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+  4  1  1  0

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+ 43 72  1  0

+ 45 73  1  0

+ 46 74  1  0

+ 49 75  1  0

+ 50 76  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+127072-58-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+    2.8214   -0.3079   -0.2886 C   0  0  0

+    1.5945    0.2790    0.0956 C   0  0  0

+    3.9831    0.2936    0.0272 C   0  0  0

+    0.4204   -0.3290   -0.2236 C   0  0  0

+    5.1573   -0.2680   -0.3405 O   0  0  0

+   -0.8002    0.2549    0.1586 C   0  0  0

+    6.1938    0.5945    0.1325 C   0  0  0

+   -1.9770   -0.3545   -0.1613 C   0  0  0

+    7.5559    0.0137   -0.2524 C   0  0  0

+   -3.1965    0.2288    0.2205 C   0  0  0

+    8.6656    0.9372    0.2541 C   0  0  0

+    7.7062   -1.2793    0.3372 O   0  0  0

+   -4.3728   -0.3803   -0.0992 C   0  0  0

+    9.9378    0.3948   -0.1054 O   0  0  0

+   -5.5946    0.2042    0.2834 C   0  0  0

+   -6.7667   -0.4027   -0.0352 C   0  0  0

+   -7.9980    0.1862    0.3503 C   0  0  0

+   -9.1513   -0.4110    0.0368 C   0  0  0

+  -10.4595    0.2149    0.4465 C   0  0  0

+  -11.2944    0.5137   -0.8004 C   0  0  0

+    2.8374   -1.3191    0.0000 H   0  0  0

+    1.5785    1.2902    0.0000 H   0  0  0

+    3.9671    1.3048    0.0000 H   0  0  0

+    0.4364   -1.3402    0.0000 H   0  0  0

+   -0.8162    1.2661    0.0000 H   0  0  0

+    6.7318    1.4508    0.0000 H   0  0  0

+    5.4327    1.2605    0.0000 H   0  0  0

+   -1.9610   -1.3657    0.0000 H   0  0  0

+    8.4949   -0.3619    0.0000 H   0  0  0

+   -3.2125    1.2400    0.0000 H   0  0  0

+    9.2036    1.7936    0.0000 H   0  0  0

+    7.9045    1.6031    0.0000 H   0  0  0

+    7.8230   -2.2839    0.0000 H   0  0  0

+   -4.3568   -1.3915    0.0000 H   0  0  0

+   10.8681   -0.0018    0.0000 H   0  0  0

+   -5.6106    1.2154    0.0000 H   0  0  0

+   -6.7507   -1.4139    0.0000 H   0  0  0

+   -8.0140    1.1974    0.0000 H   0  0  0

+   -9.1353   -1.4222    0.0000 H   0  0  0

+   -9.6454    0.8149    0.0000 H   0  0  0

+  -10.6064    1.2155    0.0000 H   0  0  0

+  -10.9536    1.4659    0.0000 H   0  0  0

+  -12.2466    0.8545    0.0000 H   0  0  0

+  -11.6352   -0.4385    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

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+  9 11  1  0

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+ 16 17  1  0

+ 17 18  2  0

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+ 19 20  1  0

+  1 21  1  0

+  2 22  1  0

+  3 23  1  0

+  4 24  1  0

+  6 25  1  0

+  7 26  1  0

+  7 27  1  0

+  8 28  1  0

+  9 29  1  0

+ 10 30  1  0

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+ 18 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 20 42  1  0

+ 20 43  1  0

+ 20 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-57-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.7438   -0.0001   -0.0746 S   0  0  0

+   -0.0178    0.0000   -0.0375 C   0  0  0

+    2.2294    0.0029    1.3678 O   0  0  0

+    2.1187   -1.2638   -0.6055 O   0  0  0

+    2.1188    1.2612   -0.6109 O   0  0  0

+   -0.7073    1.1983   -0.0255 C   0  0  0

+   -0.7077   -1.1987   -0.0261 C   0  0  0

+   -2.0883    1.2020    0.0036 C   0  0  0

+   -2.0882   -1.2022    0.0030 C   0  0  0

+   -2.7842    0.0002    0.0208 C   0  0  0

+   -4.1806    0.0003    0.0507 N   0  0  0

+    3.2663    0.0093    0.0000 H   0  0  0

+   -0.1870    2.0952    0.0000 H   0  0  0

+   -0.1875   -2.0957    0.0000 H   0  0  0

+   -2.6050    2.1010    0.0000 H   0  0  0

+   -2.6050   -2.1011    0.0000 H   0  0  0

+   -4.6990    0.8983    0.0000 H   0  0  0

+   -4.6991   -0.8976    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

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+  8 10  2  0

+ 10 11  1  0

+  9 10  1  0

+  3 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+16400-63-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.2375    0.2983    0.0030 C   0  0  0

+    1.2477   -0.8200    0.0037 C   0  0  0

+    0.6407    1.5460   -0.0006 C   0  0  0

+   -1.6115   -0.0978   -0.0004 Br  0  0  0

+    2.9120   -0.1265   -0.0011 Cl  0  0  0

+    0.2385   -1.5426    0.0000 H   0  0  0

+    1.8516   -1.9045    0.0000 H   0  0  0

+    1.8544    1.8060    0.0000 H   0  0  0

+   -0.1913    2.4671    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42471-28-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -2.5600   -0.6739   -0.2123 C   0  0  0

+   -3.3685   -0.3866    0.8892 C   0  0  0

+   -1.1944   -1.2845   -0.0297 C   0  0  0

+   -3.0455   -0.3898   -1.4737 C   0  0  0

+   -4.5671    0.1521    0.6846 N   0  0  0

+   -2.9293   -0.6587    2.1747 N   0  0  0

+   -0.1976   -0.2195    0.1069 N   0  0  0

+   -4.2534    0.1420   -1.5970 N   0  0  0

+   -4.9880    0.4117   -0.5365 C   0  0  0

+    1.1020   -0.5312    0.2812 C   0  0  0

+   -6.3526    1.0223   -0.7267 C   0  0  0

+    2.0189    0.4486    0.4068 N   0  0  0

+    1.4469   -1.6952    0.3250 O   0  0  0

+    3.4316    0.1098    0.5963 C   0  0  0

+    1.6527    1.6846    0.3602 N   0  0  0

+    4.1158   -0.0050   -0.7673 C   0  0  0

+    2.4814    2.5700    0.4738 O   0  0  0

+    5.8544   -0.4219   -0.5342 Cl  0  0  0

+   -1.6888   -2.1262    0.0000 H   0  0  0

+   -0.4124   -1.8688    0.0000 H   0  0  0

+   -2.6016    0.4796    0.0000 H   0  0  0

+   -2.9596   -1.6344    0.0000 H   0  0  0

+   -2.0691   -0.1971    0.0000 H   0  0  0

+   -0.4782    0.7155    0.0000 H   0  0  0

+   -5.9539    1.9134    0.0000 H   0  0  0

+   -7.2437    1.4210    0.0000 H   0  0  0

+   -6.7513    0.1312    0.0000 H   0  0  0

+    2.7763   -0.6138    0.0000 H   0  0  0

+    3.7519   -0.8124    0.0000 H   0  0  0

+    4.7711    0.7186    0.0000 H   0  0  0

+    3.7955    0.9172    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  3  7  1  0

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+  8  9  1  0

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+ 11 26  1  0

+ 11 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+372-48-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -0.7834   -0.0314    0.0022 C   0  0  0

+   -0.0836   -1.2273    0.0013 C   0  0  0

+   -0.1440    1.1237    0.0013 N   0  0  0

+   -2.1343   -0.0475   -0.0018 F   0  0  0

+    1.3011   -1.1984   -0.0005 C   0  0  0

+    1.1739    1.1864   -0.0004 C   0  0  0

+    1.9365    0.0350   -0.0014 C   0  0  0

+   -0.5895   -2.1312    0.0000 H   0  0  0

+    1.8495   -2.0771    0.0000 H   0  0  0

+    1.6422    2.1103    0.0000 H   0  0  0

+    2.9707    0.0916    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  6  7  2  0

+  2  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3671-71-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+    2.1557    0.1687   -0.5171 C   0  0  0

+    3.5835    0.5007   -0.2879 C   0  0  0

+    1.7664   -0.8372    0.3648 C   0  0  0

+    1.2258    0.6900   -1.4194 C   0  0  0

+    4.0867   -0.2970    0.7366 C   0  0  0

+    4.4222    1.4278   -0.9091 C   0  0  0

+    2.9662   -1.1903    1.2095 C   0  0  0

+    0.4764   -1.3184    0.3453 C   0  0  0

+   -0.0643    0.2062   -1.4375 C   0  0  0

+    5.4011   -0.1717    1.1328 C   0  0  0

+    5.7362    1.5463   -0.5058 C   0  0  0

+   -0.4453   -0.8001   -0.5579 C   0  0  0

+    6.2271    0.7493    0.5123 C   0  0  0

+   -1.7545   -1.2883   -0.5787 N   0  0  0

+   -2.5834   -1.0382    0.4542 C   0  0  0

+   -2.2103   -2.0456   -1.6849 O   0  0  0

+   -3.5353    0.0903    0.3815 C   0  0  0

+   -2.5482   -1.7407    1.4457 O   0  0  0

+   -3.5495    1.0613    1.3846 C   0  0  0

+   -4.4198    0.1930   -0.6932 C   0  0  0

+   -4.4400    2.1120    1.3104 C   0  0  0

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+    1.2918    1.5559    0.0000 H   0  0  0

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+    2.5575   -1.9565    0.0000 H   0  0  0

+    3.6338   -1.7457    0.0000 H   0  0  0

+    0.4091   -2.1842    0.0000 H   0  0  0

+   -0.6774    0.8212    0.0000 H   0  0  0

+    5.7924   -0.9470    0.0000 H   0  0  0

+    6.1251    2.3227    0.0000 H   0  0  0

+    7.0920    0.6717    0.0000 H   0  0  0

+   -2.6581   -2.7896    0.0000 H   0  0  0

+   -2.7364    1.3663    0.0000 H   0  0  0

+   -4.8318   -0.5715    0.0000 H   0  0  0

+   -4.0338    2.8796    0.0000 H   0  0  0

+   -6.1196    0.9470    0.0000 H   0  0  0

+   -5.9029    2.8469    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  5  7  1  0

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+ 11 31  1  0

+ 13 32  1  0

+ 16 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-01-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+    0.2008   -0.2858   -0.0018 C   0  0  0

+   -0.8376   -1.1957   -0.0008 C   0  0  0

+   -0.3369    0.9528   -0.0008 O   0  0  0

+    1.5796   -0.5954    0.0015 C   0  0  0

+   -2.0226   -0.4479    0.0010 C   0  0  0

+   -1.6719    0.8587    0.0009 C   0  0  0

+    2.4024    0.2978    0.0001 O   0  0  0

+   -0.7582   -2.2072    0.0000 H   0  0  0

+    1.8821   -1.5639    0.0000 H   0  0  0

+   -2.9675   -0.8175    0.0000 H   0  0  0

+   -2.3173    1.6416    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  6  2  0

+  2  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5836-29-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+    1.0359   -0.7300    0.2481 C   0  0  0

+   -0.4624   -0.6771    0.0956 C   0  0  0

+    1.6873    0.1528   -0.8145 C   0  0  0

+    1.4283   -0.1937    1.6298 C   0  0  0

+   -1.1164    0.5093    0.1991 C   0  0  0

+   -1.1893   -1.8578   -0.1607 C   0  0  0

+    3.1614    0.3061   -0.5451 C   0  0  0

+    2.9144   -0.4697    1.8493 C   0  0  0

+   -2.5716    0.5124    0.0435 C   0  0  0

+   -2.5239   -1.8472   -0.3024 O   0  0  0

+   -0.5908   -2.9142   -0.2562 O   0  0  0

+    3.7236    0.0273    0.6801 C   0  0  0

+    3.9668    0.7483   -1.5870 C   0  0  0

+   -3.2342   -0.7027   -0.2054 C   0  0  0

+   -3.3076    1.7040    0.1394 C   0  0  0

+    5.0899    0.1974    0.8648 C   0  0  0

+    5.3236    0.9139   -1.4024 C   0  0  0

+   -4.6140   -0.7100   -0.3545 C   0  0  0

+   -4.6820    1.6689   -0.0127 C   0  0  0

+   -2.6758    2.8807    0.3798 O   0  0  0

+    5.8876    0.6382   -0.1705 C   0  0  0

+   -5.3271    0.4679   -0.2586 C   0  0  0

+    1.4805   -1.6507    0.0000 H   0  0  0

+    1.8328    1.1649    0.0000 H   0  0  0

+    0.7413    0.5408    0.0000 H   0  0  0

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+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98046-75-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+   -0.4985   -0.5352   -0.0006 C   0  0  0

+   -1.8756   -0.4460   -0.0004 N   0  0  0

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+    0.3505   -1.5509    0.0034 N   0  0  0

+   -2.1991    0.8884    0.0007 C   0  0  0

+   -2.8568   -1.3956   -0.0014 C   0  0  0

+   -1.0868    1.6082    0.0011 N   0  0  0

+    1.3653    1.0086    0.0004 C   0  0  0

+    1.6530   -1.3586    0.0020 C   0  0  0

+   -3.5580    1.2728    0.0004 C   0  0  0

+   -4.1586   -1.0412   -0.0014 C   0  0  0

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+   -4.5231    0.3157   -0.0010 C   0  0  0

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+    4.3992   -0.8693   -0.0017 O   0  0  0

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+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63041-77-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.5047   -0.1378   -0.0013 C   0  0  0

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+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85977-49-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    2.5237   -0.7279   -0.3183 N   0  0  0

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+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+11012-59-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+132135                          1 V2000

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+ 68132  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19387-91-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    2.5127   -0.0793   -0.1644 S   0  0  0

+    0.8178   -0.2648    0.4548 C   0  0  0

+    3.3688    0.2333    1.4040 C   0  0  0

+    2.9515   -1.3243   -0.6906 O   0  0  0

+    2.5849    1.0881   -0.9713 O   0  0  0

+   -0.1255   -0.5445   -0.7168 C   0  0  0

+    4.8629    0.4295    1.1392 C   0  0  0

+   -1.4943   -0.6943   -0.2167 N   0  0  0

+   -2.3698    0.3182    0.0696 C   0  0  0

+   -2.1300   -1.8573    0.0424 C   0  0  0

+   -2.1147    1.7700   -0.0660 N   0  3  0

+   -3.5079   -0.2603    0.4983 C   0  0  0

+   -3.3331   -1.5899    0.4713 N   0  0  0

+   -1.5465   -3.2355   -0.1341 C   0  0  0

+   -1.5566    2.2002   -1.0595 O   0  0  0

+   -2.4629    2.5345    0.8160 O   0  5  0

+    1.1625    0.6654    0.0000 H   0  0  0

+    0.1401    0.4596    0.0000 H   0  0  0

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+   -2.4600   -3.6223    0.0000 H   0  0  0

+   -1.1597   -4.1490    0.0000 H   0  0  0

+   -0.6330   -2.8487    0.0000 H   0  0  0

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+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142438-70-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    1.6246    0.0884    0.0888 C   0  0  0

+    0.7720    0.3747    1.3265 C   0  0  0

+    1.8959    1.1814    0.9684 O   0  0  0

+    2.5536   -1.0974    0.1349 C   0  0  0

+    1.0318    0.4033   -1.2604 C   0  0  0

+   -0.4985    1.0706    0.9113 C   0  0  0

+    2.0595   -2.3456    0.0154 N   0  0  0

+    3.7458   -0.9284    0.2796 O   0  0  0

+    1.6496    1.2759   -2.0809 N   0  0  0

+   -0.0014   -0.1286   -1.6079 O   0  0  0

+   -1.6636    0.2806    0.4817 C   0  0  0

+   -0.5609    2.2813    0.9311 O   0  0  0

+   -2.5428    0.7903   -0.4793 C   0  0  0

+   -1.8941   -0.9858    1.0280 C   0  0  0

+   -3.6320    0.0442   -0.8765 C   0  0  0

+   -2.9881   -1.7198    0.6203 C   0  0  0

+   -3.8565   -1.2062   -0.3268 C   0  0  0

+    0.3987   -0.4782    0.0000 H   0  0  0

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+    2.6378   -3.0752    0.0000 H   0  0  0

+    2.5766    1.1899    0.0000 H   0  0  0

+    1.2605    2.1217    0.0000 H   0  0  0

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+   -1.1153   -1.4960    0.0000 H   0  0  0

+   -4.4138    0.5497    0.0000 H   0  0  0

+   -2.9616   -2.6504    0.0000 H   0  0  0

+   -4.7029   -1.5939    0.0000 H   0  0  0

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+ 16 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26093-31-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -1.4212   -2.8800    0.0000 C   0  0  0

+   -1.2494   -1.3829    0.0017 C   0  0  0

+    0.0841   -0.7793    0.0008 C   0  0  0

+   -2.3283   -0.5566   -0.0015 C   0  0  0

+    0.1973    0.6240    0.0020 C   0  0  0

+    1.2356   -1.5759   -0.0007 C   0  0  0

+   -2.1417    0.8404   -0.0003 C   0  0  0

+   -0.9161    1.3881    0.0035 O   0  0  0

+    1.4551    1.2058    0.0012 C   0  0  0

+    2.4666   -0.9887   -0.0011 C   0  0  0

+   -3.1174    1.5695   -0.0033 O   0  0  0

+    2.5859    0.4020   -0.0008 C   0  0  0

+    3.8487    0.9867   -0.0016 N   0  0  0

+   -2.4565   -2.7612    0.0000 H   0  0  0

+   -1.5400   -3.9153    0.0000 H   0  0  0

+   -0.3859   -2.9988    0.0000 H   0  0  0

+   -3.2913   -0.9549    0.0000 H   0  0  0

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+    3.3234   -1.5820    0.0000 H   0  0  0

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+  6 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2784-86-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.8366   -0.5094    0.2157 C   0  0  0

+   -2.3127   -0.5184    0.0656 C   0  0  0

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+    1.4409    2.3358    0.0553 O   0  0  0

+   -5.0179   -0.0160   -0.2806 C   0  0  0

+    3.2545    0.2864    0.5252 N   0  0  0

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+    5.6123   -0.1878   -0.0532 C   0  0  0

+    3.7273   -1.1279   -1.1175 O   0  0  0

+   -0.2667   -2.5237    0.0000 H   0  0  0

+   -2.9001   -2.5428    0.0000 H   0  0  0

+   -0.8644    2.4509    0.0000 H   0  0  0

+   -2.2540    2.4489    0.0000 H   0  0  0

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+ 15 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2221-41-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.3985   -0.2414   -0.1030 C   0  0  0

+   -0.7846   -1.0030   -0.2046 C   0  0  0

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+   -1.9977   -0.3247   -0.1339 C   0  0  0

+   -0.7414   -2.3482   -0.3659 O   0  0  0

+   -0.8921    1.7595    0.1260 N   0  0  0

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+    2.6938    1.3007    0.1020 C   0  0  0

+    4.0104   -0.6754   -0.1116 O   0  0  0

+   -3.3152    1.4490    0.0672 O   0  0  0

+   -4.1268    0.3842   -0.0675 C   0  0  0

+    4.9783    0.3677    0.0199 C   0  0  0

+    1.7370   -1.8708    0.0000 H   0  0  0

+    1.4360    2.9401    0.0000 H   0  0  0

+   -3.7636   -1.6930    0.0000 H   0  0  0

+   -1.8676   -2.7002    0.0000 H   0  0  0

+   -1.0956   -3.9210    0.0000 H   0  0  0

+    0.1252   -3.1490    0.0000 H   0  0  0

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+   -5.1474    0.4249    0.0000 H   0  0  0

+    5.7270   -0.3270    0.0000 H   0  0  0

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+  1  2  2  0

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+ 16 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+612-82-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    0.7353   -0.0966    0.1031 C   0  0  0

+   -0.7353    0.0966    0.1031 C   0  0  0

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+    1.1934    1.8983    0.0000 H   0  0  0

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+   -4.6528   -1.2210    0.0000 H   0  0  0

+   -4.5028   -2.6754    0.0000 H   0  0  0

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+   -5.4960   -0.1808    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102-60-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 51                          1 V2000

+   -1.8578   -0.0292   -0.2290 N   0  0  0

+   -0.4497   -0.2535   -0.5826 C   0  0  0

+   -2.4453    0.7630   -1.3177 C   0  0  0

+   -2.5152   -1.3425   -0.2603 C   0  0  0

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+   -3.4775   -1.4594    0.9234 C   0  0  0

+    1.8552    0.0304    0.1945 N   0  0  0

+   -3.2250    3.0452   -1.9703 C   0  0  0

+   -3.8831    2.0543    0.1334 O   0  0  0

+   -4.2875   -2.7512    0.7966 C   0  0  0

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+    2.6579    0.5377    1.3154 C   0  0  0

+    2.0545   -1.4245    0.1570 C   0  0  0

+    3.2553    1.8956    0.9414 C   0  0  0

+    3.1196   -1.7667   -0.8867 C   0  0  0

+    4.0536    2.4451    2.1254 C   0  0  0

+    4.1202    1.7414   -0.1856 O   0  0  0

+    3.4386   -3.2615   -0.8187 C   0  0  0

+    2.6309   -1.4427   -2.1899 O   0  0  0

+   -0.8084   -0.9829    0.0000 H   0  0  0

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+   -4.6923    1.9776    0.0000 H   0  0  0

+   -4.9761   -2.3194    0.0000 H   0  0  0

+   -4.7193   -3.4398    0.0000 H   0  0  0

+   -3.5989   -3.1830    0.0000 H   0  0  0

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+    4.9204    1.5987    0.0000 H   0  0  0

+    2.6437   -3.4311    0.0000 H   0  0  0

+    3.6082   -4.0564    0.0000 H   0  0  0

+    4.2335   -3.0919    0.0000 H   0  0  0

+    1.9535   -0.9936    0.0000 H   0  0  0

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+ 18 48  1  0

+ 19 49  1  0

+ 19 50  1  0

+ 19 51  1  0

+ 20 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+63980-20-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.1141   -0.3663   -0.1167 N   0  0  0

+   -1.1412    0.1564    0.2208 N   0  0  0

+    1.1320    0.0434    0.4609 N   0  0  0

+   -2.3437   -0.3277   -0.4617 C   0  0  0

+    2.4446   -0.5031    0.1080 C   0  0  0

+   -3.5711    0.4004    0.0900 C   0  0  0

+    3.3479    0.6246   -0.3954 C   0  0  0

+   -1.1350    1.1995    0.0000 H   0  0  0

+   -3.0570   -1.0888    0.0000 H   0  0  0

+   -1.7545   -1.1884    0.0000 H   0  0  0

+    1.9554   -1.4244    0.0000 H   0  0  0

+    3.3161   -1.0763    0.0000 H   0  0  0

+   -3.0389    1.2975    0.0000 H   0  0  0

+   -4.4682    0.9326    0.0000 H   0  0  0

+   -4.1033   -0.4967    0.0000 H   0  0  0

+    4.1620   -0.0275    0.0000 H   0  0  0

+    4.0000    1.4387    0.0000 H   0  0  0

+    2.5338    1.2767    0.0000 H   0  0  0

+  1  2  1  0

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+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51-03-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 55                          1 V2000

+   -2.9177   -1.7226    0.3503 C   0  0  0

+   -4.0798   -1.4698   -0.3744 C   0  0  0

+   -2.0609   -0.6801    0.6641 C   0  0  0

+   -2.8598   -3.0573    0.6302 O   0  0  0

+   -4.3726   -0.1773   -0.7783 C   0  0  0

+   -4.7474   -2.6469   -0.5530 O   0  0  0

+   -2.3598    0.6072    0.2584 C   0  0  0

+   -4.1965   -3.5516    0.4245 C   0  0  0

+   -3.5127    0.8579   -0.4623 C   0  0  0

+   -1.4261    1.7394    0.6010 C   0  0  0

+   -3.8334    2.2629   -0.9028 C   0  0  0

+   -0.3143    1.2323    1.3418 O   0  0  0

+   -3.3888    2.4564   -2.3539 C   0  0  0

+    0.5297    2.3475    1.6351 C   0  0  0

+   -3.7144    3.8829   -2.8012 C   0  0  0

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+    4.4171   -0.5243    1.6839 C   0  0  0

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+    6.9892   -1.4736   -2.2470 C   0  0  0

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+   -1.0958   -0.9060    0.0000 H   0  0  0

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+ 24 52  1  0

+ 24 53  1  0

+ 24 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+117-12-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.4363    0.2540   -0.0027 C   0  0  0

+   -0.9821   -1.0781   -0.0021 C   0  0  0

+   -0.4679    1.3649   -0.0023 C   0  0  0

+   -2.8101    0.5156    0.0022 C   0  0  0

+    0.4679   -1.3649   -0.0006 C   0  0  0

+   -1.9028   -2.1202   -0.0025 C   0  0  0

+    0.9821    1.0780   -0.0013 C   0  0  0

+   -0.8609    2.5152   -0.0024 O   0  0  0

+   -3.7139   -0.5429    0.0076 C   0  0  0

+   -3.2596    1.7947    0.0021 O   0  0  0

+    1.4363   -0.2541    0.0004 C   0  0  0

+    0.8609   -2.5152   -0.0005 O   0  0  0

+   -3.2613   -1.8463   -0.0035 C   0  0  0

+    1.9028    2.1202   -0.0005 C   0  0  0

+    2.8101   -0.5156    0.0012 C   0  0  0

+    3.2613    1.8463    0.0008 C   0  0  0

+    3.7139    0.5429    0.0014 C   0  0  0

+    3.2597   -1.7947    0.0022 O   0  0  0

+   -1.5705   -3.1093    0.0000 H   0  0  0

+   -4.7393   -0.3497    0.0000 H   0  0  0

+   -3.6055    2.7791    0.0000 H   0  0  0

+   -3.9476   -2.6323    0.0000 H   0  0  0

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+  1  2  2  0

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+ 10 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+19315-64-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+    0.8063   -0.3537    0.1457 C   0  0  0

+    2.1996   -0.3255    0.2899 N   0  0  0

+    0.1833   -1.4854   -0.3638 C   0  0  0

+    0.0472    0.7477    0.5175 C   0  0  0

+    2.9196    0.6441   -0.3084 C   0  0  0

+    2.8514   -1.3158    1.0642 O   0  0  0

+   -1.1898   -1.5126   -0.5053 C   0  0  0

+   -1.3262    0.7191    0.3755 C   0  0  0

+    3.4039    0.4587   -1.7233 C   0  0  0

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+   -1.9473   -0.4097   -0.1384 C   0  0  0

+   -3.2995   -0.4372   -0.2779 O   0  0  0

+   -3.7876    0.8261    0.1783 C   0  0  0

+   -5.3116    0.8614    0.0474 C   0  0  0

+    0.7023   -2.3441    0.0000 H   0  0  0

+    0.5045    1.6408    0.0000 H   0  0  0

+    3.4030   -2.1539    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6471-49-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 53 56                          1 V2000

+   -0.9102    2.4969    0.3045 C   0  0  0

+   -1.1456    1.0853    0.0014 C   0  0  0

+    0.4212    2.9625    0.4436 C   0  0  0

+   -1.9739    3.3937    0.4532 C   0  0  0

+   -0.0493    0.2352   -0.1424 C   0  0  0

+   -2.4119    0.6099   -0.1372 N   0  0  0

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+    0.6468    4.3199    0.7350 C   0  0  0

+   -1.7190    4.7036    0.7353 C   0  0  0

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+   -0.2445   -1.0761   -0.4228 O   0  0  0

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+   -4.0664   -0.8909    0.4087 C   0  0  0

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+   -3.5003   -4.2559    0.0000 H   0  0  0

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+ 27 49  1  0

+ 27 50  1  0

+ 27 51  1  0

+ 30 52  1  0

+ 33 53  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+625-48-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.1754    0.9631   -0.5590 C   0  0  0

+   -0.8212   -0.0078   -0.1002 N   0  3  0

+    1.4508    0.8166    0.2732 C   0  0  0

+   -1.8952    0.3772    0.3262 O   0  0  0

+   -0.5758   -1.2000   -0.1452 O   0  5  0

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+    0.4987    1.8700    0.0000 H   0  0  0

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+  1  2  1  0

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+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+128-08-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -1.4538    0.0000   -0.0005 Br  0  0  0

+    0.3962    0.0000   -0.0021 N   0  0  0

+    1.1207    1.1258    0.0000 C   0  0  0

+    1.1207   -1.1258    0.0003 C   0  0  0

+    0.6697    2.2510    0.0035 O   0  0  0

+    2.5917    0.7711   -0.0021 C   0  0  0

+    0.6697   -2.2510    0.0034 O   0  0  0

+    2.5917   -0.7712   -0.0019 C   0  0  0

+    3.6578    0.6868    0.0000 H   0  0  0

+    2.7597    1.8273    0.0000 H   0  0  0

+    2.7597   -1.8274    0.0000 H   0  0  0

+    3.6578   -0.6870    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  6  8  1  0

+  6  9  1  0

+  6 10  1  0

+  8 11  1  0

+  8 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6309-46-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -2.0083    0.7892    0.0668 O   0  0  0

+   -2.8419   -0.2633    0.0698 C   0  0  0

+   -0.6671    0.5936   -0.0355 C   0  0  0

+   -4.3142   -0.0577    0.3173 C   0  0  0

+   -2.4117   -1.3753   -0.1260 O   0  0  0

+    0.2029    1.6667    0.0886 C   0  0  0

+   -0.1657   -0.6808   -0.2586 C   0  0  0

+    1.5658    1.4653   -0.0158 C   0  0  0

+    1.1976   -0.8770   -0.3622 C   0  0  0

+    2.0626    0.1954   -0.2438 C   0  0  0

+    3.5495   -0.0214   -0.3577 C   0  0  0

+    3.9775   -0.9306    0.6582 O   0  0  0

+   -4.1717    0.9625    0.0000 H   0  0  0

+   -5.3344    0.0848    0.0000 H   0  0  0

+   -4.4567   -1.0779    0.0000 H   0  0  0

+   -0.1709    2.6265    0.0000 H   0  0  0

+   -0.8049   -1.4885    0.0000 H   0  0  0

+    2.2073    2.2712    0.0000 H   0  0  0

+    1.5745   -1.8356    0.0000 H   0  0  0

+    4.5488    0.2285    0.0000 H   0  0  0

+    3.4979    1.0074    0.0000 H   0  0  0

+    4.4162   -1.8626    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  2  2  0

+  6  3  2  0

+  7  3  1  0

+  8  6  1  0

+  9  7  2  0

+ 10  8  2  0

+ 11 10  1  0

+ 12 11  1  0

+  9 10  1  0

+  4 13  1  0

+  4 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67-56-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+   -0.8163    0.0000    0.0000 C   0  0  0

+    0.6127    0.0000    0.0000 O   0  0  0

+   -0.8163    1.0717    0.0000 H   0  0  0

+   -1.8880    0.0000    0.0000 H   0  0  0

+   -0.8163   -1.0717    0.0000 H   0  0  0

+    1.6844    0.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+149573-80-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.1436   -0.7090    0.3253 C   0  0  0

+    0.9887    0.1410    0.9294 C   0  0  0

+    0.7675   -1.2494   -0.7379 N   0  0  0

+   -1.2649   -1.0122    0.7670 C   0  0  0

+    2.1655    0.1141    0.2065 N   0  0  0

+    1.9742   -0.7715   -0.8261 C   0  0  0

+   -2.2178   -0.0540    0.1000 C   0  0  0

+    3.2362    0.7902    0.4528 N   0  0  0

+   -3.5401   -0.1369    0.3472 N   0  0  0

+   -1.7947    0.7919   -0.6593 O   0  0  0

+    4.2103    0.6724   -0.2689 O   0  0  0

+   -4.4354    0.7634   -0.2796 O   0  0  0

+    0.6435    0.9985    0.0000 H   0  0  0

+   -2.0317   -1.5283    0.0000 H   0  0  0

+   -0.9030   -1.8628    0.0000 H   0  0  0

+    2.6793   -1.3693    0.0000 H   0  0  0

+   -3.8681   -1.0011    0.0000 H   0  0  0

+   -5.0872    1.4188    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  7 10  2  0

+  8 11  2  0

+  9 12  1  0

+  5  6  1  0

+  2 13  1  0

+  4 14  1  0

+  4 15  1  0

+  6 16  1  0

+  9 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+73018-98-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.9388    0.1498   -0.3186 C   0  0  0

+   -0.2890    0.9255    0.1625 C   0  0  0

+    2.1693    0.6024    0.4701 C   0  0  0

+    0.7293   -1.2488   -0.1131 O   0  0  0

+   -1.4672    0.4921   -0.5927 N   0  0  0

+    3.3161   -0.1221    0.0207 O   0  0  0

+   -2.3456    0.0425   -0.0545 N   0  3  0

+   -3.2240   -0.4072    0.4837 N   0  5  0

+    1.0423    1.1277    0.0000 H   0  0  0

+    0.4038    1.6234    0.0000 H   0  0  0

+   -0.8203    1.7530    0.0000 H   0  0  0

+    2.8621    1.3003    0.0000 H   0  0  0

+    1.6380    1.4299    0.0000 H   0  0  0

+    0.5836   -2.2213    0.0000 H   0  0  0

+    4.1474   -0.6473    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  2  0

+  7  8  2  0

+  1  9  1  0

+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+874-60-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.0771   -0.2634   -0.0015 C   0  0  0

+   -1.5308   -0.5025   -0.0011 C   0  0  0

+    0.4199    1.0434   -0.0003 C   0  0  0

+    0.8120   -1.3418    0.0027 C   0  0  0

+   -1.9588   -1.6376   -0.0021 O   0  0  0

+   -2.6313    0.8401    0.0009 Cl  0  0  0

+    1.7817    1.2592   -0.0002 C   0  0  0

+    2.1716   -1.1100    0.0028 C   0  0  0

+    2.6560    0.1862   -0.0013 C   0  0  0

+    4.1430    0.4308   -0.0012 C   0  0  0

+   -0.2379    1.8530    0.0000 H   0  0  0

+    0.4482   -2.3195    0.0000 H   0  0  0

+    2.1540    2.2337    0.0000 H   0  0  0

+    2.8364   -1.9139    0.0000 H   0  0  0

+    4.3123   -0.5985    0.0000 H   0  0  0

+    5.1723    0.6001    0.0000 H   0  0  0

+    3.9737    1.4601    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  7  9  1  0

+  9 10  1  0

+  8  9  2  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+  8 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+101-80-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    1.0646    0.9629    0.0162 C   0  0  0

+   -0.0493    1.7424    0.0407 O   0  0  0

+    1.5860    0.5366   -1.1969 C   0  0  0

+    1.6823    0.5991    1.2037 C   0  0  0

+   -1.1178    0.9015    0.0283 C   0  0  0

+    2.7170   -0.2550   -1.2226 C   0  0  0

+    2.8138   -0.1926    1.1796 C   0  0  0

+   -2.4007    1.4126   -0.1029 C   0  0  0

+   -0.9239   -0.4678    0.1412 C   0  0  0

+    3.3328   -0.6244   -0.0337 C   0  0  0

+   -3.4864    0.5590   -0.1161 C   0  0  0

+   -2.0084   -1.3223    0.1283 C   0  0  0

+    4.4788   -1.4269   -0.0589 N   0  0  0

+   -3.2936   -0.8109    0.0022 C   0  0  0

+   -4.3931   -1.6763   -0.0110 N   0  0  0

+    0.9609   -0.2891    0.0000 H   0  0  0

+    2.2424    1.4702    0.0000 H   0  0  0

+    2.1534   -1.1238    0.0000 H   0  0  0

+    3.4424    0.6304    0.0000 H   0  0  0

+   -2.5489    2.4376    0.0000 H   0  0  0

+    0.0373   -0.8533    0.0000 H   0  0  0

+   -4.4472    0.9454    0.0000 H   0  0  0

+   -1.8595   -2.3472    0.0000 H   0  0  0

+    4.3885   -2.4586    0.0000 H   0  0  0

+    5.4174   -0.9893    0.0000 H   0  0  0

+   -5.3547   -1.2918    0.0000 H   0  0  0

+   -4.2453   -2.7013    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 14 15  1  0

+  7 10  2  0

+ 12 14  1  0

+  3 16  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6967-29-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -0.2291   -0.0027    0.8256 N   0  0  0

+   -1.3731   -0.0014    0.1131 C   0  0  0

+    1.0054   -0.0002    0.1670 C   0  0  0

+   -2.7027   -0.0040    0.8224 C   0  0  0

+   -1.3325    0.0019   -1.0991 O   0  0  0

+    1.6186    1.2026   -0.1573 C   0  0  0

+    1.6228   -1.2010   -0.1587 C   0  0  0

+   -4.0331   -0.0014   -0.3944 Cl  0  0  0

+    0.9552    2.5078    0.1997 C   0  0  0

+    2.8376    1.2016   -0.8071 C   0  0  0

+    0.9638   -2.5088    0.1969 C   0  0  0

+    2.8414   -1.1952   -0.8083 C   0  0  0

+    1.3605    2.9147    1.6179 C   0  0  0

+    3.4470    0.0046   -1.1346 C   0  0  0

+    1.3703   -2.9158    1.6146 C   0  0  0

+   -0.2287   -0.9999    0.0000 H   0  0  0

+   -3.2019   -0.8673    0.0000 H   0  0  0

+   -2.2035   -0.8673    0.0000 H   0  0  0

+    0.3269    3.2822    0.0000 H   0  0  0

+    0.1189    1.9647    0.0000 H   0  0  0

+    3.3591    2.0516    0.0000 H   0  0  0

+    0.1260   -1.9680    0.0000 H   0  0  0

+    0.3371   -3.2845    0.0000 H   0  0  0

+    3.3661   -2.0432    0.0000 H   0  0  0

+    2.0670    2.2110    0.0000 H   0  0  0

+    2.0642    3.6212    0.0000 H   0  0  0

+    0.6540    3.6184    0.0000 H   0  0  0

+    4.4442    0.0063    0.0000 H   0  0  0

+    0.6647   -3.6205    0.0000 H   0  0  0

+    2.0750   -3.6214    0.0000 H   0  0  0

+    2.0759   -2.2111    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  2  2  0

+  6  3  2  0

+  7  3  1  0

+  8  4  1  0

+  9  6  1  0

+ 10  6  1  0

+ 11  7  1  0

+ 12  7  2  0

+ 13  9  1  0

+ 14 10  2  0

+ 15 11  1  0

+ 12 14  1  0

+  1 16  1  0

+  4 17  1  0

+  4 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+90-04-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.5219    0.0258    0.0018 C   0  0  0

+    0.4527   -0.9697    0.0005 C   0  0  0

+   -0.1455    1.3587    0.0016 C   0  0  0

+   -1.8398   -0.3104   -0.0024 O   0  0  0

+    1.7953   -0.6208   -0.0010 C   0  0  0

+    0.0781   -2.3183    0.0011 N   0  0  0

+    1.1948    1.6991    0.0001 C   0  0  0

+   -2.5782    0.9131    0.0002 C   0  0  0

+    2.1626    0.7117   -0.0012 C   0  0  0

+   -0.8702    2.1029    0.0000 H   0  0  0

+    2.5244   -1.3607    0.0000 H   0  0  0

+   -0.9277   -2.5780    0.0000 H   0  0  0

+    0.8059   -3.0595    0.0000 H   0  0  0

+    1.4752    2.6993    0.0000 H   0  0  0

+   -1.6888    1.4498    0.0000 H   0  0  0

+   -3.1149    1.8025    0.0000 H   0  0  0

+   -3.4676    0.3764    0.0000 H   0  0  0

+    3.1682    0.9719    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7  9  1  0

+  3 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+288-47-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  8                          1 V2000

+    1.2468   -0.7084    0.0000 C   0  0  0

+    0.0553   -1.3587    0.0000 C   0  0  0

+    1.2412    0.6082    0.0000 N   0  0  0

+   -1.0744    0.0259    0.0000 S   0  0  0

+    0.1181    1.2884    0.0000 C   0  0  0

+    2.1234   -1.2261    0.0000 H   0  0  0

+   -0.1404   -2.3578    0.0000 H   0  0  0

+   -0.0186    2.2972    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  3  5  2  0

+  4  5  1  0

+  1  6  1  0

+  2  7  1  0

+  5  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+594-71-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.1449   -0.5645    0.0000 C   0  0  0

+   -1.0287    0.3124    0.0000 N   0  3  0

+    0.1218   -1.4475    1.2492 C   0  0  0

+    0.1218   -1.4475   -1.2492 C   0  0  0

+    1.6438    0.4375    0.0000 Cl  0  0  0

+   -0.8852    1.5219    0.0000 O   0  0  0

+   -2.1479   -0.1681    0.0000 O   0  5  0

+   -0.7914   -1.4236    0.0000 H   0  0  0

+    0.0979   -2.3607    0.0000 H   0  0  0

+    1.0350   -1.4714    0.0000 H   0  0  0

+   -0.7914   -1.4236    0.0000 H   0  0  0

+    0.0979   -2.3607    0.0000 H   0  0  0

+    1.0350   -1.4714    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55-80-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    0.9577   -0.4518    0.0068 C   0  0  0

+    1.8798   -1.5039    0.0070 C   0  0  0

+    1.4118    0.8719    0.0030 C   0  0  0

+   -0.3810   -0.7156    0.0046 N   0  0  0

+    3.2295   -1.2337    0.0035 C   0  0  0

+    2.7628    1.1338   -0.0005 C   0  0  0

+   -1.2298    0.2558    0.0044 N   0  0  0

+    3.6773    0.0841   -0.0003 C   0  0  0

+   -2.5711   -0.0085    0.0022 C   0  0  0

+    5.0434    0.3533   -0.0038 N   0  0  0

+   -3.4935    1.0411    0.0020 C   0  0  0

+   -3.0265   -1.3299   -0.0057 C   0  0  0

+    5.5168    1.7397   -0.0078 C   0  0  0

+    6.0074   -0.7499   -0.0036 C   0  0  0

+   -4.8453    0.7667   -0.0007 C   0  0  0

+   -4.3808   -1.5888   -0.0083 C   0  0  0

+   -5.2886   -0.5440   -0.0032 C   0  0  0

+   -5.8417    1.8973   -0.0005 C   0  0  0

+    1.5447   -2.4925    0.0000 H   0  0  0

+    0.7267    1.6595    0.0000 H   0  0  0

+    3.9181   -2.0182    0.0000 H   0  0  0

+    3.1024    2.1209    0.0000 H   0  0  0

+   -3.1604    2.0304    0.0000 H   0  0  0

+   -2.3430   -2.1189    0.0000 H   0  0  0

+    6.5047    1.4024    0.0000 H   0  0  0

+    5.8541    2.7276    0.0000 H   0  0  0

+    4.5289    2.0770    0.0000 H   0  0  0

+    5.2214   -1.4368    0.0000 H   0  0  0

+    6.6943   -1.5359    0.0000 H   0  0  0

+    6.7934   -0.0630    0.0000 H   0  0  0

+   -4.7223   -2.5752    0.0000 H   0  0  0

+   -6.3127   -0.7459    0.0000 H   0  0  0

+   -5.0586    2.5875    0.0000 H   0  0  0

+   -6.5319    2.6804    0.0000 H   0  0  0

+   -6.6248    1.2071    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  5  8  2  0

+  7  9  1  0

+  8 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 15 17  2  0

+ 15 18  1  0

+  6  8  1  0

+ 16 17  1  0

+  2 19  1  0

+  3 20  1  0

+  5 21  1  0

+  6 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+34237-98-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.6652   -0.3278    0.4633 C   0  0  0

+   -0.6652    0.3280    0.4634 C   0  0  0

+    1.7930    0.3815    0.0533 C   0  0  0

+    0.7904   -1.6528    0.8788 C   0  0  0

+   -1.7933   -0.3815    0.0534 C   0  0  0

+   -0.7903    1.6526    0.8788 C   0  0  0

+    3.0294   -0.2305    0.0544 C   0  0  0

+    2.0279   -2.2607    0.8785 C   0  0  0

+   -3.0294    0.2302    0.0549 C   0  0  0

+   -2.0281    2.2606    0.8788 C   0  0  0

+    3.1507   -1.5536    0.4648 C   0  0  0

+    4.5601    0.7306   -0.5016 Br  0  0  0

+   -3.1506    1.5539    0.4649 C   0  0  0

+   -4.5601   -0.7307   -0.5015 Br  0  0  0

+    4.4034   -2.1714    0.4658 N   0  0  0

+   -4.4032    2.1720    0.4653 N   0  0  0

+    1.7404    1.4142    0.0000 H   0  0  0

+   -0.0606   -2.2403    0.0000 H   0  0  0

+   -1.7406   -1.4142    0.0000 H   0  0  0

+    0.0607    2.2400    0.0000 H   0  0  0

+    2.0824   -3.2933    0.0000 H   0  0  0

+   -2.0825    3.2932    0.0000 H   0  0  0

+    4.4710   -3.2032    0.0000 H   0  0  0

+    5.2632   -1.5969    0.0000 H   0  0  0

+   -4.4706    3.2039    0.0000 H   0  0  0

+   -5.2631    1.5977    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  1  0

+  7 11  2  0

+  7 12  1  0

+  9 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 13 16  1  0

+  8 11  1  0

+ 10 13  2  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-96-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    0.0000    0.3696    0.0000 O   0  0  0

+   -1.1034    1.2216   -0.3140 C   0  0  0

+    1.1034    1.2216    0.3140 C   0  0  0

+   -2.3244    0.3676   -0.6614 C   0  0  0

+    2.3244    0.3676    0.6614 C   0  0  0

+   -2.6622   -0.4572    0.4556 O   0  0  0

+    2.6622   -0.4572   -0.4556 O   0  0  0

+   -3.8035   -1.2263    0.0709 C   0  0  0

+    3.8035   -1.2264   -0.0709 C   0  0  0

+   -0.3888    1.9757    0.0000 H   0  0  0

+   -1.7816    2.0086    0.0000 H   0  0  0

+    1.7816    2.0086    0.0000 H   0  0  0

+    0.3888    1.9757    0.0000 H   0  0  0

+   -2.6088    1.3668    0.0000 H   0  0  0

+   -3.3617    0.4254    0.0000 H   0  0  0

+    3.3617    0.4254    0.0000 H   0  0  0

+    2.6088    1.3668    0.0000 H   0  0  0

+   -4.3841   -0.3648    0.0000 H   0  0  0

+   -4.6650   -1.8069    0.0000 H   0  0  0

+   -3.2229   -2.0878    0.0000 H   0  0  0

+    3.2229   -2.0879    0.0000 H   0  0  0

+    4.6650   -1.8070    0.0000 H   0  0  0

+    4.3841   -0.3649    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  2 10  1  0

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+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+600-14-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.3189   -0.1822    0.0729 C   0  0  0

+   -1.1375    0.0945   -0.0358 C   0  0  0

+    1.3170    0.8175   -0.4520 C   0  0  0

+    0.7025   -1.2059    0.5865 O   0  0  0

+   -2.0270   -0.8439   -0.8100 C   0  0  0

+   -1.6081    1.0714    0.4964 O   0  0  0

+    2.7352    0.2933   -0.2178 C   0  0  0

+    1.8013    1.7091    0.0000 H   0  0  0

+    0.5038    1.4243    0.0000 H   0  0  0

+   -2.7634   -0.1459    0.0000 H   0  0  0

+   -2.7250   -1.5803    0.0000 H   0  0  0

+   -1.2906   -1.5419    0.0000 H   0  0  0

+    2.3834   -0.6584    0.0000 H   0  0  0

+    3.6869   -0.0585    0.0000 H   0  0  0

+    3.0870    1.2450    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+  5 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64099-27-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.1130    0.6783    0.0018 C   0  0  0

+   -0.8056   -0.3937    0.0008 C   0  0  0

+    1.4975    0.2341    0.0007 C   0  0  0

+   -0.4267    1.9856   -0.0017 C   0  0  0

+   -2.1747   -0.1850    0.0019 C   0  0  0

+    0.2490   -1.8178   -0.0015 S   0  0  0

+    1.7689   -1.0380   -0.0011 N   0  0  0

+    2.5053    1.1456    0.0020 O   0  0  0

+   -1.7722    2.1796   -0.0060 C   0  0  0

+   -2.6620    1.1125    0.0042 C   0  0  0

+   -3.0553   -1.2708    0.0004 N   0  0  0

+    3.7292    0.4081    0.0004 C   0  0  0

+    0.2172    2.8131    0.0000 H   0  0  0

+   -2.1477    3.1586    0.0000 H   0  0  0

+   -3.6958    1.2877    0.0000 H   0  0  0

+   -4.0908   -1.1060    0.0000 H   0  0  0

+   -2.6803   -2.2499    0.0000 H   0  0  0

+    3.1880   -0.4900    0.0000 H   0  0  0

+    4.6273   -0.1331    0.0000 H   0  0  0

+    4.2704    1.3062    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  8 12  1  0

+  6  7  1  0

+  9 10  1  0

+  4 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+31272-21-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    1.1455    0.3896   -0.0885 C   0  0  0

+   -0.2220    0.8578    0.1603 C   0  0  0

+    2.0467   -0.0869    0.8642 C   0  0  0

+    1.8007    0.3292   -1.3418 C   0  0  0

+   -1.3574   -0.0804    0.0404 C   0  0  0

+   -0.4217    2.0190    0.4656 O   0  0  0

+    3.1812   -0.4084    0.2098 N   0  0  0

+    1.8203   -0.2061    2.2191 N   0  0  0

+    3.0004   -0.1411   -1.1513 N   0  0  0

+    1.2118    0.7375   -2.6675 C   0  0  0

+   -2.6707    0.3877    0.1527 C   0  0  0

+   -1.1248   -1.4374   -0.1913 C   0  0  0

+    4.3975   -0.9499    0.8212 C   0  0  0

+   -3.7271   -0.4970    0.0387 C   0  0  0

+   -2.9062    1.6997    0.3723 F   0  0  0

+   -2.1888   -2.3075   -0.3027 C   0  0  0

+   -3.4864   -1.8399   -0.1855 C   0  0  0

+    0.9751    0.3268    0.0000 H   0  0  0

+    1.7814   -1.2045    0.0000 H   0  0  0

+    1.7811    1.5586    0.0000 H   0  0  0

+    0.3907    1.3068    0.0000 H   0  0  0

+    0.6425   -0.0836    0.0000 H   0  0  0

+   -0.1889   -1.7873    0.0000 H   0  0  0

+    3.9911   -1.8627    0.0000 H   0  0  0

+    5.3103   -1.3563    0.0000 H   0  0  0

+    4.8039   -0.0371    0.0000 H   0  0  0

+   -4.6663   -0.1562    0.0000 H   0  0  0

+   -2.0200   -3.2923    0.0000 H   0  0  0

+   -4.2498   -2.4844    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  7 13  1  0

+ 11 14  2  0

+ 11 15  1  0

+ 12 16  1  0

+ 14 17  1  0

+  7  9  1  0

+ 16 17  2  0

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+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68395-77-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.8105   -0.4406   -0.0024 C   0  0  0

+   -0.2364   -1.3539   -0.0014 C   0  0  0

+    0.5395    0.9217   -0.0018 C   0  0  0

+    2.1326   -0.8912    0.0017 N   0  0  0

+   -1.5422   -0.9050    0.0002 C   0  0  0

+   -0.7691    1.3639   -0.0002 C   0  0  0

+    3.1983    0.0411    0.0007 O   0  0  0

+   -1.8085    0.4522    0.0004 C   0  0  0

+   -2.6784   -1.8950    0.0012 C   0  0  0

+   -1.0641    2.8417    0.0010 C   0  0  0

+   -0.0365   -2.3764    0.0000 H   0  0  0

+    1.3223    1.6092    0.0000 H   0  0  0

+    2.3346   -1.9133    0.0000 H   0  0  0

+    3.9824    0.7271    0.0000 H   0  0  0

+   -2.7946    0.7883    0.0000 H   0  0  0

+   -3.3628   -1.1095    0.0000 H   0  0  0

+   -3.4639   -2.5794    0.0000 H   0  0  0

+   -1.9940   -2.6805    0.0000 H   0  0  0

+   -0.0424    3.0457    0.0000 H   0  0  0

+   -1.2681    3.8634    0.0000 H   0  0  0

+   -2.0858    2.6377    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

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+  6  8  2  0

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+  4 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1562-94-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    1.7617    0.3866   -0.0483 C   0  0  0

+    0.4583    0.5780   -0.0994 N   0  3  0

+    2.6772    1.5397    0.0532 C   0  0  0

+    2.3122   -0.9820   -0.0859 C   0  0  0

+   -0.4076   -0.5192   -0.1957 N   0  0  0

+    0.0069    1.7087   -0.0630 O   0  5  0

+    4.0093    1.3356    0.1055 C   0  0  0

+    3.6470   -1.1696   -0.0327 C   0  0  0

+   -1.7914   -0.3279   -0.1123 C   0  0  0

+    4.5468   -0.0225    0.0621 C   0  0  0

+   -2.3143    0.9583   -0.0796 C   0  0  0

+   -2.6427   -1.4238   -0.0681 C   0  0  0

+    5.8746   -0.2175    0.1146 O   0  0  0

+   -3.6799    1.1462    0.0021 C   0  0  0

+   -4.0084   -1.2340    0.0137 C   0  0  0

+    6.4126   -1.5655    0.0717 C   0  0  0

+   -4.5294    0.0507    0.0516 C   0  0  0

+   -5.8742    0.2366    0.1322 O   0  0  0

+   -6.4694   -1.0621    0.1662 C   0  0  0

+    2.2973    2.5081    0.0000 H   0  0  0

+    1.6711   -1.8012    0.0000 H   0  0  0

+    4.6577    2.1490    0.0000 H   0  0  0

+    4.0358   -2.1345    0.0000 H   0  0  0

+   -1.6759    1.7797    0.0000 H   0  0  0

+   -2.2509   -2.3875    0.0000 H   0  0  0

+   -4.0727    2.1094    0.0000 H   0  0  0

+   -4.6477   -2.0546    0.0000 H   0  0  0

+    5.4464   -1.9511    0.0000 H   0  0  0

+    6.7982   -2.5317    0.0000 H   0  0  0

+    7.3788   -1.1799    0.0000 H   0  0  0

+   -7.4151   -0.6287    0.0000 H   0  0  0

+   -6.9028   -2.0078    0.0000 H   0  0  0

+   -5.5237   -1.4955    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  9 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 12 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+  8 10  2  0

+ 15 17  2  0

+  3 20  1  0

+  4 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+605-71-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    0.6397   -0.3050   -0.0018 C   0  0  0

+   -0.6396    0.3056   -0.0010 C   0  0  0

+    1.7888    0.5033   -0.0005 C   0  0  0

+    0.7338   -1.7073    0.0018 C   0  0  0

+   -1.7889   -0.5033   -0.0019 C   0  0  0

+   -0.7336    1.7074    0.0011 C   0  0  0

+    1.6591    1.8584    0.0016 C   0  0  0

+    3.1336   -0.1153   -0.0009 N   0  3  0

+   -0.4011   -2.4583    0.0061 C   0  0  0

+   -1.6590   -1.8580   -0.0035 C   0  0  0

+   -3.1339    0.1150   -0.0005 N   0  3  0

+    0.4016    2.4586    0.0024 C   0  0  0

+    3.9890    0.2864    0.7676 O   0  0  0

+    3.3848   -1.0260   -0.7696 O   0  5  0

+   -3.9888   -0.2881    0.7676 O   0  0  0

+   -3.3856    1.0270   -0.7676 O   0  5  0

+    1.6704   -2.1709    0.0000 H   0  0  0

+   -1.6702    2.1710    0.0000 H   0  0  0

+    2.5154    2.4575    0.0000 H   0  0  0

+   -0.3284   -3.5008    0.0000 H   0  0  0

+   -2.5152   -2.4572    0.0000 H   0  0  0

+    0.3289    3.5011    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  8 13  2  0

+  8 14  1  0

+ 11 15  2  0

+ 11 16  1  0

+  7 12  2  0

+  9 10  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14618-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -3.2246    0.0584    0.6449 C   0  0  2

+   -4.6089   -0.4138    0.1960 C   0  0  0

+   -4.0978    0.8793   -0.1334 O   0  0  0

+   -2.1571   -0.5550   -0.2635 C   0  0  0

+   -0.8642   -0.1139    0.1558 O   0  0  0

+    0.0843   -0.7174   -0.7264 C   0  0  0

+    1.4758   -0.2902   -0.3363 C   0  0  0

+    2.4123   -1.2384    0.0317 C   0  0  0

+    1.8175    1.0489   -0.3517 C   0  0  0

+    3.6885   -0.8466    0.3896 C   0  0  0

+    3.0941    1.4408    0.0062 C   0  0  0

+    4.0286    0.4934    0.3796 C   0  0  0

+   -2.6281    0.8629    0.0000 H   0  0  0

+   -5.6005   -0.2727    0.0000 H   0  0  0

+   -4.5152   -1.4110    0.0000 H   0  0  0

+   -2.8483   -1.2798    0.0000 H   0  0  0

+   -1.6175   -1.3988    0.0000 H   0  0  0

+   -0.6356   -1.4137    0.0000 H   0  0  0

+    0.5935   -1.5799    0.0000 H   0  0  0

+    2.1676   -2.2096    0.0000 H   0  0  0

+    1.0925    1.7399    0.0000 H   0  0  0

+    4.4139   -1.5371    0.0000 H   0  0  0

+    3.3392    2.4119    0.0000 H   0  0  0

+    4.9952    0.7557    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

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+  7  9  2  0

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+  4 16  1  0

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+  6 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14160-38-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 47                          1 V2000

+    0.6761   -0.2907    0.3233 C   0  0  0

+   -0.6761    0.2906    0.3235 C   0  0  0

+    1.8387    0.5242   -0.1130 C   0  0  0

+    0.8678   -1.5750    0.7281 C   0  0  0

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+   -0.8678    1.5747    0.7285 C   0  0  0

+    3.1913   -0.0653   -0.1099 C   0  0  0

+    1.6763    1.6725   -0.4717 O   0  0  0

+    2.2224   -2.1487    0.7256 C   0  0  0

+   -3.1913    0.0655   -0.1100 C   0  0  0

+   -1.6766   -1.6729   -0.4706 O   0  0  0

+   -2.2222    2.1486    0.7258 C   0  0  0

+    3.3724   -1.3334    0.2854 C   0  0  0

+    4.3720    0.7599   -0.5528 C   0  0  0

+    2.3955   -3.2959    1.0873 O   0  0  0

+   -3.3722    1.3336    0.2852 C   0  0  0

+   -4.3720   -0.7597   -0.5529 C   0  0  0

+   -2.3954    3.2958    1.0877 O   0  0  0

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+    4.4253    0.7945   -2.0814 C   0  0  0

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+    5.0010   -0.0923    0.0000 H   0  0  0

+    5.3121    1.3702    0.0000 H   0  0  0

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+   -4.8701    0.9928    0.0000 H   0  0  0

+   -6.3562    0.8277    0.0000 H   0  0  0

+   -6.1911   -0.6584    0.0000 H   0  0  0

+   -4.9369   -2.0480    0.0000 H   0  0  0

+   -3.5315   -2.5582    0.0000 H   0  0  0

+   -3.0213   -1.1528    0.0000 H   0  0  0

+   -5.7623   -1.2348    0.0000 H   0  0  0

+   -5.2537   -2.6408    0.0000 H   0  0  0

+   -3.8477   -2.1322    0.0000 H   0  0  0

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+  9 13  1  0

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+ 23 43  1  0

+ 24 44  1  0

+ 24 45  1  0

+ 24 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4399-80-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -2.2443   -1.3413   -0.1248 O   0  0  0

+   -1.2912   -0.4699    0.5628 N   0  0  0

+    0.0558   -0.9142    0.1602 C   0  0  0

+   -1.5118    0.8959    0.0416 C   0  0  0

+    0.8919   -1.2318    1.4016 C   0  0  0

+   -0.0493   -2.1557   -0.7278 C   0  0  0

+    0.7034    0.2448   -0.6265 C   0  0  0

+   -2.2400    0.8418   -1.3030 C   0  0  0

+   -2.3121    1.7267    1.0466 C   0  0  0

+   -0.0905    1.4851   -0.1383 C   0  0  0

+    2.1483    0.3816   -0.2207 C   0  0  0

+    2.6723    1.6028    0.0043 N   0  0  0

+    2.8396   -0.6071   -0.0967 O   0  0  0

+   -2.9792   -2.0132    0.0000 H   0  0  0

+    0.5383   -2.1626    0.0000 H   0  0  0

+    1.8227   -1.5854    0.0000 H   0  0  0

+    1.2455   -0.3010    0.0000 H   0  0  0

+   -1.0415   -2.0717    0.0000 H   0  0  0

+   -0.1333   -3.1479    0.0000 H   0  0  0

+    0.9429   -2.2397    0.0000 H   0  0  0

+    1.2473   -0.5893    0.0000 H   0  0  0

+   -2.3138    1.8348    0.0000 H   0  0  0

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+   -2.1662   -0.1512    0.0000 H   0  0  0

+   -1.5950    2.4175    0.0000 H   0  0  0

+   -3.0029    2.4438    0.0000 H   0  0  0

+   -3.0292    1.0359    0.0000 H   0  0  0

+    0.7782    1.9717    0.0000 H   0  0  0

+   -0.5252    2.3809    0.0000 H   0  0  0

+    3.6611    1.7203    0.0000 H   0  0  0

+    2.0762    2.4004    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

+  5  3  1  0

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+  8  4  1  0

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+ 11  7  1  0

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+  9 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+139953-98-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 46                          1 V2000

+    6.1201   -0.0047    0.0834 C   0  0  0

+    4.9451   -0.9159    0.3285 C   0  0  0

+    6.6678    0.7139    1.1299 C   0  0  0

+    6.6539    0.1082   -1.1865 C   0  0  0

+    3.6443   -0.1339    0.1353 C   0  0  0

+    4.9870   -2.0061   -0.5945 O   0  0  0

+    7.7454    1.5496    0.9050 C   0  0  0

+    7.7319    0.9442   -1.4114 C   0  0  0

+    2.5301   -0.9979    0.3678 O   0  0  0

+    8.2757    1.6670   -0.3664 C   0  0  0

+    1.4144   -0.2554    0.1835 C   0  0  0

+    0.2011   -0.8150    0.3377 C   0  0  0

+   -0.9652   -0.0389    0.1450 C   0  0  0

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+   -7.0438   -1.1992    0.0000 H   0  0  0

+   -8.0920    1.6231    0.0000 H   0  0  0

+   -9.4539   -0.9528    0.0000 H   0  0  0

+   -9.9614    1.6557    0.0000 H   0  0  0

+  -11.3066    1.6278    0.0000 H   0  0  0

+  -12.0514    1.0950    0.0000 H   0  0  0

+  -12.2751   -0.3201    0.0000 H   0  0  0

+  -10.8600   -0.5438    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  2  0

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+ 21 42  1  0

+ 21 43  1  0

+ 22 44  1  0

+ 22 45  1  0

+ 22 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94-81-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -0.7998   -0.5562   -0.0035 C   0  0  0

+   -1.8672   -1.4418   -0.0016 C   0  0  0

+   -1.0352    0.8112   -0.0034 C   0  0  0

+    0.4752   -1.0271    0.0001 O   0  0  0

+   -3.1625   -0.9611    0.0005 C   0  0  0

+   -1.6143   -2.9274   -0.0012 C   0  0  0

+   -2.3315    1.2878   -0.0013 C   0  0  0

+    1.3367    0.1130   -0.0032 C   0  0  0

+   -3.3952    0.4026    0.0006 C   0  0  0

+    2.7950   -0.3497    0.0007 C   0  0  0

+   -5.0237    1.0042    0.0026 Cl  0  0  0

+    3.7174    0.8710   -0.0028 C   0  0  0

+    5.1538    0.4152    0.0010 C   0  0  0

+    6.1451    1.3202   -0.0012 O   0  0  0

+    5.4132   -0.7649    0.0060 O   0  0  0

+   -0.2359    1.4769    0.0000 H   0  0  0

+   -3.9633   -1.6250    0.0000 H   0  0  0

+   -2.6398   -3.1020    0.0000 H   0  0  0

+   -1.4397   -3.9529    0.0000 H   0  0  0

+   -0.5888   -2.7528    0.0000 H   0  0  0

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+    0.4412    0.6423    0.0000 H   0  0  0

+    2.3703   -1.2993    0.0000 H   0  0  0

+    3.6905   -0.8790    0.0000 H   0  0  0

+    4.1421    1.8206    0.0000 H   0  0  0

+    2.8219    1.4003    0.0000 H   0  0  0

+    6.9133    2.0215    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  4  8  1  0

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+ 10 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+70786-65-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.3369   -0.1327   -0.2728 C   0  0  0

+   -1.0394   -0.0341   -0.5054 N   0  0  0

+    1.0507    0.9772    0.1592 C   0  0  0

+    0.9908   -1.3424   -0.4681 C   0  0  0

+   -1.9113   -0.2996    0.4875 C   0  0  0

+   -1.5161    0.3446   -1.7838 O   0  0  0

+    2.4093    0.8766    0.3878 C   0  0  0

+    0.3442    2.2902    0.3780 C   0  0  0

+    2.3491   -1.4364   -0.2378 C   0  0  0

+   -3.3935   -0.1934    0.2370 C   0  0  0

+   -1.5030   -0.6239    1.5825 O   0  0  0

+    3.0583   -0.3276    0.1869 C   0  0  0

+    0.4377   -2.2012    0.0000 H   0  0  0

+   -2.3159    0.9800    0.0000 H   0  0  0

+    2.9650    1.7337    0.0000 H   0  0  0

+    1.2437    2.7742    0.0000 H   0  0  0

+   -0.1398    3.1897    0.0000 H   0  0  0

+   -0.5553    1.8062    0.0000 H   0  0  0

+    2.8084   -2.3488    0.0000 H   0  0  0

+   -3.3205    0.8254    0.0000 H   0  0  0

+   -4.4123   -0.1204    0.0000 H   0  0  0

+   -3.4665   -1.2122    0.0000 H   0  0  0

+    4.0790   -0.3658    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-28-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -2.6683   -0.2219    0.3815 C   0  0  0

+   -3.6905    0.4929   -0.2397 C   0  0  0

+   -1.3789    0.3200    0.4587 N   0  0  0

+   -2.9323   -1.4689    0.9282 C   0  0  0

+   -4.9634   -0.0479   -0.3131 C   0  0  0

+   -3.4390    1.7186   -0.7721 O   0  0  0

+   -0.3244   -0.3817   -0.0018 C   0  0  0

+   -4.2070   -1.9991    0.8558 C   0  0  0

+   -5.2178   -1.2944    0.2293 C   0  0  0

+   -4.6689    2.1876   -1.3284 C   0  0  0

+    1.0418    0.1296    0.1938 C   0  0  0

+   -0.5018   -1.4377   -0.5792 O   0  0  0

+    2.1922   -0.5945   -0.2855 C   0  0  0

+    1.2777    1.3260    0.8389 C   0  0  0

+    3.4012   -0.0444   -0.0585 C   0  0  0

+    3.0035    1.4623    0.8041 S   0  0  0

+    4.7347   -0.5648   -0.4355 N   0  3  0

+    5.7373    0.0654   -0.1504 O   0  0  0

+    4.8295   -1.6232   -1.0308 O   0  5  0

+   -1.2871    1.2872    0.0000 H   0  0  0

+   -2.1846   -2.0893    0.0000 H   0  0  0

+   -5.7157    0.5669    0.0000 H   0  0  0

+   -4.3111   -2.9651    0.0000 H   0  0  0

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+   -4.3227    3.0954    0.0000 H   0  0  0

+   -5.5767    2.5338    0.0000 H   0  0  0

+   -5.0151    1.2798    0.0000 H   0  0  0

+    2.1268   -1.5639    0.0000 H   0  0  0

+    0.6316    2.0516    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+  7 12  2  0

+ 11 13  1  0

+ 11 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+  8  9  2  0

+ 15 16  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-31-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  9                          1 V2000

+    1.1016   -0.0927   -0.0017 C   0  0  0

+    0.0000   -0.8720   -0.0012 O   0  0  0

+    0.6721    1.3212   -0.0006 C   0  0  0

+    2.2497   -0.4862    0.0016 O   0  0  0

+   -1.1016   -0.0927    0.0001 C   0  0  0

+   -0.6721    1.3213    0.0005 C   0  0  0

+   -2.2497   -0.4861    0.0008 O   0  0  0

+    1.2748    2.1342    0.0000 H   0  0  0

+   -1.2748    2.1343    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  5  6  1  0

+  3  8  1  0

+  6  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+113826-06-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    1.0327   -0.4565   -0.0419 C   0  0  0

+   -0.4332   -1.4334   -0.0829 S   0  0  0

+    1.6452   -0.1795    1.1662 C   0  0  0

+    1.5733    0.0281   -1.2180 C   0  0  0

+   -1.5045   -0.6790    0.6916 O   0  0  0

+   -0.8617   -1.4299   -1.4377 O   0  0  0

+   -0.1457   -2.5934    0.6859 O   0  0  0

+    2.7950    0.5868    1.1984 C   0  0  0

+    2.7235    0.7946   -1.1858 C   0  0  0

+   -1.7911    0.5085   -0.0499 C   0  0  0

+    3.3326    1.0763    0.0224 C   0  0  0

+   -2.8667    1.3171    0.6783 C   0  0  1

+    4.5863    1.9118    0.0575 C   0  0  0

+   -3.1735    2.5886   -0.1156 C   0  0  0

+   -4.0194    1.4376   -0.1576 O   0  0  0

+    2.1052   -1.0091    0.0000 H   0  0  0

+    0.9922    0.7779    0.0000 H   0  0  0

+    3.3790   -0.1607    0.0000 H   0  0  0

+    2.2600    1.6222    0.0000 H   0  0  0

+   -0.8440    0.4545    0.0000 H   0  0  0

+   -1.4651    1.3993    0.0000 H   0  0  0

+   -3.2136    0.4342    0.0000 H   0  0  0

+    5.1124    1.1224    0.0000 H   0  0  0

+    5.3757    2.4379    0.0000 H   0  0  0

+    4.0602    2.7012    0.0000 H   0  0  0

+   -2.3278    3.0184    0.0000 H   0  0  0

+   -3.7872    3.3119    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  2  7  2  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  8 11  1  0

+ 12 10  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 12 15  1  0

+  9 11  2  0

+ 14 15  1  0

+  3 16  1  0

+  4 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-75-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+    0.9549   -0.1329    0.0216 C   0  0  0

+   -0.3654   -0.8200   -0.3325 C   0  0  0

+    2.1230   -0.9786   -0.4894 C   0  0  0

+    1.0017    1.2496   -0.6322 C   0  0  0

+   -1.5336    0.0256    0.1785 C   0  0  0

+    2.9523   -1.4730    0.6975 C   0  0  0

+    1.4942    2.2346    0.3401 N   0  0  0

+   -2.8539   -0.6615   -0.1756 C   0  0  0

+   -4.0221    0.1841    0.3354 C   0  0  0

+    1.9264    0.3426    0.0000 H   0  0  0

+   -1.1271   -1.5879    0.0000 H   0  0  0

+    0.2759   -1.6910    0.0000 H   0  0  0

+    1.1492   -1.4493    0.0000 H   0  0  0

+    2.0758   -2.0592    0.0000 H   0  0  0

+    0.2830    2.0579    0.0000 H   0  0  0

+   -0.0156    0.8823    0.0000 H   0  0  0

+   -0.7719    0.7935    0.0000 H   0  0  0

+   -2.1749    0.8966    0.0000 H   0  0  0

+    2.3984   -2.4020    0.0000 H   0  0  0

+    3.8813   -2.0269    0.0000 H   0  0  0

+    3.5062   -0.5440    0.0000 H   0  0  0

+    2.5738    2.2994    0.0000 H   0  0  0

+    0.8983    3.1372    0.0000 H   0  0  0

+   -3.6156   -1.4294    0.0000 H   0  0  0

+   -2.2126   -1.5325    0.0000 H   0  0  0

+   -3.3879    1.0602    0.0000 H   0  0  0

+   -4.8982    0.8183    0.0000 H   0  0  0

+   -4.6563   -0.6920    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+  9 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119-27-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.7901    0.4162    0.0033 C   0  0  0

+   -1.1569   -0.9215    0.0017 C   0  0  0

+    0.5469    0.7648    0.0028 C   0  0  0

+   -1.8302    1.4694   -0.0005 N   0  3  0

+   -0.1795   -1.9064   -0.0005 C   0  0  0

+   -2.4712   -1.2669    0.0017 O   0  0  0

+    1.5187   -0.2184    0.0006 C   0  0  0

+   -1.5075    2.6439    0.0010 O   0  0  0

+   -3.0086    1.1616   -0.0051 O   0  5  0

+    1.1557   -1.5528   -0.0011 C   0  0  0

+   -2.5230   -2.6950   -0.0002 C   0  0  0

+    2.9503    0.1578   -0.0004 N   0  3  0

+    3.8074   -0.7076   -0.0024 O   0  0  0

+    3.2712    1.3328    0.0006 O   0  5  0

+    0.8215    1.7643    0.0000 H   0  0  0

+   -0.4511   -2.9067    0.0000 H   0  0  0

+    1.8862   -2.2882    0.0000 H   0  0  0

+   -3.5589   -2.6574    0.0000 H   0  0  0

+   -2.5606   -3.7309    0.0000 H   0  0  0

+   -1.4871   -2.7326    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+  7 10  1  0

+  3 15  1  0

+  5 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68302-57-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -0.8669    0.3515    0.3117 C   0  0  0

+   -0.7793   -1.0516    0.2513 C   0  0  0

+    0.3800    1.1193    0.5168 C   0  0  0

+   -2.0887    1.0013    0.1652 C   0  0  0

+    0.3561   -1.7246    0.4496 O   0  0  0

+   -1.8884   -1.7509    0.0038 N   0  0  0

+    1.6122    0.3305    0.2792 C   0  0  0

+    0.3932    2.2901    0.8495 O   0  0  0

+   -3.2226    0.2199   -0.0728 C   0  0  0

+    1.5018   -1.0662    0.2475 C   0  0  0

+   -3.0663   -1.1794   -0.1579 C   0  0  0

+    2.8376    0.9633    0.0896 C   0  0  0

+   -4.5474    0.8417   -0.2304 C   0  0  0

+    2.6605   -1.8078   -0.0041 C   0  0  0

+   -4.1676   -1.9662   -0.4160 N   0  0  0

+    3.9652    0.2067   -0.1480 C   0  0  0

+   -4.8067    1.6121   -1.3055 O   0  0  0

+   -5.4075    0.6604    0.6090 O   0  0  0

+    3.8671   -1.1758   -0.1977 C   0  0  0

+    5.2983    0.8788   -0.3534 C   0  0  0

+    6.2802    0.4024    0.7189 C   0  0  0

+    5.8420    0.5208   -1.7380 C   0  0  0

+   -2.1475    2.0263    0.0000 H   0  0  0

+    2.8962    1.9883    0.0000 H   0  0  0

+    2.6159   -2.8335    0.0000 H   0  0  0

+   -5.1022   -1.5411    0.0000 H   0  0  0

+   -4.0684   -2.9881    0.0000 H   0  0  0

+   -5.1342    2.5851    0.0000 H   0  0  0

+    4.7261   -1.7381    0.0000 H   0  0  0

+    5.2905    1.9054    0.0000 H   0  0  0

+    5.8320   -0.5213    0.0000 H   0  0  0

+    7.2039   -0.0458    0.0000 H   0  0  0

+    6.7284    1.3261    0.0000 H   0  0  0

+    5.2774   -0.3367    0.0000 H   0  0  0

+    6.6995   -0.0438    0.0000 H   0  0  0

+    6.4066    1.3783    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 13 17  1  0

+ 13 18  2  0

+ 14 19  2  0

+ 16 20  1  0

+ 20 21  1  0

+ 20 22  1  0

+  7 10  2  0

+  9 11  2  0

+ 16 19  1  0

+  4 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23031-38-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+    3.5308    0.2798    0.1154 C   0  0  0

+    2.2443   -0.0577   -0.6408 C   0  0  0

+    2.8279   -1.0569    0.3601 C   0  0  0

+    4.7165    0.0656   -0.7898 C   0  0  0

+    1.0847    0.6678   -0.0083 C   0  0  0

+    3.4894   -2.3164   -0.2030 C   0  0  0

+    2.0935   -1.2358    1.6903 C   0  0  0

+    5.9210    0.3702   -0.3746 C   0  0  0

+   -0.1590    0.1772   -0.1266 O   0  0  0

+    1.2747    1.6912    0.6054 O   0  0  0

+    6.1210    0.9349    1.0082 C   0  0  0

+    7.1067    0.1560   -1.2798 C   0  0  0

+   -1.2763    0.8762    0.4829 C   0  0  0

+   -2.5518    0.1234    0.2047 C   0  0  0

+   -3.6191    0.6030   -0.4545 O   0  0  0

+   -2.8123   -1.1448    0.5697 C   0  0  0

+   -4.5707   -0.3428   -0.5143 C   0  0  0

+   -4.1147   -1.4445    0.1083 C   0  0  0

+   -5.9194   -0.1958   -1.1704 C   0  0  0

+   -6.8905    0.3117   -0.1874 C   0  0  0

+   -7.6650    0.7165    0.5965 C   0  0  0

+    3.4938    1.2305    0.0000 H   0  0  0

+    1.5614   -0.7201    0.0000 H   0  0  0

+    4.7493   -0.8852    0.0000 H   0  0  0

+    2.6471   -2.7588    0.0000 H   0  0  0

+    3.9318   -3.1587    0.0000 H   0  0  0

+    4.3317   -1.8740    0.0000 H   0  0  0

+    1.8683   -0.3114    0.0000 H   0  0  0

+    1.1691   -1.4610    0.0000 H   0  0  0

+    2.3187   -2.1602    0.0000 H   0  0  0

+    7.0178    0.6173    0.0000 H   0  0  0

+    6.4386    1.8317    0.0000 H   0  0  0

+    5.2242    1.2525    0.0000 H   0  0  0

+    6.9376   -0.7803    0.0000 H   0  0  0

+    8.0430   -0.0131    0.0000 H   0  0  0

+    7.2758    1.0923    0.0000 H   0  0  0

+   -0.6500    1.5924    0.0000 H   0  0  0

+   -1.8839    1.6083    0.0000 H   0  0  0

+   -2.1317   -1.8096    0.0000 H   0  0  0

+   -4.5507   -2.2901    0.0000 H   0  0  0

+   -6.6532   -0.8014    0.0000 H   0  0  0

+   -5.6467   -1.1073    0.0000 H   0  0  0

+   -8.5082    1.1572    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+  8 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  1  0

+ 19 20  1  0

+ 20 21  3  0

+  2  3  1  0

+ 17 18  2  0

+  1 22  1  0

+  2 23  1  0

+  4 24  1  0

+  6 25  1  0

+  6 26  1  0

+  6 27  1  0

+  7 28  1  0

+  7 29  1  0

+  7 30  1  0

+ 11 31  1  0

+ 11 32  1  0

+ 11 33  1  0

+ 12 34  1  0

+ 12 35  1  0

+ 12 36  1  0

+ 13 37  1  0

+ 13 38  1  0

+ 16 39  1  0

+ 18 40  1  0

+ 19 41  1  0

+ 19 42  1  0

+ 21 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77439-76-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.0100    0.0961   -0.1163 C   0  0  0

+   -1.2320   -0.4133    0.0230 C   0  0  0

+   -0.1790    1.5567   -0.4636 C   0  0  0

+    1.2936   -0.6420    0.0477 C   0  0  0

+   -2.2292    0.6354   -0.2140 C   0  0  0

+   -1.5898   -2.0642    0.4233 Cl  0  0  0

+   -1.6136    1.7977   -0.5009 O   0  0  0

+    0.4126    2.3609    0.5588 O   0  0  0

+    2.2222   -0.5720   -1.4962 Cl  0  0  0

+    2.2574    0.1256    1.3640 Cl  0  0  0

+   -3.4331    0.4784   -0.1600 O   0  0  0

+    0.7807    1.3019    0.0000 H   0  0  0

+    1.0769   -1.6110    0.0000 H   0  0  0

+    1.0010    3.1607    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  5  7  1  0

+  3 12  1  0

+  4 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-56-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    2.2354    0.0000   -0.0005 C   0  0  0

+    0.7284    0.0000   -0.0010 C   0  0  0

+    2.7018    1.3190   -0.0036 F   0  0  0

+    2.7014   -0.6568    1.1435 F   0  0  0

+    2.7021   -0.6623   -1.1410 F   0  0  0

+    0.0376   -1.1972    0.0017 C   0  0  0

+    0.0374    1.1975    0.0017 C   0  0  0

+   -1.3447   -1.1979    0.0017 C   0  0  0

+   -1.3445    1.1981    0.0017 C   0  0  0

+   -2.0367   -0.0001   -0.0009 C   0  0  0

+   -3.7727   -0.0001   -0.0009 Cl  0  0  0

+    0.5564   -2.0950    0.0000 H   0  0  0

+    0.5562    2.0953    0.0000 H   0  0  0

+   -1.8628   -2.0961    0.0000 H   0  0  0

+   -1.8626    2.0963    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  7  9  2  0

+  8 10  2  0

+ 10 11  1  0

+  9 10  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+144-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -1.6453   -0.4000    0.0739 C   0  0  0

+   -0.6506   -1.8449    0.2400 S   0  0  0

+   -2.5414   -0.2962   -0.9740 C   0  0  0

+   -1.5320    0.6253    0.9952 C   0  0  0

+    0.7491   -1.5822   -0.6051 N   0  0  0

+   -0.2714   -1.8973    1.6084 O   0  0  0

+   -1.3391   -2.8704   -0.4626 O   0  0  0

+   -3.3226    0.8351   -1.1071 C   0  0  0

+   -2.3100    1.7590    0.8680 C   0  0  0

+    1.5789   -0.5254   -0.2611 C   0  0  0

+   -3.2073    1.8690   -0.1870 C   0  0  0

+    3.1325    0.0007   -0.9792 S   0  0  0

+    1.4464    0.3892    0.6904 N   0  0  0

+   -3.9954    3.0146   -0.3189 N   0  0  0

+    3.3894    1.3889    0.1221 C   0  0  0

+    2.3077    1.2932    0.8681 N   0  0  0

+    4.5183    2.3857    0.1766 C   0  0  0

+   -3.0419   -1.1295    0.0000 H   0  0  0

+   -0.5891    0.8617    0.0000 H   0  0  0

+    1.2533   -2.4133    0.0000 H   0  0  0

+   -4.2653    0.5978    0.0000 H   0  0  0

+   -1.8055    2.5899    0.0000 H   0  0  0

+   -3.5773    3.8922    0.0000 H   0  0  0

+   -4.9645    2.9379    0.0000 H   0  0  0

+    5.1617    1.6570    0.0000 H   0  0  0

+    5.2470    3.0291    0.0000 H   0  0  0

+    3.8749    3.1144    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  2  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  8 11  2  0

+ 10 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 12 15  1  0

+ 13 16  1  0

+ 15 17  1  0

+  9 11  1  0

+ 15 16  2  0

+  3 18  1  0

+  4 19  1  0

+  5 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 17 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+38914-96-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 48                          1 V2000

+   -3.2445    0.5072    0.3715 C   0  0  0

+   -4.1252   -0.5379    0.7147 C   0  0  0

+   -2.0592    0.2113   -0.3517 C   0  0  0

+   -3.5261    1.8366    0.7297 C   0  0  0

+   -3.7799   -1.8445    0.3167 C   0  0  0

+   -5.2852   -0.2902    1.4165 N   0  0  0

+   -1.7732   -1.0400   -0.7077 N   0  0  0

+   -1.1863    1.2659   -0.6890 C   0  0  0

+   -2.6580    2.8259    0.3848 C   0  0  0

+   -2.5757   -2.0587   -0.4047 C   0  0  0

+   -4.6098   -2.9366    0.6231 C   0  0  0

+   -6.3335   -0.0297    0.4209 C   0  0  0

+   -1.4893    2.5386   -0.3204 C   0  0  0

+   -2.2416   -3.3711   -0.7971 C   0  0  0

+   -4.2515   -4.1876    0.2258 C   0  0  0

+   -7.6562    0.2546    1.1355 C   0  0  0

+   -3.0690   -4.4024   -0.4823 C   0  0  0

+   -8.7480    0.5260    0.0986 C   0  0  0

+  -10.0179    0.7990    0.7847 N   0  0  0

+  -11.0178    1.0496   -0.2620 C   0  0  0

+  -12.3722    1.3427    0.3864 C   0  0  0

+  -13.5994    1.6504   -0.8981 Cl  0  0  0

+    9.4818    0.1844   -1.0629 O   0  0  0

+   18.1094    0.3452   -0.3290 Cl  0  0  0

+   26.7370    0.5061    0.4050 Cl  0  0  0

+   -4.4695    2.0833    0.0000 H   0  0  0

+   -5.5046   -1.2403    0.0000 H   0  0  0

+   -0.2366    1.0447    0.0000 H   0  0  0

+   -2.9506    3.7560    0.0000 H   0  0  0

+   -5.5682   -2.7568    0.0000 H   0  0  0

+   -5.6642    0.6794    0.0000 H   0  0  0

+   -6.6228    0.9015    0.0000 H   0  0  0

+   -0.7973    3.2256    0.0000 H   0  0  0

+   -1.2886   -3.5776    0.0000 H   0  0  0

+   -4.9059   -4.9104    0.0000 H   0  0  0

+   -8.3255   -0.4545    0.0000 H   0  0  0

+   -7.3669   -0.6766    0.0000 H   0  0  0

+   -2.7278   -5.3158    0.0000 H   0  0  0

+   -8.0786    1.2350    0.0000 H   0  0  0

+   -9.0373    1.4572    0.0000 H   0  0  0

+  -10.2389   -0.1507    0.0000 H   0  0  0

+  -10.3472    1.7575    0.0000 H   0  0  0

+  -11.3056    1.9812    0.0000 H   0  0  0

+  -13.0428    0.6349    0.0000 H   0  0  0

+  -12.0844    0.4111    0.0000 H   0  0  0

+    8.5067    0.1844    0.0000 H   0  0  0

+   10.4569    0.1844    0.0000 H   0  0  0

+   19.0845    0.3452    0.0000 H   0  0  0

+   27.7121    0.5061    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 14 17  2  0

+ 16 18  1  0

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+ 19 20  1  0

+ 20 21  1  0

+ 21 22  1  0

+  7 10  2  0

+  9 13  1  0

+ 15 17  1  0

+  4 26  1  0

+  6 27  1  0

+  8 28  1  0

+  9 29  1  0

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+ 18 40  1  0

+ 19 41  1  0

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+ 21 44  1  0

+ 21 45  1  0

+ 23 46  1  0

+ 23 47  1  0

+ 24 48  1  0

+ 25 49  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2080-32-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+    1.9379   -0.2203   -0.8196 S   0  0  0

+    0.2519    0.0436   -0.3811 C   0  0  0

+    2.8510    0.0610    0.5330 N   0  0  0

+    2.0553   -1.6119   -1.0821 O   0  0  0

+    2.2672    0.8192   -1.7308 O   0  0  0

+   -0.3413    1.2680   -0.6270 C   0  0  0

+   -0.4770   -0.9764    0.2030 C   0  0  0

+    3.6850    1.2625    0.6169 C   0  0  0

+    2.8249   -0.8917    1.6456 C   0  0  0

+   -1.6630    1.4780   -0.2849 C   0  0  0

+   -1.7987   -0.7729    0.5474 C   0  0  0

+    2.8614    2.4157    1.1937 C   0  0  0

+    3.8351   -2.0104    1.3830 C   0  0  0

+   -2.3960    0.4577    0.3065 C   0  0  0

+   -3.7351    0.6671    0.6543 N   0  0  0

+   -4.6927   -0.1476    0.1690 C   0  0  0

+   -6.1163   -0.0022    0.6414 C   0  0  0

+   -4.4087   -0.9979   -0.6480 O   0  0  0

+    0.2608    2.0791    0.0000 H   0  0  0

+   -0.0848   -1.9073    0.0000 H   0  0  0

+    4.4435    0.5954    0.0000 H   0  0  0

+    4.4345    1.9397    0.0000 H   0  0  0

+    1.8590   -0.5961    0.0000 H   0  0  0

+    2.2826   -1.7439    0.0000 H   0  0  0

+   -2.0518    2.4103    0.0000 H   0  0  0

+   -2.3986   -1.5856    0.0000 H   0  0  0

+    3.6834    3.0028    0.0000 H   0  0  0

+    2.2743    3.2377    0.0000 H   0  0  0

+    2.0394    1.8286    0.0000 H   0  0  0

+    3.0854   -2.6874    0.0000 H   0  0  0

+    4.5121   -2.7601    0.0000 H   0  0  0

+    4.5848   -1.3334    0.0000 H   0  0  0

+   -4.0093    1.6393    0.0000 H   0  0  0

+   -6.0137    1.0027    0.0000 H   0  0  0

+   -7.1212    0.1004    0.0000 H   0  0  0

+   -6.2189   -1.0071    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  6 10  1  0

+  7 11  2  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  2  0

+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 16 18  2  0

+ 11 14  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 15 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+533-31-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+    0.7469    0.7253   -0.0505 C   0  0  0

+    0.4642   -0.6382   -0.0606 C   0  0  0

+    2.1025    0.8898   -0.0872 O   0  0  0

+   -0.2878    1.6452   -0.0035 C   0  0  0

+   -0.8516   -1.0704   -0.0287 C   0  0  0

+    1.6414   -1.3278   -0.1037 O   0  0  0

+    2.6546   -0.3846    0.2924 C   0  0  0

+   -1.5996    1.2116    0.0336 C   0  0  0

+   -1.8840   -0.1458    0.0129 C   0  0  0

+   -3.1755   -0.5702    0.0441 O   0  0  0

+   -0.0777    2.6621    0.0000 H   0  0  0

+   -1.0645   -2.0867    0.0000 H   0  0  0

+    3.2714   -1.2199    0.0000 H   0  0  0

+    3.5545    0.1335    0.0000 H   0  0  0

+   -2.3740    1.9033    0.0000 H   0  0  0

+   -4.1620   -0.8944    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  9 10  1  0

+  6  7  1  0

+  8  9  1  0

+  4 11  1  0

+  5 12  1  0

+  7 13  1  0

+  7 14  1  0

+  8 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+203-64-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 28                          1 V2000

+    0.7152    0.0889   -0.0020 C   0  0  0

+   -0.7152    0.0889   -0.0013 C   0  0  0

+    1.2150    1.3765   -0.0005 C   0  0  0

+    1.4333   -1.1090    0.0014 C   0  0  0

+   -1.2150    1.3765    0.0007 C   0  0  0

+   -1.4333   -1.1090   -0.0021 C   0  0  0

+    0.0000    2.2797    0.0010 C   0  0  0

+    2.5730    1.4690   -0.0004 C   0  0  0

+    0.6827   -2.3058    0.0057 C   0  0  0

+    2.8254   -0.9646    0.0010 C   0  0  0

+   -2.5729    1.4691    0.0017 C   0  0  0

+   -0.6828   -2.3058   -0.0037 C   0  0  0

+   -2.8254   -0.9646   -0.0007 C   0  0  0

+    3.3455    0.3050   -0.0017 C   0  0  0

+   -3.3455    0.3050    0.0008 C   0  0  0

+    0.7038    3.0557    0.0000 H   0  0  0

+   -0.7038    3.0557    0.0000 H   0  0  0

+    3.0366    2.4085    0.0000 H   0  0  0

+    1.1898   -3.2225    0.0000 H   0  0  0

+    3.4533   -1.8032    0.0000 H   0  0  0

+   -3.0365    2.4086    0.0000 H   0  0  0

+   -1.1900   -3.2225    0.0000 H   0  0  0

+   -3.4533   -1.8032    0.0000 H   0  0  0

+    4.3880    0.4081    0.0000 H   0  0  0

+   -4.3880    0.4081    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  6 12  2  0

+  6 13  1  0

+  8 14  1  0

+ 11 15  1  0

+  5  7  1  0

+  9 12  1  0

+ 10 14  2  0

+ 13 15  2  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+765-34-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  9                          1 V2000

+   -0.3800   -0.3396   -0.6131 C   0  0  0

+   -1.5223   -0.5124    0.3900 C   0  0  0

+   -1.0422    0.7731   -0.0087 O   0  0  0

+    0.9371   -0.5771    0.0796 C   0  0  0

+    1.7667    0.2996    0.1164 O   0  0  0

+   -0.3937   -1.3106    0.0000 H   0  0  0

+   -2.4763   -0.3307    0.0000 H   0  0  0

+   -1.5408   -1.4834    0.0000 H   0  0  0

+    1.2401   -1.4998    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  2  0

+  2  3  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  4  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10143-23-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    0.8382   -0.3179   -0.2454 C   0  0  0

+   -0.6113   -0.3732    0.2410 C   0  0  0

+    1.5016    0.9597    0.2728 C   0  0  0

+    1.5993   -1.5368    0.2799 C   0  0  0

+   -1.3723    0.8458   -0.2842 C   0  0  0

+   -1.2748   -1.6507   -0.2772 C   0  0  0

+    2.9512    1.0150   -0.2136 C   0  0  0

+   -2.7262    0.7942    0.1701 O   0  0  0

+    1.9170   -0.2751    0.0000 H   0  0  0

+   -1.6901   -0.4159    0.0000 H   0  0  0

+    1.6461    2.0296    0.0000 H   0  0  0

+    0.4723    1.2855    0.0000 H   0  0  0

+    0.6835   -2.1086    0.0000 H   0  0  0

+    2.1711   -2.4526    0.0000 H   0  0  0

+    2.5151   -0.9650    0.0000 H   0  0  0

+   -0.3716    1.2510    0.0000 H   0  0  0

+   -1.5989    1.9014    0.0000 H   0  0  0

+   -2.2329   -1.1531    0.0000 H   0  0  0

+   -1.7724   -2.6088    0.0000 H   0  0  0

+   -0.3167   -2.1483    0.0000 H   0  0  0

+    2.9924   -0.0639    0.0000 H   0  0  0

+    4.0301    1.0562    0.0000 H   0  0  0

+    2.9100    2.0939    0.0000 H   0  0  0

+   -3.8051    0.7531    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  1  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-14-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -3.1542    0.1805    0.0532 C   0  0  0

+   -3.2978   -1.1433    0.4516 C   0  0  0

+   -2.0868    0.5482   -0.7441 C   0  0  0

+   -4.3179    1.3690    0.5502 Cl  0  0  0

+   -2.3676   -2.0917    0.0468 C   0  0  0

+   -4.3755   -1.5190    1.2581 N   0  0  0

+   -1.1629   -0.3993   -1.1449 C   0  0  0

+   -1.3033   -1.7171   -0.7499 C   0  0  0

+   -0.0002    0.0051   -2.0141 C   0  0  0

+    1.1628    0.4052   -1.1433 C   0  0  0

+    2.0868   -0.5443   -0.7476 C   0  0  0

+    1.3065    1.7221   -0.7464 C   0  0  0

+    3.1548   -0.1805    0.0507 C   0  0  0

+    2.3713    2.0928    0.0513 C   0  0  0

+    3.2988    1.1413    0.4554 C   0  0  0

+    4.3144   -1.3730    0.5477 Cl  0  0  0

+    4.3773    1.5131    1.2626 N   0  0  0

+   -1.8574    1.5144    0.0000 H   0  0  0

+   -2.5924   -3.0590    0.0000 H   0  0  0

+   -5.1274   -0.8704    0.0000 H   0  0  0

+   -4.5613   -2.4945    0.0000 H   0  0  0

+   -0.5245   -2.3332    0.0000 H   0  0  0

+    0.1884    0.9801    0.0000 H   0  0  0

+   -0.7509    0.6551    0.0000 H   0  0  0

+    1.8552   -1.5100    0.0000 H   0  0  0

+    0.5295    2.3405    0.0000 H   0  0  0

+    2.5992    3.0593    0.0000 H   0  0  0

+    5.1270    0.8619    0.0000 H   0  0  0

+    4.5664    2.4880    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

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+ 15 17  1  0

+  7  8  1  0

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+  3 18  1  0

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+  6 21  1  0

+  8 22  1  0

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+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1918-13-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.0000    0.1915    0.1211 C   0  0  0

+   -1.2082    0.8840   -0.0002 C   0  0  0

+    1.2091    0.8832   -0.0002 C   0  0  0

+   -0.0006   -1.2603    0.3818 C   0  0  0

+   -1.1992    2.2442   -0.2386 C   0  0  0

+   -2.7159    0.0365    0.1491 Cl  0  0  0

+    1.2012    2.2430   -0.2386 C   0  0  0

+    2.7161    0.0344    0.1490 Cl  0  0  0

+   -0.0005   -1.7172    1.6498 N   0  0  0

+   -0.0013   -2.3648   -0.9262 S   0  0  0

+    0.0011    2.9212   -0.3574 C   0  0  0

+   -2.0902    2.7686    0.0000 H   0  0  0

+    2.0926    2.7666    0.0000 H   0  0  0

+   -0.8957   -2.2343    0.0000 H   0  0  0

+    0.8950   -2.2339    0.0000 H   0  0  0

+    0.0015    3.9551    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  7 11  1  0

+  5 12  1  0

+  7 13  1  0

+  9 14  1  0

+  9 15  1  0

+ 11 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3237-50-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.0095    0.0000    0.0000 C   0  0  0

+   -0.2081   -1.2881   -0.0002 C   0  0  0

+   -0.2081    1.2881    0.0002 C   0  0  0

+   -1.8512    0.0002   -1.1548 O   0  0  0

+   -1.8513   -0.0002    1.1547 O   0  0  0

+    1.1379   -1.1855   -0.0001 N   0  0  0

+   -0.7562   -2.3695    0.0001 O   0  0  0

+    1.1379    1.1855    0.0002 N   0  0  0

+   -0.7562    2.3695   -0.0001 O   0  0  0

+    1.7580    0.0000    0.0000 C   0  0  0

+    2.9728    0.0000    0.0000 O   0  0  0

+   -2.8546    0.0004    0.0000 H   0  0  0

+   -2.8547   -0.0004    0.0000 H   0  0  0

+    1.6899   -2.0235    0.0000 H   0  0  0

+    1.6899    2.0235    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  3  9  2  0

+  6 10  1  0

+ 10 11  2  0

+  8 10  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+584-08-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  5                          1 V2000

+   -7.9635    0.0354    0.0556 C   0  0  0

+   -8.7330   -0.9140    0.5935 O   0  0  0

+   -6.8716   -0.3020   -0.6350 O   0  0  0

+   -8.2889    1.3219    0.2036 O   0  0  0

+    1.7869   -0.1185   -0.2349 K   0  3  0

+   10.4366    0.0643    0.1515 K   0  3  0

+   -5.9959   -0.5726    0.0000 H   0  0  0

+   -8.5137    2.2105    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  3  7  1  0

+  4  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3101-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    3.5729    0.3832   -0.0531 C   0  0  0

+    2.1174   -0.0045   -0.0057 C   0  0  0

+    3.6984    1.9054    0.0375 C   0  0  0

+    4.3106   -0.2602    1.1228 C   0  0  0

+    4.1873   -0.1018   -1.3676 C   0  0  0

+    1.7556   -1.3375   -0.0725 C   0  0  0

+    1.1464    0.9727    0.1103 C   0  0  0

+    0.4223   -1.6955   -0.0289 C   0  0  0

+   -0.1887    0.6198    0.1544 C   0  0  0

+   -0.5545   -0.7163    0.0822 C   0  0  0

+   -1.8670   -1.0659    0.1254 O   0  0  0

+   -2.6140    0.1469    0.2399 C   0  0  0

+   -4.1082   -0.1776    0.2937 C   0  0  0

+   -4.9080    1.1210    0.4163 C   0  0  0

+   -4.7667    0.4236   -0.8230 O   0  0  0

+    4.7307    1.8203    0.0000 H   0  0  0

+    3.7835    2.9377    0.0000 H   0  0  0

+    2.6661    1.9905    0.0000 H   0  0  0

+    3.6298   -1.0408    0.0000 H   0  0  0

+    5.0912   -0.9410    0.0000 H   0  0  0

+    4.9914    0.5204    0.0000 H   0  0  0

+    3.5455   -0.9148    0.0000 H   0  0  0

+    5.0003   -0.7436    0.0000 H   0  0  0

+    4.8291    0.7112    0.0000 H   0  0  0

+    2.4870   -2.0709    0.0000 H   0  0  0

+    1.4178    1.9723    0.0000 H   0  0  0

+    0.1539   -2.6959    0.0000 H   0  0  0

+   -0.9179    1.3555    0.0000 H   0  0  0

+   -1.6765    0.5875    0.0000 H   0  0  0

+   -2.9463    1.1280    0.0000 H   0  0  0

+   -4.3775   -1.1778    0.0000 H   0  0  0

+   -4.3125    1.9685    0.0000 H   0  0  0

+   -5.9218    1.3332    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  6  8  2  0

+  7  9  1  0

+  8 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 13 15  1  0

+  9 10  2  0

+ 14 15  1  0

+  3 16  1  0

+  3 17  1  0

+  3 18  1  0

+  4 19  1  0

+  4 20  1  0

+  4 21  1  0

+  5 22  1  0

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+  6 25  1  0

+  7 26  1  0

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+  9 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 14 32  1  0

+ 14 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75965-74-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.5335    0.0288    0.0023 C   0  0  0

+   -0.9199   -0.0846    0.0014 C   0  0  0

+    1.1221    1.2964    0.0008 C   0  0  0

+    1.6402   -0.9256   -0.0012 C   0  0  0

+   -1.6909    1.1037   -0.0010 C   0  0  0

+   -1.5618   -1.3277    0.0024 C   0  0  0

+    2.4587    1.1158    0.0017 O   0  0  0

+    0.3133    2.4387   -0.0015 C   0  0  0

+    2.7656   -0.1920    0.0016 C   0  0  0

+   -3.0915    1.0137   -0.0019 C   0  0  0

+   -1.0396    2.3528   -0.0020 C   0  0  0

+   -2.9228   -1.3902    0.0011 C   0  0  0

+    4.1398   -0.7430   -0.0004 N   0  3  0

+   -3.6926   -0.2248   -0.0004 C   0  0  0

+    5.0976    0.0095    0.0025 O   0  0  0

+    4.3126   -1.9486   -0.0048 O   0  5  0

+   -5.0488   -0.3144   -0.0009 O   0  0  0

+   -5.3708   -1.7066    0.0009 C   0  0  0

+    1.5701   -1.9711    0.0000 H   0  0  0

+   -0.9963   -2.2099    0.0000 H   0  0  0

+    0.7650    3.3842    0.0000 H   0  0  0

+   -3.6758    1.8835    0.0000 H   0  0  0

+   -1.6110    3.2311    0.0000 H   0  0  0

+   -3.3979   -2.3242    0.0000 H   0  0  0

+   -6.3917   -1.4705    0.0000 H   0  0  0

+   -5.6069   -2.7275    0.0000 H   0  0  0

+   -4.3499   -1.9427    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  9 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 13 16  1  0

+ 14 17  1  0

+ 17 18  1  0

+  7  9  1  0

+  8 11  2  0

+ 12 14  1  0

+  4 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 18 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-88-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+   -0.4928    0.2259    0.0029 C   0  0  0

+    0.5644   -0.8481    0.0027 C   0  0  0

+   -0.1433    1.4901    0.0005 C   0  0  0

+   -2.1731   -0.2101   -0.0011 Cl  0  0  0

+    2.1974   -0.0839   -0.0010 Cl  0  0  0

+   -0.3932   -1.5978    0.0000 H   0  0  0

+    1.2011   -1.8843    0.0000 H   0  0  0

+    1.0338    1.7955    0.0000 H   0  0  0

+   -0.9964    2.3568    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5598-53-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 15                          1 V2000

+   -3.8367   -0.8615   -0.7026 C   0  0  1

+   -5.2974   -0.5587   -0.3625 C   0  0  0

+   -2.9594   -0.4726    0.4593 C   0  0  0

+   -3.6843   -2.2975   -0.9722 N   0  0  0

+   -5.4844    0.9310   -0.2322 C   0  0  0

+   -2.8983   -1.1917    1.4472 O   0  0  0

+   -2.3083    0.5623    0.4148 O   0  0  0

+   -6.5483    1.3810    0.1707 O   0  0  0

+   -4.5722    1.6904   -0.5293 O   0  0  0

+    7.0725   -0.0564    0.1862 Na  0  3  0

+   15.7183    0.2593   -0.2023 Na  0  3  0

+   -3.9327    0.0370    0.0000 H   0  0  0

+   -6.2009   -0.5724    0.0000 H   0  0  0

+   -5.3828   -1.4583    0.0000 H   0  0  0

+   -4.4148   -2.8294    0.0000 H   0  0  0

+   -2.8584   -2.6642    0.0000 H   0  0  0

+   -1.8271    1.3271    0.0000 H   0  0  0

+   -3.8777    2.2685    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  5  8  2  0

+  5  9  1  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  4 15  1  0

+  4 16  1  0

+  7 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4655-34-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.5254   -0.3232   -0.1182 C   0  0  0

+   -0.5643    0.4627   -0.0096 O   0  0  0

+    1.8666    0.2527    0.0521 C   0  0  0

+    0.3985   -1.5091   -0.3520 O   0  0  0

+   -1.8895   -0.1063   -0.1779 C   0  0  0

+    2.0237    1.7219    0.3481 C   0  0  0

+    2.9425   -0.5233   -0.0551 C   0  0  0

+   -2.4150   -0.5846    1.1771 C   0  0  0

+   -2.8329    0.9568   -0.7443 C   0  0  0

+   -1.3283   -0.9781    0.0000 H   0  0  0

+    3.0546    1.6117    0.0000 H   0  0  0

+    2.1339    2.7528    0.0000 H   0  0  0

+    0.9928    1.8321    0.0000 H   0  0  0

+    2.8377   -1.5548    0.0000 H   0  0  0

+    3.8882   -0.0983    0.0000 H   0  0  0

+   -3.1129    0.1822    0.0000 H   0  0  0

+   -3.1818   -1.2825    0.0000 H   0  0  0

+   -1.7171   -1.3514    0.0000 H   0  0  0

+   -2.0574    1.6450    0.0000 H   0  0  0

+   -3.5211    1.7323    0.0000 H   0  0  0

+   -3.6084    0.2686    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58957-92-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 63 67                          1 V2000

+    0.1441   -0.7548   -0.0177 C   0  0  0

+   -0.4953   -1.8673    0.4676 C   0  0  0

+    1.6320   -0.7125   -0.2543 C   0  0  2

+   -0.5890    0.4007   -0.3201 C   0  0  0

+   -1.8837   -1.8522    0.6586 C   0  0  0

+    0.2393   -3.1347    0.8224 C   0  0  0

+    2.3305   -1.8380    0.5054 C   0  0  0

+    2.1441    0.5449    0.1913 O   0  0  0

+   -1.9699    0.4317   -0.1361 C   0  0  0

+    0.0509    1.4979   -0.7950 O   0  0  0

+   -2.6270   -0.7111    0.3633 C   0  0  0

+   -2.5089   -2.9572    1.1350 O   0  0  0

+    1.6213   -3.1562    0.1733 C   0  0  2

+    3.0796    0.9832   -0.7960 C   0  0  1

+   -2.7402    1.6462   -0.4548 C   0  0  0

+   -4.0861   -0.6942    0.5647 C   0  0  0

+    1.4786   -3.2938   -1.3206 C   0  0  0

+    2.3779   -4.2539    0.6878 O   0  0  0

+    3.1453    2.5122   -0.7933 C   0  0  0

+    4.3672    0.4438   -0.5036 O   0  0  0

+   -4.2047    1.6624   -0.2565 C   0  0  0

+   -2.1723    2.6333   -0.8804 O   0  0  0

+   -4.8595    0.5245    0.2468 C   0  0  0

+   -4.6533   -1.6813    0.9913 O   0  0  0

+    2.6262   -3.8227   -2.1416 C   0  0  0

+    0.4445   -2.9802   -1.8598 O   0  0  0

+    3.5686    2.9914    0.5998 C   0  0  1

+    4.6744    0.7700    0.8505 C   0  0  2

+   -4.9409    2.8053   -0.5567 C   0  0  0

+   -6.2388    0.5497    0.4340 C   0  0  0

+    4.8706    2.2815    0.9880 C   0  0  1

+    3.7922    4.4430    0.5713 N   0  0  0

+    5.9568    0.0489    1.2704 C   0  0  0

+   -6.3113    2.8119   -0.3678 C   0  0  0

+   -6.9546    1.6948    0.1338 C   0  0  0

+    5.9222    2.7063    0.1186 O   0  0  0

+    2.6489   -0.6265    0.0000 H   0  0  0

+   -0.7211   -3.4798    0.0000 H   0  0  0

+    0.4066   -4.1414    0.0000 H   0  0  0

+    3.1320   -2.4697    0.0000 H   0  0  0

+    3.0914   -1.1579    0.0000 H   0  0  0

+    0.5650    2.3794    0.0000 H   0  0  0

+   -3.0114   -3.8454    0.0000 H   0  0  0

+    3.1007   -0.0371    0.0000 H   0  0  0

+    2.9570   -5.0941    0.0000 H   0  0  0

+    2.6114    3.3819    0.0000 H   0  0  0

+    2.1575    2.2560    0.0000 H   0  0  0

+    2.1991   -4.7495    0.0000 H   0  0  0

+    3.5530   -4.2498    0.0000 H   0  0  0

+    3.0533   -2.8959    0.0000 H   0  0  0

+    2.6445    3.4244    0.0000 H   0  0  0

+    3.7521    1.2067    0.0000 H   0  0  0

+   -4.4501    3.7000    0.0000 H   0  0  0

+   -6.7416   -0.3383    0.0000 H   0  0  0

+    4.9294    3.3003    0.0000 H   0  0  0

+    4.7434    4.8128    0.0000 H   0  0  0

+    2.9964    5.0818    0.0000 H   0  0  0

+    5.4566   -0.8406    0.0000 H   0  0  0

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+   -7.9749    1.6763    0.0000 H   0  0  0

+    6.8684    3.0885    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+ 21 23  2  0

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+ 33 58  1  0

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+ 33 60  1  0

+ 34 61  1  0

+ 35 62  1  0

+ 36 63  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10353-53-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.3159   -0.0889   -0.5638 C   0  0  0

+   -2.4902   -0.7860    0.1260 C   0  0  0

+   -2.2919    0.6275    0.1953 O   0  0  0

+   -0.0499   -0.2713    0.2758 C   0  0  0

+    1.1244    0.4258   -0.4141 C   0  0  0

+    2.3713    0.2461    0.4130 C   0  0  0

+    3.4137   -0.3616   -0.0971 C   0  0  0

+   -0.9528    0.7990    0.0000 H   0  0  0

+   -3.4460   -0.8681    0.0000 H   0  0  0

+   -2.1969   -1.6994    0.0000 H   0  0  0

+   -0.4589   -1.1391    0.0000 H   0  0  0

+    0.6600   -0.9165    0.0000 H   0  0  0

+    1.5334    1.2935    0.0000 H   0  0  0

+    0.4145    1.0711    0.0000 H   0  0  0

+    2.6871    1.1519    0.0000 H   0  0  0

+    3.4097   -1.3209    0.0000 H   0  0  0

+    4.2465    0.1145    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  2  0

+  2  3  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78533-30-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.3472    0.9534   -0.1591 C   0  0  0

+   -0.6171    0.0216   -0.5049 C   0  0  0

+    1.7786    0.6371   -0.2709 C   0  0  0

+   -0.0420    2.2804    0.3214 C   0  0  0

+   -1.9710    0.3513   -0.3879 C   0  0  0

+   -0.2096   -1.3403   -1.0052 C   0  0  0

+    2.7305    1.6132    0.0911 C   0  0  0

+    2.2050   -0.6109   -0.7281 C   0  0  0

+   -1.3863    2.6161    0.4339 C   0  0  0

+    0.9980    3.2438    0.6793 C   0  0  0

+   -2.3635    1.6759    0.0983 C   0  0  0

+   -2.9791   -0.5715   -0.7312 C   0  0  0

+   -0.0374   -2.5729    0.5167 Br  0  0  0

+    2.3010    2.9225    0.5720 C   0  0  0

+    4.0953    1.3103   -0.0162 C   0  0  0

+    3.5521   -0.8784   -0.8219 C   0  0  0

+   -3.7360    1.9798    0.2053 C   0  0  0

+   -4.2846   -0.2158   -0.6050 C   0  0  0

+    4.4886    0.0838   -0.4661 C   0  0  0

+   -4.6585    1.0447   -0.1422 C   0  0  0

+    0.7587   -1.6765    0.0000 H   0  0  0

+    0.5308   -0.6314    0.0000 H   0  0  0

+    1.5301   -1.3823    0.0000 H   0  0  0

+   -1.6505    3.6065    0.0000 H   0  0  0

+    0.7417    4.2363    0.0000 H   0  0  0

+   -2.7378   -1.5677    0.0000 H   0  0  0

+    2.9980    3.6740    0.0000 H   0  0  0

+    4.7860    2.0676    0.0000 H   0  0  0

+    3.8564   -1.8572    0.0000 H   0  0  0

+   -4.0263    2.9628    0.0000 H   0  0  0

+   -5.0012   -0.9486    0.0000 H   0  0  0

+    5.4864   -0.1507    0.0000 H   0  0  0

+   -5.6529    1.2934    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

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+  6 13  1  0

+  7 14  1  0

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+  8 16  2  0

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+ 15 19  2  0

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+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+132929-89-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.5950   -0.6433   -0.0479 C   0  0  0

+   -0.8019   -0.8052   -0.0162 C   0  0  0

+    1.1514    0.6565   -0.0862 C   0  0  0

+    1.4353   -1.7810   -0.0471 C   0  0  0

+   -1.6430    0.3308   -0.0214 C   0  0  0

+   -1.3597   -2.1040    0.0202 C   0  0  0

+    2.5359    0.8032   -0.1187 C   0  0  0

+    0.2573    1.8115   -0.0902 C   0  0  0

+    2.8180   -1.6085   -0.0777 C   0  0  0

+    0.8303   -3.1102   -0.0147 C   0  0  0

+   -3.0292    0.1479    0.0104 C   0  0  0

+   -1.0822    1.6309   -0.0593 C   0  0  0

+   -0.5148   -3.2409    0.0258 C   0  0  0

+   -2.7505   -2.2432    0.0509 C   0  0  0

+    3.3594   -0.3244   -0.1105 C   0  0  0

+    3.1595    2.1736   -0.1646 C   0  0  0

+   -3.5613   -1.1254    0.0459 C   0  0  0

+   -3.9290    1.3237    0.0066 N   0  3  0

+    4.8271   -0.1367   -0.1435 C   0  0  0

+    4.4660    2.1752    0.6264 C   0  0  0

+   -4.8483    1.3896    0.8028 O   0  0  0

+   -3.7498    2.2250   -0.7928 O   0  5  0

+    5.3452    1.0336    0.1974 C   0  0  0

+    0.6550    2.7818    0.0000 H   0  0  0

+    3.4509   -2.4446    0.0000 H   0  0  0

+    1.4398   -3.9635    0.0000 H   0  0  0

+   -1.7158    2.4665    0.0000 H   0  0  0

+   -0.9399   -4.1995    0.0000 H   0  0  0

+   -3.1798   -3.2000    0.0000 H   0  0  0

+    3.3074    3.2118    0.0000 H   0  0  0

+    2.1529    2.4677    0.0000 H   0  0  0

+   -4.6029   -1.2466    0.0000 H   0  0  0

+    5.4539   -0.9774    0.0000 H   0  0  0

+    5.4157    2.6199    0.0000 H   0  0  0

+    4.2376    3.1987    0.0000 H   0  0  0

+    6.3864    1.1589    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

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+ 11 17  2  0

+ 11 18  1  0

+ 15 19  1  0

+ 16 20  1  0

+ 18 21  2  0

+ 18 22  1  0

+ 19 23  2  0

+  8 12  2  0

+  9 15  1  0

+ 10 13  2  0

+ 14 17  1  0

+ 20 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+25074-67-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 23                          1 V2000

+   -0.2268   -0.6070   -0.0009 C   0  0  0

+   -1.6992   -0.5130   -0.0006 C   0  0  0

+    0.2378    0.7155    0.0003 C   0  0  0

+    0.6741   -1.6668    0.0029 C   0  0  0

+   -1.9920    0.8578    0.0008 C   0  0  0

+   -2.7278   -1.4492   -0.0013 C   0  0  0

+   -0.8287    1.5452    0.0013 O   0  0  0

+    1.6071    0.9530    0.0003 C   0  0  0

+    2.0293   -1.4129    0.0018 C   0  0  0

+   -3.3202    1.2671    0.0006 C   0  0  0

+   -4.0397   -1.0242   -0.0007 C   0  0  0

+    2.4926   -0.1055   -0.0009 C   0  0  0

+   -4.3322    0.3304   -0.0011 C   0  0  0

+    4.2012    0.2020   -0.0009 Cl  0  0  0

+    0.3263   -2.6483    0.0000 H   0  0  0

+   -2.5081   -2.4671    0.0000 H   0  0  0

+    1.9653    1.9307    0.0000 H   0  0  0

+    2.7063   -2.2041    0.0000 H   0  0  0

+   -3.5514    2.2824    0.0000 H   0  0  0

+   -4.8121   -1.7226    0.0000 H   0  0  0

+   -5.3252    0.6438    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

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+  9 12  1  0

+ 11 13  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4238-71-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    0.3147   -0.0512   -1.4434 C   0  0  0

+   -0.9655   -0.0205   -0.6489 C   0  0  0

+    1.4582   -0.0365   -0.5277 N   0  0  0

+   -1.5431    1.1901   -0.3155 C   0  0  0

+   -1.5652   -1.2034   -0.2583 C   0  0  0

+    2.0834   -1.1297    0.0085 C   0  0  0

+    2.0959    1.0580   -0.0596 C   0  0  0

+   -2.7175    1.2183    0.4134 C   0  0  0

+   -2.7393   -1.1752    0.4704 C   0  0  0

+    3.0776   -0.6659    0.7895 C   0  0  0

+    3.0621    0.6739    0.7291 N   0  0  0

+   -3.3140    0.0359    0.8088 C   0  0  0

+   -0.1699   -0.8683    0.0000 H   0  0  0

+    0.7902   -0.8737    0.0000 H   0  0  0

+   -1.0266    1.9875    0.0000 H   0  0  0

+   -1.0777   -2.0189    0.0000 H   0  0  0

+    1.7959   -2.0352    0.0000 H   0  0  0

+    1.7859    1.9560    0.0000 H   0  0  0

+   -3.2058    2.0333    0.0000 H   0  0  0

+   -3.2567   -1.9720    0.0000 H   0  0  0

+    3.8818   -1.1716    0.0000 H   0  0  0

+   -4.2640    0.0474    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  2  0

+  5  2  1  0

+  6  3  1  0

+  7  3  1  0

+  8  4  1  0

+  9  5  2  0

+ 10  6  2  0

+ 11  7  2  0

+ 12  8  2  0

+ 10 11  1  0

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+  1 13  1  0

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+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7786-61-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.9870   -0.3353   -0.0029 C   0  0  0

+   -0.2503   -0.9527   -0.0032 C   0  0  0

+    1.0714    1.0549   -0.0004 C   0  0  0

+    2.1214   -1.0854    0.0005 O   0  0  0

+   -1.4124   -0.1800   -0.0009 C   0  0  0

+   -0.0837    1.8227    0.0014 C   0  0  0

+    2.2886    1.6607   -0.0001 O   0  0  0

+    1.7113   -2.4543    0.0032 C   0  0  0

+   -1.3209    1.2127    0.0016 C   0  0  0

+   -2.7371   -0.8349   -0.0007 C   0  0  0

+   -3.8404   -0.0994    0.0014 C   0  0  0

+   -0.3147   -1.9910    0.0000 H   0  0  0

+   -0.0169    2.8608    0.0000 H   0  0  0

+    3.2199    2.1242    0.0000 H   0  0  0

+    0.7148   -2.1558    0.0000 H   0  0  0

+    1.4128   -3.4508    0.0000 H   0  0  0

+    2.7078   -2.7528    0.0000 H   0  0  0

+   -2.1858    1.7907    0.0000 H   0  0  0

+   -2.8041   -1.8730    0.0000 H   0  0  0

+   -3.7735    0.9387    0.0000 H   0  0  0

+   -4.7729   -0.5605    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100924-64-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -0.9737    0.6036   -0.0093 C   0  0  0

+   -2.3594    0.3568    0.0068 C   0  0  0

+   -0.5114    1.9928   -0.0087 C   0  0  0

+   -0.0635   -0.4678   -0.0198 C   0  0  0

+   -2.8215   -1.0324    0.0068 C   0  0  0

+   -3.2693    1.4284    0.0230 C   0  0  0

+   -1.4720    3.0306    0.0078 C   0  0  0

+    0.8500    2.3092   -0.0236 C   0  0  0

+   -0.4854   -1.7530   -0.0139 C   0  0  0

+    1.4153   -0.1780   -0.0375 C   0  0  0

+   -1.8607   -2.0701   -0.0096 C   0  0  0

+   -4.1828   -1.3493    0.0231 C   0  0  0

+   -2.8471    2.7136    0.0239 C   0  0  0

+   -1.0369    4.3649    0.0086 C   0  0  0

+    1.2397    3.6171   -0.0220 C   0  0  0

+    2.1417   -1.4086   -0.0458 O   0  0  0

+   -2.2954   -3.4045   -0.0095 C   0  0  0

+   -4.5721   -2.6573    0.0230 C   0  0  0

+    0.2978    4.6407   -0.0065 C   0  0  0

+    3.6199   -1.0466   -0.0635 S   0  0  0

+   -3.6301   -3.6807    0.0061 C   0  0  0

+    4.0792   -0.9380    1.3835 O   0  0  0

+    4.2889   -2.1813   -0.5967 O   0  0  0

+    3.6885    0.2713   -0.5903 O   0  0  0

+   -4.3023    1.2262    0.0000 H   0  0  0

+    1.5711    1.5425    0.0000 H   0  0  0

+    0.2244   -2.5302    0.0000 H   0  0  0

+    2.3764    0.2512    0.0000 H   0  0  0

+    1.0975    0.8254    0.0000 H   0  0  0

+   -4.9042   -0.5828    0.0000 H   0  0  0

+   -3.5568    3.4909    0.0000 H   0  0  0

+   -1.7386    5.1495    0.0000 H   0  0  0

+    2.2652    3.8541    0.0000 H   0  0  0

+   -1.5935   -4.1889    0.0000 H   0  0  0

+   -5.5976   -2.8946    0.0000 H   0  0  0

+    0.6205    5.6426    0.0000 H   0  0  0

+   -3.9526   -4.6827    0.0000 H   0  0  0

+    5.1035   -0.6958    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+ 20 22  1  0

+ 20 23  2  0

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+  7 13  1  0

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+ 15 19  1  0

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+  6 25  1  0

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+ 15 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2425-85-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+    2.7924   -0.5387   -0.0003 C   0  0  0

+    1.6468    0.2333   -0.4807 C   0  0  0

+    4.0466    0.1059    0.1287 C   0  0  0

+    2.6716   -1.8913    0.3373 C   0  0  0

+    0.4262   -0.3478   -0.6181 N   0  0  0

+    1.8353    1.5820   -0.7948 C   0  0  0

+    4.1647    1.4672   -0.2046 C   0  0  0

+    5.1514   -0.6298    0.5897 C   0  0  0

+    3.7643   -2.5755    0.7819 C   0  0  0

+   -0.6187    0.2208   -0.1191 N   0  0  0

+    3.0906    2.1708   -0.6507 C   0  0  0

+    0.7907    2.3224   -1.2430 O   0  0  0

+    5.0004   -1.9463    0.9043 C   0  0  0

+   -1.8299   -0.4101   -0.1701 C   0  0  0

+   -2.9832    0.2479    0.2659 C   0  0  0

+   -1.9222   -1.7145   -0.6641 C   0  0  0

+   -4.2022   -0.3951    0.2109 C   0  0  0

+   -2.8967    1.6311    0.7858 N   0  3  0

+   -3.1478   -2.3444   -0.7129 C   0  0  0

+   -4.2849   -1.6883   -0.2744 C   0  0  0

+   -3.9129    2.2404    1.0678 O   0  0  0

+   -1.8092    2.1600    0.9317 O   0  5  0

+   -5.6206   -2.3839   -0.3307 C   0  0  0

+    1.7636   -2.3425    0.0000 H   0  0  0

+    5.0767    1.9102    0.0000 H   0  0  0

+    6.0711   -0.2029    0.0000 H   0  0  0

+    3.7194   -3.5884    0.0000 H   0  0  0

+    3.1622    3.1822    0.0000 H   0  0  0

+   -0.0365    2.9087    0.0000 H   0  0  0

+    5.8331   -2.5247    0.0000 H   0  0  0

+   -1.0760   -2.2730    0.0000 H   0  0  0

+   -5.0533    0.1560    0.0000 H   0  0  0

+   -3.1724   -3.3580    0.0000 H   0  0  0

+   -6.0889   -1.4846    0.0000 H   0  0  0

+   -6.5199   -2.8522    0.0000 H   0  0  0

+   -5.1523   -3.2832    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

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+ 20 23  1  0

+  7 11  1  0

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+ 16 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 23 34  1  0

+ 23 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1120-21-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 34                          1 V2000

+    0.0000   -0.4818    0.0000 C   0  0  0

+   -1.2492    0.4015    0.0000 C   0  0  0

+    1.2492    0.4015    0.0000 C   0  0  0

+   -2.4985   -0.4818    0.0000 C   0  0  0

+    2.4985   -0.4818    0.0000 C   0  0  0

+   -3.7477    0.4015    0.0000 C   0  0  0

+    3.7477    0.4015    0.0000 C   0  0  0

+   -4.9969   -0.4818    0.0000 C   0  0  0

+    4.9969   -0.4818    0.0000 C   0  0  0

+   -6.2462    0.4015    0.0000 C   0  0  0

+    6.2462    0.4015    0.0000 C   0  0  0

+   -0.7641   -1.3378    0.0000 H   0  0  0

+    0.7641   -1.3378    0.0000 H   0  0  0

+   -0.4851    1.2575    0.0000 H   0  0  0

+   -2.0133    1.2575    0.0000 H   0  0  0

+    2.0133    1.2575    0.0000 H   0  0  0

+    0.4851    1.2575    0.0000 H   0  0  0

+   -3.2626   -1.3378    0.0000 H   0  0  0

+   -1.7344   -1.3378    0.0000 H   0  0  0

+    1.7344   -1.3378    0.0000 H   0  0  0

+    3.2626   -1.3378    0.0000 H   0  0  0

+   -2.9836    1.2575    0.0000 H   0  0  0

+   -4.5118    1.2575    0.0000 H   0  0  0

+    4.5118    1.2575    0.0000 H   0  0  0

+    2.9836    1.2575    0.0000 H   0  0  0

+   -5.7610   -1.3378    0.0000 H   0  0  0

+   -4.2328   -1.3378    0.0000 H   0  0  0

+    4.2328   -1.3378    0.0000 H   0  0  0

+    5.7610   -1.3378    0.0000 H   0  0  0

+   -5.5838    1.3384    0.0000 H   0  0  0

+   -7.1831    1.0639    0.0000 H   0  0  0

+   -6.9086   -0.5354    0.0000 H   0  0  0

+    6.9086   -0.5354    0.0000 H   0  0  0

+    7.1831    1.0639    0.0000 H   0  0  0

+    5.5838    1.3384    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

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+  9 28  1  0

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+ 10 30  1  0

+ 10 31  1  0

+ 10 32  1  0

+ 11 33  1  0

+ 11 34  1  0

+ 11 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-78-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.9185    0.3993   -0.0814 C   0  0  0

+    0.1628   -0.7323   -0.4176 C   0  0  0

+    2.2616    0.2517    0.2748 C   0  0  0

+    0.3015    1.7382   -0.1093 C   0  0  0

+    0.7549   -1.9860   -0.3935 C   0  0  0

+   -1.1424   -0.6015   -0.7657 O   0  0  0

+    2.8337   -1.0018    0.2934 C   0  0  0

+    1.0317    2.8234    0.2146 O   0  0  0

+   -0.8653    1.8630   -0.4245 O   0  0  0

+    2.0831   -2.1176   -0.0396 C   0  0  0

+   -2.0933   -0.5988    0.1829 C   0  0  0

+   -3.5483   -0.5781   -0.2089 C   0  0  0

+   -1.7822   -0.6129    1.3503 O   0  0  0

+    2.8526    1.0690    0.0000 H   0  0  0

+    0.1737   -2.8103    0.0000 H   0  0  0

+    3.8389   -1.0844    0.0000 H   0  0  0

+    1.5947    3.6602    0.0000 H   0  0  0

+    2.5126   -3.0301    0.0000 H   0  0  0

+   -3.5340    0.4304    0.0000 H   0  0  0

+   -4.5568   -0.5638    0.0000 H   0  0  0

+   -3.5626   -1.5866    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  7 16  1  0

+  8 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86439-49-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.4763   -0.0997    0.0046 C   0  0  0

+   -1.9023   -0.4750    0.0293 C   0  0  0

+   -0.4346    1.3016   -0.0547 C   0  0  0

+    0.7075   -0.8346    0.0331 C   0  0  0

+   -2.6302    0.7232   -0.0166 C   0  0  0

+   -2.5711   -1.6955    0.0849 C   0  0  0

+   -1.7340    1.7768   -0.0665 N   0  0  0

+    0.7965    1.9471   -0.0892 C   0  0  0

+    1.9201   -0.1840   -0.0036 C   0  0  0

+   -4.0208    0.6766   -0.0065 C   0  0  0

+   -3.9491   -1.7214    0.0946 C   0  0  0

+    1.9668    1.2071   -0.0650 C   0  0  0

+    3.1776   -0.9642    0.0267 N   0  3  0

+   -4.6701   -0.5381    0.0480 C   0  0  0

+    3.2013    1.8593   -0.1003 N   0  0  0

+    3.3767   -1.8310   -0.8054 O   0  0  0

+    4.0133   -0.7393    0.8838 O   0  5  0

+    0.6746   -1.8766    0.0000 H   0  0  0

+   -2.0314   -2.5875    0.0000 H   0  0  0

+   -1.9997    2.7849    0.0000 H   0  0  0

+    0.8387    2.9888    0.0000 H   0  0  0

+   -4.5717    1.5617    0.0000 H   0  0  0

+   -4.4511   -2.6351    0.0000 H   0  0  0

+   -5.7122   -0.5675    0.0000 H   0  0  0

+    4.0840    1.3045    0.0000 H   0  0  0

+    3.2404    2.9011    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  2  0

+  5 10  1  0

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+  8 12  2  0

+  9 13  1  0

+ 10 14  2  0

+ 12 15  1  0

+ 13 16  2  0

+ 13 17  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 14  1  0

+  4 18  1  0

+  6 19  1  0

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+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17528-53-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+   -0.6522   -0.0342    0.2240 C   0  0  0

+   -2.0387    0.0265    0.0438 N   0  0  0

+   -0.1270   -0.3770    1.4631 C   0  0  0

+    0.1989    0.2428   -0.8374 C   0  0  0

+   -2.7447   -1.0906   -0.5886 C   0  0  0

+   -2.7840    1.2070    0.4876 C   0  0  0

+    1.2412   -0.4366    1.6400 C   0  0  0

+    1.5673    0.1827   -0.6586 C   0  0  0

+   -2.7976   -2.2741    0.3796 C   0  0  0

+   -2.7035    2.2943   -0.5859 C   0  0  0

+    2.0910   -0.1541    0.5805 C   0  0  0

+   -3.6666   -3.6488   -0.3988 Cl  0  0  0

+   -3.6208    3.7472   -0.0397 Cl  0  0  0

+    3.4384   -0.2126    0.7558 O   0  0  0

+    4.0331    0.1252   -0.4989 C   0  0  0

+    5.5341    0.0787   -0.3720 C   0  0  0

+    6.3064    0.3621   -1.4327 O   0  0  0

+    6.0423   -0.2137    0.6844 O   0  0  0

+   -0.4145   -1.2718    0.0000 H   0  0  0

+    0.0721    1.1740    0.0000 H   0  0  0

+   -3.3184   -0.3462    0.0000 H   0  0  0

+   -3.6409   -1.3737    0.0000 H   0  0  0

+   -3.6550    1.5601    0.0000 H   0  0  0

+   -3.3869    0.4860    0.0000 H   0  0  0

+    1.3711   -1.3674    0.0000 H   0  0  0

+    1.8519    1.0784    0.0000 H   0  0  0

+   -2.2240   -3.0186    0.0000 H   0  0  0

+   -1.9014   -1.9911    0.0000 H   0  0  0

+   -1.8325    1.9412    0.0000 H   0  0  0

+   -2.1007    3.0153    0.0000 H   0  0  0

+    4.3748    1.0007    0.0000 H   0  0  0

+    3.3223    0.7400    0.0000 H   0  0  0

+    7.1887    0.6859    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  3  7  2  0

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+  8 11  2  0

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+  9 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 17 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88492-34-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -1.4173   -0.0999    0.4325 C   0  0  0

+   -2.4609    0.6682   -0.1106 C   0  0  0

+   -0.4059    0.7827    0.7158 N   0  0  0

+   -1.5791   -1.4133    0.5570 N   0  0  0

+   -2.0404    1.9558   -0.1304 N   0  0  0

+   -3.6398    0.0073   -0.4963 C   0  0  0

+   -0.8346    2.0252    0.3542 C   0  0  0

+    0.8960    0.4509    1.2999 C   0  0  0

+   -2.6998   -1.9901    0.1780 C   0  0  0

+   -3.7113   -1.3091   -0.3295 N   0  0  0

+   -4.7016    0.7112   -1.0369 N   0  0  0

+    1.8495   -0.0060    0.1939 C   0  0  0

+    3.2509   -0.1993    0.7766 C   0  0  0

+    1.3865   -1.2421   -0.3535 O   0  0  0

+    4.1639   -0.6368   -0.2823 N   0  0  0

+    5.0631   -0.0143   -0.5418 N   0  3  0

+    5.9623    0.6083   -0.8012 N   0  5  0

+   -0.2896    2.8382    0.0000 H   0  0  0

+    1.6656    1.0557    0.0000 H   0  0  0

+    0.6936    1.4086    0.0000 H   0  0  0

+   -2.7571   -2.9672    0.0000 H   0  0  0

+   -4.6411    1.6881    0.0000 H   0  0  0

+   -5.5779    0.2751    0.0000 H   0  0  0

+    2.1312    0.9314    0.0000 H   0  0  0

+    3.9973    0.4340    0.0000 H   0  0  0

+    2.9773    0.7405    0.0000 H   0  0  0

+    1.0432   -2.1587    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  5  7  2  0

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+  7 18  1  0

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+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146177-62-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+    0.7773   -0.7163   -0.0016 C   0  0  0

+   -0.6680   -0.5045   -0.0008 C   0  0  0

+    1.6195    0.3987   -0.0014 C   0  0  0

+    1.5624   -1.8177    0.0029 N   0  0  0

+   -1.1613    0.8242    0.0001 C   0  0  0

+   -1.5211   -1.5276   -0.0014 N   0  0  0

+    1.0842    1.6891   -0.0005 C   0  0  0

+    2.9119   -0.0970   -0.0017 N   0  0  0

+    2.8236   -1.4577    0.0001 C   0  0  0

+   -0.2559    1.9022    0.0007 C   0  0  0

+   -2.4819    1.0337    0.0008 N   0  0  0

+   -2.8164   -1.2968   -0.0011 C   0  0  0

+    2.0172    2.8726   -0.0003 C   0  0  0

+    4.1454    0.6934   -0.0017 C   0  0  0

+    3.8974   -2.3239    0.0032 N   0  0  0

+   -0.7829    3.3141    0.0012 C   0  0  0

+   -3.3049    0.0087    0.0007 C   0  0  0

+   -3.7809   -2.4547   -0.0018 C   0  0  0

+   -4.7929    0.2476    0.0020 C   0  0  0

+    2.8382    2.2254    0.0000 H   0  0  0

+    2.6644    3.6936    0.0000 H   0  0  0

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+    4.7094   -0.1868    0.0000 H   0  0  0

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+    3.5814    1.5736    0.0000 H   0  0  0

+    3.7358   -3.3568    0.0000 H   0  0  0

+    4.8727   -1.9474    0.0000 H   0  0  0

+    0.1965    3.6797    0.0000 H   0  0  0

+   -1.1485    4.2935    0.0000 H   0  0  0

+   -1.7623    2.9485    0.0000 H   0  0  0

+   -4.5842   -1.7856    0.0000 H   0  0  0

+   -4.4500   -3.2580    0.0000 H   0  0  0

+   -2.9776   -3.1238    0.0000 H   0  0  0

+   -4.6272    1.2798    0.0000 H   0  0  0

+   -5.8251    0.4133    0.0000 H   0  0  0

+   -4.9586   -0.7846    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3340-94-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    0.3976    0.1643    0.0031 C   0  0  0

+   -0.0404   -1.1854    0.0005 C   0  0  0

+    1.8436    0.4375    0.0022 C   0  0  0

+   -0.4629    1.1705    0.0009 N   0  0  0

+   -1.4056   -1.4753    0.0011 C   0  0  0

+    0.9366   -2.2718   -0.0034 C   0  0  0

+    2.7532   -0.6400   -0.0012 C   0  0  0

+    2.3239    1.7489    0.0042 C   0  0  0

+   -1.7769    0.9645   -0.0036 C   0  0  0

+   -2.3040   -0.4030    0.0044 C   0  0  0

+   -1.8970   -2.9000   -0.0022 C   0  0  0

+    2.2590   -2.0140   -0.0042 C   0  0  0

+    4.1295   -0.3769   -0.0021 C   0  0  0

+    3.6815    1.9760    0.0028 C   0  0  0

+   -2.6903    2.0365   -0.0064 C   0  0  0

+   -3.6971   -0.6000    0.0057 C   0  0  0

+    4.5757    0.9129    0.0003 C   0  0  0

+   -4.0253    1.7808   -0.0115 C   0  0  0

+   -4.5242    0.4795    0.0094 C   0  0  0

+    0.6039   -3.2659    0.0000 H   0  0  0

+    1.6544    2.5556    0.0000 H   0  0  0

+   -2.8880   -2.5582    0.0000 H   0  0  0

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+   -2.3427    3.0255    0.0000 H   0  0  0

+   -4.0940   -1.5703    0.0000 H   0  0  0

+    5.6065    1.1038    0.0000 H   0  0  0

+   -4.6982    2.5846    0.0000 H   0  0  0

+   -5.5617    0.3292    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  1  0

+ 13 17  2  0

+ 15 18  2  0

+ 16 19  2  0

+  7 12  1  0

+  9 10  1  0

+ 14 17  1  0

+ 18 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7756-96-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    1.3660   -0.0922    0.2202 C   0  0  0

+    0.0270    0.4354    0.5333 C   0  0  0

+    2.2994    0.7072   -0.4587 C   0  0  0

+    1.7177   -1.3903    0.6022 C   0  0  0

+   -1.0687   -0.1620    0.0245 O   0  0  0

+   -0.0899    1.4095    1.2505 O   0  0  0

+    3.5595    0.1975   -0.7476 C   0  0  0

+    1.9652    1.9996   -0.8397 N   0  0  0

+    2.9715   -1.8774    0.3068 C   0  0  0

+   -2.3887    0.3581    0.3332 C   0  0  0

+    3.8890   -1.0873   -0.3684 C   0  0  0

+   -3.4493   -0.4959   -0.3643 C   0  0  0

+   -4.8402    0.0522   -0.0391 C   0  0  0

+   -5.9009   -0.8019   -0.7366 C   0  0  0

+    0.9676   -2.0648    0.0000 H   0  0  0

+    4.3187    0.8617    0.0000 H   0  0  0

+    2.6847    2.7066    0.0000 H   0  0  0

+    0.9931    2.2692    0.0000 H   0  0  0

+    3.1423   -2.8716    0.0000 H   0  0  0

+   -1.8633    1.2192    0.0000 H   0  0  0

+   -3.1468    1.0235    0.0000 H   0  0  0

+    4.8514   -1.3897    0.0000 H   0  0  0

+   -3.9747   -1.3570    0.0000 H   0  0  0

+   -2.6912   -1.1613    0.0000 H   0  0  0

+   -4.3148    0.9133    0.0000 H   0  0  0

+   -5.5983    0.7176    0.0000 H   0  0  0

+   -6.5336   -0.0162    0.0000 H   0  0  0

+   -6.6866   -1.4346    0.0000 H   0  0  0

+   -5.2682   -1.5876    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  7 11  2  0

+ 10 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+  9 11  1  0

+  4 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+73936-27-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    1.4890   -0.8407   -0.6997 C   0  0  1

+    0.7327   -1.2084    0.5785 C   0  0  2

+    2.6087    0.1107   -0.3647 C   0  0  0

+    1.6963   -2.0792   -0.0176 O   0  0  0

+   -0.6550   -1.6769    0.2239 C   0  0  0

+    3.8599   -0.3806   -0.0415 C   0  0  0

+    2.3862    1.4747   -0.3862 C   0  0  0

+   -1.7590   -0.7095    0.1423 C   0  0  0

+   -0.8611   -2.8519    0.0059 O   0  0  0

+    4.8868    0.4920    0.2657 C   0  0  0

+    3.4135    2.3475   -0.0789 C   0  0  0

+   -3.0490   -1.1413   -0.1868 C   0  0  0

+   -1.5258    0.6461    0.3989 C   0  0  0

+    4.6628    1.8562    0.2498 C   0  0  0

+   -4.0789   -0.2298   -0.2612 C   0  0  0

+   -2.5649    1.5474    0.3211 C   0  0  0

+   -3.8398    1.1137   -0.0107 C   0  0  0

+   -4.8544    2.0026   -0.0853 F   0  0  0

+    0.9336    0.0100    0.0000 H   0  0  0

+    0.3473   -0.2684    0.0000 H   0  0  0

+    4.0269   -1.3828    0.0000 H   0  0  0

+    1.4327    1.8254    0.0000 H   0  0  0

+    5.8405    0.1419    0.0000 H   0  0  0

+    3.2468    3.3497    0.0000 H   0  0  0

+   -3.2516   -2.1369    0.0000 H   0  0  0

+   -0.5690    0.9878    0.0000 H   0  0  0

+    5.4532    2.4946    0.0000 H   0  0  0

+   -5.0384   -0.5639    0.0000 H   0  0  0

+   -2.3697    2.5445    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 12 15  2  0

+ 13 16  1  0

+ 15 17  1  0

+ 17 18  1  0

+  2  4  1  0

+ 11 14  2  0

+ 16 17  2  0

+  1 19  1  0

+  2 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+610-66-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.5180    0.5838   -0.0185 C   0  0  0

+    0.3057   -0.7023   -0.4780 C   0  0  0

+    1.7600    0.9480    0.4677 C   0  0  0

+   -0.5826    1.5730   -0.0526 N   0  3  0

+    1.3353   -1.6247   -0.4514 C   0  0  0

+   -1.0482   -1.0995   -1.0075 C   0  0  0

+    2.7893    0.0259    0.4943 C   0  0  0

+   -1.0849    1.8886   -1.1164 O   0  0  0

+   -0.9858    2.0713    0.9830 O   0  5  0

+    2.5770   -1.2605    0.0342 C   0  0  0

+   -1.8725   -1.6209    0.0950 C   0  0  0

+   -2.5086   -2.0233    0.9458 N   0  0  0

+    1.9751    1.8981    0.0000 H   0  0  0

+    1.1202   -2.5748    0.0000 H   0  0  0

+   -0.9071   -0.1356    0.0000 H   0  0  0

+   -1.8652   -0.5688    0.0000 H   0  0  0

+    3.7082    0.3493    0.0000 H   0  0  0

+    3.3065   -1.9062    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+ 11 12  3  0

+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66291-31-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.4535    0.0809   -0.0027 C   0  0  0

+   -0.9732   -0.2555   -0.0018 C   0  0  0

+    0.8295    1.4430   -0.0006 C   0  0  0

+    1.4382   -0.9088    0.0003 C   0  0  0

+   -1.9182    0.7951    0.0011 C   0  0  0

+   -1.4120   -1.5809   -0.0034 C   0  0  0

+   -0.1652    2.4485    0.0027 C   0  0  0

+    2.1915    1.7761   -0.0015 C   0  0  0

+    2.7565   -0.5520   -0.0002 C   0  0  0

+    1.0482   -2.3645    0.0045 C   0  0  0

+   -1.4774    2.1391    0.0026 C   0  0  0

+   -3.2855    0.4846    0.0019 C   0  0  0

+   -2.7509   -1.8506   -0.0020 C   0  0  0

+    3.1304    0.7867   -0.0042 C   0  0  0

+    3.8178   -1.6218    0.0035 C   0  0  0

+   -3.6835   -0.8200   -0.0001 C   0  0  0

+   -0.7162   -2.3664    0.0000 H   0  0  0

+    0.1244    3.4571    0.0000 H   0  0  0

+    2.4874    2.7829    0.0000 H   0  0  0

+    0.0346   -2.0929    0.0000 H   0  0  0

+    0.7766   -3.3781    0.0000 H   0  0  0

+    2.0618   -2.6361    0.0000 H   0  0  0

+   -2.1871    2.9121    0.0000 H   0  0  0

+   -4.0000    1.2531    0.0000 H   0  0  0

+   -3.0792   -2.8473    0.0000 H   0  0  0

+    4.1488    1.0396    0.0000 H   0  0  0

+    3.0728   -2.3608    0.0000 H   0  0  0

+    4.5568   -2.3668    0.0000 H   0  0  0

+    4.5628   -0.8828    0.0000 H   0  0  0

+   -4.7076   -1.0487    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  8 14  2  0

+  9 15  1  0

+ 12 16  2  0

+  7 11  2  0

+  9 14  1  0

+ 13 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98-92-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.1905   -0.0247    0.0033 C   0  0  0

+    0.4883   -1.2489    0.0029 C   0  0  0

+    0.5513    1.1574    0.0010 C   0  0  0

+   -1.6684    0.0154    0.0001 C   0  0  0

+    1.8721   -1.2316    0.0001 C   0  0  0

+    1.8675    1.1218   -0.0016 N   0  0  0

+   -2.3104    1.2004    0.0005 N   0  0  0

+   -2.3045   -1.0205   -0.0030 O   0  0  0

+    2.5339   -0.0171   -0.0021 C   0  0  0

+   -0.0325   -2.1460    0.0000 H   0  0  0

+    0.0616    2.0719    0.0000 H   0  0  0

+    2.4074   -2.1202    0.0000 H   0  0  0

+   -1.7676    2.0844    0.0000 H   0  0  0

+   -3.3474    1.2285    0.0000 H   0  0  0

+    3.5711   -0.0013    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6  9  1  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  7 13  1  0

+  7 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+142438-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.5773    0.1792    0.4779 C   0  0  0

+   -0.4261   -0.9806    0.6108 C   0  0  0

+    0.3621   -0.5147    1.7082 O   0  0  0

+   -0.2613    1.4285    0.3801 C   0  0  0

+    1.8795    0.0933   -0.2757 C   0  0  0

+   -1.7985   -0.2886    0.5700 C   0  0  0

+   -0.2553   -2.3641   -0.0199 C   0  0  0

+   -1.5594    1.1332    0.4327 O   0  0  0

+    0.1838    2.5464    0.2694 O   0  0  0

+    2.8085   -0.8040    0.0898 O   0  0  0

+    2.0874    0.8320   -1.2089 O   0  0  0

+   -2.5878   -0.7923   -0.6400 C   0  0  0

+    4.0632   -0.8868   -0.6362 C   0  0  0

+   -4.0856   -0.7291   -0.3341 C   0  0  0

+   -2.2776    0.0870   -1.8531 C   0  0  0

+   -2.6105    0.2488    0.0000 H   0  0  0

+   -1.2217   -2.4834    0.0000 H   0  0  0

+   -0.1360   -3.3305    0.0000 H   0  0  0

+    0.7111   -2.2448    0.0000 H   0  0  0

+   -2.3347   -1.7326    0.0000 H   0  0  0

+    3.9991   -1.8584    0.0000 H   0  0  0

+    5.0348   -0.9509    0.0000 H   0  0  0

+    4.1273    0.0848    0.0000 H   0  0  0

+   -4.0445    0.2438    0.0000 H   0  0  0

+   -5.0585   -0.6880    0.0000 H   0  0  0

+   -4.1267   -1.7020    0.0000 H   0  0  0

+   -1.3593   -0.2369    0.0000 H   0  0  0

+   -1.9537    1.0053    0.0000 H   0  0  0

+   -3.1959    0.4109    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  4  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+ 10 13  1  0

+ 12 14  1  0

+ 12 15  1  0

+  2  3  1  0

+  6  8  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  7 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6931-54-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    1.1618   -0.0167    0.1532 C   0  0  0

+   -0.1123    0.4601    0.8685 C   0  0  1

+    1.9405    0.9844   -0.6875 C   0  0  0

+    2.4156    0.4984    0.5717 O   0  0  0

+    1.0738   -1.4706   -0.3243 C   0  0  0

+   -1.2561    0.5428   -0.1617 C   0  0  0

+   -0.8389   -0.7944    1.4067 C   0  0  0

+   -0.3312   -1.6790   -0.9111 C   0  0  0

+   -1.3681   -0.9848   -0.0236 C   0  0  2

+   -2.4866    1.2977    0.3452 C   0  0  0

+   -0.8024    1.0031   -1.5484 C   0  0  0

+    0.1047    1.4533    0.0000 H   0  0  0

+    2.6346    1.7272    0.0000 H   0  0  0

+    1.1671    1.6442    0.0000 H   0  0  0

+    1.1530   -2.4841    0.0000 H   0  0  0

+    2.0904   -1.4617    0.0000 H   0  0  0

+   -0.7828   -1.8095    0.0000 H   0  0  0

+    0.1498   -1.0310    0.0000 H   0  0  0

+   -1.1068   -2.3362    0.0000 H   0  0  0

+    0.0881   -2.6051    0.0000 H   0  0  0

+   -2.2818   -1.4305    0.0000 H   0  0  0

+   -1.9550    2.1642    0.0000 H   0  0  0

+   -3.3531    1.8293    0.0000 H   0  0  0

+   -3.0182    0.4312    0.0000 H   0  0  0

+   -0.0784    0.2895    0.0000 H   0  0  0

+   -0.0888    1.7271    0.0000 H   0  0  0

+   -1.5264    1.7167    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  5  8  1  0

+  6  9  1  0

+  6 10  1  0

+  6 11  1  0

+  3  4  1  0

+  7  9  1  0

+  8  9  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  5 15  1  0

+  5 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-86-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.3386    0.0001    0.0035 C   0  0  0

+    1.0305   -1.1979    0.0020 C   0  0  0

+    1.0302    1.1977    0.0021 C   0  0  0

+   -1.5524    0.0000   -0.0006 Br  0  0  0

+    2.4125   -1.1974   -0.0008 C   0  0  0

+    2.4126    1.1973   -0.0008 C   0  0  0

+    3.1036    0.0002   -0.0022 C   0  0  0

+    0.5122   -2.0961    0.0000 H   0  0  0

+    0.5119    2.0959    0.0000 H   0  0  0

+    2.9313   -2.0953    0.0000 H   0  0  0

+    2.9313    2.0953    0.0000 H   0  0  0

+    4.1406    0.0003    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  6  7  2  0

+  2  8  1  0

+  3  9  1  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3586-69-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.1380    0.3662   -0.0058 C   0  0  0

+    0.1098   -1.0793   -0.0022 C   0  0  0

+    0.9303    1.2609   -0.0051 C   0  0  0

+   -1.4729    0.8254   -0.0041 C   0  0  0

+    1.4151   -1.5670    0.0010 C   0  0  0

+   -0.9959   -1.9570   -0.0027 C   0  0  0

+    2.2360    0.7732   -0.0008 C   0  0  0

+   -2.4902   -0.0733    0.0007 C   0  0  0

+    2.4838   -0.6722    0.0009 C   0  0  0

+   -2.2544   -1.4486   -0.0063 C   0  0  0

+    3.3417    1.6507   -0.0001 C   0  0  0

+   -3.8867    0.4187    0.0030 N   0  3  0

+    3.8186   -1.1315    0.0038 C   0  0  0

+    4.6003    1.1423    0.0039 C   0  0  0

+   -4.8115   -0.3738    0.0073 O   0  0  0

+   -4.1106    1.6159    0.0004 O   0  5  0

+    4.8360   -0.2330    0.0031 C   0  0  0

+    0.7536    2.2912    0.0000 H   0  0  0

+   -1.6766    1.8507    0.0000 H   0  0  0

+    1.5917   -2.5974    0.0000 H   0  0  0

+   -0.8464   -2.9916    0.0000 H   0  0  0

+   -3.0684   -2.1046    0.0000 H   0  0  0

+    3.1922    2.6853    0.0000 H   0  0  0

+    4.0222   -2.1569    0.0000 H   0  0  0

+    5.4143    1.7983    0.0000 H   0  0  0

+    5.8219   -0.5805    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 11 14  2  0

+ 12 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+  7  9  2  0

+  8 10  1  0

+ 14 17  1  0

+  3 18  1  0

+  4 19  1  0

+  5 20  1  0

+  6 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6325-54-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.8484    0.5413   -0.0543 C   0  0  0

+    0.1073   -0.6825   -0.3644 C   0  0  0

+    2.3134    0.4718    0.0429 C   0  0  0

+    0.1787    1.7386    0.1371 C   0  0  0

+   -1.2793   -0.6526   -0.4644 C   0  0  0

+    0.8420   -1.9298   -0.5670 C   0  0  0

+    2.9603   -0.7648   -0.1641 C   0  0  0

+    3.0681    1.6090    0.3356 C   0  0  0

+   -1.2148    1.7756    0.0326 C   0  0  0

+   -1.9603    0.5507   -0.2673 C   0  0  0

+   -2.0432   -1.9119   -0.7831 C   0  0  0

+    2.1848   -1.9620   -0.4714 C   0  0  0

+    4.3578   -0.8290   -0.0710 C   0  0  0

+    4.4388    1.5137    0.4198 C   0  0  0

+   -1.9288    2.9759    0.2206 C   0  0  0

+   -3.3656    0.6183   -0.3604 C   0  0  0

+   -2.4749   -2.7572    0.7498 Cl  0  0  0

+    5.0748    0.2956    0.2167 C   0  0  0

+   -3.2832    2.9742    0.1109 C   0  0  0

+   -3.9940    1.8064   -0.1620 C   0  0  0

+    0.7168    2.6288    0.0000 H   0  0  0

+    0.3150   -2.8266    0.0000 H   0  0  0

+    2.6084    2.5421    0.0000 H   0  0  0

+   -2.5657   -1.0125    0.0000 H   0  0  0

+   -3.0830   -1.9400    0.0000 H   0  0  0

+    2.6707   -2.8817    0.0000 H   0  0  0

+    4.8369   -1.7523    0.0000 H   0  0  0

+    5.0084    2.3841    0.0000 H   0  0  0

+   -1.4151    3.8804    0.0000 H   0  0  0

+   -3.9236   -0.2596    0.0000 H   0  0  0

+    6.1140    0.2507    0.0000 H   0  0  0

+   -3.7934    3.8807    0.0000 H   0  0  0

+   -5.0337    1.8377    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  9 10  1  0

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+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-11-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.0000    0.6105    0.0435 C   0  0  0

+   -1.2492    1.1355    0.7539 C   0  0  0

+    1.2492    1.1355    0.7539 C   0  0  0

+    0.0000   -1.3550    0.0847 Br  0  0  0

+   -2.8545    0.4609   -0.1590 Br  0  0  0

+    2.8545    0.4609   -0.1590 Br  0  0  0

+    0.0000    1.9165    0.0000 H   0  0  0

+   -0.4524    2.1702    0.0000 H   0  0  0

+   -2.0460    2.1702    0.0000 H   0  0  0

+    2.0460    2.1702    0.0000 H   0  0  0

+    0.4524    2.1702    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1199-18-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -0.6850   -0.1151    0.3713 C   0  0  0

+   -0.2461    1.1805    0.1446 C   0  0  0

+    0.2123   -1.1666    0.3391 C   0  0  0

+   -2.1409   -0.3768    0.6593 C   0  0  0

+    1.0946    1.4240   -0.1145 C   0  0  0

+   -1.1304    2.2129    0.1768 O   0  0  0

+    1.5517   -0.9278    0.0802 C   0  0  0

+   -2.8946   -0.5703   -0.6580 C   0  0  0

+    1.9947    0.3718   -0.1471 C   0  0  0

+    2.4340   -1.9632    0.0482 O   0  0  0

+   -4.3138   -0.8254   -0.3772 N   0  0  0

+    3.3095    0.6083   -0.4014 O   0  0  0

+   -0.1330   -2.1306    0.0000 H   0  0  0

+   -1.8176    0.5948    0.0000 H   0  0  0

+   -2.8392    0.3721    0.0000 H   0  0  0

+    1.4378    2.3887    0.0000 H   0  0  0

+   -1.7965    2.9906    0.0000 H   0  0  0

+   -3.2179   -1.5419    0.0000 H   0  0  0

+   -2.1963   -1.3192    0.0000 H   0  0  0

+    3.0981   -2.7426    0.0000 H   0  0  0

+   -4.9746   -0.0432    0.0000 H   0  0  0

+   -4.6608   -1.7888    0.0000 H   0  0  0

+    4.3173    0.7896    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  2  0

+  4  8  1  0

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+  5 16  1  0

+  6 17  1  0

+  8 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6530-27-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.8166    0.4942   -0.0013 C   0  0  0

+   -0.5411    0.6295   -0.0015 N   0  0  0

+    1.6345    1.6292   -0.0015 C   0  0  0

+    1.3946   -0.7803    0.0048 C   0  0  0

+   -1.2936   -0.4182   -0.0014 N   0  0  0

+    3.0038    1.4886   -0.0013 C   0  0  0

+    2.7643   -0.9125    0.0049 C   0  0  0

+   -2.6541   -0.2827   -0.0016 C   0  0  0

+    3.5748    0.2194   -0.0011 C   0  0  0

+   -3.4724   -1.4152   -0.0014 C   0  0  0

+   -3.2330    0.9894    0.0039 C   0  0  0

+    4.9604    0.0813   -0.0010 N   0  0  0

+   -4.8442   -1.2707   -0.0017 C   0  0  0

+   -4.6059    1.1184    0.0037 C   0  0  0

+    5.5433   -1.2092   -0.0007 O   0  0  0

+   -5.4102   -0.0081   -0.0020 C   0  0  0

+    1.2093    2.5762    0.0000 H   0  0  0

+    0.7909   -1.6248    0.0000 H   0  0  0

+    3.6114    2.3304    0.0000 H   0  0  0

+    3.1938   -1.8576    0.0000 H   0  0  0

+   -3.0490   -2.3631    0.0000 H   0  0  0

+   -2.6309    1.8351    0.0000 H   0  0  0

+    5.5661    0.9244    0.0000 H   0  0  0

+   -5.4534   -2.1113    0.0000 H   0  0  0

+   -5.0373    2.0627    0.0000 H   0  0  0

+    5.9706   -2.1553    0.0000 H   0  0  0

+   -6.4432    0.0948    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+129-79-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.5976   -0.2136   -0.0070 C   0  0  0

+   -0.8858   -0.3034    0.0002 C   0  0  0

+    0.9652    1.1424    0.0009 C   0  0  0

+    1.5841   -1.1893   -0.0142 C   0  0  0

+   -1.4144    0.9978    0.0126 C   0  0  0

+   -1.7475   -1.3915   -0.0035 C   0  0  0

+   -0.2780    1.9492    0.0134 C   0  0  0

+    2.3092    1.4957   -0.0034 C   0  0  0

+    2.9215   -0.8236   -0.0196 C   0  0  0

+    1.2086   -2.6210   -0.0156 N   0  3  0

+   -2.7917    1.1861    0.0206 C   0  0  0

+   -3.1187   -1.1903    0.0049 C   0  0  0

+   -0.3516    3.1612    0.0229 O   0  0  0

+    3.2821    0.5095   -0.0153 C   0  0  0

+    1.6893   -3.3775    0.8092 O   0  0  0

+    0.4189   -3.0427   -0.8415 O   0  5  0

+   -3.6380    0.0899    0.0165 C   0  0  0

+    4.7136    0.8860   -0.0203 N   0  3  0

+   -5.1045    0.2906    0.0256 N   0  3  0

+    5.5709    0.0208   -0.0308 O   0  0  0

+    5.0343    2.0610   -0.0140 O   0  5  0

+   -5.8509   -0.6719    0.0220 O   0  0  0

+   -5.5648    1.4182    0.0367 O   0  5  0

+   -1.3641   -2.3581    0.0000 H   0  0  0

+    2.5841    2.4986    0.0000 H   0  0  0

+    3.6578   -1.5579    0.0000 H   0  0  0

+   -3.1858    2.1484    0.0000 H   0  0  0

+   -3.7608   -2.0082    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  3  7  1  0

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+  5  7  1  0

+  9 14  2  0

+ 12 17  1  0

+  6 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-55-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+    0.4943   -0.5256   -0.1764 C   0  0  0

+   -0.9669   -0.1691   -0.2703 C   0  0  0

+    1.5143    0.3470   -0.1327 O   0  0  0

+    0.9978   -1.7715   -0.1163 C   0  0  0

+   -1.7582   -1.1930    0.3884 O   0  0  0

+   -1.1955    1.1103    0.3771 O   0  0  0

+    2.6746   -0.3244   -0.0498 C   0  0  0

+    2.4034   -1.6418   -0.0369 C   0  0  0

+   -3.0573   -1.3373    0.0831 C   0  0  0

+   -2.2825    1.8344    0.0675 C   0  0  0

+    4.0231    0.2826    0.0188 N   0  3  0

+   -3.9104   -2.3075    0.8589 C   0  0  0

+   -3.5427   -0.6893   -0.8138 O   0  0  0

+   -2.5906    3.0958    0.8324 C   0  0  0

+   -3.0140    1.4749   -0.8244 O   0  0  0

+    5.0085   -0.4295    0.0920 O   0  0  0

+    4.1471    1.4942    0.0021 O   0  5  0

+   -1.9183    0.0643    0.0000 H   0  0  0

+    0.4880   -2.6080    0.0000 H   0  0  0

+    3.0566   -2.3718    0.0000 H   0  0  0

+   -4.6460   -1.6607    0.0000 H   0  0  0

+   -4.5572   -3.0431    0.0000 H   0  0  0

+   -3.1748   -2.9543    0.0000 H   0  0  0

+   -1.6390    3.3282    0.0000 H   0  0  0

+   -2.8230    4.0474    0.0000 H   0  0  0

+   -3.5422    2.8634    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  5  9  1  0

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+  7  8  2  0

+  2 18  1  0

+  4 19  1  0

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+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+544-63-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+    0.4727   -0.5762    0.0000 C   0  0  0

+   -0.7473    0.3470    0.0000 C   0  0  0

+    1.7498    0.2664    0.0000 C   0  0  0

+   -2.0244   -0.4956    0.0000 C   0  0  0

+    2.9699   -0.6568    0.0000 C   0  0  0

+   -3.2445    0.4275    0.0000 C   0  0  0

+    4.2470    0.1858    0.0000 C   0  0  0

+   -4.5216   -0.4151    0.0000 C   0  0  0

+    5.4671   -0.7374    0.0000 C   0  0  0

+   -5.7417    0.5081    0.0000 C   0  0  0

+    6.7249    0.0926    0.0000 C   0  0  0

+   -7.0187   -0.3345    0.0000 C   0  0  0

+    7.9253   -0.5081    0.0000 O   0  0  0

+    6.6529    1.2987    0.0000 O   0  0  0

+   -8.2388    0.5887    0.0000 C   0  0  0

+   -9.5159   -0.2539    0.0000 C   0  0  0

+   -0.3187   -1.4071    0.0000 H   0  0  0

+    1.2089   -1.4565    0.0000 H   0  0  0

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+   -2.8158   -1.3266    0.0000 H   0  0  0

+   -1.2882   -1.3758    0.0000 H   0  0  0

+    2.1785   -1.4877    0.0000 H   0  0  0

+    3.7061   -1.5371    0.0000 H   0  0  0

+   -2.4531    1.2585    0.0000 H   0  0  0

+   -3.9807    1.3077    0.0000 H   0  0  0

+    5.0384    1.0167    0.0000 H   0  0  0

+    3.5108    1.0661    0.0000 H   0  0  0

+   -5.3130   -1.2460    0.0000 H   0  0  0

+   -3.7854   -1.2954    0.0000 H   0  0  0

+    4.6757   -1.5684    0.0000 H   0  0  0

+    6.2033   -1.6176    0.0000 H   0  0  0

+   -4.9503    1.3391    0.0000 H   0  0  0

+   -6.4779    1.3883    0.0000 H   0  0  0

+   -7.8101   -1.1655    0.0000 H   0  0  0

+   -6.2825   -1.2147    0.0000 H   0  0  0

+    8.9515   -1.0216    0.0000 H   0  0  0

+   -7.4474    1.4196    0.0000 H   0  0  0

+   -8.9750    1.4690    0.0000 H   0  0  0

+  -10.1478    0.7039    0.0000 H   0  0  0

+  -10.4737   -0.8858    0.0000 H   0  0  0

+   -8.8840   -1.2117    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 39  1  0

+ 15 40  1  0

+ 15 41  1  0

+ 16 42  1  0

+ 16 43  1  0

+ 16 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1728-32-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.7680   -0.2151    0.2389 C   0  0  0

+    0.2122   -1.2440    0.7282 C   0  0  0

+   -0.4099    1.0537    0.0488 C   0  0  0

+   -2.0433   -0.5877   -0.0199 O   0  0  0

+    1.3106   -1.4112   -0.2839 C   0  0  0

+    0.9273    1.5433    0.3143 C   0  0  0

+   -2.7337    0.5824   -0.4628 C   0  0  0

+    2.1301   -0.4176   -0.5889 C   0  0  0

+    2.0535    0.8915    0.0320 C   0  0  0

+   -0.6751   -1.6804    0.0000 H   0  0  0

+    0.3629   -2.2212    0.0000 H   0  0  0

+   -1.1351    1.7258    0.0000 H   0  0  0

+    1.6636   -2.3348    0.0000 H   0  0  0

+    1.0131    2.5283    0.0000 H   0  0  0

+   -1.8821    1.0849    0.0000 H   0  0  0

+   -3.2362    1.4340    0.0000 H   0  0  0

+   -3.5853    0.0799    0.0000 H   0  0  0

+    3.0700   -0.7245    0.0000 H   0  0  0

+    2.8953    1.4103    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  2  0

+  6  9  2  0

+  8  9  1  0

+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26148-68-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    0.3096   -0.5710   -0.0011 C   0  0  0

+   -1.1621   -0.4982   -0.0006 C   0  0  0

+    0.7773    0.7521   -0.0004 C   0  0  0

+    1.2224   -1.6264    0.0030 C   0  0  0

+   -1.4897    0.8659    0.0004 C   0  0  0

+   -2.1717   -1.4576   -0.0014 C   0  0  0

+   -0.3135    1.5964    0.0005 N   0  0  0

+    2.0843    0.9904   -0.0002 N   0  0  0

+    2.5704   -1.3259    0.0010 C   0  0  0

+   -2.8281    1.2452    0.0010 C   0  0  0

+   -3.4921   -1.0623   -0.0012 C   0  0  0

+    2.9700    0.0088   -0.0007 C   0  0  0

+   -3.8175    0.2854    0.0007 C   0  0  0

+    4.3254    0.3142   -0.0010 N   0  0  0

+    0.8958   -2.6147    0.0000 H   0  0  0

+   -1.9298   -2.4700    0.0000 H   0  0  0

+   -0.2600    2.6359    0.0000 H   0  0  0

+    3.2796   -2.0878    0.0000 H   0  0  0

+   -3.0826    2.2545    0.0000 H   0  0  0

+   -4.2477   -1.7782    0.0000 H   0  0  0

+   -4.8174    0.5749    0.0000 H   0  0  0

+    5.0313   -0.4508    0.0000 H   0  0  0

+    4.6350    1.3080    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+ 10 13  2  0

+ 12 14  1  0

+  5  7  1  0

+  9 12  2  0

+ 11 13  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2945-03-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    2.9561   -0.0016    0.4076 C   0  0  0

+    1.5654   -0.0038    0.9881 C   0  0  0

+    3.5941    1.1967    0.1458 C   0  0  0

+    3.5960   -1.1976    0.1422 C   0  0  0

+    0.5827    0.0003   -0.0985 N   0  0  0

+    4.8695    1.1986   -0.3866 C   0  0  0

+    4.8719   -1.1957   -0.3903 C   0  0  0

+   -0.7350   -0.0007    0.1846 C   0  0  0

+    5.5074    0.0023   -0.6574 C   0  0  0

+   -1.7458    0.0035   -0.9331 C   0  0  0

+   -1.1072   -0.0051    1.3389 O   0  0  0

+   -3.5601    0.0007   -0.1758 Br  0  0  0

+    1.0622   -0.8709    0.0000 H   0  0  0

+    2.0664   -0.8722    0.0000 H   0  0  0

+    3.0774    2.0558    0.0000 H   0  0  0

+    3.0814   -2.0580    0.0000 H   0  0  0

+    0.5844    1.0028    0.0000 H   0  0  0

+    5.3847    2.0586    0.0000 H   0  0  0

+    5.3893   -2.0544    0.0000 H   0  0  0

+    6.5099    0.0034    0.0000 H   0  0  0

+   -1.2426    0.8706    0.0000 H   0  0  0

+   -2.2468    0.8719    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  1  0

+  8 11  2  0

+ 10 12  1  0

+  7  9  2  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1874-23-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.7744    0.2023   -0.0033 C   0  0  0

+   -0.3431   -0.5540   -0.0030 O   0  0  0

+    0.3959    1.5153   -0.0008 C   0  0  0

+    2.1515   -0.2966   -0.0003 C   0  0  0

+   -1.4191    0.2431   -0.0005 C   0  0  0

+   -1.0071    1.5304    0.0010 C   0  0  0

+    3.1836    0.5721   -0.0009 O   0  0  0

+    2.3645   -1.4940    0.0027 O   0  0  0

+   -2.8280   -0.2109    0.0006 N   0  3  0

+    4.5488    0.0775    0.0021 C   0  0  0

+   -3.7312    0.6062    0.0030 O   0  0  0

+   -3.0841   -1.4017   -0.0009 O   0  5  0

+    1.0092    2.3214    0.0000 H   0  0  0

+   -1.5998    2.3517    0.0000 H   0  0  0

+    4.2038   -0.8748    0.0000 H   0  0  0

+    5.5011   -0.2675    0.0000 H   0  0  0

+    4.8938    1.0298    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  7 10  1  0

+  9 11  2  0

+  9 12  1  0

+  5  6  2  0

+  3 13  1  0

+  6 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1187-42-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.4863   -0.4790   -0.0015 C   0  0  0

+   -0.4863    0.4790   -0.0001 C   0  0  0

+    1.8667   -0.0980   -0.0010 C   0  0  0

+    0.1359   -1.8272    0.0023 N   0  0  0

+   -1.8667    0.0980   -0.0006 C   0  0  0

+   -0.1359    1.8272    0.0019 N   0  0  0

+    2.9617    0.2042   -0.0006 N   0  0  0

+   -2.9617   -0.2042   -0.0010 N   0  0  0

+   -0.8712   -2.1052    0.0000 H   0  0  0

+    0.8802   -2.5604    0.0000 H   0  0  0

+    0.8712    2.1052    0.0000 H   0  0  0

+   -0.8802    2.5604    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  2  1  0

+  7  3  3  0

+  8  5  3  0

+  4  9  1  0

+  4 10  1  0

+  6 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+612-62-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.7279    0.5453   -0.0030 C   0  0  0

+   -1.1338   -0.8122   -0.0009 C   0  0  0

+    0.5736    0.8507   -0.0025 N   0  0  0

+   -1.7091    1.5521    0.0001 C   0  0  0

+   -0.1502   -1.8193    0.0013 C   0  0  0

+   -2.5023   -1.1272   -0.0005 C   0  0  0

+    1.4935   -0.0850    0.0000 C   0  0  0

+   -3.0265    1.2111    0.0052 C   0  0  0

+    1.1613   -1.4395    0.0013 C   0  0  0

+   -3.4235   -0.1247   -0.0022 C   0  0  0

+    3.1674    0.3750    0.0005 Cl  0  0  0

+   -1.4277    2.5591    0.0000 H   0  0  0

+   -0.4166   -2.8304    0.0000 H   0  0  0

+   -2.8120   -2.1259    0.0000 H   0  0  0

+   -3.7526    1.9635    0.0000 H   0  0  0

+    1.9158   -2.1634    0.0000 H   0  0  0

+   -4.4422   -0.3602    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  7  9  2  0

+  8 10  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56-49-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+   -1.8135   -0.1439    0.0035 C   0  0  0

+   -1.0097   -1.2686    0.0041 C   0  0  0

+   -1.2898    1.2128    0.0017 C   0  0  0

+   -3.1839   -0.4063   -0.0013 C   0  0  0

+    0.3678   -1.0832    0.0021 C   0  0  0

+   -1.9166   -2.4752    0.0064 C   0  0  0

+    0.0959    1.3941    0.0013 C   0  0  0

+   -2.2245    2.2666    0.0009 C   0  0  0

+   -3.3524   -1.9062   -0.0040 C   0  0  0

+   -4.0354    0.6527   -0.0024 C   0  0  0

+    0.9204    0.2753    0.0011 C   0  0  0

+    1.2771   -2.2266    0.0006 C   0  0  0

+   -3.5532    1.9641    0.0016 C   0  0  0

+   -5.5225    0.4090   -0.0077 C   0  0  0

+    2.3832    0.4341    0.0005 C   0  0  0

+    2.6113   -2.0471   -0.0024 C   0  0  0

+    3.2037   -0.7131   -0.0032 C   0  0  0

+    2.9650    1.7026    0.0048 C   0  0  0

+    4.5968   -0.5573   -0.0066 C   0  0  0

+    4.3367    1.8232    0.0030 C   0  0  0

+    5.1436    0.6932   -0.0038 C   0  0  0

+   -2.3879   -3.4114    0.0000 H   0  0  0

+   -1.0260   -3.0279    0.0000 H   0  0  0

+    0.5068    2.3583    0.0000 H   0  0  0

+   -1.9041    3.2646    0.0000 H   0  0  0

+   -4.3796   -1.6976    0.0000 H   0  0  0

+   -3.6509   -2.9109    0.0000 H   0  0  0

+    0.8858   -3.1989    0.0000 H   0  0  0

+   -4.2452    2.7513    0.0000 H   0  0  0

+   -5.6920    1.4433    0.0000 H   0  0  0

+   -6.5568    0.2395    0.0000 H   0  0  0

+   -5.3530   -0.6253    0.0000 H   0  0  0

+    3.2400   -2.8857    0.0000 H   0  0  0

+    2.3609    2.5592    0.0000 H   0  0  0

+    5.2185   -1.4011    0.0000 H   0  0  0

+    4.7751    2.7753    0.0000 H   0  0  0

+    6.1861    0.8020    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 15 17  1  0

+ 15 18  2  0

+ 17 19  2  0

+ 18 20  1  0

+ 19 21  1  0

+  6  9  1  0

+  7 11  2  0

+ 10 13  1  0

+ 16 17  1  0

+ 20 21  2  0

+  6 22  1  0

+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 14 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97461-43-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.3498    1.0737   -0.0071 C   0  0  0

+   -1.0613   -0.0602   -0.1774 O   0  0  0

+    1.0592    1.1917   -0.0703 C   0  0  0

+   -1.2417    2.0989    0.2339 C   0  0  0

+   -2.3676    0.2092   -0.0475 C   0  0  0

+    1.8461    0.2127    0.4449 C   0  0  0

+   -2.5231    1.5290    0.2006 C   0  0  0

+   -3.4645   -0.7776   -0.1675 N   0  3  0

+    3.1198   -0.0368   -0.1134 C   0  0  0

+    1.3610   -0.6079    1.6121 C   0  0  0

+   -4.6214   -0.4219   -0.0303 O   0  0  0

+   -3.2103   -1.9451   -0.4034 O   0  5  0

+    3.9023   -1.0103    0.3989 O   0  0  0

+    3.5116    0.6259   -1.0560 O   0  0  0

+    5.1080   -1.0176   -0.3682 C   0  0  0

+    1.4428    2.0863    0.0000 H   0  0  0

+   -1.0310    3.0493    0.0000 H   0  0  0

+   -3.3691    2.0106    0.0000 H   0  0  0

+    0.5230   -0.1125    0.0000 H   0  0  0

+    0.8656   -1.4459    0.0000 H   0  0  0

+    2.1990   -1.1033    0.0000 H   0  0  0

+    5.1021   -1.9910    0.0000 H   0  0  0

+    6.0814   -1.0235    0.0000 H   0  0  0

+    5.1139   -0.0442    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  6 10  1  0

+  8 11  2  0

+  8 12  1  0

+  9 13  1  0

+  9 14  2  0

+ 13 15  1  0

+  5  7  2  0

+  3 16  1  0

+  4 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 15 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60-09-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.3151    0.3079   -0.0013 C   0  0  0

+   -0.0313    0.5287   -0.0015 N   0  0  0

+    2.2031    1.3890   -0.0014 C   0  0  0

+    1.8115   -1.0005    0.0046 C   0  0  0

+   -0.8485   -0.4694   -0.0015 N   0  0  0

+    3.5608    1.1621   -0.0013 C   0  0  0

+    3.1701   -1.2191    0.0047 C   0  0  0

+   -2.1977   -0.2482   -0.0016 C   0  0  0

+    4.0505   -0.1406   -0.0012 C   0  0  0

+   -3.0862   -1.3271   -0.0016 C   0  0  0

+   -2.6950    1.0576    0.0041 C   0  0  0

+    5.4246   -0.3659   -0.0016 N   0  0  0

+   -4.4456   -1.0963   -0.0017 C   0  0  0

+   -4.0574    1.2730    0.0039 C   0  0  0

+   -4.9309    0.2000   -0.0019 C   0  0  0

+    1.8387    2.3608    0.0000 H   0  0  0

+    1.1558   -1.8050    0.0000 H   0  0  0

+    4.2202    1.9636    0.0000 H   0  0  0

+    3.5390   -2.1893    0.0000 H   0  0  0

+   -2.7236   -2.2996    0.0000 H   0  0  0

+   -2.0409    1.8634    0.0000 H   0  0  0

+    5.7913   -1.3369    0.0000 H   0  0  0

+    6.0822    0.4371    0.0000 H   0  0  0

+   -5.1066   -1.8965    0.0000 H   0  0  0

+   -4.4282    2.2424    0.0000 H   0  0  0

+   -5.9551    0.3679    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  2  0

+ 11 14  1  0

+ 13 15  1  0

+  7  9  1  0

+ 14 15  2  0

+  3 16  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6428-94-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.0960    0.5129   -0.0015 C   0  0  0

+   -0.2541    0.7297   -0.0015 N   0  0  0

+    1.9806    1.5944   -0.0018 C   0  0  0

+    1.5977   -0.7915    0.0046 C   0  0  0

+   -1.0680   -0.2710   -0.0012 N   0  0  0

+    3.3413    1.3680   -0.0013 C   0  0  0

+    2.9604   -1.0024    0.0050 C   0  0  0

+   -2.4135   -0.0550   -0.0012 C   0  0  0

+    3.8307    0.0738   -0.0006 C   0  0  0

+   -3.3024   -1.1421   -0.0009 C   0  0  0

+   -2.9155    1.2511    0.0043 C   0  0  0

+    5.2922   -0.1609   -0.0006 N   0  3  0

+   -4.6670   -0.9134   -0.0010 C   0  0  0

+   -2.8246   -2.4126   -0.0011 O   0  0  0

+   -4.2750    1.4645    0.0043 C   0  0  0

+    5.7263   -1.2990    0.0000 O   0  0  0

+    6.0608    0.7840   -0.0013 O   0  5  0

+   -5.1537    0.3858   -0.0012 C   0  0  0

+   -6.4936    0.6055   -0.0013 O   0  0  0

+    1.6154    2.5641    0.0000 H   0  0  0

+    0.9473   -1.5981    0.0000 H   0  0  0

+    3.9985    2.1690    0.0000 H   0  0  0

+    3.3337   -1.9689    0.0000 H   0  0  0

+   -2.2642    2.0569    0.0000 H   0  0  0

+   -5.3259   -1.7130    0.0000 H   0  0  0

+   -2.4599   -3.3824    0.0000 H   0  0  0

+   -4.6456    2.4321    0.0000 H   0  0  0

+   -7.5161    0.7732    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  4  7  2  0

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+  6  9  2  0

+  8 10  2  0

+  8 11  1  0

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+  7  9  1  0

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+  7 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 19 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+161697-00-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+   -0.1367    0.4065    0.0032 C   0  0  0

+   -0.3601   -0.9943    0.0010 C   0  0  0

+    1.1796    0.8946    0.0027 C   0  0  0

+   -1.1819    1.2422    0.0003 N   0  0  0

+   -1.6128   -1.4617    0.0010 N   0  0  0

+    0.7395   -1.8718   -0.0017 C   0  0  0

+    2.2335    0.0075    0.0000 C   0  0  0

+    1.4380    2.3793    0.0055 C   0  0  0

+   -2.4030    0.7574   -0.0047 C   0  0  0

+   -2.6223   -0.6212    0.0031 C   0  0  0

+    2.0038   -1.3749   -0.0022 C   0  0  0

+    3.5420    0.4899   -0.0005 N   0  0  0

+   -3.5792    1.6995   -0.0075 C   0  0  0

+   -4.0331   -1.1511    0.0032 C   0  0  0

+    4.6681   -0.4470   -0.0034 C   0  0  0

+    0.5832   -2.9091    0.0000 H   0  0  0

+    2.4714    2.1994    0.0000 H   0  0  0

+    1.6179    3.4127    0.0000 H   0  0  0

+    0.4046    2.5592    0.0000 H   0  0  0

+    2.8191   -2.0349    0.0000 H   0  0  0

+    3.7199    1.5237    0.0000 H   0  0  0

+   -2.9234    2.5182    0.0000 H   0  0  0

+   -4.3979    2.3553    0.0000 H   0  0  0

+   -4.2350    0.8808    0.0000 H   0  0  0

+   -4.4019   -0.1691    0.0000 H   0  0  0

+   -5.0151   -1.5199    0.0000 H   0  0  0

+   -3.6643   -2.1331    0.0000 H   0  0  0

+    3.9972   -1.2534    0.0000 H   0  0  0

+    5.4745   -1.1179    0.0000 H   0  0  0

+    5.3390    0.3594    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2304-83-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.2699    0.6620    0.0018 C   0  0  0

+   -1.0490   -0.5214    0.0006 C   0  0  0

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+   -0.9038    1.9209   -0.0023 C   0  0  0

+   -2.5109   -0.3989    0.0008 C   0  0  0

+   -0.4294   -1.7713   -0.0004 C   0  0  0

+    1.7350   -0.7128   -0.0001 C   0  0  0

+    1.9709    1.7629    0.0020 C   0  0  0

+   -2.2495    2.0337   -0.0076 C   0  0  0

+   -3.0852    0.8920    0.0025 C   0  0  0

+   -3.3358   -1.5250   -0.0009 C   0  0  0

+    0.9469   -1.8650   -0.0003 C   0  0  0

+    3.2103   -0.8106   -0.0006 C   0  0  0

+    3.3186    1.6987    0.0011 C   0  0  0

+   -4.4807    1.0205    0.0027 C   0  0  0

+   -4.7034   -1.3654   -0.0011 C   0  0  0

+    4.0002    0.4611    0.0006 C   0  0  0

+    3.7645   -1.8900   -0.0014 O   0  0  0

+   -5.2668   -0.0954    0.0014 C   0  0  0

+    5.2153    0.4292    0.0001 O   0  0  0

+   -0.3156    2.7919    0.0000 H   0  0  0

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+   -4.9214    1.9747    0.0000 H   0  0  0

+   -5.3266   -2.2117    0.0000 H   0  0  0

+   -6.3128    0.0075    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4659-45-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.0012    0.2467   -0.1337 C   0  0  0

+   -1.2134    0.9331    0.0047 C   0  0  0

+    1.2063    0.9408    0.0033 C   0  0  0

+    0.0033   -1.1974   -0.4157 C   0  0  0

+   -1.2084    2.2866    0.2748 C   0  0  0

+   -2.7185    0.0845   -0.1634 Cl  0  0  0

+    1.1928    2.2947    0.2735 C   0  0  0

+    2.7167    0.1018   -0.1653 Cl  0  0  0

+    0.0015   -1.5914   -1.5632 O   0  0  0

+    0.0114   -2.3374    0.8935 Cl  0  0  0

+   -0.0098    2.9651    0.4088 C   0  0  0

+   -2.0998    2.8085    0.0000 H   0  0  0

+    2.0809    2.8223    0.0000 H   0  0  0

+   -0.0132    3.9981    0.0000 H   0  0  0

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+  4 10  1  0

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+  7 11  2  0

+  5 12  1  0

+  7 13  1  0

+ 11 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105427-03-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    2.7404    0.1776   -0.6127 C   0  0  0

+    1.3107   -0.2013   -0.3241 C   0  0  0

+    3.2652    1.0786    0.5070 C   0  0  0

+    3.5832   -0.3126    0.4320 O   0  0  0

+    0.3697    0.7567   -0.2091 N   0  0  0

+    1.0068   -1.3684   -0.1954 O   0  0  0

+   -0.9769    0.4019   -0.0729 C   0  0  0

+   -1.9599    1.3825   -0.0894 C   0  0  0

+   -1.3337   -0.9324    0.0733 C   0  0  0

+   -3.2884    1.0289    0.0448 C   0  0  0

+   -2.6636   -1.2793    0.2070 C   0  0  0

+   -3.6399   -0.2998    0.1955 C   0  0  0

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+  5 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134308-13-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    0.1479   -0.0437    0.8331 C   0  0  0

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+    3.2979    1.4357   -0.5921 N   0  3  0

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+   -4.7519    0.4250    0.2467 C   0  0  0

+   -3.3924   -0.3055   -1.5921 C   0  0  0

+    3.8115   -1.3234   -0.5857 O   0  0  0

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+    3.8935    1.2319   -1.6348 O   0  5  0

+   -4.6365   -0.0125   -1.0609 C   0  0  0

+   -5.8705   -0.1651   -1.9124 C   0  0  0

+    0.8772    1.8194    0.0000 H   0  0  0

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+ 20 29  1  0

+ 20 30  1  0

+ 20 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97747-88-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 74                          1 V2000

+   -1.3348   -0.6541    0.0271 C   0  0  0

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+ 33 70  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+85-60-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 66 67                          1 V2000

+    0.0444    1.8915   -0.4312 C   0  0  0

+   -1.2464    1.2518    0.0110 C   0  0  0

+    1.2078    1.1118    0.1252 C   0  0  0

+    0.1156    1.8928   -1.9595 C   0  0  0

+   -1.5847   -0.0079   -0.4471 C   0  0  0

+   -2.0879    1.9235    0.8788 C   0  0  0

+    1.4488   -0.1768   -0.3150 C   0  0  0

+    2.0357    1.6879    1.0706 C   0  0  0

+    1.3434    2.6856   -2.4122 C   0  0  0

+   -2.7674   -0.5968   -0.0429 C   0  0  0

+   -3.2716    1.3393    1.2856 C   0  0  0

+   -1.7134    3.2942    1.3808 C   0  0  0

+    2.5148   -0.8934    0.1930 C   0  0  0

+    3.1033    0.9753    1.5820 C   0  0  0

+    1.7738    3.0947    1.5435 C   0  0  0

+    1.4146    2.6869   -3.9405 C   0  0  0

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+    2.7766   -2.2978   -0.2868 C   0  0  0

+   -4.7797   -0.4999    1.2222 O   0  0  0

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+   -4.4468   -1.8920   -1.3278 C   0  0  0

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+ 28 65  1  0

+ 28 66  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-01-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+    0.0917    0.4443   -0.7374 C   0  0  0

+   -0.8328   -0.0710    0.2812 N   0  0  0

+    1.4451    0.7472   -0.0912 C   0  0  0

+   -1.9622    0.8666    0.3393 C   0  0  0

+   -1.3638   -1.3401   -0.2341 C   0  0  0

+    2.0723   -0.4768    0.2968 O   0  0  0

+    0.3041    1.4540    0.0000 H   0  0  0

+   -0.7391    1.0562    0.0000 H   0  0  0

+    2.3998    1.1386    0.0000 H   0  0  0

+    1.1356    1.7315    0.0000 H   0  0  0

+   -1.3032    1.6605    0.0000 H   0  0  0

+   -2.7561    1.5256    0.0000 H   0  0  0

+   -2.6212    0.0727    0.0000 H   0  0  0

+   -2.3156   -0.9419    0.0000 H   0  0  0

+   -1.7621   -2.2919    0.0000 H   0  0  0

+   -0.4120   -1.7384    0.0000 H   0  0  0

+    2.5428   -1.3950    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+22994-85-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    2.4532    0.8279    0.5542 N   0  0  0

+    3.3432   -0.0902    0.1198 C   0  0  0

+    3.0423    2.0565    0.4230 C   0  0  0

+    1.1065    0.5596    1.0645 C   0  0  0

+    4.4281    0.5266   -0.2619 N   0  0  0

+    3.1246   -1.5538    0.0832 N   0  3  0

+    4.2711    1.8470   -0.0867 C   0  0  0

+    0.1227    0.5843   -0.0767 C   0  0  0

+    3.4776   -2.1982   -0.8882 O   0  0  0

+    2.5917   -2.1137    1.0245 O   0  5  0

+   -1.1860    0.3618    0.1567 N   0  0  0

+    0.5085    0.8043   -1.2053 O   0  0  0

+   -2.1424    0.3858   -0.9528 C   0  0  0

+   -3.5277    0.1098   -0.4278 C   0  0  0

+   -4.3319    1.1559   -0.0161 C   0  0  0

+   -3.9964   -1.1893   -0.3632 C   0  0  0

+   -5.6028    0.9027    0.4656 C   0  0  0

+   -5.2670   -1.4424    0.1183 C   0  0  0

+   -6.0693   -0.3965    0.5355 C   0  0  0

+    2.5919    2.9272    0.0000 H   0  0  0

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+   -3.9872    2.0735    0.0000 H   0  0  0

+   -3.3570   -1.9323    0.0000 H   0  0  0

+   -6.2428    1.6452    0.0000 H   0  0  0

+   -5.6122   -2.3599    0.0000 H   0  0  0

+   -7.0378   -0.5477    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

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+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71382-54-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -0.1027   -0.3611   -0.0981 C   0  0  0

+   -0.0235   -1.7367   -0.1800 C   0  0  0

+    1.1027    0.4982   -0.0808 C   0  0  0

+   -1.3810    0.2510   -0.0220 C   0  0  0

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+   -1.1766   -2.5172   -0.1958 C   0  0  0

+    2.3870   -0.0343   -0.1454 C   0  0  0

+    0.9419    1.8850    0.0026 C   0  0  0

+   -2.5425   -0.5565   -0.0330 C   0  0  0

+   -1.5095    1.6449    0.0643 C   0  0  0

+    2.5805   -1.5296   -0.2338 C   0  0  0

+    2.0647   -2.1595    0.9890 N   0  0  0

+   -2.4135   -1.9530   -0.1302 C   0  0  0

+    3.4871    0.7976   -0.1276 C   0  0  0

+    2.0475    2.7085    0.0202 C   0  0  0

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+   -2.7496    2.2038    0.1367 C   0  0  0

+    3.3194    2.1687   -0.0452 C   0  0  0

+   -3.8946    1.4102    0.1260 C   0  0  0

+    1.2557   -3.4567    0.0000 H   0  0  0

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+  1  2  2  0

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+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+120-83-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.9258    0.2860    0.0029 C   0  0  0

+   -1.1451   -1.0846    0.0006 C   0  0  0

+    0.3662    0.7780    0.0028 C   0  0  0

+   -2.2726    1.3814   -0.0014 Cl  0  0  0

+   -0.0672   -1.9574   -0.0018 C   0  0  0

+   -2.4147   -1.5708    0.0011 O   0  0  0

+    1.4395   -0.0950    0.0005 C   0  0  0

+    1.2223   -1.4616   -0.0018 C   0  0  0

+    3.0610    0.5250   -0.0002 Cl  0  0  0

+    0.5310    1.8026    0.0000 H   0  0  0

+   -0.2293   -2.9825    0.0000 H   0  0  0

+   -3.3839   -1.9420    0.0000 H   0  0  0

+    2.0288   -2.1147    0.0000 H   0  0  0

+  1  2  2  0

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+  1  4  1  0

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+  3  7  2  0

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+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  5 11  1  0

+  6 12  1  0

+  8 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86-59-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    2.0999   -0.5578    0.0010 C   0  0  0

+    1.9172   -1.7592    0.0022 O   0  0  0

+    3.3552   -0.0671   -0.0047 O   0  0  0

+    0.9496    0.3621   -0.0002 C   0  0  0

+   -0.3743   -0.1465   -0.0001 C   0  0  0

+    1.1503    1.7357    0.0042 C   0  0  0

+   -1.4589    0.7635   -0.0014 C   0  0  0

+   -0.6069   -1.4593    0.0007 N   0  0  0

+    0.0717    2.6100    0.0031 C   0  0  0

+   -1.2104    2.1458   -0.0031 C   0  0  0

+   -2.7729    0.2574   -0.0013 C   0  0  0

+   -1.8295   -1.9363    0.0003 C   0  0  0

+   -2.9415   -1.0985    0.0000 C   0  0  0

+    4.3250    0.3120    0.0000 H   0  0  0

+    2.1202    2.1144    0.0000 H   0  0  0

+    0.2447    3.6368    0.0000 H   0  0  0

+   -2.0063    2.8171    0.0000 H   0  0  0

+   -3.5933    0.8986    0.0000 H   0  0  0

+   -1.9715   -2.9678    0.0000 H   0  0  0

+   -3.9003   -1.5046    0.0000 H   0  0  0

+  2  1  2  0

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+  6 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-86-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -1.4255   -0.0005    0.0000 C   0  0  0

+   -0.7151   -1.1914    0.0000 C   0  0  0

+   -0.7164    1.1907    0.0000 C   0  0  0

+    0.6661   -1.1516    0.0000 C   0  0  0

+    0.6653    1.1521    0.0000 C   0  0  0

+    1.3078    0.0006    0.0000 N   0  0  0

+   -2.4620   -0.0010    0.0000 H   0  0  0

+   -1.2139   -2.1000    0.0000 H   0  0  0

+   -1.2160    2.0988    0.0000 H   0  0  0

+    1.2041   -2.0376    0.0000 H   0  0  0

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+  1  2  1  0

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+  3  5  1  0

+  4  6  1  0

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+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  4 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23102-68-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 22                          1 V2000

+    0.7613   -2.0587   -0.3574 C   0  0  0

+   -0.7614   -2.0587   -0.3577 C   0  0  0

+    1.4979   -0.7330   -0.1900 C   0  0  0

+   -0.0002   -2.3051    0.8264 O   0  0  0

+   -1.4979   -0.7329   -0.1902 C   0  0  0

+    0.7591    0.4409   -0.0419 C   0  0  0

+    2.8668   -0.6498   -0.1789 C   0  0  0

+   -0.7591    0.4410   -0.0417 C   0  0  0

+   -2.8668   -0.6496   -0.1793 C   0  0  0

+    1.4648    1.6253    0.1080 C   0  0  0

+    3.1589    1.0903    0.0411 S   0  0  0

+   -1.4647    1.6253    0.1085 C   0  0  0

+   -3.1588    1.0904    0.0412 S   0  0  0

+    1.4530   -2.8997    0.0000 H   0  0  0

+   -1.4531   -2.8996    0.0000 H   0  0  0

+    3.5950   -1.4593    0.0000 H   0  0  0

+   -3.5951   -1.4591    0.0000 H   0  0  0

+    1.0774    2.6429    0.0000 H   0  0  0

+   -1.0772    2.6429    0.0000 H   0  0  0

+  1  2  1  0

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+  1 14  1  0

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+  7 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+873-69-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.1124   -0.2890    0.0029 C   0  0  0

+    1.0580   -1.3149    0.0013 C   0  0  0

+    0.4968    0.9823    0.0019 N   0  0  0

+   -1.3274   -0.6193   -0.0004 C   0  0  0

+    2.4032   -0.9891   -0.0014 C   0  0  0

+    1.7698    1.3182   -0.0006 C   0  0  0

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+   -3.5880    0.0108   -0.0022 O   0  0  0

+    0.7569   -2.3084    0.0000 H   0  0  0

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+    2.0342    2.3220    0.0000 H   0  0  0

+    3.7609    0.6276    0.0000 H   0  0  0

+   -4.5998   -0.2213    0.0000 H   0  0  0

+  1  2  1  0

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+  2 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58071-32-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+207213                          1 V2000

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+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2122-77-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.9262   -0.0710   -0.1280 C   0  0  0

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+   -1.4750   -2.7254   -0.0591 Cl  0  0  0

+    1.2946    0.8284   -0.0350 C   0  0  0

+   -2.4864    1.5276   -0.2812 C   0  0  0

+    1.8101   -0.4547    0.0425 C   0  0  0

+    2.3648    2.1953   -0.0253 Cl  0  0  0

+   -3.9868    1.8090   -0.3836 C   0  0  0

+    3.5261   -0.6945    0.1495 Cl  0  0  0

+   -4.6508    1.2764    0.7643 O   0  0  0

+   -0.4605    1.9852    0.0000 H   0  0  0

+    1.3501   -2.5084    0.0000 H   0  0  0

+   -1.4478    1.5689    0.0000 H   0  0  0

+   -2.4108    2.5642    0.0000 H   0  0  0

+   -3.5612    2.7573    0.0000 H   0  0  0

+   -4.8090    2.4449    0.0000 H   0  0  0

+   -5.4616    0.6261    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 11 13  1  0

+  7  9  1  0

+  3 14  1  0

+  5 15  1  0

+  8 16  1  0

+  8 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+74-83-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  5  4                          1 V2000

+   -1.7091    0.0000    0.0000 C   0  0  0

+    0.2569    0.0000    0.0000 Br  0  0  0

+   -1.7091    1.4745    0.0000 H   0  0  0

+   -3.1836    0.0000    0.0000 H   0  0  0

+   -1.7091   -1.4745    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-21-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.6999   -0.6665   -0.3088 C   0  0  0

+   -0.6999   -0.6665    0.3088 C   0  0  0

+    1.4076    0.5003    0.1152 O   0  0  0

+   -1.4076    0.5003   -0.1152 O   0  0  0

+    0.5149   -1.6731    0.0000 H   0  0  0

+    1.6565   -1.0304    0.0000 H   0  0  0

+   -1.6565   -1.0304    0.0000 H   0  0  0

+   -0.5149   -1.6731    0.0000 H   0  0  0

+    1.9384    1.3754    0.0000 H   0  0  0

+   -1.9384    1.3754    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  4 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+151109-62-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+   -0.1202   -0.2205    0.0753 C   0  0  0

+   -0.8442   -1.4374    0.0255 C   0  0  0

+    1.2910   -0.2635    0.1402 C   0  0  0

+   -0.8142    0.9994    0.0652 C   0  0  0

+   -2.2478   -1.4095   -0.0359 C   0  0  0

+   -0.1473   -2.6601    0.0392 C   0  0  0

+    1.9407   -1.4896    0.1547 C   0  0  0

+    2.0868    0.9766    0.1918 C   0  0  0

+   -2.1685    1.0114    0.0097 C   0  0  0

+   -0.0521    2.2985    0.1157 C   0  0  0

+   -2.9092   -0.1931   -0.0478 C   0  0  0

+   -3.2492   -2.5379   -0.0955 C   0  0  0

+    1.2134   -2.6728    0.1031 C   0  0  0

+    3.4456   -1.5241    0.2274 C   0  0  1

+    3.3750    0.9413   -0.1273 C   0  0  0

+   -0.9528    3.3688    0.0914 F   0  0  0

+    0.7027    2.3509    1.2924 F   0  0  0

+    0.8011    2.3819   -0.9898 F   0  0  0

+   -4.3668   -0.3943   -0.1138 C   0  0  0

+   -4.6348   -1.8793   -0.1464 C   0  0  0

+    4.0296   -0.3453   -0.5484 C   0  0  2

+    3.8584   -1.4468    1.5933 O   0  0  0

+   -5.2058    0.4811   -0.1374 O   0  0  0

+    3.8249   -0.5480   -1.9481 O   0  0  0

+   -0.6804   -3.5678    0.0000 H   0  0  0

+    1.5947    1.9071    0.0000 H   0  0  0

+   -2.6780    1.9325    0.0000 H   0  0  0

+   -3.7884   -3.4420    0.0000 H   0  0  0

+   -2.3998   -3.1596    0.0000 H   0  0  0

+    1.7228   -3.5939    0.0000 H   0  0  0

+    3.5309   -2.5733    0.0000 H   0  0  0

+    3.9375    1.8310    0.0000 H   0  0  0

+   -5.6501   -1.6016    0.0000 H   0  0  0

+   -5.0010   -2.8662    0.0000 H   0  0  0

+    5.0822   -0.3397    0.0000 H   0  0  0

+    4.8930   -1.2531    0.0000 H   0  0  0

+    3.0769   -1.2887    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  8  1  0

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+ 15 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 24 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98033-23-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.4560    0.2082   -0.0023 C   0  0  0

+   -1.0004    0.0371   -0.0007 C   0  0  0

+    0.9860    1.5186   -0.0015 C   0  0  0

+    1.3183   -0.8883    0.0012 C   0  0  0

+   -1.8196    1.1887    0.0016 C   0  0  0

+   -1.5856   -1.2297   -0.0019 C   0  0  0

+    0.1119    2.6304    0.0013 C   0  0  0

+    2.3771    1.6984   -0.0030 C   0  0  0

+    2.6854   -0.6807    0.0000 C   0  0  0

+   -1.2272    2.4731    0.0018 C   0  0  0

+   -3.2142    1.0403    0.0031 C   0  0  0

+   -2.9615   -1.3445   -0.0008 C   0  0  0

+    3.2041    0.6160   -0.0052 C   0  0  0

+    3.5529   -1.7746    0.0040 N   0  0  0

+   -3.7666   -0.2053    0.0024 C   0  0  0

+   -3.5356   -2.5761   -0.0024 O   0  0  0

+    5.0021   -1.5602    0.0027 C   0  0  0

+    0.9330   -1.8619    0.0000 H   0  0  0

+   -0.9852   -2.0876    0.0000 H   0  0  0

+    0.5137    3.5973    0.0000 H   0  0  0

+    2.7799    2.6649    0.0000 H   0  0  0

+   -1.8422    3.3205    0.0000 H   0  0  0

+   -3.8308    1.8866    0.0000 H   0  0  0

+    4.2415    0.7579    0.0000 H   0  0  0

+    3.1677   -2.7483    0.0000 H   0  0  0

+   -4.8086   -0.3087    0.0000 H   0  0  0

+   -3.9780   -3.5252    0.0000 H   0  0  0

+    5.1553   -2.5960    0.0000 H   0  0  0

+    6.0379   -1.4070    0.0000 H   0  0  0

+    4.8489   -0.5244    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+  9 14  1  0

+ 11 15  2  0

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+ 14 17  1  0

+  7 10  2  0

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+ 10 22  1  0

+ 11 23  1  0

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+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96910-70-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+    1.5241   -0.5100    0.0414 C   0  0  2

+    0.4561   -1.5692    0.2198 C   0  0  1

+    1.4353   -1.2903    1.3578 C   0  0  0

+    1.0632    0.9067    0.1844 C   0  0  0

+    2.6766   -0.7571   -0.8976 C   0  0  0

+   -0.9508   -1.1018    0.4661 C   0  0  1

+    0.6107   -2.8948   -0.5283 C   0  0  0

+   -0.0751    1.2265    0.7117 C   0  0  0

+    1.9640    2.0100   -0.3077 C   0  0  0

+    3.8122   -0.6571   -0.4992 O   0  0  0

+   -1.0468    0.2148    1.2480 C   0  0  1

+   -1.6947   -0.7989   -0.8508 C   0  0  0

+    1.3385    3.2740   -0.0774 O   0  0  0

+   -2.4737    0.7277    0.9319 C   0  0  0

+   -2.8790    0.0893   -0.4091 C   0  0  0

+   -3.1344    1.1790   -1.4523 C   0  0  0

+   -4.1350   -0.7649   -0.2258 C   0  0  0

+    1.5821   -2.2804    0.0000 H   0  0  0

+    2.4361   -1.2733    0.0000 H   0  0  0

+    2.6149   -1.7561    0.0000 H   0  0  0

+   -1.2975   -2.0408    0.0000 H   0  0  0

+   -0.3835   -3.0108    0.0000 H   0  0  0

+    0.7267   -3.8890    0.0000 H   0  0  0

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+   -0.3381    2.1923    0.0000 H   0  0  0

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+   -0.1053   -0.1249    0.0000 H   0  0  0

+   -2.5782   -1.2694    0.0000 H   0  0  0

+   -1.6434   -1.7985    0.0000 H   0  0  0

+    0.8946    4.1711    0.0000 H   0  0  0

+   -2.0668    1.6422    0.0000 H   0  0  0

+   -3.3559    1.2006    0.0000 H   0  0  0

+   -2.1599    1.4074    0.0000 H   0  0  0

+   -3.3628    2.1535    0.0000 H   0  0  0

+   -4.1089    0.9506    0.0000 H   0  0  0

+   -4.6979    0.0628    0.0000 H   0  0  0

+   -4.9627   -1.3278    0.0000 H   0  0  0

+   -3.5721   -1.5926    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 14 32  1  0

+ 14 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 16 36  1  0

+ 17 37  1  0

+ 17 38  1  0

+ 17 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+125973-99-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.1641    0.6633    0.0035 C   0  0  0

+    0.3507   -0.5636    0.0037 C   0  0  0

+    0.9984    1.6283   -0.0006 C   0  0  0

+   -1.6277    1.0220    0.0012 C   0  0  0

+    1.8137   -0.4808   -0.0001 C   0  0  0

+    2.2008    0.8085   -0.0026 O   0  0  0

+   -2.6161   -0.4860   -0.0014 Cl  0  0  0

+    2.5664   -1.4351   -0.0002 O   0  0  0

+   -0.2297   -1.4924    0.0000 H   0  0  0

+    1.6969    2.4719    0.0000 H   0  0  0

+    0.2235    2.4023    0.0000 H   0  0  0

+   -1.2484    2.0495    0.0000 H   0  0  0

+   -2.6057    1.5150    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  2  0

+  5  6  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3689-24-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 36                          1 V2000

+   -0.0037    0.4001   -1.0524 O   0  0  0

+   -1.2771   -0.0895   -0.1976 P   0  0  0

+    1.3072   -0.0331   -0.2241 P   0  0  0

+   -1.5281    0.9299    1.0231 O   0  0  0

+   -2.5786   -0.1232   -1.1448 O   0  0  0

+   -0.9543   -1.7970    0.4754 S   0  0  0

+    1.4577   -1.6357   -0.2572 O   0  0  0

+    2.6091    0.6420   -0.8884 O   0  0  0

+    1.1434    0.5392    1.5418 S   0  0  0

+   -1.6014    2.2405    0.4583 C   0  0  0

+   -3.6294   -0.7195   -0.3818 C   0  0  0

+    2.6960   -1.9476    0.3842 C   0  0  0

+    2.3678    2.0498   -0.9317 C   0  0  0

+   -1.9757    3.2458    1.5493 C   0  0  0

+   -4.9022   -0.7822   -1.2286 C   0  0  0

+    2.9013   -3.4637    0.3867 C   0  0  0

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+   -0.6646    1.8798    0.0000 H   0  0  0

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+   -1.0349    3.5961    0.0000 H   0  0  0

+   -2.3260    4.1866    0.0000 H   0  0  0

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+   -4.9516    0.2204    0.0000 H   0  0  0

+   -5.9048   -0.8316    0.0000 H   0  0  0

+   -4.8528   -1.7848    0.0000 H   0  0  0

+    1.9065   -3.5984    0.0000 H   0  0  0

+    3.0360   -4.4585    0.0000 H   0  0  0

+    3.8961   -3.3290    0.0000 H   0  0  0

+    4.1181    1.8951    0.0000 H   0  0  0

+    4.4905    3.2651    0.0000 H   0  0  0

+    3.1205    3.6375    0.0000 H   0  0  0

+  2  1  1  0

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+  4  2  1  0

+  5  2  1  0

+  6  2  2  0

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+ 10 18  1  0

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+ 16 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80984-67-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 46                          1 V2000

+    0.8491   -1.0849    0.1696 C   0  0  0

+    1.7686   -2.2700    0.3488 C   0  0  0

+    1.3792    0.1931    0.0157 C   0  0  0

+   -0.5132   -1.2796    0.1541 C   0  0  0

+    3.2830   -2.0127    0.3534 C   0  0  0

+    2.5805   -2.4413   -0.8634 N   0  0  0

+    2.8411    0.4405    0.0204 C   0  0  0

+    0.5135    1.2785   -0.1489 C   0  0  0

+   -1.3794   -0.1939   -0.0109 C   0  0  0

+    3.7604   -0.5906    0.1796 C   0  0  0

+    3.3032    1.7503   -0.1393 C   0  0  0

+   -0.8493    1.0844   -0.1586 C   0  0  0

+   -2.8413   -0.4412   -0.0230 C   0  0  0

+    5.1142   -0.3212    0.1790 C   0  0  0

+    4.6570    2.0099   -0.1391 C   0  0  0

+   -1.7676    2.2705   -0.3375 C   0  0  0

+   -3.7598    0.5907   -0.1820 C   0  0  0

+   -3.3048   -1.7513    0.1299 C   0  0  0

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+   -3.2822    2.0144   -0.3422 C   0  0  0

+   -2.5794    2.4422    0.8747 N   0  0  0

+   -5.1138    0.3219   -0.1885 C   0  0  0

+   -4.6587   -2.0103    0.1225 C   0  0  0

+   -5.5645   -0.9767   -0.0367 C   0  0  0

+    1.2187   -3.1481    0.0000 H   0  0  0

+   -0.8953   -2.2426    0.0000 H   0  0  0

+    4.0929   -2.6589    0.0000 H   0  0  0

+    2.7557   -3.4625    0.0000 H   0  0  0

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+    4.9931    2.9899    0.0000 H   0  0  0

+   -1.2171    3.1482    0.0000 H   0  0  0

+   -2.6295   -2.5371    0.0000 H   0  0  0

+    6.5804    1.1766    0.0000 H   0  0  0

+   -4.0918    2.6609    0.0000 H   0  0  0

+   -2.7539    3.4635    0.0000 H   0  0  0

+   -5.7941    1.1033    0.0000 H   0  0  0

+   -4.9955   -2.9901    0.0000 H   0  0  0

+   -6.5814   -1.1752    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+ 13 18  1  0

+ 14 19  2  0

+ 16 20  1  0

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+ 17 22  1  0

+ 18 23  2  0

+ 22 24  2  0

+  5  6  1  0

+  7 10  2  0

+  9 12  2  0

+ 15 19  1  0

+ 17 20  1  0

+ 20 21  1  0

+ 23 24  1  0

+  2 25  1  0

+  4 26  1  0

+  5 27  1  0

+  6 28  1  0

+  8 29  1  0

+ 11 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+ 23 39  1  0

+ 24 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+885-62-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.0425    0.6665   -0.0006 C   0  0  0

+   -0.5207   -0.5941    0.0636 C   0  0  0

+    1.4172    0.8083   -0.0384 C   0  0  0

+   -0.8264    1.8643   -0.0350 N   0  3  0

+    0.2908   -1.7132    0.0899 C   0  0  0

+   -2.2727   -0.7749    0.1123 S   0  0  0

+    2.2284   -0.3104   -0.0120 C   0  0  0

+   -1.7750    1.9069   -0.7978 O   0  0  0

+   -0.5927    2.8074    0.6994 O   0  5  0

+    1.6651   -1.5714    0.0517 C   0  0  0

+   -2.7747   -0.7320   -1.3238 O   0  0  0

+   -2.5116   -2.1004    0.5654 O   0  0  0

+   -2.7657    0.4065    0.7291 O   0  0  0

+    3.7002   -0.1585   -0.0520 N   0  3  0

+    4.4150   -1.1444   -0.0287 O   0  0  0

+    4.1965    0.9524   -0.1081 O   0  5  0

+    1.8398    1.7538    0.0000 H   0  0  0

+   -0.1318   -2.6587    0.0000 H   0  0  0

+    2.2725   -2.4102    0.0000 H   0  0  0

+   -3.8066   -0.6438    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  6 12  2  0

+  6 13  2  0

+  7 14  1  0

+ 14 15  2  0

+ 14 16  1  0

+  7 10  1  0

+  3 17  1  0

+  5 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2422-79-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.3336    0.0600   -0.0025 C   0  0  0

+   -1.7672   -0.2661   -0.0021 C   0  0  0

+    0.0651    1.4686    0.0000 C   0  0  0

+    0.6234   -0.9409    0.0005 C   0  0  0

+   -2.7125    0.7812    0.0008 C   0  0  0

+   -2.2014   -1.5923   -0.0034 C   0  0  0

+    1.4120    1.8128    0.0001 C   0  0  0

+   -0.9681    2.5030    0.0029 C   0  0  0

+    1.9797   -0.6007   -0.0001 C   0  0  0

+    0.2054   -2.3888    0.0047 C   0  0  0

+   -2.2734    2.1731    0.0028 C   0  0  0

+   -4.0788    0.4684    0.0013 C   0  0  0

+   -3.5507   -1.8674   -0.0019 C   0  0  0

+    2.3821    0.8076   -0.0022 C   0  0  0

+    2.9805   -1.5926    0.0033 C   0  0  0

+   -4.4803   -0.8360   -0.0011 C   0  0  0

+    3.7570    1.1196   -0.0020 C   0  0  0

+    4.2887   -1.2248    0.0031 C   0  0  0

+    4.6721    0.1154   -0.0042 C   0  0  0

+   -1.5041   -2.3750    0.0000 H   0  0  0

+    1.6981    2.8212    0.0000 H   0  0  0

+   -0.6893    3.5135    0.0000 H   0  0  0

+   -0.8017   -2.0981    0.0000 H   0  0  0

+   -0.0853   -3.3959    0.0000 H   0  0  0

+    1.2125   -2.6795    0.0000 H   0  0  0

+   -2.9928    2.9355    0.0000 H   0  0  0

+   -4.7923    1.2364    0.0000 H   0  0  0

+   -3.8785   -2.8631    0.0000 H   0  0  0

+    2.7177   -2.6073    0.0000 H   0  0  0

+   -5.5038   -1.0622    0.0000 H   0  0  0

+    4.0711    2.1197    0.0000 H   0  0  0

+    5.0282   -1.9677    0.0000 H   0  0  0

+    5.6927    0.3546    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  7 14  1  0

+  9 15  1  0

+ 12 16  1  0

+ 14 17  1  0

+ 15 18  2  0

+ 17 19  2  0

+  8 11  2  0

+  9 14  2  0

+ 13 16  2  0

+ 18 19  1  0

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+  8 22  1  0

+ 10 23  1  0

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+ 11 26  1  0

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+ 13 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117333-21-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -0.9180   -0.8038    0.3500 C   0  0  0

+   -2.1588   -0.2364    0.0161 C   0  0  0

+    0.0176    0.3193    0.5088 C   0  0  0

+   -0.7921   -2.1872    0.4580 C   0  0  0

+   -1.9800    1.1404   -0.0231 N   0  0  0

+   -3.2526   -1.0614   -0.1988 C   0  0  0

+   -0.6687    1.4442    0.2756 C   0  0  0

+    1.4781    0.2217    0.8672 C   0  0  0

+   -1.8900   -2.9923    0.2358 C   0  0  0

+   -2.8994    2.0025   -0.2976 N   0  0  0

+   -3.1160   -2.4307   -0.0838 C   0  0  0

+    2.3153    0.1762   -0.4127 C   0  0  0

+   -2.6365    3.1918   -0.3052 O   0  0  0

+    3.7790    0.2231   -0.0573 C   0  0  0

+    2.0358   -1.0325   -1.1219 O   0  0  0

+    4.2729    1.2740    0.6160 O   0  0  0

+    4.5081   -0.6853   -0.3785 O   0  0  0

+    0.1343   -2.6050    0.0000 H   0  0  0

+   -4.1836   -0.6539    0.0000 H   0  0  0

+   -0.2751    2.3811    0.0000 H   0  0  0

+    0.9159   -0.6249    0.0000 H   0  0  0

+    1.9339   -0.6866    0.0000 H   0  0  0

+   -1.7869   -4.0033    0.0000 H   0  0  0

+   -3.9429   -3.0214    0.0000 H   0  0  0

+    2.3266    1.1924    0.0000 H   0  0  0

+    1.8068   -2.0226    0.0000 H   0  0  0

+    4.7052    2.1937    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+ 10 13  2  0

+ 12 14  1  0

+ 12 15  1  0

+ 14 16  1  0

+ 14 17  2  0

+  5  7  1  0

+  9 11  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51-28-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.9831   -0.0888   -0.0101 C   0  0  0

+   -0.2853   -0.6349    0.0335 C   0  0  0

+    1.1423    1.2873   -0.0815 C   0  0  0

+    2.1710   -0.9711    0.0255 N   0  3  0

+   -1.3952    0.1889    0.0061 C   0  0  0

+    0.0268    2.1120   -0.1089 C   0  0  0

+    2.3889    1.8269   -0.1241 O   0  0  0

+    2.1902   -1.9937   -0.6359 O   0  0  0

+    3.1294   -0.6745    0.7163 O   0  5  0

+   -1.2390    1.5611   -0.0646 C   0  0  0

+   -2.7529   -0.3988    0.0529 N   0  3  0

+   -3.7314    0.3261    0.0288 O   0  0  0

+   -2.8916   -1.6073    0.1156 O   0  5  0

+   -0.4052   -1.6637    0.0000 H   0  0  0

+    0.1437    3.1411    0.0000 H   0  0  0

+    3.3394    2.2383    0.0000 H   0  0  0

+   -2.0717    2.1770    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+ 11 12  2  0

+ 11 13  1  0

+  6 10  2  0

+  2 14  1  0

+  6 15  1  0

+  7 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+443-48-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.4920    0.4517    0.2425 N   0  0  0

+   -0.8576    0.4974    0.0185 C   0  0  0

+    0.9677    1.7041    0.0731 C   0  0  0

+    1.2734   -0.7334    0.6046 C   0  0  0

+   -1.1599    1.7754   -0.2799 C   0  0  0

+   -1.8031   -0.6394    0.0904 N   0  3  0

+   -0.0259    2.4904   -0.2392 N   0  0  0

+    2.4074    2.1243    0.2207 C   0  0  0

+    1.6095   -1.5283   -0.6587 C   0  0  0

+   -1.7335   -1.4319    1.0126 O   0  0  0

+   -2.6505   -0.7822   -0.7727 O   0  5  0

+    2.3717   -2.6843   -0.3055 O   0  0  0

+    2.2765   -0.7963    0.0000 H   0  0  0

+    1.7774    0.1362    0.0000 H   0  0  0

+   -2.0903    2.1557    0.0000 H   0  0  0

+    2.6890    1.1594    0.0000 H   0  0  0

+    3.3723    2.4059    0.0000 H   0  0  0

+    2.1258    3.0892    0.0000 H   0  0  0

+    0.6064   -1.4654    0.0000 H   0  0  0

+    1.1055   -2.3979    0.0000 H   0  0  0

+    2.9250   -3.5234    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  5  7  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13366-73-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 32                          1 V2000

+   -1.1436   -0.5752    0.0000 C   0  0  1

+    0.7965    1.4840    0.0000 C   0  0  2

+   -2.5834   -0.4357    0.0000 C   0  0  1

+   -0.3404   -1.4976    0.0000 C   0  0  2

+   -0.6331    1.1675    0.0000 C   0  0  1

+    2.1783    0.2587    0.0000 C   0  0  1

+   -1.1981    0.1736    0.0000 C   0  0  1

+   -3.1382    0.7012    0.0000 C   0  0  0

+    0.2383   -0.7931    0.0000 C   0  0  1

+    1.8856   -1.3376    0.0000 C   0  0  0

+   -1.1811   -2.3996    0.0000 Cl  0  0  0

+   -1.9741    1.7120    0.0000 C   0  0  0

+    1.4227   -0.7182    0.0000 C   0  0  1

+    3.5636    0.6671    0.0000 Cl  0  0  0

+   -3.3015    2.1954    0.0000 O   0  0  0

+    0.4833    0.1532    0.0000 Cl  0  0  0

+    2.1579   -2.4745    0.0000 Cl  0  0  0

+    3.0905   -1.9639    0.0000 Cl  0  0  0

+    1.1777    0.2383    0.0000 Cl  0  0  0

+   -1.6340   -1.5277    0.0000 H   0  0  0

+    1.0655    2.5210    0.0000 H   0  0  0

+   -3.1942   -1.3159    0.0000 H   0  0  0

+   -0.5433    2.2351    0.0000 H   0  0  0

+   -1.9158    0.9690    0.0000 H   0  0  0

+   -4.1674    0.4037    0.0000 H   0  0  0

+   -1.5892    2.7118    0.0000 H   0  0  0

+    1.9248   -1.6646    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  3  8  1  0

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+  5 12  1  0

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+  5  7  1  0

+  6 10  1  0

+  7  9  1  0

+  8 12  1  0

+  9 13  1  0

+ 12 15  1  0

+  1 20  1  0

+  2 21  1  0

+  3 22  1  0

+  5 23  1  0

+  7 24  1  0

+  8 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+585-79-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    1.7035    0.2098   -0.0034 C   0  0  0

+    0.4534   -0.3795   -0.0033 C   0  0  0

+    1.8185    1.5876   -0.0008 C   0  0  0

+    2.9193   -0.6342   -0.0001 N   0  3  0

+   -0.6830    0.4094   -0.0006 C   0  0  0

+    0.6833    2.3762    0.0019 C   0  0  0

+    4.0211   -0.1149   -0.0001 O   0  0  0

+    2.8181   -1.8479    0.0028 O   0  5  0

+   -0.5675    1.7877    0.0019 C   0  0  0

+   -2.3937   -0.3963    0.0001 Br  0  0  0

+    0.3673   -1.4128    0.0000 H   0  0  0

+    2.7565    2.0294    0.0000 H   0  0  0

+    0.7700    3.4094    0.0000 H   0  0  0

+   -1.4189    2.3794    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6  9  1  0

+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+31551-45-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.7431   -0.7879   -0.0009 C   0  0  0

+   -0.7431   -0.7878   -0.0007 C   0  0  0

+    1.1921    0.5434   -0.0005 C   0  0  0

+    1.6688   -1.8215    0.0036 C   0  0  0

+   -1.1919    0.5431    0.0000 C   0  0  0

+   -1.6690   -1.8217   -0.0010 C   0  0  0

+    0.0000    1.4239    0.0001 C   0  0  0

+    2.5550    0.8147   -0.0003 C   0  0  0

+    3.0258   -1.5376    0.0026 C   0  0  0

+   -2.5553    0.8144    0.0000 C   0  0  0

+   -3.0256   -1.5379   -0.0006 C   0  0  0

+   -0.0002    2.6382    0.0012 O   0  0  0

+    3.4665   -0.2287   -0.0005 C   0  0  0

+   -3.4664   -0.2286   -0.0007 C   0  0  0

+    4.9182    0.0605   -0.0007 N   0  3  0

+   -4.9181    0.0605   -0.0001 N   0  3  0

+    5.7215   -0.8550   -0.0009 O   0  0  0

+    5.3094    1.2139   -0.0008 O   0  5  0

+   -5.7214   -0.8550   -0.0007 O   0  0  0

+   -5.3093    1.2140    0.0009 O   0  5  0

+    1.3445   -2.8099    0.0000 H   0  0  0

+   -1.3446   -2.8101    0.0000 H   0  0  0

+    2.8902    1.7994    0.0000 H   0  0  0

+    3.7165   -2.3154    0.0000 H   0  0  0

+   -2.8906    1.7991    0.0000 H   0  0  0

+   -3.7163   -2.3157    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+  3  7  1  0

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+ 16 20  1  0

+  5  7  1  0

+  9 13  2  0

+ 11 14  1  0

+  4 21  1  0

+  6 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15444-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+   -0.2128    0.2674    0.0030 C   0  0  0

+   -0.0678   -1.1340   -0.0282 C   0  0  0

+    0.9773    1.1338    0.0520 C   0  0  0

+   -1.4921    0.8198   -0.0188 C   0  0  0

+    1.2032   -1.7461   -0.0139 C   0  0  0

+   -1.2219   -1.9572   -0.0758 C   0  0  0

+    2.2646    0.5607    0.0677 C   0  0  0

+    0.8428    2.5219    0.0828 C   0  0  0

+   -2.6231   -0.0095   -0.0714 C   0  0  0

+   -1.6450    2.1667    0.0113 O   0  0  0

+    2.4141   -0.9027    0.0355 C   0  0  0

+    1.3012   -3.0665   -0.0451 N   0  0  0

+   -2.4985   -1.3686   -0.0905 C   0  0  0

+   -1.0408   -3.3484   -0.1065 C   0  0  0

+    3.3900    1.3878    0.1138 C   0  0  0

+    1.9657    3.3200    0.1281 C   0  0  0

+   -3.8619    0.5491   -0.0915 O   0  0  0

+   -2.0361    2.5674   -1.3034 C   0  0  0

+    3.5202   -1.4106    0.0490 O   0  0  0

+    0.2444   -3.8532   -0.0899 C   0  0  0

+    3.2332    2.7558    0.1435 C   0  0  0

+   -4.2134    0.8233    1.2662 C   0  0  0

+   -0.1080    2.9558    0.0000 H   0  0  0

+   -3.3521   -1.9717    0.0000 H   0  0  0

+   -1.8645   -3.9916    0.0000 H   0  0  0

+    4.3479    0.9698    0.0000 H   0  0  0

+    1.8618    4.3599    0.0000 H   0  0  0

+   -1.2882    3.2974    0.0000 H   0  0  0

+   -2.7661    3.3153    0.0000 H   0  0  0

+   -2.7840    1.8374    0.0000 H   0  0  0

+    0.3828   -4.8891    0.0000 H   0  0  0

+    4.0758    3.3741    0.0000 H   0  0  0

+   -3.5706    1.6473    0.0000 H   0  0  0

+   -5.0374    1.4661    0.0000 H   0  0  0

+   -4.8562   -0.0007    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  2  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  2  0

+ 12 20  1  0

+ 15 21  2  0

+ 17 22  1  0

+  7 11  1  0

+  9 13  2  0

+ 14 20  2  0

+ 16 21  1  0

+  8 23  1  0

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+ 16 27  1  0

+ 18 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+ 20 31  1  0

+ 21 32  1  0

+ 22 33  1  0

+ 22 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3817-11-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+    0.6173   -0.6992    0.1291 N   0  0  0

+   -0.5700   -0.1023    0.7459 C   0  0  0

+    1.5323    0.1337   -0.6553 C   0  0  0

+    0.8599   -1.9570    0.2812 N   0  0  0

+   -1.7452   -0.1794   -0.2307 C   0  0  0

+    2.6128    0.7084    0.2629 C   0  0  0

+    1.8470   -2.4532   -0.2316 O   0  0  0

+   -2.9852    0.4439    0.4134 C   0  0  0

+    3.5685    1.5783   -0.5563 C   0  0  0

+   -4.1605    0.3668   -0.5632 C   0  0  0

+    4.6490    2.1530    0.3619 C   0  0  0

+   -5.3186    0.9490    0.0384 O   0  0  0

+    0.1036    0.5360    0.0000 H   0  0  0

+   -0.9416    0.7480    0.0000 H   0  0  0

+    1.4874    1.0606    0.0000 H   0  0  0

+    0.6747    0.4882    0.0000 H   0  0  0

+   -2.4188   -0.8177    0.0000 H   0  0  0

+   -1.3736   -1.0297    0.0000 H   0  0  0

+    2.6577   -0.2185    0.0000 H   0  0  0

+    3.4704    0.3539    0.0000 H   0  0  0

+   -2.3116    1.0822    0.0000 H   0  0  0

+   -3.3568    1.2942    0.0000 H   0  0  0

+    3.5236    2.5052    0.0000 H   0  0  0

+    2.7109    1.9328    0.0000 H   0  0  0

+   -4.8341   -0.2715    0.0000 H   0  0  0

+   -3.7889   -0.4835    0.0000 H   0  0  0

+    5.0848    1.3337    0.0000 H   0  0  0

+    5.4683    2.5888    0.0000 H   0  0  0

+    4.2132    2.9723    0.0000 H   0  0  0

+   -6.1477    1.3658    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  5 17  1  0

+  5 18  1  0

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+  8 21  1  0

+  8 22  1  0

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+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2431-96-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    1.4409    0.4561    0.2508 C   0  0  0

+    0.0158    0.8883    0.4818 C   0  0  0

+    2.0960    0.8256   -0.9092 C   0  0  0

+    2.0948   -0.3050    1.2013 C   0  0  0

+   -0.9213   -0.1502   -0.0789 C   0  0  0

+    3.4030    0.4291   -1.1210 C   0  0  0

+    3.4022   -0.7016    0.9895 C   0  0  0

+   -2.2544    0.0248    0.0135 N   0  0  0

+   -0.4758   -1.1436   -0.6134 O   0  0  0

+    4.0552   -0.3370   -0.1728 C   0  0  0

+   -2.7940    1.1478    0.7843 C   0  0  0

+   -3.1639   -0.9078   -0.6567 C   0  0  0

+   -3.0619    2.3274   -0.1525 C   0  0  0

+   -3.3030   -2.1780    0.1848 C   0  0  0

+    0.4198    1.7441    0.0000 H   0  0  0

+   -0.7719    1.4129    0.0000 H   0  0  0

+    1.9926    1.7663    0.0000 H   0  0  0

+    1.5779   -1.0978    0.0000 H   0  0  0

+    3.9217    1.2207    0.0000 H   0  0  0

+    3.5036   -1.6425    0.0000 H   0  0  0

+    4.9866   -0.5047    0.0000 H   0  0  0

+   -3.7164    1.3593    0.0000 H   0  0  0

+   -3.3848    0.4084    0.0000 H   0  0  0

+   -3.6140   -0.0753    0.0000 H   0  0  0

+   -4.0927   -1.0896    0.0000 H   0  0  0

+   -2.1390    2.5370    0.0000 H   0  0  0

+   -3.2715    3.2503    0.0000 H   0  0  0

+   -3.9848    2.1178    0.0000 H   0  0  0

+   -4.2438   -2.0750    0.0000 H   0  0  0

+   -3.4060   -3.1188    0.0000 H   0  0  0

+   -2.3622   -2.2810    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

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+  6 10  1  0

+  8 11  1  0

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+ 11 13  1  0

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+  7 10  2  0

+  2 15  1  0

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+  4 18  1  0

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+ 10 21  1  0

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+ 13 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+77-78-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.0000   -0.3780    0.0000 S   0  0  0

+   -0.8465    0.5233    0.8874 O   0  0  0

+    0.8469    0.5229   -0.8875 O   0  0  0

+    0.9134   -1.0302    0.8716 O   0  0  0

+   -0.9136   -1.0300   -0.8715 O   0  0  0

+   -1.7854    1.1799    0.0333 C   0  0  0

+    1.7852    1.1801   -0.0334 C   0  0  0

+   -1.2930    1.8840    0.0000 H   0  0  0

+   -2.4895    1.6723    0.0000 H   0  0  0

+   -2.2778    0.4758    0.0000 H   0  0  0

+    2.2781    0.4763    0.0000 H   0  0  0

+    2.4890    1.6730    0.0000 H   0  0  0

+    1.2923    1.8839    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  6  8  1  0

+  6  9  1  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86334-95-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+    0.7207    0.2063    0.3851 C   0  0  0

+   -0.6519    0.0807    1.0494 C   0  0  0

+    1.7969   -0.3191    1.3379 C   0  0  2

+    0.7337   -0.5512   -0.8233 O   0  0  0

+    0.9800    1.5794    0.0864 O   0  0  0

+   -1.6831    0.5834    0.1383 N   0  0  0

+    3.1707   -0.1578    0.6773 C   0  0  1

+    1.5586   -1.7017    1.6098 O   0  0  0

+    1.9568   -0.2651   -1.4989 C   0  0  0

+   -2.3305   -0.3272   -0.8093 C   0  0  0

+   -2.0211    1.8279    0.1703 N   0  0  0

+    3.1343   -0.8291   -0.7003 C   0  0  1

+    3.4643    1.2321    0.5221 O   0  0  0

+   -3.5508   -0.9355   -0.1675 C   0  0  0

+   -2.8784    2.2459   -0.5872 O   0  0  0

+    4.3537   -0.5586   -1.3944 O   0  0  0

+   -4.3064   -1.8069   -0.8541 O   0  0  0

+   -3.8492   -0.6387    0.9651 O   0  0  0

+   -1.3229   -0.5768    0.0000 H   0  0  0

+   -0.2575   -0.7719    0.0000 H   0  0  0

+    1.9546    0.6070    0.0000 H   0  0  0

+    1.1543    2.5025    0.0000 H   0  0  0

+    4.1021   -0.2807    0.0000 H   0  0  0

+    1.3990   -2.6275    0.0000 H   0  0  0

+    2.5936    0.4256    0.0000 H   0  0  0

+    1.4836    0.5465    0.0000 H   0  0  0

+   -2.2346   -1.2617    0.0000 H   0  0  0

+   -1.4221   -0.5668    0.0000 H   0  0  0

+    3.0273   -1.7624    0.0000 H   0  0  0

+    3.6585    2.1513    0.0000 H   0  0  0

+    5.2708   -0.3552    0.0000 H   0  0  0

+   -4.9218   -2.5167    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+ 10 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4685-14-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.7420   -0.0002   -0.0018 C   0  0  0

+   -0.7420    0.0000   -0.0016 C   0  0  0

+    1.4598    1.1273   -0.4092 C   0  0  0

+    1.4597   -1.1262    0.4111 C   0  0  0

+   -1.4598   -1.1275   -0.4088 C   0  0  0

+   -1.4597    1.1260    0.4114 C   0  0  0

+    2.8393    1.0846   -0.3935 C   0  0  0

+    2.8389   -1.0836    0.3957 C   0  0  0

+   -2.8394   -1.0846   -0.3933 C   0  0  0

+   -2.8388    1.0836    0.3959 C   0  0  0

+    3.4786   -0.0003   -0.0012 N   0  3  0

+   -3.4786    0.0005   -0.0013 N   0  3  0

+    4.9436   -0.0006   -0.0014 C   0  0  0

+   -4.9436    0.0009   -0.0016 C   0  0  0

+    0.9911    2.0135    0.0000 H   0  0  0

+    0.9913   -2.0125    0.0000 H   0  0  0

+   -0.9912   -2.0137    0.0000 H   0  0  0

+   -0.9912    2.0122    0.0000 H   0  0  0

+    3.3501    1.9472    0.0000 H   0  0  0

+    3.3492   -1.9464    0.0000 H   0  0  0

+   -3.3503   -1.9471    0.0000 H   0  0  0

+   -3.3490    1.9465    0.0000 H   0  0  0

+    4.9434   -1.0030    0.0000 H   0  0  0

+    5.9460   -0.0008    0.0000 H   0  0  0

+    4.9438    1.0018    0.0000 H   0  0  0

+   -4.9433    1.0033    0.0000 H   0  0  0

+   -5.9460    0.0012    0.0000 H   0  0  0

+   -4.9439   -1.0015    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

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+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7241-98-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -0.3619   -0.3930    0.3167 C   0  0  0

+   -1.7288   -0.2054    0.3422 C   0  0  0

+    0.4931    0.7205    0.1666 C   0  0  0

+    0.1635   -1.6368    0.4549 O   0  0  0

+   -2.2772    1.0672    0.2315 C   0  0  0

+   -2.8793   -1.1798    0.4928 C   0  0  1

+    1.8878    0.5278    0.0897 C   0  0  0

+   -0.0625    2.0130    0.0843 C   0  0  0

+    1.3971   -1.8723   -0.0617 C   0  0  0

+   -3.6355    1.0208    0.2557 O   0  0  0

+   -1.4308    2.1737    0.1125 C   0  0  0

+   -4.0677   -0.2276    0.8187 C   0  0  1

+   -3.2305   -1.7496   -0.8973 C   0  0  0

+    2.3659   -0.7720    0.0023 C   0  0  0

+    2.8283    1.6997    0.0977 C   0  0  0

+    0.7472    3.0957   -0.0220 O   0  0  0

+    1.6857   -2.9464   -0.5554 O   0  0  0

+   -5.1604   -0.7281    0.0190 O   0  0  0

+   -4.5759   -1.0802   -1.2532 C   0  0  0

+    3.8124   -1.0237   -0.0379 C   0  0  0

+    4.2203    1.2659    0.5602 C   0  0  0

+    0.6203    3.5765   -1.3616 C   0  0  0

+    4.6167    0.0674   -0.1717 O   0  0  0

+    4.2683   -2.1477    0.0444 O   0  0  0

+   -2.0953   -1.8540    0.0000 H   0  0  0

+   -1.8339    3.1259    0.0000 H   0  0  0

+   -4.8332    0.4676    0.0000 H   0  0  0

+   -3.7189   -2.6610    0.0000 H   0  0  0

+   -2.3342   -2.2653    0.0000 H   0  0  0

+    3.2564    2.6410    0.0000 H   0  0  0

+    1.9476    2.2415    0.0000 H   0  0  0

+   -5.4671   -1.6046    0.0000 H   0  0  0

+   -4.5396   -2.1136    0.0000 H   0  0  0

+    5.2478    1.3817    0.0000 H   0  0  0

+    4.3183    2.2953    0.0000 H   0  0  0

+    1.6201    3.8404    0.0000 H   0  0  0

+    0.3564    4.5763    0.0000 H   0  0  0

+   -0.3795    3.3126    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  5 10  1  0

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+  6 12  1  0

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+ 12 18  1  0

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+ 16 22  1  0

+ 20 23  1  0

+ 20 24  2  0

+  8 11  1  0

+  9 14  1  0

+ 10 12  1  0

+ 18 19  1  0

+ 21 23  1  0

+  6 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+ 21 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+26761-40-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 78 78                          1 V2000

+    0.7222    3.3244   -0.1202 C   0  0  0

+   -0.6349    3.1184    0.1937 C   0  0  0

+    1.3155    4.5508    0.1659 C   0  0  0

+    1.5138    2.2428   -0.7442 C   0  0  0

+   -1.3668    4.1435    0.7863 C   0  0  0

+   -1.2787    1.8213   -0.1047 C   0  0  0

+    0.5726    5.5574    0.7547 C   0  0  0

+    2.6521    1.8193   -0.1617 O   0  0  0

+    1.1377    1.7362   -1.7819 O   0  0  0

+   -0.7605    5.3550    1.0631 C   0  0  0

+   -2.6042    1.6690    0.0802 O   0  0  0

+   -0.6124    0.8932   -0.5166 O   0  0  0

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+ 32 78  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99400-75-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 66                          1 V2000

+  -12.8147   -1.9350   -0.6012 C   0  0  0

+  -13.9344   -1.3429   -0.1367 N   0  0  0

+  -11.5769   -1.8326    0.1771 C   0  0  0

+  -12.8334   -2.5508   -1.6509 O   0  0  0

+  -13.9062   -0.6683    1.0280 C   0  0  0

+  -11.5881   -1.1709    1.3007 N   0  0  0

+  -12.7726   -0.5715    1.7451 N   0  0  0

+  -14.9210   -0.1382    1.4376 O   0  0  0

+    5.0914   -1.8693   -1.9427 C   0  0  0

+    3.9531   -1.2279   -2.0375 C   0  0  0

+    6.3815   -1.1002   -1.8195 C   0  0  0

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+    7.3528   -1.8736   -0.9255 C   0  0  0

+    2.7506    0.8813   -1.5330 C   0  0  0

+    8.6627   -1.0929   -0.8004 C   0  0  0

+    2.3079    1.8239   -0.4121 C   0  0  0

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+    1.5416    3.0046   -1.0116 C   0  0  0

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+ 26 64  1  0

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+ 27 66  1  0

+ 27 67  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17177-50-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.9852   -0.8127   -0.0009 C   0  0  0

+   -0.2987   -0.0806   -0.3962 C   0  0  0

+    2.1792   -0.1644   -0.7045 C   0  0  0

+    1.8653    0.0950    0.6652 O   0  0  0

+   -1.4927   -0.7289    0.3074 C   0  0  0

+   -0.2039    1.2912   -0.0072 O   0  0  0

+   -2.6919   -0.0451   -0.0618 O   0  0  0

+    0.9746   -1.8316    0.0000 H   0  0  0

+   -1.1559    0.4703    0.0000 H   0  0  0

+    2.7754   -0.9908    0.0000 H   0  0  0

+    2.9230    0.5321    0.0000 H   0  0  0

+   -2.1517   -1.5061    0.0000 H   0  0  0

+   -0.8500   -1.5196    0.0000 H   0  0  0

+   -0.1336    2.3078    0.0000 H   0  0  0

+   -3.5771    0.4596    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  5  7  1  0

+  3  4  1  0

+  1  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+140-11-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.8803    0.3068    0.2379 C   0  0  0

+   -0.5576    0.6782    0.4936 C   0  0  0

+    1.7297    1.2109   -0.3715 C   0  0  0

+    1.3514   -0.9363    0.6181 C   0  0  0

+   -1.4288   -0.2502   -0.2047 O   0  0  0

+    3.0490    0.8701   -0.6061 C   0  0  0

+    2.6701   -1.2769    0.3836 C   0  0  0

+   -2.7613   -0.1126   -0.1206 C   0  0  0

+    3.5184   -0.3746   -0.2312 C   0  0  0

+   -3.6655   -1.0762   -0.8453 C   0  0  0

+   -3.2359    0.7837    0.5361 O   0  0  0

+   -0.1513    1.5887    0.0000 H   0  0  0

+   -1.3879    1.2301    0.0000 H   0  0  0

+    1.4523    2.1686    0.0000 H   0  0  0

+    0.6860   -1.6788    0.0000 H   0  0  0

+    3.7150    1.6121    0.0000 H   0  0  0

+    2.9473   -2.2346    0.0000 H   0  0  0

+    4.4962   -0.5697    0.0000 H   0  0  0

+   -4.3926   -0.3940    0.0000 H   0  0  0

+   -4.3477   -1.8033    0.0000 H   0  0  0

+   -2.9384   -1.7584    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  4  7  2  0

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+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+34244-14-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    1.3028    0.1304   -0.0022 C   0  0  0

+    0.1071   -0.3921   -0.0021 C   0  0  0

+    1.4731    1.5956   -0.0011 C   0  0  0

+    2.4981   -0.7321    0.0027 C   0  0  0

+   -1.0838    0.4782   -0.0009 C   0  0  0

+   -0.0719   -1.8552   -0.0028 C   0  0  0

+    0.4172    2.3738    0.0004 C   0  0  0

+    2.8488    2.1232   -0.0011 C   0  0  0

+    2.3269   -2.1947    0.0081 C   0  0  0

+    3.6862   -0.1747    0.0026 C   0  0  0

+   -0.9375    1.7818    0.0000 C   0  0  0

+   -2.4055   -0.1729   -0.0002 C   0  0  0

+    1.1177   -2.7231   -0.0037 C   0  0  0

+   -1.2881   -2.3484   -0.0021 C   0  0  0

+    3.8618    1.2832   -0.0022 C   0  0  0

+   -2.4772   -1.4869   -0.0008 C   0  0  0

+   -3.8540    0.7839    0.0019 Cl  0  0  0

+    0.5400    3.4698    0.0000 H   0  0  0

+    3.0278    3.2114    0.0000 H   0  0  0

+    3.2130   -2.8513    0.0000 H   0  0  0

+    4.5799   -0.8209    0.0000 H   0  0  0

+   -1.8252    2.4362    0.0000 H   0  0  0

+    0.9975   -3.8194    0.0000 H   0  0  0

+   -1.4211   -3.4432    0.0000 H   0  0  0

+    4.8863    1.6916    0.0000 H   0  0  0

+   -3.4728   -1.9613    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1953-54-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    0.8265    0.7004    0.0026 C   0  0  0

+    0.5256   -0.6732   -0.0002 C   0  0  0

+    2.2007    0.8150    0.0021 N   0  0  0

+   -0.2092    1.6290   -0.0001 C   0  0  0

+   -0.8055   -1.0963   -0.0004 C   0  0  0

+    1.8139   -1.3705   -0.0023 C   0  0  0

+    2.7706   -0.4287   -0.0008 C   0  0  0

+   -1.5177    1.2006   -0.0053 C   0  0  0

+   -1.8190   -0.1591    0.0020 C   0  0  0

+   -3.1168   -0.5652    0.0014 O   0  0  0

+    2.7232    1.7088    0.0000 H   0  0  0

+    0.0038    2.6421    0.0000 H   0  0  0

+   -1.0307   -2.1068    0.0000 H   0  0  0

+    1.9591   -2.3956    0.0000 H   0  0  0

+    3.7888   -0.6159    0.0000 H   0  0  0

+   -2.2849    1.8958    0.0000 H   0  0  0

+   -4.1049   -0.8744    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

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+  6  7  2  0

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+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+111990-50-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    1.1150   -0.1391   -0.2414 C   0  0  0

+    0.0665    0.7652   -0.4825 C   0  0  0

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+    0.9513   -1.5191   -0.4507 C   0  0  0

+   -1.2647    0.2656   -0.9818 C   0  0  0

+    0.2598    2.0943   -0.2631 C   0  0  0

+    2.5220    1.7291    0.4419 C   0  0  0

+    3.4081   -0.5547    0.4695 C   0  0  0

+    1.9889   -2.3650   -0.2060 C   0  0  0

+   -2.1535   -0.0956    0.2101 C   0  0  0

+    1.4841    2.5749    0.1980 C   0  0  0

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+   -4.3938   -0.9641    0.8950 C   0  0  0

+   -4.5436    0.2594    0.1721 O   0  0  0

+    0.0175   -1.8968    0.0000 H   0  0  0

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+   -3.1383   -1.5410    0.0000 H   0  0  0

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+   -4.0980   -1.9270    0.0000 H   0  0  0

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+ 13 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71712-70-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -1.0082    0.6114   -0.0057 C   0  0  0

+   -0.9771   -0.7797   -0.0027 C   0  0  0

+    0.1542    1.3180   -0.0058 O   0  0  0

+   -2.2239    1.2748   -0.0028 C   0  0  0

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+   -2.1620   -1.4967   -0.0021 C   0  0  0

+    1.3471    0.6639   -0.0029 C   0  0  0

+   -3.4046    0.5542    0.0031 C   0  0  0

+    1.3780   -0.7271    0.0001 C   0  0  0

+   -3.3743   -0.8286   -0.0045 C   0  0  0

+    2.5318    1.3811   -0.0035 C   0  0  0

+   -4.7034    1.2645    0.0061 N   0  3  0

+    2.5935   -1.3910    0.0025 C   0  0  0

+   -4.8592   -1.7278   -0.0044 Cl  0  0  0

+    3.7443    0.7136   -0.0010 C   0  0  0

+   -4.7316    2.4822    0.0035 O   0  0  0

+   -5.7438    0.6313    0.0113 O   0  5  0

+    3.7751   -0.6702    0.0019 C   0  0  0

+    5.2289    1.6134   -0.0017 Cl  0  0  0

+    5.2982   -1.5032    0.0055 Cl  0  0  0

+   -2.2490    2.3126    0.0000 H   0  0  0

+   -2.1410   -2.5346    0.0000 H   0  0  0

+    2.5105    2.4190    0.0000 H   0  0  0

+    2.6183   -2.4288    0.0000 H   0  0  0

+  1  2  2  0

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+  4 21  1  0

+  6 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+116355-84-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+108107                          1 V2000

+    2.2068   -0.9958   -1.3553 C   0  0  0

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+ 49108  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+52645-53-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 48                          1 V2000

+    3.7667    0.2271   -0.0536 C   0  0  0

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+ 26 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+557-91-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.0000   -0.7895    0.4965 C   0  0  0

+    0.0000   -2.1455   -0.2122 C   0  0  0

+    1.6052    0.2206   -0.0214 Br  0  0  0

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+   -1.2452   -1.4771    0.0000 H   0  0  0

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+  1  2  1  0

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+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94739-29-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 53                          1 V2000

+    0.5309   -0.7088   -0.6396 C   0  0  0

+   -0.9248   -0.3498   -0.7355 C   0  0  0

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+    2.2132    0.9200    0.2463 C   0  0  0

+    0.6892   -0.1039    1.7842 C   0  0  0

+   -0.3230   -2.9503    0.0056 C   0  0  0

+    1.9655   -2.7769   -0.6263 C   0  0  0

+   -1.5614   -2.4100    0.2201 N   0  0  0

+   -3.3308   -0.7847   -0.4178 C   0  0  0

+   -1.5585    1.9434   -0.4724 O   0  0  0

+   -1.3745    1.0329   -2.4926 O   0  0  0

+    2.7932    1.6221    1.2897 C   0  0  0

+    2.8038    1.1257   -1.3731 Cl  0  0  0

+    1.2680    0.5968    2.8256 C   0  0  0

+   -0.1041   -4.4237    0.2344 C   0  0  0

+    2.8185   -2.9489    0.4052 O   0  0  0

+    2.2845   -3.1328   -1.7454 O   0  0  0

+   -3.8780   -0.5856    0.9123 O   0  0  0

+   -1.9534    3.0308   -1.3112 C   0  0  0

+    2.3214    1.4577    2.5794 C   0  0  0

+    4.1119    2.7075    0.9791 Cl  0  0  0

+    3.9929   -3.5641   -0.1282 C   0  0  0

+   -5.1878   -0.3154    1.0679 C   0  0  0

+   -3.3985    3.4207   -0.9940 C   0  0  0

+   -1.0351    4.2285   -1.0596 C   0  0  0

+   -5.7186   -0.2427    2.3046 N   0  0  0

+   -5.8913   -0.1371    0.0934 O   0  0  0

+    1.4478   -0.9806    0.0000 H   0  0  0

+   -0.0989   -0.6457    0.0000 H   0  0  0

+   -2.2874   -3.0325    0.0000 H   0  0  0

+   -4.0476   -1.4178    0.0000 H   0  0  0

+   -3.1174   -1.7169    0.0000 H   0  0  0

+    0.5935    1.2748    0.0000 H   0  0  0

+   -1.0500   -4.5642    0.0000 H   0  0  0

+    0.0364   -5.3696    0.0000 H   0  0  0

+    0.8418   -4.2832    0.0000 H   0  0  0

+   -2.6003    2.3265    0.0000 H   0  0  0

+    1.8543    2.2922    0.0000 H   0  0  0

+    3.5491   -4.4112    0.0000 H   0  0  0

+    4.8400   -4.0079    0.0000 H   0  0  0

+    4.4367   -2.7170    0.0000 H   0  0  0

+   -3.1494    4.3440    0.0000 H   0  0  0

+   -4.3218    3.6698    0.0000 H   0  0  0

+   -3.6476    2.4974    0.0000 H   0  0  0

+   -0.2762    3.6466    0.0000 H   0  0  0

+   -0.4532    4.9874    0.0000 H   0  0  0

+   -1.7940    4.8104    0.0000 H   0  0  0

+   -6.0800    0.6427    0.0000 H   0  0  0

+   -6.3047   -0.9984    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  1  0

+  7 16  1  0

+  8 17  2  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  2  0

+ 12 21  1  0

+ 13 22  1  0

+ 15 23  2  0

+ 15 24  1  0

+ 19 25  1  0

+ 21 26  1  0

+ 22 27  1  0

+ 22 28  1  0

+ 26 29  1  0

+ 26 30  2  0

+  9 11  1  0

+ 17 23  1  0

+  1 31  1  0

+  8 32  1  0

+ 11 33  1  0

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+ 12 35  1  0

+ 17 36  1  0

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+ 25 42  1  0

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+ 25 44  1  0

+ 27 45  1  0

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+ 27 47  1  0

+ 28 48  1  0

+ 28 49  1  0

+ 28 50  1  0

+ 29 51  1  0

+ 29 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146795-34-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -0.6017   -0.3151    0.0569 C   0  0  0

+   -1.7070    0.6096    0.0270 C   0  0  0

+    0.7922    0.1546    0.1044 C   0  0  0

+   -0.9086   -1.6601    0.0448 C   0  0  0

+   -2.9463    0.0825   -0.0159 C   0  0  0

+    1.8030   -0.7364    0.1315 N   0  0  0

+    1.0320    1.3471    0.1192 O   0  0  0

+   -2.6395   -1.6719   -0.0054 S   0  0  0

+   -4.2465    0.7894   -0.0527 N   0  3  0

+    3.1272   -0.2947    0.0435 C   0  0  0

+   -5.2846    0.1534   -0.0900 O   0  0  0

+   -4.2781    2.0070   -0.0457 O   0  5  0

+    4.1622   -1.2148   -0.0642 C   0  0  0

+    3.4096    1.0649    0.0581 C   0  0  0

+    5.4684   -0.7754   -0.1508 C   0  0  0

+    4.7184    1.4978   -0.0289 C   0  0  0

+    5.7467    0.5792   -0.1304 C   0  0  0

+   -1.5550    1.6343    0.0000 H   0  0  0

+   -0.2599   -2.4678    0.0000 H   0  0  0

+    1.5969   -1.7516    0.0000 H   0  0  0

+    3.9553   -2.2298    0.0000 H   0  0  0

+    2.6363    1.7542    0.0000 H   0  0  0

+    6.2442   -1.4619    0.0000 H   0  0  0

+    4.9291    2.5121    0.0000 H   0  0  0

+    6.7302    0.9046    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 18  1  0

+  4 19  1  0

+  6 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63019-40-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 34                          1 V2000

+    0.6214    0.7178    0.0021 C   0  0  0

+   -0.2818   -0.3620    0.0010 C   0  0  0

+    2.0565    0.4281    0.0013 C   0  0  0

+    0.1437    2.0399   -0.0020 C   0  0  0

+   -1.7161   -0.0729    0.0012 C   0  0  0

+    0.1955   -1.6848    0.0003 C   0  0  0

+    2.4790   -0.9216   -0.0002 C   0  0  0

+    3.0083    1.4517    0.0016 C   0  0  0

+   -1.1814    2.3119   -0.0073 C   0  0  0

+   -2.1401    1.2757    0.0027 C   0  0  0

+   -2.6701   -1.1011   -0.0004 C   0  0  0

+    1.5203   -1.9573    0.0002 C   0  0  0

+    3.8530   -1.2079   -0.0010 C   0  0  0

+    4.3367    1.1391    0.0004 C   0  0  0

+   -3.5139    1.5630    0.0027 C   0  0  0

+   -4.0125   -0.7810   -0.0007 C   0  0  0

+   -2.2759   -2.4009   -0.0021 O   0  0  0

+    4.7562   -0.1871   -0.0003 C   0  0  0

+   -4.4226    0.5471    0.0014 C   0  0  0

+    0.8322    2.8357    0.0000 H   0  0  0

+   -0.4934   -2.4803    0.0000 H   0  0  0

+    2.7020    2.4584    0.0000 H   0  0  0

+   -1.5033    3.3138    0.0000 H   0  0  0

+    1.8419   -2.9593    0.0000 H   0  0  0

+    4.1845   -2.2066    0.0000 H   0  0  0

+    5.0523    1.9106    0.0000 H   0  0  0

+   -3.8424    2.5627    0.0000 H   0  0  0

+   -4.7319   -1.5490    0.0000 H   0  0  0

+   -1.9705   -3.4079    0.0000 H   0  0  0

+    5.7856   -0.4054    0.0000 H   0  0  0

+   -5.4506    0.7717    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  1  0

+ 11 16  2  0

+ 11 17  1  0

+ 13 18  2  0

+ 15 19  2  0

+  7 12  1  0

+  9 10  1  0

+ 14 18  1  0

+ 16 19  1  0

+  4 20  1  0

+  6 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 12 24  1  0

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+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93-05-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    0.2411    0.0011   -0.0010 C   0  0  0

+    1.6411    0.0000   -0.0009 N   0  0  0

+   -0.4534   -0.5653   -1.0614 C   0  0  0

+   -0.4529    0.5635    1.0624 C   0  0  0

+    2.3728   -0.9478    0.8432 C   0  0  0

+    2.3744    0.9466   -0.8449 C   0  0  0

+   -1.8346   -0.5647   -1.0612 C   0  0  0

+   -1.8336    0.5642    1.0625 C   0  0  0

+    2.3856   -2.3231    0.1730 C   0  0  0

+    2.3971    2.3197   -0.1703 C   0  0  0

+   -2.5284    0.0024   -0.0007 C   0  0  0

+   -3.9284    0.0030   -0.0005 N   0  0  0

+   -0.1302   -1.4735    0.0000 H   0  0  0

+   -0.1307    1.4721    0.0000 H   0  0  0

+    3.2943   -1.2311    0.0000 H   0  0  0

+    2.9217   -0.1553    0.0000 H   0  0  0

+    2.9205    0.1522    0.0000 H   0  0  0

+    3.2974    1.2249    0.0000 H   0  0  0

+   -2.1587   -1.4726    0.0000 H   0  0  0

+   -2.1548    1.4731    0.0000 H   0  0  0

+    1.4216   -2.3321    0.0000 H   0  0  0

+    2.3946   -3.2871    0.0000 H   0  0  0

+    3.3496   -2.3141    0.0000 H   0  0  0

+    3.3610    2.3038    0.0000 H   0  0  0

+    2.4130    3.2836    0.0000 H   0  0  0

+    1.4332    2.3356    0.0000 H   0  0  0

+   -4.4100    0.8381    0.0000 H   0  0  0

+   -4.4108   -0.8317    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  1  0

+  7 11  2  0

+ 11 12  1  0

+  8 11  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+115-77-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -1.2840   -0.8561    0.0000 C   0  0  0

+   -1.2483    0.0492    0.8833 C   0  0  0

+    0.0492    1.2483   -0.8833 C   0  0  0

+    1.2483   -0.0492    0.8833 C   0  0  0

+   -0.0492   -1.2483   -0.8833 C   0  0  0

+   -2.4141    0.0952    0.0583 O   0  0  0

+    0.0952    2.4141   -0.0583 O   0  0  0

+    2.4141   -0.0952    0.0583 O   0  0  0

+   -0.0952   -2.4141   -0.0583 O   0  0  0

+   -0.3430    0.0135    0.0000 H   0  0  0

+   -1.2126    0.9545    0.0000 H   0  0  0

+    0.6029    0.5312    0.0000 H   0  0  0

+    0.9123    1.5239    0.0000 H   0  0  0

+    1.6400    0.7677    0.0000 H   0  0  0

+    0.6536    0.6343    0.0000 H   0  0  0

+    0.8493   -1.3647    0.0000 H   0  0  0

+    0.1469   -0.3638    0.0000 H   0  0  0

+   -3.3194    0.1309    0.0000 H   0  0  0

+    0.1309    3.3194    0.0000 H   0  0  0

+    3.3194   -0.1309    0.0000 H   0  0  0

+   -0.1309   -3.3194    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  2 10  1  0

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+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+156243-39-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.1820    1.0820    0.0038 C   0  0  0

+   -1.1769   -0.3330    0.0030 C   0  0  0

+    0.0072    1.7958    0.0031 C   0  0  0

+   -2.4856    1.4737   -0.0003 N   0  0  0

+    0.0009   -1.0423    0.0015 C   0  0  0

+   -2.5109   -0.7196    0.0032 N   0  0  0

+    1.2256    1.1085    0.0015 C   0  0  0

+   -3.2636    0.4206   -0.0035 C   0  0  0

+    1.2241   -0.3567    0.0007 C   0  0  0

+   -0.0225   -2.5491    0.0011 C   0  0  0

+   -3.0168   -2.0944    0.0021 C   0  0  0

+    2.3971    1.7570    0.0008 N   0  0  0

+   -4.6397    0.4569   -0.0076 N   0  0  0

+    2.3924   -1.0078   -0.0012 N   0  0  0

+    3.5164    1.0701   -0.0007 C   0  0  0

+    3.5141   -0.3245   -0.0022 C   0  0  0

+    4.8274   -1.0636   -0.0044 C   0  0  0

+   -0.0068    2.8359    0.0000 H   0  0  0

+   -1.0626   -2.5329    0.0000 H   0  0  0

+   -0.0387   -3.5892    0.0000 H   0  0  0

+    1.0176   -2.5653    0.0000 H   0  0  0

+   -3.9930   -1.7352    0.0000 H   0  0  0

+   -3.3760   -3.0706    0.0000 H   0  0  0

+   -2.0406   -2.4536    0.0000 H   0  0  0

+   -5.1359    1.3712    0.0000 H   0  0  0

+   -5.1834   -0.4299    0.0000 H   0  0  0

+    4.4246    1.5773    0.0000 H   0  0  0

+    4.3172   -1.9701    0.0000 H   0  0  0

+    5.7339   -1.5738    0.0000 H   0  0  0

+    5.3376   -0.1571    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  8 13  1  0

+  9 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+ 16 17  1  0

+  6  8  1  0

+  7  9  2  0

+ 15 16  1  0

+  3 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15121-84-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.7051    0.4862   -0.0383 C   0  0  0

+    0.2906   -0.8039   -0.3126 C   0  0  0

+    2.0277    0.7351    0.2762 C   0  0  0

+   -0.2665    1.6018   -0.0872 N   0  3  0

+    1.1991   -1.8448   -0.2725 C   0  0  0

+   -1.1514   -1.0752   -0.6559 C   0  0  0

+    2.9364   -0.3062    0.3163 C   0  0  0

+   -0.8401    1.8645   -1.1291 O   0  0  0

+   -0.4924    2.2571    0.9143 O   0  5  0

+    2.5221   -1.5960    0.0424 C   0  0  0

+   -1.9817   -1.1200    0.6285 C   0  0  0

+   -3.3491   -1.3772    0.3030 O   0  0  0

+    2.3605    1.6952    0.0000 H   0  0  0

+    0.8663   -2.8049    0.0000 H   0  0  0

+   -1.5710   -2.0007    0.0000 H   0  0  0

+   -0.5239   -1.8745    0.0000 H   0  0  0

+    3.9316   -0.1010    0.0000 H   0  0  0

+    3.1944   -2.3580    0.0000 H   0  0  0

+   -1.5621   -0.1945    0.0000 H   0  0  0

+   -2.6091   -0.3207    0.0000 H   0  0  0

+   -4.3477   -1.5650    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+ 11 12  1  0

+  7 10  2  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+892-17-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+    0.4446    0.3199    0.0021 C   0  0  0

+   -0.3039   -0.8789    0.0009 C   0  0  0

+    1.9076    0.2365    0.0014 C   0  0  0

+   -0.2166    1.5518   -0.0019 C   0  0  0

+   -1.7035   -0.8225    0.0008 C   0  0  0

+    0.3929   -2.1610   -0.0007 C   0  0  0

+    2.5249   -1.0341   -0.0002 C   0  0  0

+    2.6972    1.3899    0.0019 C   0  0  0

+   -1.5750    1.5962   -0.0071 C   0  0  0

+    0.5780    2.8323   -0.0001 C   0  0  0

+   -2.3411    0.4101    0.0020 C   0  0  0

+   -2.7303   -1.9293   -0.0008 C   0  0  0

+    1.7408   -2.2113   -0.0012 C   0  0  0

+    3.9259   -1.1119   -0.0009 C   0  0  0

+    4.0580    1.2798    0.0008 C   0  0  0

+   -3.8039    0.2378    0.0011 C   0  0  0

+   -4.1026   -1.2417   -0.0007 C   0  0  0

+    4.6692    0.0314    0.0000 C   0  0  0

+   -4.6255    1.1297    0.0018 O   0  0  0

+   -0.1635   -3.0582    0.0000 H   0  0  0

+    2.2429    2.3428    0.0000 H   0  0  0

+   -2.0647    2.5315    0.0000 H   0  0  0

+    1.4750    2.2757    0.0000 H   0  0  0

+    1.1346    3.7293    0.0000 H   0  0  0

+   -0.3190    3.3889    0.0000 H   0  0  0

+   -3.2901   -2.8243    0.0000 H   0  0  0

+   -1.8921   -2.5711    0.0000 H   0  0  0

+    2.2217   -3.1511    0.0000 H   0  0  0

+    4.4035   -2.0534    0.0000 H   0  0  0

+    4.6524    2.1522    0.0000 H   0  0  0

+   -5.1149   -0.9422    0.0000 H   0  0  0

+   -4.4903   -2.2236    0.0000 H   0  0  0

+    5.7229   -0.0325    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+591-35-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.0001   -1.8055   -0.0021 C   0  0  0

+   -1.2009   -1.1109   -0.0015 C   0  0  0

+    1.2007   -1.1112   -0.0017 C   0  0  0

+    0.0000   -3.1645    0.0025 O   0  0  0

+   -1.1988    0.2716   -0.0004 C   0  0  0

+    1.1987    0.2717   -0.0006 C   0  0  0

+    0.0002    0.9626    0.0005 C   0  0  0

+   -2.7012    1.1413    0.0004 Cl  0  0  0

+    2.7012    1.1413    0.0005 Cl  0  0  0

+   -2.1003   -1.6288    0.0000 H   0  0  0

+    2.1001   -1.6292    0.0000 H   0  0  0

+   -0.0001   -4.2024    0.0000 H   0  0  0

+    0.0003    2.0005    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  3  6  1  0

+  5  7  1  0

+  5  8  1  0

+  6  9  1  0

+  6  7  2  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7745-89-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+   -2.6129    0.4308   -0.0646 C   0  0  0

+   -3.3277   -0.6081    0.5063 C   0  0  0

+   -1.3608    0.1969   -0.6006 C   0  0  0

+   -3.2929    2.0274   -0.1137 Cl  0  0  0

+   -2.7916   -1.8818    0.5424 C   0  0  0

+   -4.6929   -0.3500    1.0900 C   0  0  0

+   -0.8204   -1.0823   -0.5658 C   0  0  0

+   -1.5406   -2.1220    0.0083 C   0  0  0

+    0.4446   -1.3225   -1.1070 N   0  0  0

+    8.9264    0.3304    0.2409 Cl  0  0  0

+   -0.7552    0.9491    0.0000 H   0  0  0

+   -3.3996   -2.6321    0.0000 H   0  0  0

+   -4.5135    0.5989    0.0000 H   0  0  0

+   -5.6418   -0.1706    0.0000 H   0  0  0

+   -4.8723   -1.2989    0.0000 H   0  0  0

+   -1.1756   -3.0160    0.0000 H   0  0  0

+    0.7630   -2.2342    0.0000 H   0  0  0

+    1.0750   -0.5909    0.0000 H   0  0  0

+    9.8921    0.3304    0.0000 H   0  0  0

+  1  2  1  0

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+  6 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3179-47-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 41                          1 V2000

+    2.2094   -0.5686    0.0000 C   0  0  0

+    0.9747    0.3350    0.0000 C   0  0  0

+    3.4084    0.2502    0.0000 O   0  0  0

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+ 16 40  1  0

+ 16 41  1  0

+ 16 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5002-47-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 85 88                          1 V2000

+    4.3313    1.4386    0.0698 C   0  0  0

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+    5.8742    1.0409    2.3156 S   0  0  0

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+ 41 84  1  0

+ 41 85  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+32861-85-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.8811   -0.7639    0.3760 C   0  0  0

+   -0.0544   -1.7234    0.6006 O   0  0  0

+    2.2305   -1.0682    0.4934 C   0  0  0

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+   -1.2657   -1.1077    0.5624 C   0  0  0

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+ 15 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-20-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -3.4336   -0.4615    0.3794 C   0  0  0

+   -4.2760    0.2306   -0.4751 C   0  0  0

+   -2.2005    0.0662    0.7124 C   0  0  0

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+   -3.8850    1.4505   -0.9972 C   0  0  0

+   -5.8245   -0.4343   -0.8920 Cl  0  0  0

+   -1.8069    1.2909    0.1895 C   0  0  0

+   -2.6533    1.9819   -0.6672 C   0  0  0

+   -0.5586    1.8280    0.5254 N   0  0  0

+    0.5617    1.1057    0.3259 C   0  0  0

+    1.7482    1.5659    0.7695 N   0  0  0

+    0.5018    0.0388   -0.2542 O   0  0  0

+    2.9285    0.8879    0.4425 C   0  0  0

+    4.1608    1.4421    0.7634 C   0  0  0

+    2.8690   -0.3424   -0.1980 C   0  0  0

+    5.3236    0.7711    0.4402 C   0  0  0

+    4.0351   -1.0097   -0.5192 C   0  0  0

+    5.2616   -0.4529   -0.2031 C   0  0  0

+    6.7253   -1.2937   -0.6086 Cl  0  0  0

+   -1.4567   -0.6112    0.0000 H   0  0  0

+   -4.6301    2.1265    0.0000 H   0  0  0

+   -2.5142    2.9783    0.0000 H   0  0  0

+   -0.4750    2.8305    0.0000 H   0  0  0

+    1.8243    2.5690    0.0000 H   0  0  0

+    4.2115    2.4468    0.0000 H   0  0  0

+    1.9868   -0.8259    0.0000 H   0  0  0

+    6.2072    1.2520    0.0000 H   0  0  0

+    3.9880   -2.0146    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  7  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 10 12  2  0

+ 11 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+ 18 19  1  0

+  7  8  2  0

+ 17 18  2  0

+  3 20  1  0

+  5 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+65945-06-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 34                          1 V2000

+   -0.0025    0.5836    0.0022 C   0  0  0

+   -0.8184   -0.5634    0.0010 C   0  0  0

+    1.4511    0.4078    0.0016 C   0  0  0

+   -0.5818    1.8647   -0.0018 C   0  0  0

+   -2.2718   -0.3870    0.0010 C   0  0  0

+   -0.2393   -1.8446   -0.0007 C   0  0  0

+    1.9779   -0.9049    0.0000 C   0  0  0

+    2.3169    1.5056    0.0020 C   0  0  0

+   -1.9240    2.0329   -0.0072 C   0  0  0

+   -2.7988    0.9254    0.0025 C   0  0  0

+   -3.1404   -1.4821   -0.0008 C   0  0  0

+    1.1028   -2.0126   -0.0016 C   0  0  0

+    3.3691   -1.0846   -0.0007 C   0  0  0

+    3.6658    1.3073    0.0009 C   0  0  0

+   -4.1909    1.1032    0.0024 C   0  0  0

+   -4.4892   -1.2746   -0.0012 C   0  0  0

+    4.1973    0.0164    0.0001 C   0  0  0

+   -5.0114    0.0147    0.0010 C   0  0  0

+    5.5452   -0.1559   -0.0005 O   0  0  0

+    0.0416    2.7100    0.0000 H   0  0  0

+   -0.8627   -2.6899    0.0000 H   0  0  0

+    1.9288    2.4816    0.0000 H   0  0  0

+   -2.3222    3.0048    0.0000 H   0  0  0

+   -2.7569   -2.4599    0.0000 H   0  0  0

+    1.5010   -2.9845    0.0000 H   0  0  0

+    3.7769   -2.0525    0.0000 H   0  0  0

+    4.3123    2.1351    0.0000 H   0  0  0

+   -4.5989    2.0711    0.0000 H   0  0  0

+   -5.1409   -2.0983    0.0000 H   0  0  0

+   -6.0528    0.1514    0.0000 H   0  0  0

+    6.5871   -0.2891    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  1  0

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+ 13 17  2  0

+ 15 18  2  0

+ 17 19  1  0

+  7 12  1  0

+  9 10  1  0

+ 14 17  1  0

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+  4 20  1  0

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+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

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+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+613-12-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.9228    0.5696   -0.0047 C   0  0  0

+   -0.8116   -0.8928   -0.0020 C   0  0  0

+    0.2253    1.3602   -0.0046 C   0  0  0

+   -2.2083    1.1519   -0.0014 C   0  0  0

+    0.4427   -1.5008    0.0007 C   0  0  0

+   -1.9943   -1.6627   -0.0017 C   0  0  0

+    1.4790    0.7522   -0.0020 C   0  0  0

+   -3.3057    0.3525    0.0041 C   0  0  0

+    1.5902   -0.7102    0.0007 C   0  0  0

+   -3.2000   -1.0384   -0.0038 C   0  0  0

+    2.6623    1.5222   -0.0008 C   0  0  0

+   -4.6738    0.9844    0.0075 C   0  0  0

+    2.8761   -1.2927    0.0029 C   0  0  0

+    3.8676    0.8979    0.0028 C   0  0  0

+    3.9733   -0.4935    0.0024 C   0  0  0

+    0.1461    2.4034    0.0000 H   0  0  0

+   -2.3150    2.1926    0.0000 H   0  0  0

+    0.5221   -2.5440    0.0000 H   0  0  0

+   -1.9424   -2.7076    0.0000 H   0  0  0

+   -4.0725   -1.6156    0.0000 H   0  0  0

+    2.6106    2.5671    0.0000 H   0  0  0

+   -4.2351    1.9342    0.0000 H   0  0  0

+   -5.6236    1.4231    0.0000 H   0  0  0

+   -5.1125    0.0346    0.0000 H   0  0  0

+    2.9827   -2.3334    0.0000 H   0  0  0

+    4.7402    1.4750    0.0000 H   0  0  0

+    4.9231   -0.9322    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 11 14  2  0

+ 13 15  2  0

+  7  9  1  0

+  8 10  2  0

+ 14 15  1  0

+  3 16  1  0

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+  5 18  1  0

+  6 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15972-60-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+   -0.8751   -0.3699   -0.0533 C   0  0  0

+    0.1872    0.4294    0.3832 N   0  0  0

+   -1.6648    0.0430   -1.1181 C   0  0  0

+   -1.1384   -1.5808    0.5741 C   0  0  0

+    1.3835    0.3557   -0.2333 C   0  0  0

+   -0.0009    1.3463    1.5101 C   0  0  0

+   -2.7128   -0.7484   -1.5465 C   0  0  0

+   -1.3791    1.3534   -1.8053 C   0  0  0

+   -2.1875   -2.3674    0.1410 C   0  0  0

+   -0.2803   -2.0356    1.7264 C   0  0  0

+    2.6261    0.0595    0.5662 C   0  0  0

+    1.4599    0.5279   -1.4314 O   0  0  0

+   -1.2478    2.0294    1.3654 O   0  0  0

+   -2.9758   -1.9505   -0.9162 C   0  0  0

+   -2.5045    2.3445   -1.5017 C   0  0  0

+    0.9415   -2.7831    1.1885 C   0  0  0

+    4.0546    0.0270   -0.5334 Cl  0  0  0

+   -1.7007    2.3458    2.6833 C   0  0  0

+    0.9423    1.3159    0.0000 H   0  0  0

+    0.2478    2.2567    0.0000 H   0  0  0

+   -3.5075   -0.2394    0.0000 H   0  0  0

+   -0.5040    1.0000    0.0000 H   0  0  0

+   -0.8835    2.1565    0.0000 H   0  0  0

+   -2.1135   -3.3082    0.0000 H   0  0  0

+    0.5393   -1.5677    0.0000 H   0  0  0

+   -0.2951   -1.0920    0.0000 H   0  0  0

+    2.0274   -0.6700    0.0000 H   0  0  0

+    3.0199   -0.7981    0.0000 H   0  0  0

+   -3.8319   -2.3477    0.0000 H   0  0  0

+   -1.8808    3.0527    0.0000 H   0  0  0

+   -3.2127    2.9682    0.0000 H   0  0  0

+   -3.1282    1.6363    0.0000 H   0  0  0

+    0.4490   -3.5881    0.0000 H   0  0  0

+    1.7465   -3.2756    0.0000 H   0  0  0

+    1.4340   -1.9781    0.0000 H   0  0  0

+   -1.1602    3.1194    0.0000 H   0  0  0

+   -2.4743    2.8863    0.0000 H   0  0  0

+   -2.2412    1.5722    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  9 14  1  0

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+  8 22  1  0

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+ 11 27  1  0

+ 11 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+194-59-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+    0.7314   -0.6789    0.0020 C   0  0  0

+   -0.7319   -0.6790    0.0015 C   0  0  0

+    1.7472    0.3676    0.0012 C   0  0  0

+    1.1326   -2.0178   -0.0030 C   0  0  0

+   -1.7474    0.3676    0.0003 C   0  0  0

+   -1.1335   -2.0178    0.0029 C   0  0  0

+    3.1123   -0.0092    0.0022 C   0  0  0

+    1.4057    1.7247   -0.0012 C   0  0  0

+   -0.0005   -2.8060   -0.0065 N   0  0  0

+    2.4983   -2.3356   -0.0032 C   0  0  0

+   -3.1126   -0.0085    0.0005 C   0  0  0

+   -1.4047    1.7245    0.0000 C   0  0  0

+   -2.4994   -2.3351    0.0030 C   0  0  0

+    3.4542   -1.3753    0.0036 C   0  0  0

+    4.0994    0.9891    0.0015 C   0  0  0

+    2.3897    2.6687   -0.0023 C   0  0  0

+   -3.4550   -1.3745    0.0014 C   0  0  0

+   -4.0990    0.9906   -0.0006 C   0  0  0

+   -2.3881    2.6691   -0.0001 C   0  0  0

+    3.7323    2.3011   -0.0004 C   0  0  0

+   -3.7309    2.3022   -0.0019 C   0  0  0

+    0.3970    2.0146    0.0000 H   0  0  0

+   -0.0005   -3.8556    0.0000 H   0  0  0

+    2.7879   -3.3444    0.0000 H   0  0  0

+   -0.3957    2.0136    0.0000 H   0  0  0

+   -2.7893   -3.3438    0.0000 H   0  0  0

+    4.4660   -1.6542    0.0000 H   0  0  0

+    5.1154    0.7259    0.0000 H   0  0  0

+    2.1314    3.6860    0.0000 H   0  0  0

+   -4.4669   -1.6530    0.0000 H   0  0  0

+   -5.1152    0.7282    0.0000 H   0  0  0

+   -2.1292    3.6862    0.0000 H   0  0  0

+    4.4724    3.0453    0.0000 H   0  0  0

+   -4.4705    3.0469    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

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+  8 16  2  0

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+ 12 19  2  0

+ 15 20  2  0

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+  6  9  1  0

+ 10 14  2  0

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+ 16 20  1  0

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+  9 23  1  0

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+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-94-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.4466    0.0240   -0.0014 C   0  0  0

+   -0.8382    0.7229    0.0010 C   0  0  0

+    1.7322    0.8104    0.0002 C   0  0  0

+    0.4774   -1.1889    0.0005 O   0  0  0

+   -1.9767    0.0265   -0.0004 C   0  0  0

+   -0.8648    1.7715    0.0000 H   0  0  0

+    2.2796   -0.0844    0.0000 H   0  0  0

+    2.6270    1.3578    0.0000 H   0  0  0

+    1.1848    1.7052    0.0000 H   0  0  0

+   -2.8981    0.5278    0.0000 H   0  0  0

+   -1.9501   -1.0221    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1820-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    0.7417   -0.6935   -0.0176 C   0  0  0

+   -0.7418   -0.6935    0.0177 C   0  0  0

+    1.4552    0.3503    0.5684 C   0  0  0

+    1.4264   -1.7399   -0.6317 C   0  0  0

+   -1.4552    0.3505   -0.5680 C   0  0  0

+   -1.4265   -1.7400    0.6316 C   0  0  0

+    2.8347    0.3453    0.5326 C   0  0  0

+    0.7347    1.4627    1.2277 N   0  3  0

+    2.8065   -1.7348   -0.6617 C   0  0  0

+   -2.8347    0.3455   -0.5322 C   0  0  0

+   -0.7347    1.4625   -1.2278 N   0  3  0

+   -2.8065   -1.7349    0.6616 C   0  0  0

+    3.5094   -0.6935   -0.0836 C   0  0  0

+    1.3594    2.3744    1.7395 O   0  0  0

+   -0.4829    1.4662    1.2583 O   0  5  0

+   -3.5094   -0.6934    0.0837 C   0  0  0

+   -1.3593    2.3744   -1.7394 O   0  0  0

+    0.4829    1.4656   -1.2591 O   0  5  0

+    4.9892   -0.6935   -0.1188 N   0  3  0

+   -4.9892   -0.6934    0.1189 N   0  3  0

+    5.5855   -1.6069   -0.6608 O   0  0  0

+    5.6106    0.2200    0.3941 O   0  5  0

+   -5.5855   -1.6069    0.6606 O   0  0  0

+   -5.6106    0.2202   -0.3937 O   0  5  0

+    0.9798   -2.5696    0.0000 H   0  0  0

+   -0.9798   -2.5697    0.0000 H   0  0  0

+    3.2858    1.1726    0.0000 H   0  0  0

+    3.2502   -2.5660    0.0000 H   0  0  0

+   -3.2858    1.1728    0.0000 H   0  0  0

+   -3.2503   -2.5661    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+  8 15  1  0

+ 10 16  1  0

+ 11 17  2  0

+ 11 18  1  0

+ 13 19  1  0

+ 16 20  1  0

+ 19 21  2  0

+ 19 22  1  0

+ 20 23  2  0

+ 20 24  1  0

+  9 13  2  0

+ 12 16  2  0

+  4 25  1  0

+  6 26  1  0

+  7 27  1  0

+  9 28  1  0

+ 10 29  1  0

+ 12 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-40-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.5934    0.0051    0.1561 C   0  0  0

+    0.1503   -1.1806   -0.4715 C   0  0  0

+    0.1335    1.2938   -0.2344 C   0  0  0

+   -2.0057    0.0464   -0.3679 C   0  0  0

+    1.5196   -1.3036    0.2005 C   0  0  0

+    1.6036    1.1602    0.0356 C   0  0  0

+   -3.0152   -0.0514    0.4613 C   0  0  0

+    2.2073    0.0301    0.2203 C   0  0  0

+   -1.1174   -0.9102    0.0000 H   0  0  0

+   -0.8428   -1.5359    0.0000 H   0  0  0

+    0.2839   -2.2268    0.0000 H   0  0  0

+    0.3756    2.3203    0.0000 H   0  0  0

+   -0.8488    1.6777    0.0000 H   0  0  0

+   -2.0412    1.1005    0.0000 H   0  0  0

+    1.2911   -2.3332    0.0000 H   0  0  0

+    2.5114   -1.6625    0.0000 H   0  0  0

+    2.1864    2.0393    0.0000 H   0  0  0

+   -3.6282    0.8069    0.0000 H   0  0  0

+   -3.4520   -1.0114    0.0000 H   0  0  0

+    3.2620    0.0378    0.0000 H   0  0  0

+  1  2  1  0

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+  2 10  1  0

+  2 11  1  0

+  3 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+153-98-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -0.1524   -0.1850    0.1793 C   0  0  0

+   -0.8854   -1.3495   -0.1103 C   0  0  0

+    1.2368   -0.6142    0.3580 C   0  0  0

+   -0.8015    1.0499    0.2464 C   0  0  0

+    0.0056   -2.4020   -0.1049 N   0  0  0

+   -2.2555   -1.2594   -0.3329 C   0  0  0

+    1.2638   -1.9440    0.1759 C   0  0  0

+    2.4129    0.2696    0.6845 C   0  0  0

+   -2.1626    1.1177    0.0269 C   0  0  0

+   -2.8843   -0.0362   -0.2688 C   0  0  0

+    3.0531    0.7665   -0.6133 C   0  0  0

+   -2.8000    2.3173    0.0908 O   0  0  0

+    4.1996    1.6281   -0.2950 N   0  0  0

+   -0.2468    1.9185    0.0000 H   0  0  0

+   -0.2590   -3.3981    0.0000 H   0  0  0

+   -2.8210   -2.1210    0.0000 H   0  0  0

+    2.1140   -2.5265    0.0000 H   0  0  0

+    2.5425   -0.7529    0.0000 H   0  0  0

+    3.3652   -0.1245    0.0000 H   0  0  0

+   -3.9140    0.0071    0.0000 H   0  0  0

+    2.9235    1.7890    0.0000 H   0  0  0

+    2.1008    1.1606    0.0000 H   0  0  0

+   -3.2836    3.2275    0.0000 H   0  0  0

+    5.1478    1.2241    0.0000 H   0  0  0

+    4.0753    2.6512    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  6 10  2  0

+  8 11  1  0

+  9 12  1  0

+ 11 13  1  0

+  5  7  1  0

+  9 10  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+548-08-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+    0.4805   -0.0968   -0.0163 C   0  0  0

+   -0.6065    0.7753   -0.1026 C   0  0  0

+    1.7772    0.4021    0.0934 C   0  0  0

+    0.2399   -1.5593   -0.0489 C   0  0  0

+   -2.0019    0.2191   -0.1973 C   0  0  1

+   -0.3913    2.1377   -0.1051 C   0  0  0

+    1.9817    1.7783    0.1137 C   0  0  0

+    2.9863   -0.2214    0.1940 O   0  0  0

+   -1.0361   -2.0395    0.2424 C   0  0  0

+    1.2637   -2.4462   -0.3648 C   0  0  0

+   -2.1301   -1.0737    0.6050 C   0  0  0

+   -2.9561    1.2033    0.3320 N   0  0  0

+    0.8990    2.6346    0.0136 C   0  0  0

+   -1.5259    3.1114   -0.2637 C   0  0  0

+    3.3205    2.0182    0.2338 O   0  0  0

+    3.9657    0.7833   -0.1296 C   0  0  0

+   -1.2809   -3.3970    0.2065 C   0  0  0

+    1.0078   -3.8030   -0.3943 C   0  0  0

+   -2.8484    2.3992   -0.5031 C   0  0  0

+   -4.2991    0.6517    0.1082 C   0  0  0

+   -0.2608   -4.2761   -0.1102 C   0  0  0

+   -2.9797   -0.1219    0.0000 H   0  0  0

+    2.2416   -2.1055    0.0000 H   0  0  0

+   -3.1172   -0.7608    0.0000 H   0  0  0

+   -2.6402   -1.9749    0.0000 H   0  0  0

+    1.0545    3.6584    0.0000 H   0  0  0

+   -0.7605    3.8089    0.0000 H   0  0  0

+   -2.1246    3.9563    0.0000 H   0  0  0

+    4.6269   -0.0136    0.0000 H   0  0  0

+    4.8279    1.3569    0.0000 H   0  0  0

+   -2.2570   -3.7429    0.0000 H   0  0  0

+    1.7997   -4.4702    0.0000 H   0  0  0

+   -3.1538    3.3887    0.0000 H   0  0  0

+   -3.8783    2.2909    0.0000 H   0  0  0

+   -4.6925    1.6096    0.0000 H   0  0  0

+   -5.2570    0.2583    0.0000 H   0  0  0

+   -3.9057   -0.3062    0.0000 H   0  0  0

+   -0.4433   -5.2954    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  2  0

+ 12 19  1  0

+ 12 20  1  0

+ 17 21  2  0

+  7 13  1  0

+  9 11  1  0

+ 14 19  1  0

+ 15 16  1  0

+ 18 21  1  0

+  5 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2381-39-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.4003   -0.0821   -0.0020 C   0  0  0

+   -1.7938    0.1063   -0.0014 C   0  0  0

+    0.4560    1.0336   -0.0002 C   0  0  0

+    0.1489   -1.4386    0.0015 C   0  0  0

+   -2.3174    1.4198    0.0006 C   0  0  0

+   -2.6603   -1.0094   -0.0023 C   0  0  0

+    1.8990    0.8026   -0.0009 C   0  0  0

+   -0.0888    2.3314    0.0026 C   0  0  0

+    1.5217   -1.6239    0.0005 C   0  0  0

+   -0.7754   -2.5730    0.0057 C   0  0  0

+   -1.4322    2.5209    0.0014 C   0  0  0

+   -3.7064    1.5953    0.0012 C   0  0  0

+   -2.1096   -2.3623   -0.0034 C   0  0  0

+   -4.0396   -0.7915   -0.0016 C   0  0  0

+    2.3960   -0.5253   -0.0034 C   0  0  0

+    2.7974    1.8768    0.0012 C   0  0  0

+    2.0837   -3.0221    0.0047 C   0  0  0

+   -4.5414    0.4974   -0.0001 C   0  0  0

+    3.7902   -0.7314   -0.0035 C   0  0  0

+    4.1395    1.6389    0.0010 C   0  0  0

+    4.6330    0.3365   -0.0014 C   0  0  0

+    0.5551    3.1667    0.0000 H   0  0  0

+   -0.3987   -3.5581    0.0000 H   0  0  0

+   -1.8202    3.5016    0.0000 H   0  0  0

+   -4.1146    2.5677    0.0000 H   0  0  0

+   -2.7649   -3.1887    0.0000 H   0  0  0

+   -4.7012   -1.6128    0.0000 H   0  0  0

+    2.4363    2.8677    0.0000 H   0  0  0

+    1.1052   -3.4154    0.0000 H   0  0  0

+    2.4770   -4.0006    0.0000 H   0  0  0

+    3.0622   -2.6288    0.0000 H   0  0  0

+   -5.5858    0.6440    0.0000 H   0  0  0

+    4.1794   -1.7116    0.0000 H   0  0  0

+    4.8125    2.4509    0.0000 H   0  0  0

+    5.6753    0.1758    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

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+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+ 12 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 19 21  2  0

+  8 11  2  0

+  9 15  2  0

+ 10 13  2  0

+ 14 18  2  0

+ 20 21  1  0

+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-33-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    1.0778   -0.3411   -0.0030 C   0  0  0

+   -0.1639   -0.9439   -0.0030 C   0  0  0

+    1.1782    1.0501   -0.0007 C   0  0  0

+    2.2038   -1.1039    0.0004 O   0  0  0

+   -1.3210   -0.1552   -0.0006 C   0  0  0

+    0.0309    1.8334    0.0017 C   0  0  0

+    2.4006    1.6404   -0.0002 O   0  0  0

+    1.7785   -2.4681    0.0034 C   0  0  0

+   -1.2118    1.2407    0.0018 C   0  0  0

+   -2.6452   -0.7902   -0.0011 C   0  0  0

+   -3.6463   -0.1053    0.0010 O   0  0  0

+   -0.2401   -1.9830    0.0000 H   0  0  0

+    0.1111    2.8722    0.0000 H   0  0  0

+    3.3388    2.0935    0.0000 H   0  0  0

+    0.7838   -2.1580    0.0000 H   0  0  0

+    1.4684   -3.4628    0.0000 H   0  0  0

+    2.7732   -2.7782    0.0000 H   0  0  0

+   -2.0706    1.8306    0.0000 H   0  0  0

+   -2.7248   -1.8291    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+ 10 11  2  0

+  6  9  2  0

+  2 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+26446-35-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    1.3362   -0.1283   -0.2604 C   0  0  0

+    0.0035    0.5620    0.0367 C   0  0  0

+    2.4867    0.8379    0.0290 C   0  0  0

+    1.4675   -1.2865    0.5663 O   0  0  0

+   -1.0883   -0.3550   -0.2380 O   0  0  0

+    3.7314    0.1932   -0.2485 O   0  0  0

+   -2.3579    0.0370   -0.0478 C   0  0  0

+   -3.4911   -0.9148   -0.3328 C   0  0  0

+   -2.5922    1.1528    0.3520 O   0  0  0

+    0.4628   -0.7295    0.0000 H   0  0  0

+    0.6104    1.4315    0.0000 H   0  0  0

+   -0.7790    1.2776    0.0000 H   0  0  0

+    3.0936    1.7074    0.0000 H   0  0  0

+    1.7043    1.5535    0.0000 H   0  0  0

+    1.5869   -2.3401    0.0000 H   0  0  0

+    4.6729   -0.2945    0.0000 H   0  0  0

+   -4.1731   -0.1029    0.0000 H   0  0  0

+   -4.3030   -1.5968    0.0000 H   0  0  0

+   -2.8091   -1.7267    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  7  8  1  0

+  7  9  2  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+22248-79-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    0.3437   -0.6212    0.2866 C   0  0  0

+   -1.1064   -0.8105    0.5126 C   0  0  0

+    1.0472   -1.5082   -0.5307 C   0  0  0

+    1.0117    0.4470    0.8846 C   0  0  0

+   -1.9912   -0.5318   -0.4811 O   0  0  0

+   -1.5448   -1.2540    1.6898 C   0  0  0

+    2.4001   -1.3267   -0.7379 C   0  0  0

+    0.2224   -2.8369   -1.2845 Cl  0  0  0

+    2.3650    0.6187    0.6703 C   0  0  0

+   -2.2017    1.0644   -0.4826 P   0  0  0

+   -3.2286   -1.6151    1.9090 Cl  0  0  0

+    3.0592   -0.2679   -0.1371 C   0  0  0

+    3.1981    1.9482    1.4134 Cl  0  0  0

+   -1.0083    1.7623   -1.3078 O   0  0  0

+   -3.6115    1.4191   -1.1744 O   0  0  0

+   -2.1962    1.5641    0.9105 O   0  0  0

+    4.7604   -0.0459   -0.4022 Cl  0  0  0

+   -0.9246    1.0864   -2.5641 C   0  0  0

+   -3.8582    2.8040   -0.9227 C   0  0  0

+    0.4600    1.3094    0.0000 H   0  0  0

+   -1.0529   -2.1518    0.0000 H   0  0  0

+    2.9557   -2.1866    0.0000 H   0  0  0

+   -1.9406    0.9606    0.0000 H   0  0  0

+   -0.7988    0.0704    0.0000 H   0  0  0

+    0.0914    1.2122    0.0000 H   0  0  0

+   -2.8503    2.9835    0.0000 H   0  0  0

+   -4.0377    3.8119    0.0000 H   0  0  0

+   -4.8661    2.6245    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

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+  6 11  1  0

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+  9 13  1  0

+ 10 14  1  0

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+ 12 17  1  0

+ 14 18  1  0

+ 15 19  1  0

+  9 12  2  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+ 18 23  1  0

+ 18 24  1  0

+ 18 25  1  0

+ 19 26  1  0

+ 19 27  1  0

+ 19 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-39-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.7043    0.2446   -0.4192 C   0  0  0

+   -0.6733    0.5833   -0.8055 C   0  0  0

+    1.1116   -1.0929   -0.3674 C   0  0  0

+    1.6168    1.2587   -0.1068 C   0  0  0

+   -1.7061    0.2373   -0.0019 C   0  0  0

+    2.4054   -1.4020   -0.0045 C   0  0  0

+    2.9066    0.9328    0.2541 C   0  0  0

+   -2.9693   -0.0478   -0.5604 C   0  0  0

+   -1.5061    0.1567    1.4896 C   0  0  0

+    3.3002   -0.3935    0.3080 C   0  0  0

+   -3.8959   -0.3582    0.1606 O   0  0  0

+   -0.7143    1.5802    0.0000 H   0  0  0

+    0.4280   -1.8196    0.0000 H   0  0  0

+    1.3264    2.2133    0.0000 H   0  0  0

+    2.7053   -2.3536    0.0000 H   0  0  0

+    3.5975    1.6526    0.0000 H   0  0  0

+   -3.2379    0.9131    0.0000 H   0  0  0

+   -1.8790   -0.7687    0.0000 H   0  0  0

+   -0.5807   -0.2162    0.0000 H   0  0  0

+   -1.1332    1.0821    0.0000 H   0  0  0

+    4.2742   -0.6099    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

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+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+483-65-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -4.5377   -1.5107   -0.0002 C   0  0  0

+   -3.6004   -0.3306    0.0012 C   0  0  0

+   -2.2135   -0.5339    0.0007 C   0  0  0

+   -4.0987    0.9395   -0.0028 C   0  0  0

+   -1.3534    0.5876    0.0015 C   0  0  0

+   -1.6685   -1.8391    0.0000 C   0  0  0

+   -3.2496    2.0394   -0.0020 C   0  0  0

+    0.0953    0.3639    0.0009 C   0  0  0

+   -1.8935    1.8746    0.0024 C   0  0  0

+   -0.3360   -2.0446   -0.0001 C   0  0  0

+    0.5771   -0.9644   -0.0004 C   0  0  0

+    0.9986    1.4285    0.0011 C   0  0  0

+    1.9611   -1.1888   -0.0010 C   0  0  0

+    2.3410    1.1768    0.0000 C   0  0  0

+    2.8190   -0.1284   -0.0004 C   0  0  0

+    4.3056   -0.3753   -0.0005 C   0  0  0

+    4.9269    0.2535   -1.2494 C   0  0  0

+    4.9269    0.2520    1.2490 C   0  0  0

+   -5.3575   -0.8595    0.0000 H   0  0  0

+   -5.1889   -2.3305    0.0000 H   0  0  0

+   -3.7179   -2.1619    0.0000 H   0  0  0

+   -5.1352    1.0874    0.0000 H   0  0  0

+   -2.3138   -2.6635    0.0000 H   0  0  0

+   -3.6537    3.0053    0.0000 H   0  0  0

+   -1.2622    2.7098    0.0000 H   0  0  0

+    0.0309   -3.0252    0.0000 H   0  0  0

+    0.6485    2.4152    0.0000 H   0  0  0

+    2.3347   -2.1668    0.0000 H   0  0  0

+    3.0175    1.9758    0.0000 H   0  0  0

+    4.6278   -1.3715    0.0000 H   0  0  0

+    5.6716   -0.4824    0.0000 H   0  0  0

+    5.6628    0.9982    0.0000 H   0  0  0

+    4.1822    0.9894    0.0000 H   0  0  0

+    5.6708   -0.4848    0.0000 H   0  0  0

+    5.6637    0.9959    0.0000 H   0  0  0

+    4.1830    0.9888    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

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+  7  4  2  0

+  8  5  1  0

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+ 10  6  2  0

+ 11  8  2  0

+ 12  8  1  0

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+ 16 15  1  0

+ 17 16  1  0

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+  7  9  1  0

+ 10 11  1  0

+ 14 15  1  0

+  1 19  1  0

+  1 20  1  0

+  1 21  1  0

+  4 22  1  0

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+ 12 27  1  0

+ 13 28  1  0

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+ 16 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6099-90-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 19                          1 V2000

+   -3.5883    1.3324    0.1765 C   0  0  0

+   -4.3959    0.3045    0.6388 C   0  0  0

+   -2.4049    1.0404   -0.4853 C   0  0  0

+   -3.9590    2.6258    0.3670 O   0  0  0

+   -4.0203   -1.0157    0.4394 C   0  0  0

+   -2.0295   -0.2794   -0.6847 C   0  0  0

+   -2.8373   -1.3076   -0.2223 C   0  0  0

+   -4.8116   -2.0232    0.8929 O   0  0  0

+   -0.8700   -0.5655   -1.3331 O   0  0  0

+    7.7530   -0.2193   -0.3740 O   0  0  0

+   16.3568    0.1262    0.5506 O   0  0  0

+   -5.3578    0.4939    0.0000 H   0  0  0

+   -1.7240    1.7457    0.0000 H   0  0  0

+   -4.2291    3.5683    0.0000 H   0  0  0

+   -2.5182   -2.2346    0.0000 H   0  0  0

+   -5.4172   -2.7942    0.0000 H   0  0  0

+    0.0819   -0.8004    0.0000 H   0  0  0

+    6.7726   -0.2193    0.0000 H   0  0  0

+    8.7334   -0.2193    0.0000 H   0  0  0

+   15.3764    0.1262    0.0000 H   0  0  0

+   17.3372    0.1262    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2846-29-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 79                          1 V2000

+    1.2892   -0.5958   -0.3071 C   0  0  1

+    0.0137   -1.0647    0.3693 C   0  0  1

+    1.9679    0.4105    0.6326 C   0  0  1

+    2.2356   -1.7857   -0.4988 C   0  0  1

+   -0.9168    0.1715    0.4933 C   0  0  1

+   -0.8555   -2.0269   -0.4475 C   0  0  0

+    3.2473    0.9427    0.0097 C   0  0  2

+    1.0416    1.5724    0.9815 C   0  0  0

+    3.5555   -1.2886   -1.0125 C   0  0  0

+    2.4300   -2.4463    0.7533 O   0  0  0

+   -2.2690   -0.4427    0.8416 C   0  0  2

+   -0.3032    1.0817    1.5400 C   0  0  0

+   -1.0038    0.8966   -0.8512 C   0  0  0

+   -2.2620   -1.8465    0.1865 C   0  0  0

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+    2.6763   -3.8629    0.4523 O   0  0  0

+   -3.3865    0.4017    0.2261 C   0  0  1

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+ 30 75  1  0

+ 30 76  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+843-55-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 42                          1 V2000

+   -4.1245   -2.7495    0.0222 O   0  0  0

+   -3.1142   -1.8405    0.0152 C   0  0  0

+   -2.5954   -1.3692    1.2122 C   0  0  0

+   -2.5961   -1.3867   -1.1893 C   0  0  0

+   -1.5684   -0.4451    1.2024 C   0  0  0

+   -1.5694   -0.4628   -1.1938 C   0  0  0

+   -1.0578    0.0099    0.0009 C   0  0  0

+    0.0625    1.0179   -0.0069 C   0  0  0

+   -0.0428    1.8877   -1.2611 C   0  0  0

+   -0.0389    1.9026    1.2373 C   0  0  0

+    1.3862    0.2977   -0.0046 C   0  0  0

+   -1.3868    2.6188   -1.2634 C   0  0  0

+   -1.3829    2.6337    1.2350 C   0  0  0

+    2.5639    1.0187    0.0614 C   0  0  0

+    1.4207   -1.0835   -0.0628 C   0  0  0

+   -1.4882    3.5035   -0.0193 C   0  0  0

+    3.7789    0.3607    0.0641 C   0  0  0

+    2.6327   -1.7460   -0.0605 C   0  0  0

+    3.8163   -1.0244    0.0004 C   0  0  0

+    5.0101   -1.6738    0.0025 O   0  0  0

+   -4.8945   -3.4423    0.0000 H   0  0  0

+   -3.2900   -0.6009    0.0000 H   0  0  0

+   -1.9084   -2.1613    0.0000 H   0  0  0

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+    2.6572   -2.7815    0.0000 H   0  0  0

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+  2  1  1  0

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+ 16 37  1  0

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+ 18 39  1  0

+ 20 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90-65-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    0.0070   -0.1631   -0.1823 C   0  0  0

+   -1.3950    0.1702   -0.5256 C   0  0  0

+    0.9951    0.7272   -0.4330 C   0  0  0

+    0.2989   -1.3548    0.3870 O   0  0  0

+   -2.3643    0.4532    0.5400 C   0  0  0

+   -1.7428    0.2093   -1.6899 O   0  0  0

+    2.3535    0.4705    0.0533 C   0  0  0

+   -0.0082   -2.3609   -0.5803 C   0  0  0

+   -1.9770    0.2554    1.9829 C   0  0  0

+   -3.5880    0.8854    0.2311 C   0  0  0

+    3.3325    1.3697   -0.1746 O   0  0  0

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+    0.7467    1.6132    0.0000 H   0  0  0

+   -0.8883   -2.0923    0.0000 H   0  0  0

+   -0.2768   -3.2410    0.0000 H   0  0  0

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+  1  2  1  0

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+  9 18  1  0

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+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+513-88-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    1.0896   -0.7136   -0.1024 C   0  0  0

+   -0.1079    0.0801   -0.5574 C   0  0  0

+    2.4104   -0.0233    0.1213 C   0  0  0

+    0.9896   -1.9020    0.0877 O   0  0  0

+   -1.6123   -0.6859    0.0756 Cl  0  0  0

+    0.0164    1.7668    0.0672 Cl  0  0  0

+   -1.0387    0.6989    0.0000 H   0  0  0

+    2.9281   -1.0139    0.0000 H   0  0  0

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+  1  2  1  0

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+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92072-10-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.6940    0.7615    0.0275 C   0  0  0

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+   -2.0143    3.2313    0.0515 C   0  0  0

+   -4.3196   -0.3512    0.0244 N   0  3  0

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+ 18 23  2  0

+ 20 24  1  0

+  6 27  1  0

+  8 28  1  0

+ 10 29  1  0

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+ 14 31  1  0

+ 15 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 23 35  1  0

+ 24 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64314-52-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 68                          1 V2000

+    0.0926   -0.6107    0.1564 C   0  0  0

+   -0.5127   -1.6974    0.7350 C   0  0  0

+    1.5825   -0.5296   -0.0566 C   0  0  2

+   -0.6789    0.4794   -0.2687 C   0  0  0

+   -1.9044   -1.7217    0.8989 C   0  0  0

+    0.2637   -2.8936    1.2231 C   0  0  0

+    2.3083   -1.5475    0.8201 C   0  0  0

+    2.0346    0.7848    0.2750 O   0  0  0

+   -2.0636    0.4705   -0.1132 C   0  0  0

+   -0.0728    1.5518   -0.8355 O   0  0  0

+   -2.6857   -0.6457    0.4821 C   0  0  0

+   -2.4956   -2.8012    1.4683 O   0  0  0

+    1.6591   -2.9197    0.6038 C   0  0  2

+    2.9797    1.1619   -0.7284 C   0  0  1

+   -2.8743    1.6160   -0.5608 C   0  0  0

+   -4.1483   -0.6702    0.6550 C   0  0  0

+    1.5544   -3.2049   -0.8723 C   0  0  0

+    2.4472   -3.9310    1.2348 O   0  0  0

+    2.9880    2.6853   -0.8746 C   0  0  0

+    4.2781    0.7054   -0.3540 O   0  0  0

+   -4.3423    1.5904   -0.3911 C   0  0  0

+   -2.3368    2.5807   -1.0693 O   0  0  0

+   -4.9623    0.4796    0.2076 C   0  0  0

+   -4.6852   -1.6348    1.1644 O   0  0  0

+    2.7267   -3.7983   -1.6101 C   0  0  0

+    0.5309   -2.9580   -1.4638 O   0  0  0

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+   -5.1163    2.6679   -0.8128 C   0  0  0

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+    4.6713    2.6982    0.9610 C   0  0  1

+    3.5246    4.7641    0.3084 N   0  0  0

+    5.8323    0.5490    1.4872 C   0  0  0

+   -6.4897    2.6358   -0.6499 C   0  0  0

+   -7.0991    1.5459   -0.0547 C   0  0  0

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+   -6.8019   -0.4213    0.0000 H   0  0  0

+    1.4965   -4.4290    0.0000 H   0  0  0

+    4.7178    3.6944    0.0000 H   0  0  0

+    4.4404    5.1589    0.0000 H   0  0  0

+    2.7248    5.3598    0.0000 H   0  0  0

+    5.3993   -0.3494    0.0000 H   0  0  0

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+    6.2653    1.4474    0.0000 H   0  0  0

+   -7.0043    3.4901    0.0000 H   0  0  0

+   -8.0952    1.4964    0.0000 H   0  0  0

+    6.6684    3.4148    0.0000 H   0  0  0

+  1  2  1  0

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+ 34 60  1  0

+ 34 61  1  0

+ 35 62  1  0

+ 36 63  1  0

+ 37 64  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4074-88-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    3.7379    0.4630   -0.0581 C   0  0  0

+    2.7052   -0.3789    0.1460 O   0  0  0

+    4.2221    1.3117    1.0395 C   0  0  0

+    4.2717    0.5167   -1.1486 O   0  0  0

+    2.2268   -1.2175   -0.9385 C   0  0  0

+    5.2416    2.1429    0.8379 C   0  0  0

+    1.0571   -2.0714   -0.4451 C   0  0  0

+   -0.0001   -1.2194    0.0003 O   0  0  0

+   -1.0572   -2.0713    0.4463 C   0  0  0

+   -2.2270   -1.2173    0.9392 C   0  0  0

+   -2.7056   -0.3796   -0.1460 O   0  0  0

+   -3.7385    0.4623    0.0576 C   0  0  0

+   -4.2229    1.3100   -1.0407 C   0  0  0

+   -4.2691    0.5202    1.1494 O   0  0  0

+   -5.2426    2.1412   -0.8397 C   0  0  0

+    3.4692    1.9493    0.0000 H   0  0  0

+    2.4686   -2.1740    0.0000 H   0  0  0

+    3.2044   -1.3507    0.0000 H   0  0  0

+    6.1638    1.7924    0.0000 H   0  0  0

+    5.0840    3.1168    0.0000 H   0  0  0

+    0.3734   -2.7827    0.0000 H   0  0  0

+    1.7061   -2.8145    0.0000 H   0  0  0

+   -1.7062   -2.8144    0.0000 H   0  0  0

+   -0.3735   -2.7826    0.0000 H   0  0  0

+   -3.2045   -1.3509    0.0000 H   0  0  0

+   -2.4686   -2.1739    0.0000 H   0  0  0

+   -3.4702    1.9479    0.0000 H   0  0  0

+   -5.0851    3.1152    0.0000 H   0  0  0

+   -6.1648    1.7906    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  7  8  1  0

+  8  9  1  0

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+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13048-33-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 33                          1 V2000

+    5.5352   -0.0583   -0.0009 C   0  0  0

+    4.3000    0.4815   -0.0002 O   0  0  0

+    6.7180    0.8136   -0.0001 C   0  0  0

+    5.6705   -1.2661    0.0027 O   0  0  0

+    3.1312   -0.3800   -0.0011 C   0  0  0

+    7.9375    0.2807   -0.0008 C   0  0  0

+    1.8648    0.4785    0.0000 C   0  0  0

+    0.6332   -0.4293   -0.0009 C   0  0  0

+   -0.6332    0.4293    0.0002 C   0  0  0

+   -1.8648   -0.4785   -0.0008 C   0  0  0

+   -3.1312    0.3800    0.0003 C   0  0  0

+   -4.3000   -0.4815   -0.0006 O   0  0  0

+   -5.5352    0.0583    0.0002 C   0  0  0

+   -6.7180   -0.8136   -0.0007 C   0  0  0

+   -5.6705    1.2661    0.0015 O   0  0  0

+   -7.9375   -0.2807    0.0000 C   0  0  0

+    6.5967    1.8958    0.0000 H   0  0  0

+    2.4222   -1.2065    0.0000 H   0  0  0

+    3.8723   -1.1779    0.0000 H   0  0  0

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+    1.1237    1.2764    0.0000 H   0  0  0

+   -0.0759   -1.2558    0.0000 H   0  0  0

+    1.3743   -1.2272    0.0000 H   0  0  0

+    0.0759    1.2558    0.0000 H   0  0  0

+   -1.3743    1.2272    0.0000 H   0  0  0

+   -2.5738   -1.3050    0.0000 H   0  0  0

+   -1.1237   -1.2764    0.0000 H   0  0  0

+   -2.4222    1.2065    0.0000 H   0  0  0

+   -3.8723    1.1779    0.0000 H   0  0  0

+   -6.5967   -1.8958    0.0000 H   0  0  0

+   -8.0588    0.8015    0.0000 H   0  0  0

+   -8.8141   -0.9269    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  7  8  1  0

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+ 10 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+ 14 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+191-24-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 39                          1 V2000

+    0.7053   -0.8693   -0.0023 C   0  0  0

+   -0.7053   -0.8693   -0.0019 C   0  0  0

+    1.4216    0.3469   -0.0016 C   0  0  0

+    1.4043   -2.0948    0.0025 C   0  0  0

+   -1.4216    0.3469   -0.0008 C   0  0  0

+   -1.4043   -2.0947   -0.0022 C   0  0  0

+    0.7366    1.5817   -0.0005 C   0  0  0

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+   -2.8175   -2.0870   -0.0013 C   0  0  0

+    1.4658    2.7635    0.0007 C   0  0  0

+    3.5075   -0.9227   -0.0025 C   0  0  0

+    3.5360    1.5326   -0.0007 C   0  0  0

+   -1.4657    2.7636    0.0014 C   0  0  0

+   -3.5075   -0.9227   -0.0007 C   0  0  0

+   -3.5360    1.5326    0.0011 C   0  0  0

+    2.8512    2.7282    0.0007 C   0  0  0

+   -2.8512    2.7282    0.0023 C   0  0  0

+    1.2004   -4.2210    0.0000 H   0  0  0

+    3.3438   -3.0048    0.0000 H   0  0  0

+   -1.2006   -4.2209    0.0000 H   0  0  0

+   -3.3438   -3.0048    0.0000 H   0  0  0

+    0.9621    3.6938    0.0000 H   0  0  0

+    4.5653   -0.9432    0.0000 H   0  0  0

+    4.5939    1.5301    0.0000 H   0  0  0

+   -0.9620    3.6939    0.0000 H   0  0  0

+   -4.5653   -0.9432    0.0000 H   0  0  0

+   -4.5939    1.5301    0.0000 H   0  0  0

+    3.3934    3.6367    0.0000 H   0  0  0

+   -3.3934    3.6366    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141-46-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.5918   -0.6248   -0.0757 C   0  0  0

+   -0.6474    0.0412    0.4644 C   0  0  0

+    1.6758    0.3062   -0.0657 O   0  0  0

+   -1.6340    0.1318   -0.2261 O   0  0  0

+   -0.0177   -1.4861    0.0000 H   0  0  0

+    1.3720   -1.3351    0.0000 H   0  0  0

+   -0.3433    1.0515    0.0000 H   0  0  0

+    2.4762    0.9937    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6623-66-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.0336    0.0007    0.1118 C   0  0  0

+   -1.2287   -0.7640    0.0888 C   0  0  0

+   -0.0251    1.3954    0.2622 C   0  0  0

+    1.2657   -0.6337   -0.0177 C   0  0  0

+   -2.4327   -0.0348   -0.0372 C   0  0  0

+   -1.2683   -2.1476    0.1854 C   0  0  0

+   -1.2260    2.0154    0.3926 O   0  0  0

+    1.1506    2.1300    0.2795 C   0  0  0

+    2.4253    0.1132    0.0038 C   0  0  0

+   -2.3330    1.4338   -0.1326 C   0  0  0

+   -3.6500   -0.7046   -0.0662 C   0  0  0

+   -2.4869   -2.7969    0.1559 C   0  0  0

+    2.3670    1.4891    0.1529 C   0  0  0

+    3.7373   -0.5583   -0.1332 N   0  3  0

+   -3.2063    2.0951   -0.6602 O   0  0  0

+   -3.6683   -2.0815    0.0304 C   0  0  0

+    4.7627    0.0987   -0.1145 O   0  0  0

+    3.7915   -1.7680   -0.2647 O   0  5  0

+    1.3158   -1.6682    0.0000 H   0  0  0

+   -0.3880   -2.6933    0.0000 H   0  0  0

+    1.1125    3.1650    0.0000 H   0  0  0

+   -4.5381   -0.1716    0.0000 H   0  0  0

+   -2.5153   -3.8322    0.0000 H   0  0  0

+    3.2422    2.0429    0.0000 H   0  0  0

+   -4.5740   -2.5840    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  2  0

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+  3  7  1  0

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+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

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+  8 13  1  0

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+ 10 15  2  0

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+ 14 17  2  0

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+  7 10  1  0

+  9 13  2  0

+ 12 16  1  0

+  4 19  1  0

+  6 20  1  0

+  8 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68-12-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.5188    0.0014   -0.0018 N   0  0  0

+   -0.6539   -0.6628   -0.0012 C   0  0  0

+    0.5309    1.4664    0.0003 C   0  0  0

+    1.7815   -0.7415    0.0015 C   0  0  0

+   -1.6992   -0.0478    0.0011 O   0  0  0

+   -0.6626   -1.7176    0.0000 H   0  0  0

+    1.5857    1.4577    0.0000 H   0  0  0

+    0.5396    2.5212    0.0000 H   0  0  0

+   -0.5239    1.4751    0.0000 H   0  0  0

+    1.2466   -1.6506    0.0000 H   0  0  0

+    2.6906   -1.2764    0.0000 H   0  0  0

+    2.3164    0.1676    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101489-25-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 46                          1 V2000

+    1.6918    0.2746    0.1237 C   0  0  0

+    0.3481    0.0177   -0.1298 C   0  0  0

+    2.4509    1.5806    0.2396 C   0  0  1

+    2.6018   -0.7523    0.3172 C   0  0  0

+   -0.0768   -1.3210   -0.1361 C   0  0  0

+   -0.4654    1.0492   -0.3814 O   0  0  0

+    3.7834    1.1181    0.9007 C   0  0  1

+    2.8757    2.0338   -1.1726 C   0  0  0

+    3.8554   -0.2671    0.5282 O   0  0  0

+    2.1679   -2.0803    0.2703 C   0  0  0

+    0.8367   -2.3657    0.0406 C   0  0  0

+   -1.5178   -1.5912   -0.3082 C   0  0  0

+   -1.7701    0.8611   -0.1517 C   0  0  0

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+   -2.3771   -0.4015   -0.1185 C   0  0  0

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+   -2.5788    1.9844    0.0663 C   0  0  0

+    1.5669   -4.4739    0.2013 C   0  0  0

+   -3.7523   -0.5382    0.0919 C   0  0  0

+   -3.9340    1.8418    0.2880 C   0  0  0

+   -2.0235    3.2266    0.0599 O   0  0  0

+   -4.5273    0.5906    0.2980 C   0  0  0

+   -4.3243   -1.7696    0.0936 O   0  0  0

+   -3.0826    4.1537    0.3067 C   0  0  0

+    1.6224    2.1972    0.0000 H   0  0  0

+    3.6426    2.1412    0.0000 H   0  0  0

+    3.2340    3.0024    0.0000 H   0  0  0

+    1.9972    2.5768    0.0000 H   0  0  0

+    2.8590   -2.8478    0.0000 H   0  0  0

+    3.8203    0.9417    0.0000 H   0  0  0

+    4.9241    0.9050    0.0000 H   0  0  0

+    0.9678   -5.3152    0.0000 H   0  0  0

+    2.4082   -5.0730    0.0000 H   0  0  0

+    2.1660   -3.6326    0.0000 H   0  0  0

+   -4.5311    2.6845    0.0000 H   0  0  0

+   -5.5568    0.5086    0.0000 H   0  0  0

+   -4.7594   -2.7063    0.0000 H   0  0  0

+   -2.4024    4.9308    0.0000 H   0  0  0

+   -3.8597    4.8339    0.0000 H   0  0  0

+   -3.7628    3.3766    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+ 19 22  2  0

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+ 21 25  1  0

+ 23 26  1  0

+  7  9  1  0

+ 10 11  2  0

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+ 22 37  1  0

+ 24 38  1  0

+ 25 39  1  0

+ 26 40  1  0

+ 26 41  1  0

+ 26 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6312-87-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.6962    0.0582    1.5704 O   0  0  0

+    0.4877   -0.0769    0.9627 C   0  0  0

+    2.6310    0.0833    0.5845 C   0  0  0

+   -0.0268   -1.3414    0.7158 C   0  0  0

+   -0.2336    1.0501    0.5948 C   0  0  0

+    3.0101    1.2911    0.0169 C   0  0  0

+    3.2123   -1.0988    0.1476 C   0  0  0

+   -1.2546   -1.4793    0.0989 C   0  0  0

+   -1.4611    0.9135   -0.0220 C   0  0  0

+    3.9610    1.3139   -0.9851 C   0  0  0

+    4.1625   -1.0704   -0.8544 C   0  0  0

+   -1.9742   -0.3521   -0.2742 C   0  0  0

+    4.5347    0.1344   -1.4221 C   0  0  0

+   -3.2198   -0.4914   -0.9000 N   0  0  0

+   -4.3053    0.1183   -0.3836 C   0  0  0

+   -5.6174    0.0747   -1.1236 C   0  0  0

+   -4.2261    0.7021    0.6766 O   0  0  0

+    0.5424   -2.0931    0.0000 H   0  0  0

+    0.1725    1.9010    0.0000 H   0  0  0

+    2.4430    2.0444    0.0000 H   0  0  0

+    2.7260   -1.9066    0.0000 H   0  0  0

+   -1.6608   -2.3302    0.0000 H   0  0  0

+   -2.0304    1.6651    0.0000 H   0  0  0

+    4.4515    2.1192    0.0000 H   0  0  0

+    4.7335   -1.8207    0.0000 H   0  0  0

+    5.4748    0.2065    0.0000 H   0  0  0

+   -3.4073   -1.4154    0.0000 H   0  0  0

+   -5.6487    1.0171    0.0000 H   0  0  0

+   -6.5598    0.0434    0.0000 H   0  0  0

+   -5.5861   -0.8677    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

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+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87625-62-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 61                          1 V2000

+    3.0244   -1.1390   -0.7134 C   0  0  0

+    2.8491   -0.8814    0.7853 C   0  0  1

+    4.3738   -0.8056   -1.3452 C   0  0  0

+    3.9640   -2.2657   -1.1390 C   0  0  0

+    1.7808   -0.9087   -1.5303 C   0  0  0

+    2.1121    0.4367    0.9794 C   0  0  2

+    2.0371   -2.0185    1.4087 C   0  0  0

+    4.1317   -0.8086    1.4111 O   0  0  0

+    0.7875   -0.2210   -1.0592 C   0  0  0

+    1.6892   -1.4867   -2.9190 C   0  0  0

+    0.7351    0.4113    0.2955 C   0  0  1

+    2.8613    1.5750    0.3222 C   0  0  0

+   -0.2461   -0.2072    1.1302 O   0  0  0

+    0.4401    1.9249    0.1023 C   0  0  0

+    1.8207    2.5258   -0.2367 C   0  0  1

+    4.0603    1.7024    0.2558 O   0  0  0

+   -1.4572   -0.2610    0.3737 C   0  0  2

+    1.9623    3.8912    0.4389 C   0  0  0

+   -2.2141    0.9260    0.6030 O   0  0  0

+   -2.2709   -1.4850    0.7998 C   0  0  1

+   -3.3163    0.9167   -0.3023 C   0  0  1

+   -3.5495   -1.5528   -0.0430 C   0  0  2

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+   -4.0473    2.2588   -0.2296 C   0  0  0

+   -4.3907   -2.5972    0.4508 O   0  0  0

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+    0.9382    3.9974    0.0000 H   0  0  0

+   -2.7812   -0.5908    0.0000 H   0  0  0

+   -2.8820   -0.0167    0.0000 H   0  0  0

+   -3.0806   -2.4694    0.0000 H   0  0  0

+   -0.9346   -3.5300    0.0000 H   0  0  0

+   -4.7077    0.7265    0.0000 H   0  0  0

+   -4.7563    3.0053    0.0000 H   0  0  0

+   -4.8797    1.6529    0.0000 H   0  0  0

+   -5.0365   -3.3990    0.0000 H   0  0  0

+   -6.4240   -0.1890    0.0000 H   0  0  0

+   -2.5692    4.0837    0.0000 H   0  0  0

+  1  2  1  0

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+ 25 55  1  0

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+ 27 57  1  0

+ 28 58  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7144-65-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+    0.9568   -1.0596    0.0688 C   0  0  0

+   -0.4295   -0.9248   -0.0513 C   0  0  0

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+    1.5167   -2.3263    0.2185 C   0  0  0

+   -0.9849    0.3068   -0.1929 O   0  0  0

+   -1.2351   -2.0521   -0.0257 C   0  0  0

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+    1.6659    1.1423    0.9989 C   0  0  0

+    0.7023   -3.4401    0.2476 C   0  0  0

+   -2.3976    0.1143   -0.2890 C   0  0  0

+   -0.6689   -3.3044    0.1180 C   0  0  0

+    3.6117    1.3949   -0.9603 C   0  0  0

+    2.4783    2.2579    0.9698 C   0  0  0

+   -3.0873    1.4703   -0.4511 C   0  0  0

+    3.4508    2.3832   -0.0056 C   0  0  0

+   -4.5998    1.2642   -0.5540 C   0  0  0

+   -3.9665    1.6926    0.6532 O   0  0  0

+    2.5456   -2.4374    0.0000 H   0  0  0

+   -2.2650   -1.9509    0.0000 H   0  0  0

+    3.3384   -0.6116    0.0000 H   0  0  0

+    0.6595    1.3832    0.0000 H   0  0  0

+    1.1246   -4.3848    0.0000 H   0  0  0

+   -3.3665   -0.2491    0.0000 H   0  0  0

+   -2.1445   -0.8891    0.0000 H   0  0  0

+   -1.2722   -4.1452    0.0000 H   0  0  0

+    4.6189    1.1575    0.0000 H   0  0  0

+    1.9509    3.1483    0.0000 H   0  0  0

+   -2.4415    2.2789    0.0000 H   0  0  0

+    4.0693    3.2128    0.0000 H   0  0  0

+   -5.4506    1.8532    0.0000 H   0  0  0

+   -4.8408    0.2578    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77109-49-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+   -2.3439   -0.1138   -0.4436 C   0  0  1

+   -3.3343   -1.2423   -0.3140 C   0  0  0

+   -2.6307    0.9063    0.5679 N   0  0  0

+   -0.9269   -0.6527   -0.2370 C   0  0  0

+   -3.4151   -1.9359    0.8323 O   0  0  0

+   -4.0557   -1.5225   -1.2419 O   0  0  0

+   -3.4769    1.9165    0.2852 C   0  0  0

+    0.2653    0.7056   -0.3930 S   0  0  0

+   -4.3694   -3.0232    0.9572 C   0  0  0

+   -3.7719    2.9659    1.3257 C   0  0  0

+   -4.0008    1.9811   -0.8067 O   0  0  0

+    1.8120   -0.1988   -0.1098 C   0  0  0

+    2.9926    0.7705   -0.1958 C   0  0  0

+    4.6690   -0.2096    0.1111 Br  0  0  0

+   -1.5432    0.6184    0.0000 H   0  0  0

+   -1.6712    1.4128    0.0000 H   0  0  0

+   -1.4302   -1.6139    0.0000 H   0  0  0

+   -0.0322   -1.2666    0.0000 H   0  0  0

+   -5.1849   -2.3075    0.0000 H   0  0  0

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+   -3.5539   -3.7389    0.0000 H   0  0  0

+   -2.7274    3.2595    0.0000 H   0  0  0

+   -4.0655    4.0104    0.0000 H   0  0  0

+   -4.8164    2.6723    0.0000 H   0  0  0

+    1.1578   -1.0644    0.0000 H   0  0  0

+    2.5945   -0.9504    0.0000 H   0  0  0

+    3.6468    1.6361    0.0000 H   0  0  0

+    2.2101    1.5221    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

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+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78400-41-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 44                          1 V2000

+    0.2662   -0.9614    0.1411 C   0  0  0

+    1.1963   -2.1475    0.2386 C   0  0  0

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+   -1.0769   -1.1727    0.1265 C   0  0  0

+    2.7084   -1.8817    0.2403 C   0  0  0

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+   -3.2749   -0.3732    0.0343 C   0  0  0

+   -3.4007   -1.8749    0.1193 C   0  0  0

+    4.5310   -0.1774    0.1375 C   0  0  0

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+  1  2  1  0

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+  5  6  1  0

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+ 20 35  1  0

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+ 22 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+926-06-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.8788    0.0000   -0.0835 S   0  0  0

+   -0.3806    0.0003    0.7711 O   0  0  0

+    2.2125    0.0006    1.1460 C   0  0  0

+    0.7962   -1.2438   -0.7657 O   0  0  0

+    0.7960    1.2431   -0.7669 O   0  0  0

+   -1.4906   -0.0001   -0.1289 C   0  0  0

+   -2.3410   -1.2492    0.1106 C   0  0  0

+   -2.3409    1.2493    0.1096 C   0  0  0

+    2.2129   -0.9439    0.0000 H   0  0  0

+    3.1571    0.0010    0.0000 H   0  0  0

+    2.2121    0.9451    0.0000 H   0  0  0

+   -1.0488   -0.8350    0.0000 H   0  0  0

+   -3.1218   -0.7176    0.0000 H   0  0  0

+   -2.8726   -2.0300    0.0000 H   0  0  0

+   -1.5602   -1.7808    0.0000 H   0  0  0

+   -1.5600    1.7807    0.0000 H   0  0  0

+   -2.8723    2.0302    0.0000 H   0  0  0

+   -3.1218    0.7179    0.0000 H   0  0  0

+  1  2  1  0

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+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+28553-12-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 72 72                          1 V2000

+    0.7250   -3.1704   -0.1141 C   0  0  0

+   -0.6310   -2.9576    0.1984 C   0  0  0

+    1.5259   -2.0889   -0.7263 C   0  0  0

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+   -1.2633   -1.6514   -0.0846 C   0  0  0

+   -1.3732   -3.9848    0.7751 C   0  0  0

+    2.6508   -1.6594   -0.1226 O   0  0  0

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+    0.5577   -5.4102    0.7399 C   0  0  0

+   -2.5875   -1.4897    0.1019 O   0  0  0

+   -0.5887   -0.7243   -0.4852 O   0  0  0

+   -0.7778   -5.2044    1.0374 C   0  0  0

+    3.4373   -0.5972   -0.7238 C   0  0  0

+   -3.2084   -0.2069   -0.1760 C   0  0  0

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+ 30 71  1  0

+ 30 72  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17455-13-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 42                          1 V2000

+   -0.1979   -3.6252   -0.2275 C   0  0  0

+   -1.6148   -3.2545    0.2153 C   0  0  0

+    0.7239   -2.6453    0.2554 O   0  0  0

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+    2.6409   -0.6927   -0.2324 O   0  0  0

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+    3.6361    0.2328    0.2091 C   0  0  0

+   -3.0485    1.9878   -0.2156 C   0  0  0

+    3.2468    1.6468   -0.2268 C   0  0  0

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+    1.9234    1.9377    0.2272 O   0  0  0

+   -0.7193    2.6323   -0.2277 O   0  0  0

+    1.6145    3.2595   -0.2195 C   0  0  0

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+  1  2  1  0

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+ 17 39  1  0

+ 17 40  1  0

+ 18 41  1  0

+ 18 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99-97-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -0.6590    0.0001   -0.0012 C   0  0  0

+   -2.0557    0.0000   -0.0007 N   0  0  0

+    0.0370    1.2020    0.0004 C   0  0  0

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+   -2.7882   -1.2687   -0.0024 C   0  0  0

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+    2.1080    0.0001   -0.0012 C   0  0  0

+    3.6150    0.0001   -0.0018 C   0  0  0

+   -0.4821    2.1053    0.0000 H   0  0  0

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+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5579-05-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+   -2.8280    0.9424    0.1043 O   0  0  0

+   -3.6928   -0.0796   -0.0420 C   0  0  0

+   -1.4893    0.7086    0.0808 C   0  0  0

+   -5.0160    0.1312    0.1039 N   0  0  0

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+ 16 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+60032-80-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 47                          1 V2000

+    0.1566    0.1504   -0.0038 C   0  0  0

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+    3.2428   -2.5121    0.0000 H   0  0  0

+   -4.3990    3.4664    0.0000 H   0  0  0

+   -1.3585   -4.8604    0.0000 H   0  0  0

+   -0.2670   -4.0153    0.0000 H   0  0  0

+   -4.5116   -2.4628    0.0000 H   0  0  0

+   -4.2220   -3.7492    0.0000 H   0  0  0

+   -2.5974    5.0883    0.0000 H   0  0  0

+    4.4721    2.2058    0.0000 H   0  0  0

+    5.5555   -1.8447    0.0000 H   0  0  0

+   -3.6714   -4.4017    0.0000 H   0  0  0

+   -2.4634   -4.9172    0.0000 H   0  0  0

+    6.1597    0.5014    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

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+  7 14  1  0

+  8 15  1  0

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+  5  7  2  0

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+ 21 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 24 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4176-53-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    1.0704   -0.3939   -0.0016 C   0  0  0

+   -0.3811   -0.6001   -0.0011 C   0  0  0

+    1.5683    0.9286   -0.0008 C   0  0  0

+    1.9613   -1.4688    0.0031 C   0  0  0

+   -1.2263    0.5314    0.0001 C   0  0  0

+   -0.9352   -1.8818   -0.0015 C   0  0  0

+    0.6685    2.0194    0.0009 C   0  0  0

+    2.9549    1.1370   -0.0012 C   0  0  0

+    3.3066   -1.2327    0.0030 C   0  0  0

+   -0.6669    1.8286    0.0004 C   0  0  0

+   -2.6226    0.3467    0.0005 C   0  0  0

+   -2.3023   -2.0384   -0.0006 C   0  0  0

+    3.8003    0.0666   -0.0023 C   0  0  0

+   -3.1424   -0.9331   -0.0003 C   0  0  0

+   -3.4750    1.4491    0.0012 N   0  0  0

+    1.5998   -2.4515    0.0000 H   0  0  0

+   -0.3112   -2.7227    0.0000 H   0  0  0

+    1.0467    2.9958    0.0000 H   0  0  0

+    3.3399    2.1107    0.0000 H   0  0  0

+    3.9737   -2.0398    0.0000 H   0  0  0

+   -1.3029    2.6604    0.0000 H   0  0  0

+   -2.7133   -3.0014    0.0000 H   0  0  0

+    4.8352    0.2259    0.0000 H   0  0  0

+   -4.1804   -1.0710    0.0000 H   0  0  0

+   -3.0779    2.4180    0.0000 H   0  0  0

+   -4.5126    1.3086    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  4  9  2  0

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+  7 18  1  0

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+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+61477-94-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 58                          1 V2000

+   -2.1695    1.2944   -0.6405 C   0  0  0

+   -3.3217    2.2540   -0.4904 C   0  0  0

+   -1.0486    1.7077    0.2781 C   0  0  0

+   -2.6317   -0.1183   -0.2776 C   0  0  0

+   -1.7081    1.3119   -1.9929 O   0  0  0

+   -4.1237    2.5464   -1.5774 C   0  0  0

+   -3.5800    2.8376    0.7361 C   0  0  0

+   -0.1359    2.6563   -0.1421 C   0  0  0

+   -0.9532    1.1637    1.4757 N   0  0  0

+   -1.4292   -1.0643   -0.2785 C   0  0  0

+   -5.1808    3.4268   -1.4396 C   0  0  0

+   -4.6367    3.7177    0.8738 C   0  0  0

+    0.8915    3.0300    0.7110 C   0  0  0

+    0.0102    1.4948    2.3129 C   0  0  0

+   -1.8914   -2.4769    0.0844 C   0  0  0

+   -5.4355    4.0145   -0.2149 C   0  0  0

+    0.9623    2.4326    1.9599 C   0  0  0

+   -0.7606   -3.4073   -0.0327 N   0  0  0

+   -0.5920   -4.0335    1.2830 C   0  0  1

+   -1.1753   -4.4592   -0.9669 C   0  0  2

+    0.5704   -5.0272    1.2380 C   0  0  0

+   -0.3004   -2.9545    2.3277 C   0  0  0

+   -0.0450   -5.4765   -1.1358 C   0  0  0

+   -1.5062   -3.8347   -2.3239 C   0  0  0

+    0.2545   -6.1262    0.2187 C   0  0  0

+   13.8189    1.7035   -0.5300 Cl  0  0  0

+   -3.4015    0.2375    0.0000 H   0  0  0

+   -3.0748   -0.8414    0.0000 H   0  0  0

+   -0.8607    1.3440    0.0000 H   0  0  0

+   -4.5466    1.8113    0.0000 H   0  0  0

+   -2.9031    3.3484    0.0000 H   0  0  0

+   -0.5983    3.3671    0.0000 H   0  0  0

+   -0.6594   -1.4201    0.0000 H   0  0  0

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+   -2.6585   -2.1155    0.0000 H   0  0  0

+   -2.3450   -3.1934    0.0000 H   0  0  0

+   -6.0509    4.5980    0.0000 H   0  0  0

+    1.7625    2.1518    0.0000 H   0  0  0

+   -1.3090   -4.4863    0.0000 H   0  0  0

+   -1.8439   -4.9809    0.0000 H   0  0  0

+    1.3439   -5.3748    0.0000 H   0  0  0

+    1.0243   -4.3109    0.0000 H   0  0  0

+    0.5183   -3.1757    0.0000 H   0  0  0

+   -0.0792   -2.1358    0.0000 H   0  0  0

+   -1.1191   -2.7333    0.0000 H   0  0  0

+    0.8022   -5.4395    0.0000 H   0  0  0

+    0.2415   -4.6783    0.0000 H   0  0  0

+   -0.7569   -3.4377    0.0000 H   0  0  0

+   -1.9032   -3.0854    0.0000 H   0  0  0

+   -2.2555   -4.2317    0.0000 H   0  0  0

+   -0.3840   -6.6843    0.0000 H   0  0  0

+    0.9702   -6.5811    0.0000 H   0  0  0

+   14.6669    1.7035    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 12 16  1  0

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+ 23 25  1  0

+  4 27  1  0

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+ 24 52  1  0

+ 24 53  1  0

+ 24 54  1  0

+ 25 55  1  0

+ 25 56  1  0

+ 26 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-69-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 42                          1 V2000

+    0.7011   -1.4262   -0.2679 C   0  0  0

+   -0.6494   -1.2462    0.0863 C   0  0  0

+    1.5125   -0.2740   -0.7152 C   0  0  0

+    1.2696   -2.6948   -0.1890 C   0  0  0

+   -1.2653    0.0958    0.0125 C   0  0  0

+   -1.4018   -2.3400    0.5063 C   0  0  0

+    2.6479    0.0436   -0.0636 O   0  0  0

+    1.1554    0.3860   -1.6701 O   0  0  0

+    0.5085   -3.7679    0.2352 C   0  0  0

+   -2.5857    0.2441    0.2342 O   0  0  0

+   -0.5807    1.0646   -0.2481 O   0  0  0

+   -0.8218   -3.5929    0.5733 C   0  0  0

+    3.4448    1.1751   -0.5028 C   0  0  0

+   -3.1905    1.5621    0.1616 C   0  0  0

+    4.6715    1.3162    0.4005 C   0  0  0

+   -4.6887    1.4524    0.4519 C   0  0  0

+    5.5112    2.5085   -0.0623 C   0  0  0

+    4.2184    1.5415    1.8444 C   0  0  0

+   -5.3260    2.8412    0.3754 C   0  0  0

+   -5.3425    0.5336   -0.5822 C   0  0  0

+    2.2788   -2.7938    0.0000 H   0  0  0

+   -2.4123   -2.2544    0.0000 H   0  0  0

+    0.9142   -4.6973    0.0000 H   0  0  0

+   -1.4225   -4.4099    0.0000 H   0  0  0

+    3.5744    2.1809    0.0000 H   0  0  0

+    2.4997    1.5426    0.0000 H   0  0  0

+   -2.2251    1.8726    0.0000 H   0  0  0

+   -3.3841    2.5575    0.0000 H   0  0  0

+    5.1893    0.4443    0.0000 H   0  0  0

+   -4.1912    0.5687    0.0000 H   0  0  0

+    6.3403    1.9246    0.0000 H   0  0  0

+    6.0951    3.3376    0.0000 H   0  0  0

+    4.6821    3.0924    0.0000 H   0  0  0

+    4.6699    2.4495    0.0000 H   0  0  0

+    3.3104    1.9930    0.0000 H   0  0  0

+    3.7669    0.6335    0.0000 H   0  0  0

+   -4.4043    3.2641    0.0000 H   0  0  0

+   -5.7489    3.7629    0.0000 H   0  0  0

+   -6.2477    2.4183    0.0000 H   0  0  0

+   -6.1687    1.1215    0.0000 H   0  0  0

+   -5.9304   -0.2926    0.0000 H   0  0  0

+   -4.5163   -0.0543    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 19 37  1  0

+ 19 38  1  0

+ 19 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+ 20 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5412-25-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.0003   -0.3442   -0.9718 P   0  0  0

+   -1.3081    0.0888   -0.1395 O   0  0  0

+    1.3087   -0.1507   -0.0539 O   0  0  0

+   -0.1269   -1.8894   -1.4059 O   0  0  0

+    0.1172    0.5001   -2.1817 O   0  0  0

+   -2.4299   -0.1046   -1.0033 C   0  0  0

+    2.4305   -0.5495   -0.8443 C   0  0  0

+   -3.7128    0.2906   -0.2693 C   0  0  0

+    3.7135   -0.3891   -0.0263 C   0  0  0

+   -4.9139    0.0835   -1.1942 C   0  0  0

+   -3.9207   -0.8267    1.3349 Br  0  0  0

+    4.9145   -0.8161   -0.8726 C   0  0  0

+    3.9215    1.4925    0.5043 Br  0  0  0

+   -6.5625    0.5914   -0.2510 Br  0  0  0

+    6.5631   -0.6100    0.1784 Br  0  0  0

+   -0.2074   -2.8670    0.0000 H   0  0  0

+   -3.0358   -0.8759    0.0000 H   0  0  0

+   -1.9275   -0.9470    0.0000 H   0  0  0

+    1.7913   -1.2934    0.0000 H   0  0  0

+    2.8944   -1.4137    0.0000 H   0  0  0

+   -3.6500    1.2694    0.0000 H   0  0  0

+    3.6072   -1.3642    0.0000 H   0  0  0

+   -5.5199   -0.6878    0.0000 H   0  0  0

+   -4.4114   -0.7589    0.0000 H   0  0  0

+    4.2752   -1.5600    0.0000 H   0  0  0

+    5.3784   -1.6803    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+620-88-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -0.2896   -1.0981    0.0063 C   0  0  0

+   -1.5556   -1.5920    0.0031 O   0  0  0

+    0.3263   -0.7729    1.2061 C   0  0  0

+    0.3914   -0.9235   -1.1902 C   0  0  0

+   -2.3942   -0.5230   -0.0100 C   0  0  0

+    1.6134   -0.2709    1.2066 C   0  0  0

+    1.6780   -0.4213   -1.1841 C   0  0  0

+   -3.7613   -0.7104    0.1343 C   0  0  0

+   -1.8842    0.7588   -0.1619 C   0  0  0

+    2.2876   -0.0925    0.0129 C   0  0  0

+   -4.6118    0.3783    0.1206 C   0  0  0

+   -2.7389    1.8437   -0.1749 C   0  0  0

+    3.6664    0.4460    0.0164 N   0  3  0

+   -4.1017    1.6536   -0.0366 C   0  0  0

+    4.2613    0.6036   -1.0347 O   0  0  0

+    4.2060    0.7316    1.0704 O   0  5  0

+   -0.1021    0.1640    0.0000 H   0  0  0

+    0.7072   -1.9041    0.0000 H   0  0  0

+    1.2940    0.7085    0.0000 H   0  0  0

+    2.1106   -1.3562    0.0000 H   0  0  0

+   -4.1488   -1.6649    0.0000 H   0  0  0

+   -0.8648    0.9069    0.0000 H   0  0  0

+   -5.6317    0.2332    0.0000 H   0  0  0

+   -2.3544    2.7994    0.0000 H   0  0  0

+   -4.7369    2.4646    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  2  0

+  5  9  1  0

+  6 10  2  0

+  8 11  1  0

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+  7 10  1  0

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+  3 17  1  0

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+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+133591-38-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    1.3202   -0.4450   -0.0023 C   0  0  0

+   -0.0607    0.0720   -0.0014 C   0  0  0

+    2.1644    0.6753   -0.0008 C   0  0  0

+    1.8638   -1.7275    0.0007 C   0  0  0

+    0.0383    1.4712    0.0007 C   0  0  0

+   -1.3128   -0.5384   -0.0017 C   0  0  0

+    1.3786    1.8138    0.0011 N   0  0  0

+    3.5437    0.4894   -0.0008 C   0  0  0

+    3.2321   -1.8913   -0.0008 C   0  0  0

+    0.9584   -2.9321    0.0061 C   0  0  0

+   -1.1240    2.2367    0.0016 C   0  0  0

+   -2.4523    0.2366    0.0000 C   0  0  0

+    4.0680   -0.7850   -0.0020 C   0  0  0

+    4.4643    1.6825    0.0009 C   0  0  0

+   -2.3563    1.6198    0.0005 C   0  0  0

+   -3.7838   -0.4101   -0.0004 N   0  3  0

+   -4.7924    0.2727    0.0011 O   0  0  0

+   -3.8708   -1.6250   -0.0022 O   0  5  0

+   -1.3876   -1.5776    0.0000 H   0  0  0

+    1.7439    2.7895    0.0000 H   0  0  0

+    3.6400   -2.8500    0.0000 H   0  0  0

+    0.1255   -2.3061    0.0000 H   0  0  0

+    0.3324   -3.7650    0.0000 H   0  0  0

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+   -1.0624    3.2768    0.0000 H   0  0  0

+    5.1013   -0.9184    0.0000 H   0  0  0

+    5.2892    1.0460    0.0000 H   0  0  0

+    5.1008    2.5074    0.0000 H   0  0  0

+    3.6394    2.3190    0.0000 H   0  0  0

+   -3.2232    2.1977    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+  8 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 16 17  2  0

+ 16 18  1  0

+  5  7  1  0

+  9 13  1  0

+ 12 15  1  0

+  6 19  1  0

+  7 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+39179-91-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -0.8291   -0.5088   -0.0032 C   0  0  0

+   -1.8715   -1.4273   -0.0012 C   0  0  0

+   -1.1069    0.8521   -0.0031 C   0  0  0

+    0.4951   -0.9528    0.0004 N   0  0  0

+   -3.1795   -0.9849    0.0009 C   0  0  0

+   -2.4176    1.2878   -0.0009 C   0  0  0

+    1.5930    0.0172   -0.0017 C   0  0  0

+   -3.4526    0.3710    0.0011 C   0  0  0

+    2.9303   -0.7261    0.0030 C   0  0  0

+   -4.8814    0.8501    0.0034 C   0  0  0

+    4.2815    0.4677    0.0004 Cl  0  0  0

+   -1.6665   -2.4489    0.0000 H   0  0  0

+   -0.3274    1.5436    0.0000 H   0  0  0

+    0.7022   -1.9740    0.0000 H   0  0  0

+   -3.9617   -1.6733    0.0000 H   0  0  0

+   -2.6266    2.3086    0.0000 H   0  0  0

+    2.1989    0.8649    0.0000 H   0  0  0

+    0.8192    0.7151    0.0000 H   0  0  0

+    2.3244   -1.5738    0.0000 H   0  0  0

+    3.7041   -1.4240    0.0000 H   0  0  0

+   -4.5501    1.8380    0.0000 H   0  0  0

+   -5.8693    1.1814    0.0000 H   0  0  0

+   -5.2127   -0.1378    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  6  8  2  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6610-08-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.7417    0.6290   -0.0030 C   0  0  0

+   -0.9560   -0.7737   -0.0006 C   0  0  0

+    0.5606    1.1398   -0.0028 C   0  0  0

+   -1.8524    1.4972    0.0002 C   0  0  0

+    0.1401   -1.6627    0.0011 C   0  0  0

+   -2.2702   -1.2652   -0.0004 C   0  0  0

+    1.6488    0.2542   -0.0002 C   0  0  0

+   -3.1119    0.9814    0.0057 C   0  0  0

+    1.4064   -1.1878    0.0004 C   0  0  0

+   -3.3204   -0.3959   -0.0025 C   0  0  0

+    2.8982    0.7253   -0.0004 N   0  0  0

+    3.8402   -0.0468    0.0019 O   0  0  0

+    0.7222    2.1764    0.0000 H   0  0  0

+   -1.7087    2.5365    0.0000 H   0  0  0

+   -0.0284   -2.6982    0.0000 H   0  0  0

+   -2.4444   -2.2998    0.0000 H   0  0  0

+   -3.9367    1.6298    0.0000 H   0  0  0

+    2.2161   -1.8550    0.0000 H   0  0  0

+   -4.3006   -0.7700    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+ 11 12  2  0

+  7  9  1  0

+  8 10  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112-52-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+   -1.0150   -0.3459   -0.0038 C   0  0  0

+   -2.2835    0.5095    0.0056 C   0  0  0

+    0.2144    0.5648    0.0062 C   0  0  0

+   -3.5128   -0.4013   -0.0044 C   0  0  0

+    1.4829   -0.2906   -0.0032 C   0  0  0

+   -4.7813    0.4541    0.0050 C   0  0  0

+    2.7122    0.6202    0.0068 C   0  0  0

+   -6.0107   -0.4566   -0.0050 C   0  0  0

+    3.9807   -0.2352   -0.0026 C   0  0  0

+   -7.2792    0.3988    0.0044 C   0  0  0

+    5.2101    0.6756    0.0074 C   0  0  0

+   -8.5085   -0.5120   -0.0056 C   0  0  0

+    6.7049   -0.3325   -0.0036 Cl  0  0  0

+   -1.7600   -1.2186    0.0000 H   0  0  0

+   -0.2321   -1.1848    0.0000 H   0  0  0

+   -1.5385    1.3823    0.0000 H   0  0  0

+   -3.0665    1.3484    0.0000 H   0  0  0

+    0.9594    1.4375    0.0000 H   0  0  0

+   -0.5685    1.4037    0.0000 H   0  0  0

+   -4.2578   -1.2741    0.0000 H   0  0  0

+   -2.7298   -1.2402    0.0000 H   0  0  0

+    0.7379   -1.1634    0.0000 H   0  0  0

+    2.2659   -1.1295    0.0000 H   0  0  0

+   -4.0363    1.3268    0.0000 H   0  0  0

+   -5.5642    1.2930    0.0000 H   0  0  0

+    3.4572    1.4930    0.0000 H   0  0  0

+    1.9292    1.4591    0.0000 H   0  0  0

+   -6.7557   -1.3293    0.0000 H   0  0  0

+   -5.2278   -1.2955    0.0000 H   0  0  0

+    3.2357   -1.1079    0.0000 H   0  0  0

+    4.7636   -1.0741    0.0000 H   0  0  0

+   -6.5342    1.2716    0.0000 H   0  0  0

+   -8.0622    1.2377    0.0000 H   0  0  0

+    5.9551    1.5483    0.0000 H   0  0  0

+    4.4272    1.5145    0.0000 H   0  0  0

+   -9.1916    0.4100    0.0000 H   0  0  0

+   -9.4305   -1.1951    0.0000 H   0  0  0

+   -7.8254   -1.4340    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  1  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

+  9  7  1  0

+ 10  8  1  0

+ 11  9  1  0

+ 12 10  1  0

+ 13 11  1  0

+  1 14  1  0

+  1 15  1  0

+  2 16  1  0

+  2 17  1  0

+  3 18  1  0

+  3 19  1  0

+  4 20  1  0

+  4 21  1  0

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+  7 26  1  0

+  7 27  1  0

+  8 28  1  0

+  8 29  1  0

+  9 30  1  0

+  9 31  1  0

+ 10 32  1  0

+ 10 33  1  0

+ 11 34  1  0

+ 11 35  1  0

+ 12 36  1  0

+ 12 37  1  0

+ 12 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+147293-14-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.3657   -0.4040   -0.0014 C   0  0  0

+   -1.0928   -0.3719   -0.0005 C   0  0  0

+    1.0604    0.8104   -0.0009 C   0  0  0

+    1.2795   -1.3931    0.0027 N   0  0  0

+   -1.7475    0.8866    0.0008 C   0  0  0

+   -1.8675   -1.5348   -0.0019 C   0  0  0

+    2.4059    0.4809   -0.0019 N   0  0  0

+    0.3687    2.0227    0.0011 C   0  0  0

+    2.4867   -0.8803   -0.0006 C   0  0  0

+   -0.9896    2.0682    0.0008 C   0  0  0

+   -3.1540    0.9006    0.0016 C   0  0  0

+   -3.1794   -1.4486   -0.0020 N   0  0  0

+    3.5312    1.4190   -0.0018 C   0  0  0

+    3.6590   -1.6070    0.0024 N   0  0  0

+   -3.8198   -0.2881    0.0011 C   0  0  0

+   -1.4074   -2.4663    0.0000 H   0  0  0

+    0.9054    2.9123    0.0000 H   0  0  0

+   -1.4726    2.9881    0.0000 H   0  0  0

+   -3.6749    1.7996    0.0000 H   0  0  0

+    4.1965    0.6210    0.0000 H   0  0  0

+    4.3292    2.0843    0.0000 H   0  0  0

+    2.8659    2.2170    0.0000 H   0  0  0

+    3.6265   -2.6454    0.0000 H   0  0  0

+    4.5746   -1.1160    0.0000 H   0  0  0

+   -4.8587   -0.2848    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+  7  9  1  0

+  8 10  1  0

+ 12 15  1  0

+  6 16  1  0

+  8 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+56-55-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.3227   -0.0711   -0.0019 C   0  0  0

+   -1.7574   -0.3907   -0.0015 C   0  0  0

+    0.0824    1.3356    0.0004 C   0  0  0

+    0.6301   -1.0765    0.0013 C   0  0  0

+   -2.6980    0.6608    0.0011 C   0  0  0

+   -2.1977   -1.7153   -0.0032 C   0  0  0

+    1.4313    1.6737   -0.0004 C   0  0  0

+   -0.9459    2.3744    0.0030 C   0  0  0

+    1.9876   -0.7424    0.0014 C   0  0  0

+   -2.2529    2.0504    0.0028 C   0  0  0

+   -4.0661    0.3539    0.0015 C   0  0  0

+   -3.5478   -1.9843   -0.0023 C   0  0  0

+    2.3965    0.6643   -0.0033 C   0  0  0

+    2.9840   -1.7389    0.0054 C   0  0  0

+   -4.4732   -0.9484   -0.0007 C   0  0  0

+    3.7728    0.9700   -0.0036 C   0  0  0

+    4.2938   -1.3769    0.0061 C   0  0  0

+    4.6833   -0.0384   -0.0060 C   0  0  0

+    0.3351   -2.0816    0.0000 H   0  0  0

+   -1.5044   -2.5005    0.0000 H   0  0  0

+    1.7219    2.6800    0.0000 H   0  0  0

+   -0.6627    3.3829    0.0000 H   0  0  0

+   -2.9683    2.8154    0.0000 H   0  0  0

+   -4.7757    1.1244    0.0000 H   0  0  0

+   -3.8798   -2.9778    0.0000 H   0  0  0

+    2.7168   -2.7517    0.0000 H   0  0  0

+   -5.4970   -1.1699    0.0000 H   0  0  0

+    4.0912    1.9679    0.0000 H   0  0  0

+    5.0294   -2.1226    0.0000 H   0  0  0

+    5.7042    0.1959    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

+  3  8  2  0

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+  5 10  2  0

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+  8 10  1  0

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+ 17 18  1  0

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+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13114-72-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -0.0388   -0.3954   -0.0211 N   0  0  0

+   -1.2916    0.2296    0.0038 C   0  0  0

+    1.1291    0.3772   -0.0283 C   0  0  0

+    0.0431   -1.7406   -0.0326 C   0  0  0

+   -2.4481   -0.5236   -0.1482 C   0  0  0

+   -1.3803    1.6036    0.1863 C   0  0  0

+    1.6644    0.8178   -1.2312 C   0  0  0

+    1.7512    0.7092    1.1683 C   0  0  0

+    1.2450   -2.3434    0.0595 N   0  0  0

+   -0.9674   -2.4104   -0.1261 O   0  0  0

+   -3.6824    0.0959   -0.1232 C   0  0  0

+   -2.6173    2.2170    0.2103 C   0  0  0

+    2.8163    1.5802   -1.2349 C   0  0  0

+    2.9025    1.4716    1.1579 C   0  0  0

+    1.3258   -3.8009    0.1843 C   0  0  0

+   -3.7671    1.4646    0.0529 C   0  0  0

+    3.4362    1.9045   -0.0423 C   0  0  0

+   -2.3903   -1.5536    0.0000 H   0  0  0

+   -0.5216    2.1754    0.0000 H   0  0  0

+    1.0511    1.6473    0.0000 H   0  0  0

+    2.2794   -0.1769    0.0000 H   0  0  0

+    2.1075   -1.7775    0.0000 H   0  0  0

+   -4.5432   -0.4726    0.0000 H   0  0  0

+   -2.6787    3.2468    0.0000 H   0  0  0

+    2.2918    2.4685    0.0000 H   0  0  0

+    3.5129    0.6400    0.0000 H   0  0  0

+    0.2958   -3.8580    0.0000 H   0  0  0

+    1.3829   -4.8309    0.0000 H   0  0  0

+    2.3558   -3.7438    0.0000 H   0  0  0

+   -4.6893    1.9270    0.0000 H   0  0  0

+    4.2981    2.4713    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 11 16  2  0

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+ 12 16  1  0

+ 14 17  1  0

+  5 18  1  0

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+ 11 23  1  0

+ 12 24  1  0

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+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-18-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -0.0769    1.0325   -0.1551 P   0  0  2

+    0.0611   -0.5848    0.2895 N   0  0  0

+    1.1525    1.9739    0.4952 N   0  0  0

+   -1.2708    1.7730    0.6220 O   0  0  0

+   -0.1825    1.1906   -1.6228 O   0  0  0

+   -1.0629   -1.2925   -0.3380 C   0  0  0

+    1.2858   -1.0933   -0.3426 C   0  0  0

+    1.0305    3.3141   -0.0878 C   0  0  0

+   -1.4485    3.0538    0.0228 C   0  0  0

+   -2.1265   -1.5984    0.7184 C   0  0  0

+    2.3343   -1.3798    0.7343 C   0  0  0

+   -0.2723    3.9619    0.3859 C   0  0  0

+   -3.5061   -2.4670   -0.0517 Cl  0  0  0

+    3.8375   -2.0040   -0.0415 Cl  0  0  0

+    2.0972    1.5597    0.0000 H   0  0  0

+   -1.2166   -2.3125    0.0000 H   0  0  0

+   -0.1997   -1.8571    0.0000 H   0  0  0

+    0.4942   -1.7546    0.0000 H   0  0  0

+    1.5055   -2.1011    0.0000 H   0  0  0

+    2.0575    3.2180    0.0000 H   0  0  0

+    1.3129    4.3062    0.0000 H   0  0  0

+   -1.9287    3.9667    0.0000 H   0  0  0

+   -2.4305    2.7381    0.0000 H   0  0  0

+   -1.9728   -0.5784    0.0000 H   0  0  0

+   -2.9897   -1.0338    0.0000 H   0  0  0

+    3.1259   -0.7185    0.0000 H   0  0  0

+    2.1147   -0.3720    0.0000 H   0  0  0

+    0.3204    4.8061    0.0000 H   0  0  0

+   -1.0180    4.6745    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+  6 10  1  0

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+  3 15  1  0

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+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+142-62-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.6778   -0.7444    0.0000 C   0  0  0

+   -0.4736    0.2631    0.0000 C   0  0  0

+    1.9915   -0.0059    0.0000 C   0  0  0

+   -1.8073   -0.4867    0.0000 C   0  0  0

+    3.1462   -0.6902    0.0000 O   0  0  0

+    2.0053    1.2023    0.0000 O   0  0  0

+   -2.9588    0.5208    0.0000 C   0  0  0

+   -4.2924   -0.2291    0.0000 C   0  0  0

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+  1  2  1  0

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+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20562-02-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+134142                          1 V2000

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+ 61134  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+301-13-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 79 78                          1 V2000

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+ 28 77  1  0

+ 28 78  1  0

+ 28 79  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+28149-15-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.3999   -0.6991    0.0096 C   0  0  0

+   -1.8832   -0.6642   -0.0121 C   0  0  0

+    0.0969    0.5881   -0.1745 C   0  0  0

+    0.4918   -1.7597    0.1813 C   0  0  0

+   -2.3134    0.6448   -0.2099 C   0  0  0

+   -2.8284   -1.6824    0.1273 C   0  0  0

+   -1.0852    1.5142   -0.3242 C   0  0  0

+    1.4574    0.8120   -0.1918 C   0  0  0

+    1.8510   -1.5265    0.1617 C   0  0  0

+   -3.6608    0.9322   -0.2677 C   0  0  0

+   -4.1740   -1.3855    0.0685 C   0  0  0

+   -1.0783    2.4708    0.7373 O   0  0  0

+    2.3354   -0.2443   -0.0259 C   0  0  0

+   -4.5919   -0.0816   -0.1291 C   0  0  0

+    3.7954   -0.0015   -0.0454 N   0  3  0

+    4.5693   -0.9307    0.1006 O   0  0  0

+    4.2230    1.1274   -0.2074 O   0  5  0

+    0.1366   -2.7302    0.0000 H   0  0  0

+   -2.5203   -2.6689    0.0000 H   0  0  0

+   -0.1544    1.9633    0.0000 H   0  0  0

+    1.8187    1.7803    0.0000 H   0  0  0

+    2.5086   -2.3237    0.0000 H   0  0  0

+   -3.9750    1.9168    0.0000 H   0  0  0

+   -4.8700   -2.1495    0.0000 H   0  0  0

+   -1.0708    3.5042    0.0000 H   0  0  0

+   -5.6013    0.1403    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  2  0

+ 10 14  2  0

+ 13 15  1  0

+ 15 16  2  0

+ 15 17  1  0

+  5  7  1  0

+  9 13  1  0

+ 11 14  1  0

+  4 18  1  0

+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+76919-33-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -1.7579    0.7600    0.0019 C   0  0  0

+   -1.8832   -0.6487    0.0095 C   0  0  0

+   -0.4471    1.2859    0.0604 C   0  0  0

+   -3.0384    1.4383   -0.0610 C   0  0  0

+   -0.7866   -1.4814    0.0707 C   0  0  0

+   -3.6379   -0.8859   -0.0727 S   0  0  0

+    0.6344    0.4403    0.1210 C   0  0  0

+   -4.1366    0.7478   -0.1031 N   0  0  0

+    0.4715   -0.9438    0.1265 C   0  0  0

+    1.8880    0.9643    0.1768 O   0  0  0

+    2.7947   -0.1389    0.2314 C   0  0  0

+    4.2311    0.3843    0.2960 C   0  0  0

+    5.2019   -0.7968    0.3546 C   0  0  0

+    4.9549   -0.0685   -0.8499 O   0  0  0

+   -0.2992    2.3277    0.0000 H   0  0  0

+   -3.0774    2.4898    0.0000 H   0  0  0

+   -0.9155   -2.5257    0.0000 H   0  0  0

+    1.3142   -1.5739    0.0000 H   0  0  0

+    1.9117   -0.7112    0.0000 H   0  0  0

+    3.2639   -1.0808    0.0000 H   0  0  0

+    4.3412    1.4308    0.0000 H   0  0  0

+    4.7164   -1.7304    0.0000 H   0  0  0

+    6.2511   -0.8770    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  7 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 12 14  1  0

+  6  8  1  0

+  7  9  2  0

+ 13 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+59-31-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.2944    0.5863   -0.0029 C   0  0  0

+   -0.5753   -0.8019   -0.0009 C   0  0  0

+    0.9744    1.0098   -0.0022 N   0  0  0

+   -1.3626    1.4998    0.0003 C   0  0  0

+    0.4955   -1.7178    0.0014 C   0  0  0

+   -1.9091   -1.2397   -0.0007 C   0  0  0

+    1.9780    0.1592    0.0004 C   0  0  0

+   -2.6441    1.0409    0.0051 C   0  0  0

+    1.7665   -1.2247    0.0015 C   0  0  0

+   -2.9180   -0.3250   -0.0025 C   0  0  0

+    3.2478    0.6343    0.0006 O   0  0  0

+   -1.1757    2.5164    0.0000 H   0  0  0

+    0.3219   -2.7368    0.0000 H   0  0  0

+   -2.1242   -2.2507    0.0000 H   0  0  0

+   -3.4263    1.7166    0.0000 H   0  0  0

+    2.5727   -1.8716    0.0000 H   0  0  0

+   -3.8998   -0.6484    0.0000 H   0  0  0

+    4.2159    0.9965    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  7  9  2  0

+  8 10  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106671-90-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.6273    0.2508    0.0379 C   0  0  0

+   -1.5245   -0.8976   -0.1209 C   0  0  0

+    0.8500    0.2244    0.0332 C   0  0  0

+   -1.3995    1.3176    0.1806 N   0  0  0

+   -2.8328   -0.3698   -0.0477 N   0  0  0

+   -1.1841   -2.1514   -0.2941 N   0  0  0

+    1.5681    1.2382   -0.6060 C   0  0  0

+    1.5353   -0.8111    0.6728 C   0  0  0

+   -2.6711    0.9712    0.1297 C   0  0  0

+   -4.1205   -0.8456   -0.1137 C   0  0  0

+   -2.0446   -3.0053   -0.4122 O   0  0  0

+    2.9467    1.2072   -0.6065 C   0  0  0

+    2.9145   -0.8295    0.6645 C   0  0  0

+   -4.2946    1.5656    0.2056 S   0  0  0

+   -5.1406    0.0077    0.0043 C   0  0  0

+    3.6191    0.1748    0.0245 C   0  0  0

+    5.0991    0.1481    0.0193 N   0  3  0

+    5.6937   -0.7589    0.5736 O   0  0  0

+    5.7223    1.0332   -0.5392 O   0  5  0

+    1.1199    2.1293    0.0000 H   0  0  0

+    1.0573   -1.6866    0.0000 H   0  0  0

+   -4.2906   -1.8284    0.0000 H   0  0  0

+    3.4319    2.0787    0.0000 H   0  0  0

+    3.3688   -1.7175    0.0000 H   0  0  0

+   -6.1204   -0.1791    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  2  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  2  0

+ 12 16  1  0

+ 16 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+  5  9  1  0

+ 13 16  2  0

+ 14 15  1  0

+  7 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+129-00-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    0.6524    0.0150   -0.0021 C   0  0  0

+   -0.6524    0.0150   -0.0016 C   0  0  0

+    1.3952    1.2894   -0.0006 C   0  0  0

+    1.4023   -1.2539    0.0021 C   0  0  0

+   -1.3952    1.2894    0.0004 C   0  0  0

+   -1.4023   -1.2539   -0.0025 C   0  0  0

+    0.7392    2.4253    0.0015 C   0  0  0

+    2.8671    1.2220   -0.0012 C   0  0  0

+    0.6598   -2.5256    0.0072 C   0  0  0

+    2.7142   -1.2190    0.0016 C   0  0  0

+   -0.7392    2.4253    0.0016 C   0  0  0

+   -2.8670    1.2220    0.0015 C   0  0  0

+   -0.6598   -2.5256   -0.0042 C   0  0  0

+   -2.7143   -1.2189   -0.0014 C   0  0  0

+    3.4589    0.0467   -0.0029 C   0  0  0

+   -3.4589    0.0467    0.0007 C   0  0  0

+    1.2898    3.3792    0.0000 H   0  0  0

+    3.4661    2.1463    0.0000 H   0  0  0

+    1.2082   -3.4808    0.0000 H   0  0  0

+    3.2736   -2.1677    0.0000 H   0  0  0

+   -1.2898    3.3792    0.0000 H   0  0  0

+   -3.4660    2.1463    0.0000 H   0  0  0

+   -1.2082   -3.4808    0.0000 H   0  0  0

+   -3.2738   -2.1676    0.0000 H   0  0  0

+    4.5597    0.0107    0.0000 H   0  0  0

+   -4.5597    0.0108    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  8 15  2  0

+ 12 16  2  0

+  7 11  1  0

+  9 13  2  0

+ 10 15  1  0

+ 14 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6000-43-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 10                          1 V2000

+   -3.0246    0.2082   -0.2076 C   0  0  0

+   -3.9316   -0.9947   -0.1698 C   0  0  0

+   -1.8792    0.1635   -0.9061 O   0  0  0

+   -3.3308    1.2146    0.3867 O   0  0  0

+   -5.1097   -0.6939    0.6547 N   0  0  0

+    6.7275   -0.0813    0.1035 Cl  0  0  0

+   -4.2618   -1.8167    0.0000 H   0  0  0

+   -3.1603   -1.4303    0.0000 H   0  0  0

+   -0.9941    0.1290    0.0000 H   0  0  0

+   -5.3491    0.1590    0.0000 H   0  0  0

+   -5.7286   -1.3276    0.0000 H   0  0  0

+    7.6133   -0.0813    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6098-44-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -1.6280    0.4687    0.4170 C   0  0  0

+   -3.0946    0.2690    0.3152 C   0  0  0

+   -0.9825   -0.3636   -0.4945 C   0  0  0

+   -0.8712    1.3136    1.2330 C   0  0  0

+   -3.3661   -0.6878   -0.6595 C   0  0  0

+   -4.1525    0.8614    1.0072 C   0  0  0

+   -2.0452   -1.1441   -1.2289 C   0  0  0

+    0.3915   -0.3589   -0.5892 C   0  0  0

+    0.5028    1.3160    1.1376 C   0  0  0

+   -4.6678   -1.0462   -0.9376 C   0  0  0

+   -5.4521    0.4967    0.7218 C   0  0  0

+    1.1416    0.4801    0.2280 C   0  0  0

+   -5.7117   -0.4551   -0.2475 C   0  0  0

+    2.5339    0.4853    0.1332 N   0  0  0

+    3.1979   -0.2090    0.8819 O   0  0  0

+    3.1438    1.2587   -0.7868 C   0  0  0

+    3.4143   -1.4967    0.5850 C   0  0  0

+    4.0647    2.3679   -0.3478 C   0  0  0

+    2.9513    1.0619   -1.9687 O   0  0  0

+    4.2359   -2.3557    1.5113 C   0  0  0

+    2.9493   -1.9714   -0.4292 O   0  0  0

+   -1.2389    2.1347    0.0000 H   0  0  0

+   -4.0462    1.7548    0.0000 H   0  0  0

+   -2.5033   -1.9185    0.0000 H   0  0  0

+   -1.3782   -1.7479    0.0000 H   0  0  0

+    0.7603   -1.1796    0.0000 H   0  0  0

+    0.9008    2.1229    0.0000 H   0  0  0

+   -4.7784   -1.9391    0.0000 H   0  0  0

+   -6.0906    1.1306    0.0000 H   0  0  0

+   -6.5423   -0.8010    0.0000 H   0  0  0

+    4.7569    1.7932    0.0000 H   0  0  0

+    4.6394    3.0601    0.0000 H   0  0  0

+    3.3725    2.9426    0.0000 H   0  0  0

+    3.5857   -2.9776    0.0000 H   0  0  0

+    4.8578   -3.0059    0.0000 H   0  0  0

+    4.8861   -1.7338    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+ 10 13  1  0

+ 12 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 16 19  2  0

+ 17 20  1  0

+ 17 21  2  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  2  0

+  4 22  1  0

+  6 23  1  0

+  7 24  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 13 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-88-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.8035    0.1332    0.0035 C   0  0  0

+    0.0626   -0.9448    0.0030 C   0  0  0

+   -0.3072    1.4236    0.0017 C   0  0  0

+   -2.2659   -0.0950   -0.0003 N   0  3  0

+    1.4315   -0.7338    0.0008 C   0  0  0

+    1.0576    1.6427   -0.0005 C   0  0  0

+   -3.0302    0.8533    0.0001 O   0  0  0

+   -2.7049   -1.2311   -0.0038 O   0  5  0

+    1.9325    0.5661   -0.0010 C   0  0  0

+    2.2845   -1.7932    0.0008 O   0  0  0

+    3.3149    0.7854   -0.0028 N   0  0  0

+   -0.3129   -1.9115    0.0000 H   0  0  0

+   -0.9605    2.2291    0.0000 H   0  0  0

+    1.4274    2.6116    0.0000 H   0  0  0

+    2.9349   -2.6010    0.0000 H   0  0  0

+    3.9678   -0.0204    0.0000 H   0  0  0

+    3.6863    1.7537    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  9 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15950-66-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    1.0571    0.0109   -0.0020 C   0  0  0

+   -0.2948   -0.2836   -0.0011 C   0  0  0

+    1.4776    1.3335   -0.0013 C   0  0  0

+    2.2260   -1.2726    0.0032 Cl  0  0  0

+   -1.2265    0.7406    0.0005 C   0  0  0

+   -0.8229   -1.9373   -0.0026 Cl  0  0  0

+    0.5415    2.3571    0.0003 C   0  0  0

+    2.8053    1.6255   -0.0026 O   0  0  0

+   -0.8076    2.0592    0.0007 C   0  0  0

+   -2.9224    0.3697    0.0016 Cl  0  0  0

+    0.8550    3.3481    0.0000 H   0  0  0

+    3.8204    1.8488    0.0000 H   0  0  0

+   -1.5086    2.8266    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7  9  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+873-75-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -2.3224   -0.2069   -0.2615 C   0  0  0

+   -1.5765   -1.3533   -0.0619 C   0  0  0

+   -1.6923    1.0196   -0.3625 C   0  0  0

+   -3.8226   -0.2946   -0.3751 C   0  0  0

+   -0.1999   -1.2740    0.0367 C   0  0  0

+   -0.3161    1.0998   -0.2641 C   0  0  0

+   -4.4250    0.4841    0.6606 O   0  0  0

+    0.4309   -0.0473   -0.0644 C   0  0  0

+    2.3139    0.0619    0.0711 Br  0  0  0

+   -2.0432   -2.2762    0.0000 H   0  0  0

+   -2.2566    1.8862    0.0000 H   0  0  0

+   -4.7500   -0.7522    0.0000 H   0  0  0

+   -3.5583   -1.2944    0.0000 H   0  0  0

+    0.3640   -2.1409    0.0000 H   0  0  0

+    0.1501    2.0229    0.0000 H   0  0  0

+   -5.0578    1.3021    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  8  9  1  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109-06-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.9336   -0.0423    0.0020 C   0  0  0

+   -0.2274   -1.2305    0.0013 C   0  0  0

+   -0.3041    1.1163    0.0011 N   0  0  0

+   -2.4403   -0.0713   -0.0025 C   0  0  0

+    1.1584   -1.1928   -0.0004 C   0  0  0

+    1.0127    1.1902   -0.0005 C   0  0  0

+    1.7849    0.0444   -0.0013 C   0  0  0

+   -0.7277   -2.1384    0.0000 H   0  0  0

+   -2.4602    0.9652    0.0000 H   0  0  0

+   -3.4768   -0.0912    0.0000 H   0  0  0

+   -2.4204   -1.1078    0.0000 H   0  0  0

+    1.7131   -2.0686    0.0000 H   0  0  0

+    1.4737    2.1187    0.0000 H   0  0  0

+    2.8196    0.1088    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  6  7  2  0

+  2  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13379-35-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -1.0585    0.5630    0.1888 C   0  0  0

+   -1.0615   -0.8353    0.3202 C   0  0  0

+    0.2349    1.2656    0.2998 C   0  0  0

+   -2.2404    1.2717   -0.0573 C   0  0  0

+    0.0250   -1.5506    0.6285 O   0  0  0

+   -2.2695   -1.5077    0.1349 C   0  0  0

+    1.4127    0.3732    0.1818 C   0  0  0

+    0.3259    2.4677    0.4721 O   0  0  0

+   -3.4261    0.5803   -0.2267 C   0  0  0

+   -2.2229    2.6264   -0.1285 O   0  0  0

+    1.2125   -1.0042    0.3433 C   0  0  0

+   -3.4313   -0.8074   -0.1377 C   0  0  0

+    2.6758    0.8936   -0.0859 C   0  0  0

+    2.3178   -1.8495    0.2026 C   0  0  0

+   -4.5928   -1.4849   -0.3214 O   0  0  0

+    3.7542    0.0369   -0.2111 C   0  0  0

+    3.5633   -1.3339   -0.0698 C   0  0  0

+   -5.6035   -0.5089   -0.5823 C   0  0  0

+    4.9940    0.5315   -0.4705 O   0  0  0

+    5.8790   -0.5882   -0.5407 C   0  0  0

+   -2.2873   -2.5408    0.0000 H   0  0  0

+   -4.3211    1.0967    0.0000 H   0  0  0

+   -2.2096    3.6596    0.0000 H   0  0  0

+    2.8202    1.9167    0.0000 H   0  0  0

+    2.1837   -2.8740    0.0000 H   0  0  0

+    4.3806   -1.9661    0.0000 H   0  0  0

+   -4.8857    0.2344    0.0000 H   0  0  0

+   -6.3468    0.2089    0.0000 H   0  0  0

+   -6.3213   -1.2522    0.0000 H   0  0  0

+    5.0684   -1.2289    0.0000 H   0  0  0

+    6.5197   -1.3988    0.0000 H   0  0  0

+    6.6896    0.0525    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 19 20  1  0

+  7 11  2  0

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+ 16 17  1  0

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+ 10 23  1  0

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+ 18 27  1  0

+ 18 28  1  0

+ 18 29  1  0

+ 20 30  1  0

+ 20 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+481-39-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+    0.6243   -0.7537    0.0021 C   0  0  0

+   -0.4418    0.1655    0.0013 C   0  0  0

+    2.0142   -0.2501    0.0010 C   0  0  0

+    0.3605   -2.1173   -0.0018 C   0  0  0

+   -0.1507    1.6107   -0.0007 C   0  0  0

+   -1.7578   -0.3015    0.0018 C   0  0  0

+    2.2651    1.2030   -0.0010 C   0  0  0

+    2.9458   -1.0301    0.0022 O   0  0  0

+   -0.9525   -2.5692   -0.0065 C   0  0  0

+    1.2490    2.0764   -0.0018 C   0  0  0

+   -1.0612    2.4160   -0.0018 O   0  0  0

+   -2.0014   -1.6754    0.0032 C   0  0  0

+   -2.7920    0.5744    0.0015 O   0  0  0

+    1.1487   -2.8020    0.0000 H   0  0  0

+    3.2477    1.5560    0.0000 H   0  0  0

+   -1.1467   -3.5951    0.0000 H   0  0  0

+    1.4507    3.1008    0.0000 H   0  0  0

+   -2.9840   -2.0283    0.0000 H   0  0  0

+   -3.5887    1.2492    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  5 10  1  0

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+  6 13  1  0

+  7 10  2  0

+  9 12  1  0

+  4 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1447-88-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -3.3693   -1.9931   -0.2575 O   0  0  0

+   -2.8126   -0.7576   -0.1654 C   0  0  0

+   -1.4210   -0.6123   -0.1245 C   0  0  0

+   -3.6177    0.3694   -0.1170 C   0  0  0

+   -0.8448    0.6667   -0.0290 C   0  0  0

+   -0.5286   -1.7826   -0.1801 C   0  0  0

+   -4.9722    0.2397   -0.1619 O   0  0  0

+   -3.0425    1.6351   -0.0220 C   0  0  0

+    0.4991    0.7951    0.0089 O   0  0  0

+   -1.6652    1.7825    0.0246 C   0  0  0

+   -0.9737   -2.9160   -0.2628 O   0  0  0

+    0.8647   -1.5419   -0.1334 C   0  0  0

+   -5.4201    0.1137    1.1893 C   0  0  0

+   -3.8390    2.7344    0.0250 O   0  0  0

+    1.3222   -0.2640   -0.0416 C   0  0  0

+    2.7784   -0.0335    0.0049 C   0  0  0

+    3.6003   -0.8903    0.7421 C   0  0  0

+    3.3409    1.0392   -0.6929 C   0  0  0

+    4.9597   -0.6714    0.7828 C   0  0  0

+    4.7008    1.2507   -0.6468 C   0  0  0

+    5.5139    0.3995    0.0923 C   0  0  0

+    6.8541    0.6119    0.1355 O   0  0  0

+   -3.7881   -2.9224    0.0000 H   0  0  0

+   -1.2541    2.7153    0.0000 H   0  0  0

+    1.5206   -2.3222    0.0000 H   0  0  0

+   -5.6961    1.0949    0.0000 H   0  0  0

+   -6.4013   -0.1623    0.0000 H   0  0  0

+   -5.1441   -0.8675    0.0000 H   0  0  0

+   -4.4371    3.5598    0.0000 H   0  0  0

+    3.2765   -1.8568    0.0000 H   0  0  0

+    2.7477    1.8682    0.0000 H   0  0  0

+    5.5573   -1.4972    0.0000 H   0  0  0

+    5.0282    2.2160    0.0000 H   0  0  0

+    7.8609    0.7715    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

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+  7  4  1  0

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+ 10  5  2  0

+ 11  6  2  0

+ 12  6  1  0

+ 13  7  1  0

+ 14  8  1  0

+ 15  9  1  0

+ 16 15  1  0

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+ 18 16  1  0

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+  8 10  1  0

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+ 14 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2589-39-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -0.3167   -2.6321    0.0044 O   0  0  0

+   -0.4363   -1.4223    0.0046 C   0  0  0

+    0.7599   -0.5626    0.0017 C   0  0  0

+   -1.7823   -0.8116    0.0015 C   0  0  0

+    0.6214    0.8403    0.0015 C   0  0  0

+    2.0362   -1.1304   -0.0002 C   0  0  0

+   -1.9203    0.5876    0.0013 C   0  0  0

+   -2.9186   -1.6159   -0.0016 C   0  0  0

+   -0.7197    1.4496    0.0040 C   0  0  0

+    1.7616    1.6472   -0.0008 C   0  0  0

+    2.1797   -2.4788   -0.0004 O   0  0  0

+    3.1622   -0.3082   -0.0025 C   0  0  0

+   -3.1915    1.1553   -0.0021 C   0  0  0

+   -4.1743   -1.0354   -0.0049 C   0  0  0

+   -0.8388    2.6595    0.0038 O   0  0  0

+    1.6381    2.9976   -0.0006 O   0  0  0

+    3.0269    1.0616   -0.0028 C   0  0  0

+    4.5377   -0.9239   -0.0041 C   0  0  0

+   -4.3099    0.3411   -0.0052 C   0  0  0

+   -2.8231   -2.6572    0.0000 H   0  0  0

+    2.2904   -3.5186    0.0000 H   0  0  0

+   -3.3007    2.1953    0.0000 H   0  0  0

+   -5.0266   -1.6413    0.0000 H   0  0  0

+    1.5429    4.0389    0.0000 H   0  0  0

+    3.8792    1.6674    0.0000 H   0  0  0

+    4.1105   -1.8783    0.0000 H   0  0  0

+    5.4921   -1.3511    0.0000 H   0  0  0

+    4.9649    0.0305    0.0000 H   0  0  0

+   -5.2640    0.7691    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  9  5  1  0

+ 10  5  1  0

+ 11  6  1  0

+ 12  6  2  0

+ 13  7  1  0

+ 14  8  2  0

+ 15  9  2  0

+ 16 10  1  0

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+ 18 12  1  0

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+  7  9  1  0

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+ 14 19  1  0

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+ 11 21  1  0

+ 13 22  1  0

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+ 16 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+79-44-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.0163    0.4551   -0.0022 C   0  0  0

+   -1.0766   -0.3336   -0.0004 N   0  0  0

+   -0.1066    1.6622   -0.0011 O   0  0  0

+    1.6000   -0.2561    0.0010 Cl  0  0  0

+   -0.9281   -1.7911   -0.0018 C   0  0  0

+   -2.4130    0.2666    0.0030 C   0  0  0

+   -2.0212   -1.9025    0.0000 H   0  0  0

+   -0.8167   -2.8842    0.0000 H   0  0  0

+    0.1650   -1.6797    0.0000 H   0  0  0

+   -1.9629    1.2689    0.0000 H   0  0  0

+   -3.4153    0.7168    0.0000 H   0  0  0

+   -2.8632   -0.7357    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  5  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  6 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3544-23-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+   -0.7677   -0.1433   -0.0009 C   0  0  0

+   -1.7833    0.8198    0.0003 C   0  0  0

+    0.5407    0.2430    0.0004 N   0  0  0

+   -1.0971   -1.5025    0.0025 C   0  0  0

+   -3.1054    0.4241   -0.0010 C   0  0  0

+    1.4757   -0.6458   -0.0007 N   0  0  0

+   -2.4190   -1.8910    0.0070 C   0  0  0

+   -3.4275   -0.9347   -0.0035 C   0  0  0

+   -4.0946    1.3575    0.0006 O   0  0  0

+    2.7868   -0.2586    0.0006 C   0  0  0

+   -4.7643   -1.3330   -0.0048 N   0  0  0

+   -3.4562    2.6359    0.0035 C   0  0  0

+    3.8025   -1.2188   -0.0006 C   0  0  0

+    3.1180    1.0988   -0.0029 C   0  0  0

+    5.1227   -0.8208    0.0002 C   0  0  0

+    4.4431    1.4819   -0.0021 C   0  0  0

+    5.4432    0.5257    0.0021 C   0  0  0

+   -1.5426    1.8294    0.0000 H   0  0  0

+   -0.3458   -2.2186    0.0000 H   0  0  0

+   -2.6622   -2.9000    0.0000 H   0  0  0

+   -5.5183   -0.6197    0.0000 H   0  0  0

+   -5.0050   -2.3426    0.0000 H   0  0  0

+   -2.5276    2.1722    0.0000 H   0  0  0

+   -2.9925    3.5645    0.0000 H   0  0  0

+   -4.3848    3.0996    0.0000 H   0  0  0

+    3.5636   -2.2288    0.0000 H   0  0  0

+    2.3688    1.8171    0.0000 H   0  0  0

+    5.8780   -1.5327    0.0000 H   0  0  0

+    4.6906    2.4899    0.0000 H   0  0  0

+    6.4386    0.8196    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  7  8  2  0

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+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6452-73-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 42                          1 V2000

+   -1.3877   -0.7972   -0.0111 C   0  0  0

+   -2.7264   -0.4173    0.0206 C   0  0  0

+   -0.4100    0.1459    0.0523 O   0  0  0

+   -1.0536   -2.1385   -0.1015 C   0  0  0

+   -3.7187   -1.3817   -0.0438 C   0  0  0

+   -3.0595    0.8979    0.1149 O   0  0  0

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+   -4.9237    2.4014    0.2280 C   0  0  0

+    3.3221   -0.2833    0.0087 C   0  0  0

+    1.8945    1.3609   -1.0395 O   0  0  0

+   -4.0278    3.3549    0.2924 C   0  0  0

+    4.4247    0.6852    0.0734 N   0  0  0

+    5.6713   -0.0896    0.0141 C   0  0  0

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+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 11 14  1  0

+ 12 15  2  0

+ 13 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+ 17 19  1  0

+  8  9  2  0

+  4 20  1  0

+  5 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+ 14 32  1  0

+ 15 33  1  0

+ 15 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 18 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 19 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+500-66-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    0.2814    0.0014   -0.5675 C   0  0  0

+    0.9321   -1.1965   -0.3428 C   0  0  0

+    0.9346    1.1981   -0.3419 C   0  0  0

+   -1.1410    0.0029   -1.0653 C   0  0  0

+    2.2440   -1.2006    0.1102 C   0  0  0

+    2.2461    1.1993    0.1110 C   0  0  0

+   -2.0989    0.0000    0.1277 C   0  0  0

+    2.9014   -0.0015    0.3372 C   0  0  0

+    2.8837   -2.3791    0.3307 O   0  0  0

+    2.8880    2.3765    0.3327 O   0  0  0

+   -3.5430    0.0016   -0.3777 C   0  0  0

+   -4.5009   -0.0014    0.8153 C   0  0  0

+   -5.9450    0.0002    0.3099 C   0  0  0

+    0.4081   -2.0744    0.0000 H   0  0  0

+    0.4124    2.0771    0.0000 H   0  0  0

+   -0.6301    0.8885    0.0000 H   0  0  0

+   -1.6537    0.8875    0.0000 H   0  0  0

+   -2.6099   -0.8856    0.0000 H   0  0  0

+   -1.5862   -0.8846    0.0000 H   0  0  0

+    3.9238   -0.0025    0.0000 H   0  0  0

+    3.3715   -3.2777    0.0000 H   0  0  0

+    3.3775    3.2741    0.0000 H   0  0  0

+   -3.0321    0.8872    0.0000 H   0  0  0

+   -4.0557    0.8862    0.0000 H   0  0  0

+   -5.0118   -0.8870    0.0000 H   0  0  0

+   -3.9882   -0.8860    0.0000 H   0  0  0

+   -5.9439    1.0226    0.0000 H   0  0  0

+   -6.9674    0.0013    0.0000 H   0  0  0

+   -5.9461   -1.0222    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+  6  8  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+36840-85-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 30                          1 V2000

+    4.9083   -0.0585   -0.0010 C   0  0  0

+    3.6840    0.5055   -0.0002 O   0  0  0

+    6.1082    0.7899   -0.0001 C   0  0  0

+    5.0198   -1.2687    0.0027 O   0  0  0

+    2.4985   -0.3328   -0.0010 C   0  0  0

+    7.3169    0.2330   -0.0008 C   0  0  0

+    1.2492    0.5506    0.0001 C   0  0  0

+    0.0000   -0.3327   -0.0008 C   0  0  0

+   -1.2492    0.5507    0.0003 C   0  0  0

+   -2.4985   -0.3326   -0.0006 C   0  0  0

+   -3.6840    0.5057    0.0005 O   0  0  0

+   -4.9083   -0.0583    0.0000 C   0  0  0

+   -6.1081    0.7902    0.0011 C   0  0  0

+   -5.0199   -1.2685   -0.0014 O   0  0  0

+   -7.3169    0.2334    0.0006 C   0  0  0

+    6.0083    1.8743    0.0000 H   0  0  0

+    1.7733   -1.1452    0.0000 H   0  0  0

+    3.2237   -1.1452    0.0000 H   0  0  0

+    7.4168   -0.8514    0.0000 H   0  0  0

+    8.2061    0.8617    0.0000 H   0  0  0

+    1.9744    1.3630    0.0000 H   0  0  0

+    0.5240    1.3630    0.0000 H   0  0  0

+   -0.7252   -1.1450    0.0000 H   0  0  0

+    0.7252   -1.1451    0.0000 H   0  0  0

+   -0.5240    1.3630    0.0000 H   0  0  0

+   -1.9744    1.3631    0.0000 H   0  0  0

+   -3.2237   -1.1449    0.0000 H   0  0  0

+   -1.7733   -1.1450    0.0000 H   0  0  0

+   -6.0081    1.8746    0.0000 H   0  0  0

+   -8.2060    0.8622    0.0000 H   0  0  0

+   -7.4169   -0.8510    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  7  8  1  0

+  8  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+  3 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

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+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67910-07-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -1.6868    0.6390    0.0127 C   0  0  0

+   -2.8565   -0.2580   -0.0008 C   0  0  0

+   -0.4134    0.0584   -0.1921 C   0  0  0

+   -2.1623    1.9287    0.2348 C   0  0  0

+   -4.0198    0.6079    0.2330 C   0  0  0

+   -2.6527   -1.5981   -0.2090 C   0  0  0

+   -0.3333   -1.2739   -0.3876 C   0  0  0

+    0.8290    0.9112   -0.1923 C   0  0  0

+   -3.5307    1.9172    0.3618 C   0  0  0

+   -5.3638    0.2043    0.3057 C   0  0  0

+   -1.4140   -2.0622   -0.3936 O   0  0  0

+    1.9917    0.0725   -0.4227 O   0  0  0

+   -5.6547   -0.9680    0.1689 O   0  0  0

+    3.2166    0.6200   -0.4642 C   0  0  0

+    4.4233   -0.2505   -0.7032 C   0  0  0

+    3.3516    1.8107   -0.3098 O   0  0  0

+    5.3411   -0.1969    0.5197 C   0  0  0

+    4.7717   -1.0895    1.6242 C   0  0  0

+    6.7361   -0.6917    0.1325 C   0  0  0

+   -1.5776    2.7750    0.0000 H   0  0  0

+   -3.4515   -2.2462    0.0000 H   0  0  0

+    0.5972   -1.7123    0.0000 H   0  0  0

+    1.5224    1.6710    0.0000 H   0  0  0

+    0.1536    1.6870    0.0000 H   0  0  0

+   -4.1207    2.7598    0.0000 H   0  0  0

+   -6.1086    0.9138    0.0000 H   0  0  0

+    3.6044   -0.8730    0.0000 H   0  0  0

+    4.7800   -1.2153    0.0000 H   0  0  0

+    5.4859    0.8215    0.0000 H   0  0  0

+    3.9045   -0.5363    0.0000 H   0  0  0

+    4.2185   -1.9567    0.0000 H   0  0  0

+    5.6389   -1.6427    0.0000 H   0  0  0

+    6.3922   -1.6612    0.0000 H   0  0  0

+    7.7056   -1.0356    0.0000 H   0  0  0

+    7.0800    0.2778    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  8 12  1  0

+ 10 13  2  0

+ 12 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+ 15 17  1  0

+ 17 18  1  0

+ 17 19  1  0

+  5  9  2  0

+  7 11  1  0

+  4 20  1  0

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+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

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+ 10 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17526-33-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    0.1478    0.9432   -0.0895 C   0  0  0

+   -0.6657   -0.1505   -0.3336 C   0  0  0

+    1.6113    0.8308   -0.1741 C   0  0  0

+   -0.4368    2.2409    0.2534 C   0  0  0

+   -2.0545   -0.0130   -0.2456 C   0  0  0

+   -0.0575   -1.4818   -0.6927 C   0  0  0

+    2.4059    1.9680    0.0816 C   0  0  0

+    2.2209   -0.3812   -0.5021 C   0  0  0

+   -1.8169    2.3853    0.3362 C   0  0  0

+    0.4468    3.3781    0.5058 C   0  0  0

+   -2.6422    1.2824    0.1032 C   0  0  0

+   -2.9127   -1.1040   -0.4880 C   0  0  0

+    0.1892   -2.2436    0.5185 O   0  0  0

+    1.7839    3.2423    0.4268 C   0  0  0

+    3.8014    1.8594    0.0004 C   0  0  0

+    3.5936   -0.4562   -0.5734 C   0  0  0

+   -4.0455    1.3908    0.1840 C   0  0  0

+   -4.2575   -0.9329   -0.3936 C   0  0  0

+    0.7309   -3.4693    0.4418 C   0  0  0

+    4.3750    0.6643   -0.3225 C   0  0  0

+   -4.8171    0.2998   -0.0616 C   0  0  0

+    0.9870   -4.2600    1.6989 C   0  0  0

+    1.0133   -3.9387   -0.6352 O   0  0  0

+    0.9594   -1.6584    0.0000 H   0  0  0

+    0.5729   -0.6646    0.0000 H   0  0  0

+    1.6556   -1.2447    0.0000 H   0  0  0

+   -2.2303    3.3310    0.0000 H   0  0  0

+    0.0406    4.3269    0.0000 H   0  0  0

+   -2.5214   -2.0590    0.0000 H   0  0  0

+    2.3743    4.0889    0.0000 H   0  0  0

+    4.3846    2.7109    0.0000 H   0  0  0

+    4.0459   -1.3839    0.0000 H   0  0  0

+   -4.4842    2.3250    0.0000 H   0  0  0

+   -4.8702   -1.7634    0.0000 H   0  0  0

+    5.4037    0.5811    0.0000 H   0  0  0

+   -5.8446    0.3974    0.0000 H   0  0  0

+    0.0051   -4.5780    0.0000 H   0  0  0

+    1.3050   -5.2419    0.0000 H   0  0  0

+    1.9689   -3.9420    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  2  0

+ 11 17  1  0

+ 12 18  2  0

+ 13 19  1  0

+ 15 20  2  0

+ 17 21  2  0

+ 19 22  1  0

+ 19 23  2  0

+  9 11  1  0

+ 10 14  2  0

+ 16 20  1  0

+ 18 21  1  0

+  6 24  1  0

+  6 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 12 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-71-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.2226   -0.2475   -0.0012 C   0  0  0

+   -1.1927    0.1437   -0.0004 C   0  0  0

+    1.1455    0.6611    0.0000 N   0  0  0

+    0.6012   -1.7061    0.0027 C   0  0  0

+   -1.5713    1.6024    0.0020 C   0  0  0

+   -2.0569   -0.7070   -0.0015 O   0  0  0

+    2.5103    0.2839   -0.0008 O   0  0  0

+   -0.4457   -1.9778    0.0000 H   0  0  0

+    0.8729   -2.7530    0.0000 H   0  0  0

+    1.6481   -1.4344    0.0000 H   0  0  0

+   -0.5244    1.8741    0.0000 H   0  0  0

+   -1.8430    2.6493    0.0000 H   0  0  0

+   -2.6182    1.3307    0.0000 H   0  0  0

+    3.5528   -0.0042    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+  7 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97-52-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    1.3705   -0.3560   -0.0028 C   0  0  0

+    0.0348   -0.7225   -0.0024 C   0  0  0

+    1.7191    0.9929   -0.0010 C   0  0  0

+    2.3393   -1.3105    0.0006 O   0  0  0

+   -0.9492    0.2490   -0.0001 C   0  0  0

+    0.7265    1.9620    0.0013 C   0  0  0

+    3.0672    1.3692   -0.0009 N   0  0  0

+    1.6735   -2.5749    0.0041 C   0  0  0

+   -0.6041    1.5878    0.0018 C   0  0  0

+   -2.3758   -0.1454   -0.0001 N   0  3  0

+   -3.2438    0.7089    0.0019 O   0  0  0

+   -2.6816   -1.3244   -0.0022 O   0  5  0

+   -0.2276   -1.7267    0.0000 H   0  0  0

+    0.9829    2.9678    0.0000 H   0  0  0

+    3.8087    0.6429    0.0000 H   0  0  0

+    3.3254    2.3745    0.0000 H   0  0  0

+    0.7551   -2.0913    0.0000 H   0  0  0

+    1.1899   -3.4933    0.0000 H   0  0  0

+    2.5919   -3.0585    0.0000 H   0  0  0

+   -1.3460    2.3137    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  9  2  0

+  2 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67464-46-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    0.7681   -1.9850   -0.3234 C   0  0  0

+   -0.7681   -1.9848   -0.3241 C   0  0  0

+    1.4758   -0.6596   -0.1716 C   0  0  0

+   -0.0005   -2.2676    0.8961 N   0  0  0

+   -1.4758   -0.6593   -0.1722 C   0  0  0

+    0.7417    0.5135   -0.0378 C   0  0  0

+    2.8558   -0.6212   -0.1672 C   0  0  0

+   -0.7416    0.5135   -0.0370 C   0  0  0

+   -2.8558   -0.6209   -0.1680 C   0  0  0

+    1.4165    1.7296    0.1012 C   0  0  0

+    3.5163    0.5860   -0.0292 C   0  0  0

+   -1.4163    1.7295    0.1026 C   0  0  0

+   -3.5162    0.5863   -0.0294 C   0  0  0

+    2.7947    1.7587    0.1050 C   0  0  0

+   -2.7945    1.7588    0.1056 C   0  0  0

+    1.4480   -2.7659    0.0000 H   0  0  0

+   -1.4482   -2.7655    0.0000 H   0  0  0

+   -0.0008   -3.3030    0.0000 H   0  0  0

+    3.3961   -1.5045    0.0000 H   0  0  0

+   -3.3961   -1.5041    0.0000 H   0  0  0

+    0.8818    2.6163    0.0000 H   0  0  0

+    4.5514    0.6124    0.0000 H   0  0  0

+   -0.8815    2.6161    0.0000 H   0  0  0

+   -4.5513    0.6128    0.0000 H   0  0  0

+    3.2902    2.6678    0.0000 H   0  0  0

+   -3.2899    2.6680    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  7 11  2  0

+  8 12  1  0

+  9 13  2  0

+ 10 14  2  0

+ 12 15  2  0

+  2  4  1  0

+  6  8  1  0

+ 11 14  1  0

+ 13 15  1  0

+  1 16  1  0

+  2 17  1  0

+  4 18  1  0

+  7 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+41340-19-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+   -1.2767    0.2799   -0.2679 C   0  0  0

+    0.2203    0.1833   -0.1018 C   0  0  0

+   -1.7252   -0.8241   -1.0581 O   0  0  0

+   -1.9491    0.2339    1.1057 C   0  0  0

+   -1.6310    1.5915   -0.9715 C   0  0  0

+    0.8934   -0.9781   -0.2897 C   0  0  0

+    1.0981    1.1721    0.2412 N   0  0  0

+   -1.3118   -2.0335   -0.4236 C   0  0  0

+   -3.4252   -0.0167    0.9343 C   0  0  0

+   -1.6873    1.3604   -2.4829 C   0  0  0

+    2.2906   -0.7086   -0.0560 C   0  0  0

+    0.1896   -2.2583   -0.6662 C   0  0  0

+    2.3686    0.6696    0.2788 C   0  0  0

+    0.7328    2.5621    0.5251 C   0  0  0

+   -3.9898   -1.1032    1.4842 O   0  0  0

+   -4.1004    0.7605    0.3019 O   0  0  0

+    3.4381   -1.5070   -0.1047 C   0  0  0

+    3.5962    1.2603    0.5695 C   0  0  0

+    4.6332   -0.8974    0.1853 C   0  0  0

+    4.7138    0.4459    0.5144 C   0  0  0

+   -1.5312    1.1647    0.0000 H   0  0  0

+   -2.5735    1.0409    0.0000 H   0  0  0

+   -0.8005    2.1842    0.0000 H   0  0  0

+   -2.4760    2.1634    0.0000 H   0  0  0

+   -2.3174   -2.2062    0.0000 H   0  0  0

+   -1.3009   -3.0538    0.0000 H   0  0  0

+   -2.6787    1.6019    0.0000 H   0  0  0

+   -1.9288    0.3690    0.0000 H   0  0  0

+   -0.6959    1.1189    0.0000 H   0  0  0

+   -0.0792   -3.2426    0.0000 H   0  0  0

+    1.1354   -2.6412    0.0000 H   0  0  0

+    1.7196    2.8214    0.0000 H   0  0  0

+    0.4735    3.5489    0.0000 H   0  0  0

+   -0.2540    2.3028    0.0000 H   0  0  0

+   -4.4603   -2.0086    0.0000 H   0  0  0

+    3.3687   -2.5250    0.0000 H   0  0  0

+    3.6885    2.2765    0.0000 H   0  0  0

+    5.4870   -1.4562    0.0000 H   0  0  0

+    5.6367    0.8810    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

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+ 11 17  1  0

+ 13 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+  8 12  1  0

+ 11 13  2  0

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+ 14 34  1  0

+ 15 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60-51-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    1.5200   -0.0260    0.0137 P   0  0  0

+   -0.3631   -0.6906   -0.6980 S   0  0  0

+    1.7954   -0.6543    1.4702 O   0  0  0

+    2.6754   -0.4998   -1.0024 O   0  0  0

+    1.5190    1.8340    0.1296 S   0  0  0

+   -1.4631    0.3335    0.3177 C   0  0  0

+    1.5658   -2.0607    1.3635 C   0  0  0

+    3.8695    0.1847   -0.6182 C   0  0  0

+   -2.8973    0.0233   -0.0257 C   0  0  0

+   -3.8967    0.6684    0.6080 N   0  0  0

+   -3.1523   -0.8069   -0.8722 O   0  0  0

+   -5.2909    0.3669    0.2742 C   0  0  0

+   -0.5923    0.9531    0.0000 H   0  0  0

+   -1.8947    1.3112    0.0000 H   0  0  0

+    0.5110   -1.8885    0.0000 H   0  0  0

+    1.3936   -3.1155    0.0000 H   0  0  0

+    2.6206   -2.2329    0.0000 H   0  0  0

+    4.4010   -0.7425    0.0000 H   0  0  0

+    4.7967    0.7162    0.0000 H   0  0  0

+    3.3380    1.1119    0.0000 H   0  0  0

+   -3.7052    1.7199    0.0000 H   0  0  0

+   -5.5168    1.4115    0.0000 H   0  0  0

+   -6.3355    0.1410    0.0000 H   0  0  0

+   -5.0650   -0.6777    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+65847-03-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 44                          1 V2000

+    1.4903   -1.5296    0.6883 C   0  0  0

+    2.0109   -2.1327   -0.5909 C   0  0  0

+    0.9290   -0.1598    0.4058 C   0  0  0

+    3.2741   -2.4645   -0.6920 C   0  0  0

+   -0.4474    0.0013    0.1767 C   0  0  0

+    1.7576    0.9247    0.3781 C   0  0  0

+    3.7947   -3.0677   -1.9711 C   0  0  0

+    4.2067   -2.2431    0.4709 C   0  0  0

+   -0.9743    1.2903   -0.0874 C   0  0  0

+   -1.3224   -1.1045    0.2043 C   0  0  0

+    1.2484    2.2061    0.1173 C   0  0  0

+    3.1067    1.0266    0.5703 O   0  0  0

+   -0.0974    2.3934   -0.1159 C   0  0  0

+   -2.2828    1.4578   -0.3073 N   0  0  0

+   -0.8638   -2.3556    0.4542 O   0  0  0

+   -2.6729   -0.8670   -0.0334 C   0  0  0

+    2.2849    3.0969    0.1488 O   0  0  0

+    3.4789    2.3035    0.0200 C   0  0  0

+   -0.5787    3.6406   -0.3670 O   0  0  0

+   -3.1281    0.4446   -0.2898 C   0  0  0

+   -1.4396   -2.7662    1.6959 C   0  0  0

+   -3.8678   -1.7190   -0.0907 C   0  0  0

+   -4.4625    0.3660   -0.4804 O   0  0  0

+   -4.8936   -0.9033   -0.3615 C   0  0  0

+    0.4760   -1.5022    0.0000 H   0  0  0

+    1.0555   -2.4464    0.0000 H   0  0  0

+    1.4738   -2.9936    0.0000 H   0  0  0

+    3.0265   -3.7307    0.0000 H   0  0  0

+    4.4577   -3.8359    0.0000 H   0  0  0

+    4.5629   -2.4047    0.0000 H   0  0  0

+    4.4411   -3.2304    0.0000 H   0  0  0

+    5.1940   -2.0087    0.0000 H   0  0  0

+    3.9723   -1.2558    0.0000 H   0  0  0

+    4.4195    1.9228    0.0000 H   0  0  0

+    3.9524    3.2009    0.0000 H   0  0  0

+   -0.9440    4.5873    0.0000 H   0  0  0

+   -2.0287   -1.9400    0.0000 H   0  0  0

+   -2.2658   -3.3553    0.0000 H   0  0  0

+   -0.8505   -3.5924    0.0000 H   0  0  0

+   -3.8944   -2.7334    0.0000 H   0  0  0

+   -5.8671   -1.1894    0.0000 H   0  0  0

+  2  1  1  0

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+ 11 13  1  0

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+ 23 24  1  0

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+ 18 34  1  0

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+ 19 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 24 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+611-22-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.4128   -0.0179    0.0020 C   0  0  0

+    0.5773   -0.9925    0.0005 C   0  0  0

+   -0.0603    1.3256    0.0019 C   0  0  0

+   -1.7595   -0.3882   -0.0021 N   0  0  0

+    1.9077   -0.6229   -0.0012 C   0  0  0

+    0.1997   -2.4514    0.0011 C   0  0  0

+    1.2724    1.6883    0.0002 C   0  0  0

+   -2.7673    0.6065   -0.0005 O   0  0  0

+    2.2552    0.7158   -0.0014 C   0  0  0

+   -0.8003    2.0588    0.0000 H   0  0  0

+   -2.0225   -1.3962    0.0000 H   0  0  0

+    2.6506   -1.3532    0.0000 H   0  0  0

+   -0.8088   -2.1904    0.0000 H   0  0  0

+   -0.0613   -3.4599    0.0000 H   0  0  0

+    1.2082   -2.7124    0.0000 H   0  0  0

+    1.5374    2.6958    0.0000 H   0  0  0

+   -3.5087    1.3383    0.0000 H   0  0  0

+    3.2596    0.9920    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

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+  3 10  1  0

+  4 11  1  0

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+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+357-57-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 61                          1 V2000

+   -0.2896    0.9987   -0.3411 C   0  0  2

+   -1.0226   -0.3248   -0.4041 C   0  0  2

+    1.1543    0.6231   -0.1549 C   0  0  0

+   -0.7848    2.0308    0.6409 C   0  0  1

+   -0.3927    1.7045   -1.7259 C   0  0  0

+   -1.8295   -0.6709    0.8466 C   0  0  1

+    0.0299   -1.3767   -0.3461 N   0  0  0

+    1.2667   -0.7688   -0.2502 C   0  0  0

+    2.2498    1.4367    0.0708 C   0  0  0

+   -1.6048    2.9970   -0.1195 N   0  0  0

+   -1.5670    1.5304    1.8349 C   0  0  0

+   -0.8314    3.1486   -1.3932 C   0  0  0

+   -2.6196    0.5324    1.3156 C   0  0  1

+   -2.6000   -1.9432    0.6186 C   0  0  2

+   -0.3209   -2.6714   -0.2439 C   0  0  0

+    2.5233   -1.3791   -0.1727 C   0  0  0

+    3.4932    0.8186    0.1661 C   0  0  0

+   -2.8442    2.3852   -0.5586 C   0  0  0

+   -3.3063    1.1497    0.1207 C   0  0  0

+   -1.6659   -3.0992    0.2638 C   0  0  0

+   -3.6116   -1.8215   -0.3794 O   0  0  0

+    0.4780   -3.5223   -0.5741 O   0  0  0

+    3.6229   -0.5582    0.0369 C   0  0  0

+    4.6009    1.5764    0.3896 O   0  0  0

+   -4.2929    0.4607   -0.3954 C   0  0  0

+   -4.6154   -0.9232    0.0998 C   0  0  0

+    4.8600   -1.1170    0.1185 O   0  0  0

+    4.1622    2.9336    0.4767 C   0  0  0

+    4.6886   -2.5259   -0.0475 C   0  0  0

+   -1.7158    0.4419    0.0000 H   0  0  0

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+   -3.8740    2.4737    0.0000 H   0  0  0

+   -2.5439   -3.6445    0.0000 H   0  0  0

+   -1.2333   -4.0379    0.0000 H   0  0  0

+   -5.1488    1.0401    0.0000 H   0  0  0

+   -5.5690   -0.5245    0.0000 H   0  0  0

+   -5.1670   -1.7973    0.0000 H   0  0  0

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+    3.8443    3.9171    0.0000 H   0  0  0

+    3.1787    2.6157    0.0000 H   0  0  0

+    3.6626   -2.4011    0.0000 H   0  0  0

+    4.5638   -3.5519    0.0000 H   0  0  0

+    5.7146   -2.6507    0.0000 H   0  0  0

+  1  2  1  0

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+ 28 50  1  0

+ 28 51  1  0

+ 28 52  1  0

+ 29 53  1  0

+ 29 54  1  0

+ 29 55  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120-23-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -1.9764    0.6156   -0.0028 C   0  0  0

+   -2.2035   -0.7839   -0.0013 C   0  0  0

+   -0.6586    1.1004   -0.0026 C   0  0  0

+   -3.0756    1.4921    0.0014 C   0  0  0

+   -1.1058   -1.6617    0.0004 C   0  0  0

+   -3.5230   -1.2672   -0.0010 C   0  0  0

+    0.3851    0.2190   -0.0009 C   0  0  0

+   -4.3393    0.9872    0.0068 C   0  0  0

+    0.1587   -1.1606    0.0005 C   0  0  0

+   -4.5624   -0.3886   -0.0022 C   0  0  0

+    1.6599    0.6893   -0.0011 O   0  0  0

+    2.5209   -0.4512    0.0008 C   0  0  0

+    3.9575    0.0040    0.0007 C   0  0  0

+    4.9485   -0.9014    0.0024 O   0  0  0

+    4.2174    1.1840   -0.0010 O   0  0  0

+   -0.4770    2.1315    0.0000 H   0  0  0

+   -2.9228    2.5278    0.0000 H   0  0  0

+   -1.2608   -2.6971    0.0000 H   0  0  0

+   -3.7056   -2.2981    0.0000 H   0  0  0

+   -5.1562    1.6420    0.0000 H   0  0  0

+    0.9740   -1.8173    0.0000 H   0  0  0

+   -5.5444   -0.7517    0.0000 H   0  0  0

+    1.6194   -0.9835    0.0000 H   0  0  0

+    2.9479   -1.4071    0.0000 H   0  0  0

+    5.7214   -1.6076    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+  7  9  2  0

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+  3 16  1  0

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+  6 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78448-08-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    0.9922    0.7654   -0.0026 C   0  0  0

+   -0.4519    1.0024   -0.0003 C   0  0  0

+    1.6050    2.0216   -0.0020 C   0  0  0

+    1.8249   -0.4317    0.0002 C   0  0  0

+   -1.6236    0.1337   -0.0002 C   0  0  0

+   -0.6312    2.3884    0.0016 C   0  0  0

+    0.6143    2.9831    0.0005 N   0  0  0

+    3.0041    2.1139   -0.0038 C   0  0  0

+    3.2330   -0.2813   -0.0029 C   0  0  0

+    1.2675   -1.7154    0.0063 C   0  0  0

+   -2.9102    0.7256    0.0020 C   0  0  0

+   -1.5034   -1.2600   -0.0031 C   0  0  0

+   -1.9278    2.9225    0.0037 C   0  0  0

+    3.7918    1.0113   -0.0062 C   0  0  0

+    4.0449   -1.4267   -0.0003 C   0  0  0

+    2.0852   -2.8066    0.0092 C   0  0  0

+   -3.0262    2.1292    0.0035 C   0  0  0

+   -4.0480   -0.0975    0.0022 C   0  0  0

+   -2.6398   -2.0401   -0.0039 C   0  0  0

+    3.4697   -2.6616    0.0052 C   0  0  0

+   -3.9065   -1.4511    0.0003 C   0  0  0

+   -2.5269   -3.3943   -0.0072 O   0  0  0

+    0.7840    4.0180    0.0000 H   0  0  0

+    3.4530    3.0617    0.0000 H   0  0  0

+    0.2259   -1.8375    0.0000 H   0  0  0

+   -0.5553   -1.7082    0.0000 H   0  0  0

+   -2.0506    3.9640    0.0000 H   0  0  0

+    4.8346    1.1224    0.0000 H   0  0  0

+    5.0893   -1.3321    0.0000 H   0  0  0

+    1.6656   -3.7677    0.0000 H   0  0  0

+   -3.9788    2.5677    0.0000 H   0  0  0

+   -5.0055    0.3303    0.0000 H   0  0  0

+    4.0787   -3.5154    0.0000 H   0  0  0

+   -4.7601   -2.0603    0.0000 H   0  0  0

+   -2.4398   -4.4394    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  8 14  2  0

+  9 15  1  0

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+ 11 17  1  0

+ 11 18  1  0

+ 12 19  2  0

+ 15 20  2  0

+ 18 21  2  0

+ 19 22  1  0

+  6  7  1  0

+  9 14  1  0

+ 13 17  2  0

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+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13284-42-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.7520   -1.0075   -0.0988 C   0  0  0

+   -0.5388   -1.1347    0.1979 C   0  0  0

+    1.2912    0.3213   -0.5620 C   0  0  0

+   -1.4156   -0.0090    0.0770 C   0  0  0

+    2.3738    0.7986    0.4081 C   0  0  0

+   -2.1112    0.8840   -0.0190 N   0  0  0

+    1.3343   -1.7867    0.0000 H   0  0  0

+   -0.9225   -2.0286    0.0000 H   0  0  0

+    1.1474    1.2834    0.0000 H   0  0  0

+    0.3252    0.4364    0.0000 H   0  0  0

+    2.7662   -0.0915    0.0000 H   0  0  0

+    3.2639    1.1910    0.0000 H   0  0  0

+    1.9814    1.6887    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  3  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-26-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    2.1005    0.0916    0.0340 C   0  0  0

+    0.9837    0.4835    0.6787 N   0  0  0

+    3.0882   -0.7542    0.7215 C   0  0  0

+    2.2892    0.4332   -1.1179 O   0  0  0

+    0.0000    1.3260   -0.0061 C   0  0  0

+    4.1902   -1.1410    0.0853 C   0  0  0

+   -0.9834    0.4767   -0.6829 N   0  0  0

+   -2.1000    0.0905   -0.0344 C   0  0  0

+   -3.0874   -0.7622   -0.7140 C   0  0  0

+   -2.2912    0.4470    1.1124 O   0  0  0

+   -4.1893   -1.1433   -0.0742 C   0  0  0

+    0.5408   -0.2849    0.0000 H   0  0  0

+    2.6453   -1.5226    0.0000 H   0  0  0

+    0.6099    1.9699    0.0000 H   0  0  0

+   -0.6126    1.9674    0.0000 H   0  0  0

+    4.3542   -2.0126    0.0000 H   0  0  0

+    4.8630   -0.5631    0.0000 H   0  0  0

+   -0.5407   -0.2918    0.0000 H   0  0  0

+   -2.6447   -1.5307    0.0000 H   0  0  0

+   -4.8594   -0.5624    0.0000 H   0  0  0

+   -4.3573   -2.0141    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

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+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-29-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -1.3161   -0.0268    0.0037 C   0  0  0

+   -0.8028   -1.3109    0.0031 C   0  0  0

+   -0.4631    1.0611    0.0028 C   0  0  0

+   -2.7811    0.1832   -0.0008 N   0  3  0

+    0.5641   -1.5095    0.0015 C   0  0  0

+    0.9050    0.8678    0.0012 C   0  0  0

+   -3.2343    1.3138   -0.0002 O   0  0  0

+   -3.5336   -0.7745   -0.0050 O   0  5  0

+    1.4224   -0.4193    0.0005 C   0  0  0

+    2.7676   -0.6121   -0.0006 O   0  0  0

+    3.3706    0.6835   -0.0014 C   0  0  0

+    4.8935    0.5372   -0.0027 C   0  0  0

+   -1.4446   -2.1254    0.0000 H   0  0  0

+   -0.8504    2.0231    0.0000 H   0  0  0

+    0.9485   -2.4726    0.0000 H   0  0  0

+    1.5445    1.6842    0.0000 H   0  0  0

+    3.5858    1.6979    0.0000 H   0  0  0

+    2.3870    1.0120    0.0000 H   0  0  0

+    4.7943   -0.4950    0.0000 H   0  0  0

+    5.9257    0.4380    0.0000 H   0  0  0

+    4.9927    1.5694    0.0000 H   0  0  0

+  1  2  1  0

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+  6  9  2  0

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+  6 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5306-96-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.6904   -0.7173   -0.0014 C   0  0  0

+   -0.6904   -0.7173   -0.0008 C   0  0  0

+    1.3848    0.4855   -0.0008 C   0  0  0

+    1.4438   -2.0224    0.0036 C   0  0  0

+   -1.3848    0.4855    0.0004 C   0  0  0

+   -1.4439   -2.0224   -0.0019 C   0  0  0

+    0.6906    1.6878    0.0004 C   0  0  0

+    2.7848    0.4855   -0.0010 N   0  0  0

+   -0.6906    1.6878    0.0010 C   0  0  0

+   -2.7848    0.4855    0.0006 N   0  0  0

+    0.5417   -2.5432    0.0000 H   0  0  0

+    1.9646   -2.9245    0.0000 H   0  0  0

+    2.3459   -1.5016    0.0000 H   0  0  0

+   -2.3460   -1.5016    0.0000 H   0  0  0

+   -1.9647   -2.9245    0.0000 H   0  0  0

+   -0.5418   -2.5432    0.0000 H   0  0  0

+    1.2114    2.5899    0.0000 H   0  0  0

+    3.3056   -0.4166    0.0000 H   0  0  0

+    3.3056    1.3876    0.0000 H   0  0  0

+   -1.2114    2.5899    0.0000 H   0  0  0

+   -3.3056    1.3876    0.0000 H   0  0  0

+   -3.3056   -0.4166    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

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+  7  9  1  0

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+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24085-08-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 51                          1 V2000

+   -3.0530    0.6922   -0.1790 C   0  0  0

+   -3.9349    1.0254    0.8566 C   0  0  0

+   -1.6033    0.7045    0.0553 C   0  0  0

+   -3.5585    0.3417   -1.4370 C   0  0  0

+   -5.2828    1.0133    0.6363 C   0  0  0

+   -0.6565    0.3455   -1.0609 C   0  0  0

+   -1.1679    1.0035    1.1472 O   0  0  0

+   -4.9188    0.3271   -1.6469 C   0  0  0

+   -5.7852    0.6709   -0.6146 C   0  0  0

+   -6.2292    1.3718    1.7529 C   0  0  0

+    0.6903    0.1370   -0.5126 N   0  0  0

+   -7.1253    0.6613   -0.8254 O   0  0  0

+   -5.4810    1.6831    2.9299 O   0  0  0

+    1.2664   -1.0070   -1.2317 C   0  0  0

+    1.4852    1.3144   -0.8865 C   0  0  0

+    1.0134   -2.2706   -0.4504 C   0  0  0

+    0.8797    2.5637   -0.2436 C   0  0  0

+    2.9236    1.1350   -0.3970 C   0  0  0

+    1.4802    1.4707   -2.4085 C   0  0  0

+    0.1107   -3.2052   -0.9212 C   0  0  0

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+    0.5940    1.4424    0.0000 H   0  0  0

+   -0.6746   -2.7935    0.0000 H   0  0  0

+    2.4560   -2.0533    0.0000 H   0  0  0

+   -0.8885   -4.8091    0.0000 H   0  0  0

+    2.2412   -4.0693    0.0000 H   0  0  0

+    0.7587   -5.4501    0.0000 H   0  0  0

+   14.3822    1.3529    0.0000 H   0  0  0

+  1  2  1  0

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+ 23 49  1  0

+ 24 50  1  0

+ 25 51  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6638-64-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.2138   -0.6064    0.0185 C   0  0  0

+   -1.6809   -0.7677    0.0321 C   0  0  0

+    0.3261    0.6738    0.2183 C   0  0  0

+    0.6313   -1.6926   -0.1928 C   0  0  0

+   -2.4680    0.4053   -0.0099 C   0  0  0

+   -2.2976   -2.0096    0.0841 C   0  0  0

+   -0.4963    1.7335    0.4283 O   0  0  0

+    1.7024    0.8444    0.2022 C   0  0  0

+    1.9974   -1.5043   -0.2034 C   0  0  0

+   -1.7609    1.6988   -0.0607 C   0  0  0

+   -3.8545    0.3114   -0.0013 C   0  0  0

+   -3.6766   -2.0843    0.0929 C   0  0  0

+    2.5299   -0.2405   -0.0055 C   0  0  0

+   -2.2892    2.6920   -0.5220 O   0  0  0

+   -4.4491   -0.9333    0.0498 C   0  0  0

+    3.9979   -0.0516   -0.0214 N   0  3  0

+    4.7327   -1.0057   -0.2043 O   0  0  0

+    4.4711    1.0578    0.1484 O   0  5  0

+    0.2413   -2.6515    0.0000 H   0  0  0

+   -1.7286   -2.8743    0.0000 H   0  0  0

+    2.1035    1.7987    0.0000 H   0  0  0

+    2.6276   -2.3256    0.0000 H   0  0  0

+   -4.4359    1.1679    0.0000 H   0  0  0

+   -4.1387   -3.0106    0.0000 H   0  0  0

+   -5.4815   -1.0085    0.0000 H   0  0  0

+  1  2  1  0

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+  4 19  1  0

+  6 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-40-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -1.0924   -0.0709    0.0641 C   0  0  0

+   -2.3004    0.7143    0.0215 C   0  0  0

+    0.2351    0.5630    0.1072 C   0  0  0

+   -1.2360   -1.4430    0.0686 C   0  0  0

+   -3.4675    0.0421   -0.0161 C   0  0  0

+    1.3453   -0.2001    0.1465 N   0  0  0

+    0.3303    1.7758    0.1073 O   0  0  0

+   -2.9528   -1.6627    0.0167 S   0  0  0

+   -4.8429    0.5876   -0.0633 N   0  3  0

+    2.6078    0.3965    0.0574 C   0  0  0

+   -5.7973   -0.1686   -0.0936 O   0  0  0

+   -5.0202    1.7926   -0.0719 O   0  5  0

+    3.7472   -0.3945   -0.0344 C   0  0  0

+    2.7250    1.7798    0.0548 C   0  0  0

+    4.9922    0.1984   -0.1227 C   0  0  0

+    3.6062   -2.1247   -0.0376 Cl  0  0  0

+    3.9729    2.3659   -0.0338 C   0  0  0

+    5.1049    1.5769   -0.1197 C   0  0  0

+   -2.2725    1.7512    0.0000 H   0  0  0

+   -0.4941   -2.1680    0.0000 H   0  0  0

+    1.2620   -1.2341    0.0000 H   0  0  0

+    1.8736    2.3724    0.0000 H   0  0  0

+    5.8460   -0.3907    0.0000 H   0  0  0

+    4.0608    3.3995    0.0000 H   0  0  0

+    6.0433    2.0190    0.0000 H   0  0  0

+  1  2  1  0

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+  5  8  1  0

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+  4 20  1  0

+  6 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 17 24  1  0

+ 18 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134514-27-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.7698    0.1510    0.0119 C   0  0  0

+   -0.3177   -1.1573   -0.0932 C   0  0  0

+    0.1360    1.1908    0.0995 C   0  0  0

+   -2.2228    0.4327    0.0241 N   0  3  0

+    1.0457   -1.4220   -0.1101 C   0  0  0

+   -1.2361   -2.2101   -0.1819 N   0  0  0

+    1.4982    0.9282    0.0824 C   0  0  0

+   -2.7005    1.2034   -0.7891 O   0  0  0

+   -2.9408   -0.1061    0.8473 O   0  5  0

+    1.9522   -0.3822   -0.0225 C   0  0  0

+    2.4167    1.9833    0.1708 N   0  0  0

+    3.2785   -0.6388   -0.0384 F   0  0  0

+   -0.2026    2.1732    0.0000 H   0  0  0

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+   -2.2558   -2.0101    0.0000 H   0  0  0

+   -0.8995   -3.1932    0.0000 H   0  0  0

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+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6151-25-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+   -2.7038    2.0130   -0.2990 C   0  0  0

+   -3.1672    1.0526    0.6170 C   0  0  0

+   -1.6609    1.6218   -1.2607 C   0  0  0

+   -3.2270    3.3128   -0.2831 C   0  0  0

+   -2.6538   -0.1953    0.5988 O   0  0  0

+   -4.1496    1.4018    1.5313 C   0  0  0

+   -1.1851    0.2863   -1.2008 C   0  0  0

+   -1.2219    2.4154   -2.0778 O   0  0  0

+   -4.2017    3.6430    0.6396 C   0  0  0

+   -2.7798    4.2406   -1.1669 O   0  0  0

+   -1.7008   -0.5677   -0.2727 C   0  0  0

+   -4.6664    2.6876    1.5375 C   0  0  0

+   -0.2214   -0.1379   -2.0629 O   0  0  0

+   -1.1953   -1.9520   -0.2233 C   0  0  0

+   -5.6283    3.0211    2.4356 O   0  0  0

+   -0.3026   -2.3365    0.7812 C   0  0  0

+   -1.6119   -2.8844   -1.1775 C   0  0  0

+    0.1680   -3.6350    0.8228 C   0  0  0

+   -1.1382   -4.1779   -1.1296 C   0  0  0

+   -0.2474   -4.5579   -0.1354 C   0  0  0

+    1.0369   -4.0123    1.7985 O   0  0  0

+    0.2169   -5.8342   -0.0931 O   0  0  0

+   13.0184    1.0050   -0.1155 O   0  0  0

+   21.4947    2.5696    0.7227 O   0  0  0

+   -4.6939    0.8350    0.0000 H   0  0  0

+   -4.5046    4.3681    0.0000 H   0  0  0

+   -2.4386    4.9485    0.0000 H   0  0  0

+    0.4978   -0.4545    0.0000 H   0  0  0

+   -6.3708    3.2785    0.0000 H   0  0  0

+    0.2692   -1.7975    0.0000 H   0  0  0

+   -2.3973   -2.8572    0.0000 H   0  0  0

+   -1.7082   -4.7189    0.0000 H   0  0  0

+    1.7577   -4.3253    0.0000 H   0  0  0

+    0.4855   -6.5727    0.0000 H   0  0  0

+   12.2326    1.0050    0.0000 H   0  0  0

+   13.8042    1.0050    0.0000 H   0  0  0

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+   22.2805    2.5696    0.0000 H   0  0  0

+  1  2  2  0

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+ 21 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+ 23 36  1  0

+ 24 37  1  0

+ 24 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35282-72-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -1.9037   -0.5738    0.0524 C   0  0  0

+   -2.9347   -1.4652    0.3698 C   0  0  0

+   -2.2062    0.7531   -0.2715 C   0  0  0

+   -0.6064   -0.9962    0.0644 N   0  0  0

+   -4.2414   -1.0339    0.3622 C   0  0  0

+   -3.5159    1.1769   -0.2769 C   0  0  0

+    0.3427   -0.1731   -0.2284 N   0  0  0

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+   -5.8619    0.7199    0.0327 N   0  0  0

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+    1.9474   -1.9183    0.1181 C   0  0  0

+   -6.1766    2.1098   -0.3068 C   0  0  0

+   -6.9398   -0.2149    0.3652 C   0  0  0

+    3.9823   -0.1413   -0.5186 C   0  0  0

+    3.2613   -2.3381    0.1285 C   0  0  0

+    4.2762   -1.4537   -0.1913 C   0  0  0

+    5.0953    0.8155   -0.8602 C   0  0  0

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+   -6.2697   -0.9875    0.0000 H   0  0  0

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+    5.2480   -1.7724    0.0000 H   0  0  0

+    5.3686   -0.1700    0.0000 H   0  0  0

+    6.1035    0.6435    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111712-50-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.5318    0.1724   -0.9714 C   0  0  0

+   -0.9651    0.2182   -1.2843 C   0  0  0

+    0.9644    1.5031   -0.3524 C   0  0  0

+    0.8921   -1.2874    0.2953 Br  0  0  0

+   -1.3976   -1.1125   -1.9033 C   0  0  0

+   -1.9724    0.5270    0.3755 Br  0  0  0

+    2.7284    1.4491    0.0164 Cl  0  0  0

+    1.6174    0.1331    0.0000 H   0  0  0

+   -0.7877    1.2899    0.0000 H   0  0  0

+    1.1000    2.5809    0.0000 H   0  0  0

+   -0.0958    1.7399    0.0000 H   0  0  0

+   -2.4307   -0.7767    0.0000 H   0  0  0

+   -1.7334   -2.1456    0.0000 H   0  0  0

+   -0.3645   -1.4483    0.0000 H   0  0  0

+  1  2  1  0

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+  3 10  1  0

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+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97284-34-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    1.0620    0.0173   -0.0020 C   0  0  0

+   -0.3862   -0.2253   -0.0020 C   0  0  0

+    1.5228    1.4186   -0.0010 C   0  0  0

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+   -0.8706   -1.6189   -0.0028 C   0  0  0

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+    1.4223   -2.3770    0.0079 C   0  0  0

+    3.3504   -0.6944    0.0025 C   0  0  0

+   -0.7818    2.1616    0.0010 C   0  0  0

+   -2.6766    0.4211    0.0008 C   0  0  0

+    0.1418   -2.6877   -0.0039 C   0  0  0

+   -2.1614   -1.8373   -0.0031 C   0  0  0

+    3.7693    0.5537   -0.0025 C   0  0  0

+   -3.0374   -0.8048    0.0005 N   0  0  0

+   -3.6160    1.4072    0.0027 O   0  0  0

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+   -0.1587   -3.7051    0.0000 H   0  0  0

+   -2.5250   -2.8339    0.0000 H   0  0  0

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+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+140695-21-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 59                          1 V2000

+    5.6338    0.8594   -0.6881 C   0  0  0

+    6.4792    0.8682    0.3554 O   0  0  0

+    6.3418    0.6214   -1.8068 C   0  0  0

+    4.1438    1.0735   -0.6170 C   0  0  0

+    7.7290    0.6377   -0.0789 C   0  0  0

+    7.6925    0.4785   -1.4141 C   0  0  0

+    3.3139   -0.5230   -0.3863 S   0  0  0

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+    1.5853    0.0247   -0.3372 C   0  0  0

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+    0.6716   -1.1872   -0.1440 C   0  0  0

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+   -0.7245   -0.7448   -0.1043 N   0  0  0

+   -1.7326   -1.6647    0.0624 C   0  0  0

+   -3.0427   -1.2496    0.0997 N   0  0  0

+   -1.4462   -2.9303    0.1851 N   0  0  0

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+   -0.8902   -5.0993    0.0000 H   0  0  0

+   -6.1708   -0.9831    0.0000 H   0  0  0

+   -6.3738    2.2632    0.0000 H   0  0  0

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+   -6.6830    3.6638    0.0000 H   0  0  0

+   -4.6258    4.1097    0.0000 H   0  0  0

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+ 28 57  1  0

+ 30 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+671-16-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 35                          1 V2000

+   -0.7879    0.3500   -0.0905 C   0  0  0

+   -2.2321    0.5408    0.1618 C   0  0  0

+    0.0832    1.4394   -0.0362 C   0  0  0

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+   -5.0857   -1.5997    0.9688 C   0  0  0

+    3.3892   -0.2021   -0.8206 C   0  0  0

+    4.0729   -0.4968    0.4458 N   0  0  0

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+    6.2154    0.3457    0.8922 C   0  0  0

+   -0.2958    2.3885    0.0000 H   0  0  0

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+    5.3865    0.9435    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146177-57-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.5401   -0.5628   -0.0017 C   0  0  0

+   -0.9135   -0.7072   -0.0008 C   0  0  0

+    1.0873    0.7230   -0.0014 C   0  0  0

+    1.5685   -1.4413    0.0026 N   0  0  0

+   -1.7138    0.4626    0.0003 C   0  0  0

+   -1.4935   -1.9064   -0.0015 N   0  0  0

+    0.2555    1.8454   -0.0003 C   0  0  0

+    2.4613    0.5549   -0.0018 N   0  0  0

+    2.7050   -0.7867   -0.0002 C   0  0  0

+   -1.0964    1.7277    0.0010 C   0  0  0

+   -3.0458    0.3461    0.0010 N   0  0  0

+   -2.8062   -1.9961   -0.0012 C   0  0  0

+    3.4667    1.6205   -0.0017 C   0  0  0

+    3.9566   -1.3671    0.0028 N   0  0  0

+   -1.9495    2.9700    0.0017 C   0  0  0

+   -3.5962   -0.8477    0.0008 C   0  0  0

+    0.6810    2.7905    0.0000 H   0  0  0

+   -3.2570   -2.9294    0.0000 H   0  0  0

+    4.2206    0.9092    0.0000 H   0  0  0

+    4.1780    2.3744    0.0000 H   0  0  0

+    2.7128    2.3318    0.0000 H   0  0  0

+    4.0491   -2.3994    0.0000 H   0  0  0

+    4.8043   -0.7708    0.0000 H   0  0  0

+   -1.0951    3.5567    0.0000 H   0  0  0

+   -2.5362    3.8244    0.0000 H   0  0  0

+   -2.8039    2.3833    0.0000 H   0  0  0

+   -4.6289   -0.9360    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  2  0

+  7 10  2  0

+  8  9  1  0

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+  7 17  1  0

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+ 14 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7258-52-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 34                          1 V2000

+   -0.2391   -0.3196    0.0236 C   0  0  0

+   -1.3839    0.4842    0.0590 C   0  0  0

+    1.1041    0.2677    0.0172 C   0  0  0

+   -0.3647   -1.7253   -0.0128 C   0  0  0

+   -2.6188   -0.0992    0.0646 C   0  0  0

+   -1.5212    1.9916    0.0944 C   0  0  0

+    2.2219   -0.5959   -0.0210 C   0  0  0

+    1.2976    1.6499    0.0490 C   0  0  0

+   -1.6459   -2.2943   -0.0116 C   0  0  0

+    0.7933   -2.5364   -0.0501 C   0  0  0

+   -2.7425   -1.4877    0.0356 C   0  0  0

+   -3.6932    0.9686    0.1043 C   0  0  0

+   -2.9821    2.2719   -0.3174 C   0  0  0

+    2.0290   -1.9968   -0.0507 C   0  0  0

+    3.5110   -0.0446   -0.0284 C   0  0  0

+    2.5662    2.1559    0.0421 C   0  0  0

+    3.6683    1.3100    0.0022 C   0  0  0

+   -0.4697    1.9888    0.0000 H   0  0  0

+   -1.4203    3.0382    0.0000 H   0  0  0

+    0.4703    2.2989    0.0000 H   0  0  0

+   -1.7594   -3.3396    0.0000 H   0  0  0

+    0.6887   -3.5826    0.0000 H   0  0  0

+   -3.7009   -1.9202    0.0000 H   0  0  0

+   -4.5647    1.5569    0.0000 H   0  0  0

+   -4.3609    0.1563    0.0000 H   0  0  0

+   -2.6785    3.2786    0.0000 H   0  0  0

+   -3.9521    2.6776    0.0000 H   0  0  0

+    2.8674   -2.6314    0.0000 H   0  0  0

+    4.3537   -0.6735    0.0000 H   0  0  0

+    2.7104    3.1974    0.0000 H   0  0  0

+    4.6366    1.7197    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  2  0

+ 15 17  2  0

+  9 11  2  0

+ 10 14  2  0

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+  6 18  1  0

+  6 19  1  0

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+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87633-43-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+    1.9702   -0.1952   -0.0524 C   0  0  0

+    0.8131   -0.9952    0.0427 C   0  0  0

+    1.9879    1.2463   -0.2702 C   0  0  0

+    3.2866   -0.6527    0.0526 C   0  0  0

+   -0.4551   -0.2492   -0.0720 C   0  0  0

+    1.0345   -2.3403    0.2353 C   0  0  0

+    0.6915    1.9918   -0.4414 C   0  0  0

+    3.2744    1.5801   -0.2779 C   0  0  0

+    4.0641    0.4570   -0.0867 N   0  0  0

+    3.4744   -2.0192    0.2566 C   0  0  0

+   -0.4448    1.2206    0.2466 C   0  0  1

+   -1.5458   -0.9005   -0.4437 C   0  0  0

+    2.3395   -2.8187    0.3310 C   0  0  0

+    5.5283    0.4632   -0.0378 C   0  0  0

+   -1.7088    1.8868   -0.0328 N   0  0  0

+   -2.8687   -0.1873   -0.5547 C   0  0  2

+   -2.8204    1.0297    0.3776 C   0  0  0

+   -1.7561    3.0789    0.8243 C   0  0  0

+   -3.9927   -1.1255   -0.1107 C   0  0  0

+   -5.2472   -0.4492   -0.2159 O   0  0  0

+   -6.2512   -1.3724    0.2104 C   0  0  0

+    0.2303   -3.0058    0.0000 H   0  0  0

+    1.3420    2.8082    0.0000 H   0  0  0

+   -0.0178    2.7576    0.0000 H   0  0  0

+    3.6343    2.5599    0.0000 H   0  0  0

+    4.4316   -2.4355    0.0000 H   0  0  0

+    0.4758    0.7286    0.0000 H   0  0  0

+   -1.5229   -1.9441    0.0000 H   0  0  0

+    2.4760   -3.8536    0.0000 H   0  0  0

+    5.5327   -0.5806    0.0000 H   0  0  0

+    6.5721    0.4676    0.0000 H   0  0  0

+    5.5239    1.5070    0.0000 H   0  0  0

+   -3.8052    0.2737    0.0000 H   0  0  0

+   -3.2505    1.9808    0.0000 H   0  0  0

+   -3.8450    0.8300    0.0000 H   0  0  0

+   -0.7131    3.1203    0.0000 H   0  0  0

+   -1.7975    4.1219    0.0000 H   0  0  0

+   -2.7991    3.0375    0.0000 H   0  0  0

+   -4.6004   -1.9742    0.0000 H   0  0  0

+   -3.2277   -1.8357    0.0000 H   0  0  0

+   -6.9577   -0.6040    0.0000 H   0  0  0

+   -7.0196   -2.0789    0.0000 H   0  0  0

+   -5.5447   -2.1408    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+ 19 20  1  0

+ 20 21  1  0

+  7 11  1  0

+  8  9  1  0

+ 10 13  1  0

+ 16 17  1  0

+  6 22  1  0

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+ 18 38  1  0

+ 19 39  1  0

+ 19 40  1  0

+ 21 41  1  0

+ 21 42  1  0

+ 21 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+29128-23-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.3022    0.0005    0.0038 C   0  0  0

+    0.3964   -1.2048   -0.0073 C   0  0  0

+    0.3976    1.2056    0.0127 C   0  0  0

+   -1.7861    0.0012   -0.0002 C   0  0  0

+    1.7768   -1.1995   -0.0094 C   0  0  0

+   -0.3402   -2.4887   -0.0174 N   0  3  0

+    1.7776    1.1991    0.0106 C   0  0  0

+   -0.3378    2.4901    0.0241 N   0  3  0

+   -2.4822    0.0590   -1.2060 C   0  0  0

+   -2.4884   -0.0618    1.2014 C   0  0  0

+    2.4662   -0.0007   -0.0004 C   0  0  0

+    0.2664   -3.5397    0.0876 O   0  0  0

+   -1.5529   -2.4942   -0.1307 O   0  5  0

+    0.2693    3.5405   -0.0835 O   0  0  0

+   -1.5502    2.4967    0.1409 O   0  5  0

+   -3.8622    0.0594   -1.2038 C   0  0  0

+   -3.8688   -0.0608    1.1919 C   0  0  0

+    3.9464   -0.0013   -0.0027 N   0  3  0

+   -4.5546    0.0025   -0.0074 C   0  0  0

+    4.5559    1.0532    0.0052 O   0  0  0

+    4.5550   -1.0564   -0.0124 O   0  5  0

+    2.2968   -2.0944    0.0000 H   0  0  0

+    2.2984    2.0936    0.0000 H   0  0  0

+   -2.4392    1.0931    0.0000 H   0  0  0

+   -2.4425   -1.0958    0.0000 H   0  0  0

+   -3.9045    1.0935    0.0000 H   0  0  0

+   -3.9168   -1.0947    0.0000 H   0  0  0

+   -5.5896    0.0077    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

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+  7 11  1  0

+ 17 19  2  0

+  5 22  1  0

+  7 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 19 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+260-94-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -1.1963    0.7650   -0.0029 C   0  0  0

+   -1.1588   -0.7008   -0.0009 C   0  0  0

+   -0.0001    1.4865   -0.0030 C   0  0  0

+   -2.4456    1.4181    0.0010 C   0  0  0

+   -0.0001   -1.3504    0.0006 N   0  0  0

+   -2.3832   -1.4033   -0.0009 C   0  0  0

+    1.1965    0.7650   -0.0010 C   0  0  0

+   -3.5859    0.6800    0.0066 C   0  0  0

+    1.1590   -0.7008    0.0002 C   0  0  0

+   -3.5530   -0.7145   -0.0029 C   0  0  0

+    2.4454    1.4179   -0.0004 C   0  0  0

+    2.3829   -1.4032    0.0013 C   0  0  0

+    3.5860    0.6798    0.0019 C   0  0  0

+    3.5532   -0.7143    0.0004 C   0  0  0

+   -0.0002    2.5334    0.0000 H   0  0  0

+   -2.4941    2.4639    0.0000 H   0  0  0

+   -2.3891   -2.4502    0.0000 H   0  0  0

+   -4.5114    1.1694    0.0000 H   0  0  0

+   -4.4557   -1.2448    0.0000 H   0  0  0

+    2.4939    2.4637    0.0000 H   0  0  0

+    2.3887   -2.4501    0.0000 H   0  0  0

+    4.5115    1.1692    0.0000 H   0  0  0

+    4.4559   -1.2446    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

+  4  8  2  0

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+  3 15  1  0

+  4 16  1  0

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+  8 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+74011-58-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 42                          1 V2000

+    0.3311    0.3391   -0.0923 C   0  0  0

+    0.9549   -0.9157    0.0188 C   0  0  0

+    1.0922    1.4809   -0.1920 N   0  0  0

+   -0.9945    0.4152   -0.0948 N   0  0  0

+    2.4243   -0.9808    0.0262 C   0  0  0

+    0.1758   -2.0751    0.1205 C   0  0  0

+    2.4322    1.4650   -0.1888 C   0  0  0

+    0.4075    2.7710   -0.3064 C   0  0  0

+   -1.7501   -0.6654    0.0051 C   0  0  0

+    3.1539    0.2941   -0.0852 C   0  0  0

+    3.0130   -2.0439    0.1208 O   0  0  0

+   -1.1871   -1.9418    0.1077 C   0  0  0

+    0.1676    3.3466    1.0907 C   0  0  0

+   -3.1291   -0.5314   -0.0025 N   0  0  0

+    4.6234    0.3180   -0.0861 C   0  0  0

+   -1.9801   -3.0314    0.2033 F   0  0  0

+   -3.4788    0.1610   -1.2488 C   0  0  0

+   -3.4708    0.3762    1.0997 C   0  0  0

+    5.3163   -0.8339    0.0156 O   0  0  0

+    5.2141    1.3764   -0.1786 O   0  0  0

+   -4.9794    0.4541   -1.2706 C   0  0  0

+   -4.9714    0.6693    1.0780 C   0  0  0

+   -5.3211    1.3617   -0.1684 N   0  0  0

+    0.6140   -3.0040    0.0000 H   0  0  0

+    2.9382    2.3588    0.0000 H   0  0  0

+   -0.6147    2.8712    0.0000 H   0  0  0

+   -0.1642    1.9177    0.0000 H   0  0  0

+    1.1156    3.7417    0.0000 H   0  0  0

+   -0.2275    4.2946    0.0000 H   0  0  0

+   -0.7804    2.9515    0.0000 H   0  0  0

+   -2.4830    0.4126    0.0000 H   0  0  0

+   -3.5068    1.1877    0.0000 H   0  0  0

+   -2.4596    0.5558    0.0000 H   0  0  0

+   -3.4620    1.4032    0.0000 H   0  0  0

+    5.8457   -1.7140    0.0000 H   0  0  0

+   -5.9906    0.2745    0.0000 H   0  0  0

+   -4.9882   -0.5729    0.0000 H   0  0  0

+   -5.9672    0.4177    0.0000 H   0  0  0

+   -4.9434   -0.3574    0.0000 H   0  0  0

+   -5.7341    2.3020    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  2  0

+  8 13  1  0

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+ 12 16  1  0

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+  7 10  2  0

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+ 17 31  1  0

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+ 19 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58337-49-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+    1.5667   -0.4780    0.2854 C   0  0  2

+    0.1274   -0.9064   -0.0073 C   0  0  0

+    1.9050    0.6888   -0.5333 N   0  0  0

+    2.5046   -1.6110   -0.0429 C   0  0  0

+   -1.0015    0.4574    0.3879 S   0  0  0

+    2.7956    1.5938   -0.0813 C   0  0  0

+    3.7564   -1.3493   -0.4507 O   0  0  0

+    2.1298   -2.7549    0.0610 O   0  0  0

+   -2.5871   -0.3110   -0.0436 C   0  0  0

+    3.1436    2.7941   -0.9235 C   0  0  0

+    3.3169    1.4423    1.0032 O   0  0  0

+   -3.7221    0.6819    0.2147 C   0  0  0

+   -5.2980   -0.0819   -0.2142 Cl  0  0  0

+    2.5763   -0.2685    0.0000 H   0  0  0

+   -0.7477   -1.4518    0.0000 H   0  0  0

+    0.5510   -1.8465    0.0000 H   0  0  0

+    1.0152    1.2099    0.0000 H   0  0  0

+    4.7657   -1.1383    0.0000 H   0  0  0

+   -3.3634   -0.9897    0.0000 H   0  0  0

+   -2.0178   -1.1707    0.0000 H   0  0  0

+    4.1340    2.5070    0.0000 H   0  0  0

+    3.4307    3.7845    0.0000 H   0  0  0

+    2.1532    3.0812    0.0000 H   0  0  0

+   -2.9459    1.3606    0.0000 H   0  0  0

+   -4.2914    1.5416    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  4  7  1  0

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+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-87-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.5134    0.0049    0.2826 C   0  0  0

+    1.4516    0.0104    1.2980 C   0  0  0

+    0.9235   -0.0037   -1.0373 C   0  0  0

+   -0.9566    0.0020    0.6148 C   0  0  0

+    2.7997    0.0073    0.9933 C   0  0  0

+    2.2720   -0.0069   -1.3421 C   0  0  0

+   -1.7340    1.4700   -0.0861 Cl  0  0  0

+   -1.7262   -1.4742   -0.0774 Cl  0  0  0

+    3.2100   -0.0014   -0.3270 C   0  0  0

+    1.4498    1.0215    0.0000 H   0  0  0

+    0.9117   -1.0147    0.0000 H   0  0  0

+   -1.9677   -0.0013    0.0000 H   0  0  0

+    2.8116    1.0183    0.0000 H   0  0  0

+    2.2738   -1.0180    0.0000 H   0  0  0

+    4.2210   -0.0092    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6  9  2  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1204-68-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    0.7312   -0.4369   -0.0148 C   0  0  0

+   -0.4845    0.2508   -0.0280 N   0  0  0

+    1.1812   -1.0328    1.1568 C   0  0  0

+    1.4901   -0.5313   -1.1741 C   0  0  0

+   -1.6881   -0.3993   -0.5524 C   0  0  0

+   -0.5560    1.6221    0.4825 C   0  0  0

+    2.3833   -1.7123    1.1663 C   0  0  0

+    2.6916   -1.2124   -1.1576 C   0  0  0

+   -2.3134   -1.2709    0.5385 C   0  0  0

+    0.1306    2.5696   -0.5032 C   0  0  0

+    3.1390   -1.7999    0.0113 C   0  0  0

+   -3.7947   -2.0710   -0.1069 Cl  0  0  0

+    0.0426    4.2573    0.1251 Cl  0  0  0

+    4.4507   -2.5418    0.0256 C   0  0  0

+    0.5040   -1.8061    0.0000 H   0  0  0

+    1.8132    0.4445    0.0000 H   0  0  0

+   -1.8139    0.6209    0.0000 H   0  0  0

+   -2.6841   -0.1452    0.0000 H   0  0  0

+   -1.1752    2.4426    0.0000 H   0  0  0

+   -1.5218    1.2703    0.0000 H   0  0  0

+    2.0649   -2.6897    0.0000 H   0  0  0

+    3.3677   -0.4381    0.0000 H   0  0  0

+   -2.1876   -2.2911    0.0000 H   0  0  0

+   -1.3174   -1.5250    0.0000 H   0  0  0

+    0.7498    1.7491    0.0000 H   0  0  0

+    1.0964    2.9214    0.0000 H   0  0  0

+    3.9446   -3.4365    0.0000 H   0  0  0

+    5.3454   -3.0479    0.0000 H   0  0  0

+    4.9568   -1.6471    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+  8 11  2  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7297-53-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.4885   -0.5797    0.0073 C   0  0  0

+    2.4754   -1.5691    0.0081 C   0  0  0

+    1.8593    0.7674    0.0028 C   0  0  0

+    0.0632   -0.9554    0.0052 C   0  0  0

+    3.8069   -1.2100    0.0044 C   0  0  0

+    3.1951    1.1114   -0.0009 C   0  0  0

+   -0.8822   -0.0024    0.0045 C   0  0  0

+    4.1667    0.1264   -0.0001 C   0  0  0

+   -2.3074   -0.3781    0.0023 C   0  0  0

+    5.5981    0.5037   -0.0036 N   0  3  0

+   -3.2941    0.6113    0.0015 C   0  0  0

+   -2.6780   -1.7252   -0.0048 C   0  0  0

+    5.9180    1.6790   -0.0076 O   0  0  0

+    6.4558   -0.3610   -0.0025 O   0  5  0

+   -4.6267    0.2517   -0.0005 C   0  0  0

+   -4.0137   -2.0701   -0.0067 C   0  0  0

+   -4.9860   -1.0860   -0.0012 C   0  0  0

+   -5.8549    1.4786   -0.0014 Cl  0  0  0

+    2.2069   -2.5718    0.0000 H   0  0  0

+    1.1314    1.5074    0.0000 H   0  0  0

+   -0.2095   -1.9569    0.0000 H   0  0  0

+    4.5410   -1.9438    0.0000 H   0  0  0

+    3.4721    2.1118    0.0000 H   0  0  0

+   -0.6095    0.9991    0.0000 H   0  0  0

+   -3.0257    1.6140    0.0000 H   0  0  0

+   -1.9498   -2.4649    0.0000 H   0  0  0

+   -4.2899   -3.0707    0.0000 H   0  0  0

+   -5.9895   -1.3513    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  9 12  2  0

+ 10 13  2  0

+ 10 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+  6  8  2  0

+ 16 17  2  0

+  2 19  1  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  7 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106323-85-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.2256   -0.3134    0.4093 C   0  0  0

+   -0.2478   -0.2028    0.5465 C   0  0  0

+    1.9605    0.7478   -0.1148 C   0  0  0

+    1.8798   -1.4769    0.8095 C   0  0  0

+   -1.0788   -0.5923   -0.5017 C   0  0  0

+   -0.8056    0.2858    1.7264 C   0  0  0

+    3.3310    0.6397   -0.2397 C   0  0  0

+    1.2731    1.9888   -0.5372 N   0  3  0

+    3.2503   -1.5742    0.6801 C   0  0  0

+   -2.4487   -0.4872   -0.3686 C   0  0  0

+   -2.1764    0.3866    1.8486 C   0  0  0

+    3.9745   -0.5193    0.1542 C   0  0  0

+    1.9002    2.8742   -1.0906 O   0  0  0

+    0.0803    2.1245   -0.3314 O   0  5  0

+   -2.9967    0.0037    0.8024 C   0  0  0

+   -3.3329   -0.9003   -1.4816 N   0  3  0

+    5.4443   -0.6296    0.0173 N   0  3  0

+   -4.4664    0.1140    0.9393 N   0  3  0

+   -3.2576   -2.0293   -1.9323 O   0  0  0

+   -4.1356   -0.1111   -1.9467 O   0  5  0

+    6.0133   -1.6494    0.3636 O   0  0  0

+    6.0846    0.2993   -0.4415 O   0  5  0

+   -4.9538    0.4869    1.9914 O   0  0  0

+   -5.1884   -0.1680   -0.0002 O   0  5  0

+    1.3979   -2.2375    0.0000 H   0  0  0

+   -0.9168   -1.4780    0.0000 H   0  0  0

+   -0.4580    1.1164    0.0000 H   0  0  0

+    3.8179    1.3971    0.0000 H   0  0  0

+    3.6412   -2.3853    0.0000 H   0  0  0

+   -2.3391    1.2722    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  2  0

+  8 13  2  0

+  8 14  1  0

+ 10 15  2  0

+ 10 16  1  0

+ 12 17  1  0

+ 15 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+ 17 21  2  0

+ 17 22  1  0

+ 18 23  2  0

+ 18 24  1  0

+  9 12  1  0

+ 11 15  1  0

+  4 25  1  0

+  5 26  1  0

+  6 27  1  0

+  7 28  1  0

+  9 29  1  0

+ 11 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1085-98-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -0.4400   -0.1042   -0.3465 N   0  0  0

+   -0.9910    1.1741   -0.2318 C   0  0  0

+   -1.1781   -1.3927    0.3865 S   0  0  0

+    0.9475   -0.3324   -1.2211 S   0  0  0

+   -0.8219    2.0992   -1.2540 C   0  0  0

+   -1.7142    1.5214    0.9024 C   0  0  0

+   -2.5216   -1.7674   -0.5063 N   0  0  0

+   -0.2893   -2.4897    0.2255 O   0  0  0

+   -1.6643   -0.9036    1.6289 O   0  0  0

+    2.1746   -0.2721    0.1135 C   0  0  0

+   -1.3685    3.3623   -1.1376 C   0  0  0

+   -2.2579    2.7859    1.0123 C   0  0  0

+   -2.5698   -1.4343   -1.9322 C   0  0  0

+   -3.6618   -2.4319    0.1296 C   0  0  0

+    2.1348   -1.4682    0.8381 F   0  0  0

+    3.8192   -0.0511   -0.5917 Cl  0  0  0

+    1.8011    1.1084    1.2115 Cl  0  0  0

+   -2.0832    3.7063   -0.0051 C   0  0  0

+    0.1826    2.2140    0.0000 H   0  0  0

+   -2.4438    0.8215    0.0000 H   0  0  0

+   -0.6394    4.0627    0.0000 H   0  0  0

+   -3.2629    2.6757    0.0000 H   0  0  0

+   -1.5692   -1.2895    0.0000 H   0  0  0

+   -2.7146   -0.4337    0.0000 H   0  0  0

+   -3.5704   -1.5791    0.0000 H   0  0  0

+   -4.1709   -1.5584    0.0000 H   0  0  0

+   -4.5353   -2.9410    0.0000 H   0  0  0

+   -3.1527   -3.3054    0.0000 H   0  0  0

+   -2.5386    4.6089    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  3  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  7 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 11 18  2  0

+ 12 18  1  0

+  5 19  1  0

+  6 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+924-16-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+   -0.0696   -0.5874    0.1307 N   0  0  0

+   -1.1627    0.1614    0.7558 C   0  0  0

+    0.9466    0.1181   -0.6541 C   0  0  0

+    0.0010   -1.8673    0.2756 N   0  0  0

+   -2.3415    0.2493   -0.2156 C   0  0  0

+    2.0986    0.5364    0.2618 C   0  0  0

+    0.9098   -2.4898   -0.2441 O   0  0  0

+   -3.4831    1.0313    0.4372 C   0  0  0

+    3.1599    1.2732   -0.5577 C   0  0  0

+   -4.6618    1.1193   -0.5342 C   0  0  0

+    4.3120    1.6914    0.3582 C   0  0  0

+   -0.4121    0.6995    0.0000 H   0  0  0

+   -1.4124    1.0505    0.0000 H   0  0  0

+    1.0288    1.0380    0.0000 H   0  0  0

+    0.1482    0.5822    0.0000 H   0  0  0

+   -3.0921   -0.2888    0.0000 H   0  0  0

+   -2.0918   -0.6398    0.0000 H   0  0  0

+    2.0164   -0.3835    0.0000 H   0  0  0

+    2.8970    0.0723    0.0000 H   0  0  0

+   -2.7325    1.5694    0.0000 H   0  0  0

+   -3.7327    1.9204    0.0000 H   0  0  0

+    3.2422    2.1931    0.0000 H   0  0  0

+    2.3615    1.7373    0.0000 H   0  0  0

+   -4.5930    2.0403    0.0000 H   0  0  0

+   -5.5828    1.1881    0.0000 H   0  0  0

+   -4.7306    0.1983    0.0000 H   0  0  0

+    4.6271    0.8233    0.0000 H   0  0  0

+    5.1801    2.0065    0.0000 H   0  0  0

+    3.9969    2.5595    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  1  0

+  8 10  1  0

+  9 11  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  3 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14308-65-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.1914    0.0759   -0.0035 C   0  0  0

+   -1.3331   -0.6434   -0.0028 O   0  0  0

+   -0.5350    1.4120   -0.0011 C   0  0  0

+    1.1244   -0.4472   -0.0011 C   0  0  0

+   -2.3842    0.1881    0.0001 C   0  0  0

+   -1.9372    1.4635    0.0012 C   0  0  0

+    2.1885    0.3937   -0.0022 C   0  0  0

+   -3.8060   -0.2242    0.0010 N   0  3  0

+    3.5039   -0.1293    0.0003 C   0  0  0

+   -4.6847    0.6192    0.0037 O   0  0  0

+   -4.0972   -1.4069   -0.0009 O   0  5  0

+    4.5613    0.7063   -0.0009 N   0  0  0

+    3.6801   -1.3343    0.0034 O   0  0  0

+    5.9227    0.1651    0.0017 C   0  0  0

+    0.1018    2.2029    0.0000 H   0  0  0

+    1.2713   -1.4519    0.0000 H   0  0  0

+   -2.5093    2.3024    0.0000 H   0  0  0

+    2.0416    1.3984    0.0000 H   0  0  0

+    4.4144    1.7110    0.0000 H   0  0  0

+    5.5476   -0.7785    0.0000 H   0  0  0

+    6.8663   -0.2100    0.0000 H   0  0  0

+    6.2978    1.1087    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  2  0

+  8 11  1  0

+  9 12  1  0

+  9 13  2  0

+ 12 14  1  0

+  5  6  2  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+ 12 19  1  0

+ 14 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111-42-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.0000    0.0424    0.0000 N   0  0  0

+   -1.1403    0.9193   -0.2978 C   0  0  0

+    1.1403    0.9193    0.2978 C   0  0  0

+   -2.3693    0.0664   -0.6187 C   0  0  0

+    2.3693    0.0664    0.6187 C   0  0  0

+   -2.6834   -0.7584    0.5052 O   0  0  0

+    2.6834   -0.7584   -0.5052 O   0  0  0

+    0.0000   -1.0365    0.0000 H   0  0  0

+   -0.3983    1.7025    0.0000 H   0  0  0

+   -1.8432    1.7378    0.0000 H   0  0  0

+    1.8432    1.7378    0.0000 H   0  0  0

+    0.3983    1.7025    0.0000 H   0  0  0

+   -2.6707    1.1023    0.0000 H   0  0  0

+   -3.4473    0.1099    0.0000 H   0  0  0

+    3.4473    0.1099    0.0000 H   0  0  0

+    2.6707    1.1023    0.0000 H   0  0  0

+   -3.0674   -1.7666    0.0000 H   0  0  0

+    3.0674   -1.7666    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51264-14-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 50                          1 V2000

+   -2.1813   -0.1723    0.5771 C   0  0  0

+   -2.9065   -1.0359   -0.2687 C   0  0  0

+   -2.5427    1.1899    0.5899 C   0  0  0

+   -1.1577   -0.6447    1.3686 N   0  0  0

+   -3.9582   -0.5115   -1.0648 C   0  0  0

+   -2.6019   -2.4060   -0.3339 C   0  0  0

+   -3.6074    1.6369   -0.2363 C   0  0  0

+   -1.8642    2.1092    1.4076 C   0  0  0

+    0.1539   -0.6721    0.8757 C   0  0  0

+   -4.2648    0.7842   -1.0206 N   0  0  0

+   -4.6754   -1.3863   -1.9063 C   0  0  0

+   -3.3178   -3.2171   -1.1594 C   0  0  0

+   -3.9586    3.0022   -0.2138 C   0  0  0

+   -2.2337    3.4189    1.3999 C   0  0  0

+    1.1900   -1.1501    1.6762 C   0  0  0

+    0.4210   -0.2288   -0.4113 C   0  0  0

+   -4.3526   -2.7062   -1.9427 C   0  0  0

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+    2.4846   -1.1761    1.1870 C   0  0  0

+    0.9292   -1.5907    2.9359 O   0  0  0

+    1.7140   -0.2555   -0.8980 C   0  0  0

+    2.7486   -0.7259   -0.1002 C   0  0  0

+    2.1764   -2.0101    3.4932 C   0  0  0

+    4.0568   -0.7519   -0.5953 N   0  0  0

+    4.7970    0.6570   -1.0530 S   0  0  0

+    5.0203    1.5359    0.5182 C   0  0  0

+    6.0364    0.2047   -1.5806 O   0  0  0

+    3.8125    1.2803   -1.8663 O   0  0  0

+   -1.3523   -1.4886    0.0000 H   0  0  0

+   -1.7632   -2.6221    0.0000 H   0  0  0

+   -1.0122    1.9538    0.0000 H   0  0  0

+   -5.5199   -1.1944    0.0000 H   0  0  0

+   -3.1504   -4.0668    0.0000 H   0  0  0

+   -4.8059    3.1813    0.0000 H   0  0  0

+   -1.5840    3.9916    0.0000 H   0  0  0

+    0.0028    0.5296    0.0000 H   0  0  0

+   -5.0282   -3.2481    0.0000 H   0  0  0

+   -3.4945    4.7011    0.0000 H   0  0  0

+    2.9075   -1.9319    0.0000 H   0  0  0

+    1.9061    0.5890    0.0000 H   0  0  0

+    1.9004   -2.8310    0.0000 H   0  0  0

+    2.9973   -2.2861    0.0000 H   0  0  0

+    2.4524   -1.1892    0.0000 H   0  0  0

+    4.4973   -1.4976    0.0000 H   0  0  0

+    5.8597    1.3226    0.0000 H   0  0  0

+    5.2336    2.3753    0.0000 H   0  0  0

+    4.1809    1.7492    0.0000 H   0  0  0

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+  7 10  2  0

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+ 21 22  2  0

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+ 23 43  1  0

+ 24 44  1  0

+ 26 45  1  0

+ 26 46  1  0

+ 26 47  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+111380-08-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    0.3324   -0.6257    0.0848 C   0  0  0

+   -1.1147   -0.3359    0.0710 C   0  0  0

+    1.3843    0.3259    0.1187 C   0  0  0

+    0.9013   -1.8331    0.0737 N   0  0  0

+   -1.9753   -1.0936   -0.7292 C   0  0  0

+   -1.6324    0.6937    0.8621 C   0  0  0

+    2.5572   -0.4181    0.1200 N   0  0  0

+    1.2723    1.6375    0.1430 N   0  0  0

+    2.2061   -1.7155    0.0924 C   0  0  0

+   -3.3259   -0.8170   -0.7370 C   0  0  0

+   -2.9857    0.9586    0.8439 C   0  0  0

+    3.9225    0.1122    0.1497 C   0  0  0

+    1.1265    2.2556   -0.8963 O   0  0  0

+   -3.8306    0.2081    0.0449 C   0  0  0

+   -1.7180   -2.0610    0.0000 H   0  0  0

+   -1.0273    1.4912    0.0000 H   0  0  0

+    2.8496   -2.4823    0.0000 H   0  0  0

+   -3.9378   -1.6093    0.0000 H   0  0  0

+   -3.2493    1.9243    0.0000 H   0  0  0

+    4.2849   -0.8209    0.0000 H   0  0  0

+    4.8556    0.4746    0.0000 H   0  0  0

+    3.5601    1.0453    0.0000 H   0  0  0

+   -4.8130    0.4006    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

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+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2815-45-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    2.3032    0.0000   -0.0638 C   0  0  0

+    3.0313   -1.2521    0.4290 C   0  0  0

+    3.0347    1.2463    0.4386 C   0  0  0

+    2.2771    0.0059   -1.5936 C   0  0  0

+    0.8696   -0.0001    0.4707 C   0  0  0

+    0.1418    1.2516   -0.0219 C   0  0  0

+    0.1418   -1.2516   -0.0223 C   0  0  0

+   -1.2666    1.2923    0.5795 C   0  0  0

+   -1.2666   -1.2925    0.5791 C   0  0  0

+   -1.9996    0.0000    0.2125 C   0  0  0

+   -3.5255    0.0000    0.2742 C   0  0  0

+   -2.8082    0.0002   -0.9623 O   0  0  0

+    2.0944   -1.7969    0.0000 H   0  0  0

+    3.5761   -2.1890    0.0000 H   0  0  0

+    3.9682   -0.7073    0.0000 H   0  0  0

+    3.9694    0.6977    0.0000 H   0  0  0

+    3.5833    2.1810    0.0000 H   0  0  0

+    2.1000    1.7949    0.0000 H   0  0  0

+    2.5161    1.0631    0.0000 H   0  0  0

+    1.2199    0.2449    0.0000 H   0  0  0

+    2.0381   -1.0513    0.0000 H   0  0  0

+    1.4101   -0.9396    0.0000 H   0  0  0

+    1.1631    1.6146    0.0000 H   0  0  0

+   -0.0269    2.3222    0.0000 H   0  0  0

+   -0.0268   -2.3222    0.0000 H   0  0  0

+    1.1631   -1.6146    0.0000 H   0  0  0

+   -1.0606    2.3564    0.0000 H   0  0  0

+   -2.2834    1.6676    0.0000 H   0  0  0

+   -2.2834   -1.6678    0.0000 H   0  0  0

+   -1.0605   -2.3566    0.0000 H   0  0  0

+   -4.0676    0.9385    0.0000 H   0  0  0

+   -4.0673   -0.9387    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  1  1  0

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+  8 27  1  0

+  8 28  1  0

+  9 29  1  0

+  9 30  1  0

+ 11 31  1  0

+ 11 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+138835-36-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+    0.5438    0.0615   -0.0020 C   0  0  0

+   -0.7640    0.5717    0.0155 C   0  0  0

+    1.6414    0.9442    0.0152 C   0  0  0

+    0.7714   -1.3831   -0.0320 C   0  0  0

+   -1.8666   -0.3111   -0.0013 C   0  0  0

+   -0.9617    1.9715    0.0504 C   0  0  0

+    2.9744    0.3447   -0.0040 C   0  0  0

+    1.4223    2.3301    0.0498 C   0  0  0

+    2.0061   -1.8569   -0.0475 N   0  0  0

+   -0.3925   -2.2692   -0.0436 C   0  0  0

+   -3.1564    0.2246    0.0167 C   0  0  0

+   -1.6422   -1.7533   -0.0364 C   0  0  0

+    0.1593    2.8314    0.0665 C   0  0  0

+   -2.2710    2.4671    0.0676 C   0  0  0

+    3.0867   -1.0691   -0.0384 C   0  0  0

+    4.1273    1.1354    0.0103 C   0  0  0

+   -3.3400    1.5951    0.0504 C   0  0  0

+   -4.3304   -0.6771   -0.0007 N   0  3  0

+    4.3735   -1.6426   -0.0568 C   0  0  0

+    5.3557    0.5431   -0.0088 C   0  0  0

+   -5.2548   -0.4585   -0.7631 O   0  0  0

+   -4.3718   -1.6375    0.7472 O   0  5  0

+    5.4746   -0.8437   -0.0416 C   0  0  0

+    2.2421    2.9861    0.0000 H   0  0  0

+   -0.2568   -3.3104    0.0000 H   0  0  0

+   -2.4673   -2.4027    0.0000 H   0  0  0

+    0.0146    3.8714    0.0000 H   0  0  0

+   -2.4395    3.5035    0.0000 H   0  0  0

+    4.0476    2.1823    0.0000 H   0  0  0

+   -4.3164    1.9813    0.0000 H   0  0  0

+    4.4827   -2.6869    0.0000 H   0  0  0

+    6.2202    1.1390    0.0000 H   0  0  0

+    6.4295   -1.2803    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 23 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+76-38-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.7891   -0.2468    0.0457 C   0  0  0

+   -0.6053    0.0665    0.5918 C   0  0  0

+    1.7166    0.7327    0.5175 O   0  0  0

+    1.1872   -1.5147    0.4830 F   0  0  0

+    0.7582   -0.2243   -1.3528 F   0  0  0

+   -1.1183    1.7005    0.0281 Cl  0  0  0

+   -1.7755   -1.1693   -0.0034 Cl  0  0  0

+    2.9932    0.3871   -0.0237 C   0  0  0

+   -0.3104   -0.9013    0.0000 H   0  0  0

+    2.7288   -0.5895    0.0000 H   0  0  0

+    3.9698    0.1227    0.0000 H   0  0  0

+    3.2576    1.3637    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  2  9  1  0

+  8 10  1  0

+  8 11  1  0

+  8 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+39653-72-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 23                          1 V2000

+    0.5971   -0.0077   -0.0017 C   0  0  0

+   -0.7226   -0.6368   -0.0013 C   0  0  0

+    0.4083    1.4420    0.0001 C   0  0  0

+    1.7298   -0.6239    0.0015 C   0  0  0

+   -1.6784    0.4772    0.0003 C   0  0  0

+   -0.7469   -1.9512   -0.0021 C   0  0  0

+   -1.0462    1.6393    0.0012 C   0  0  0

+    1.4987    2.1765    0.0000 C   0  0  0

+    1.7030   -2.0950    0.0060 C   0  0  0

+    2.9503    0.1977    0.0000 C   0  0  0

+   -3.1024    0.3265    0.0006 C   0  0  0

+    0.5261   -2.7010   -0.0033 C   0  0  0

+    2.8198    1.5150   -0.0021 C   0  0  0

+   -4.2321    0.2070    0.0007 N   0  0  0

+   -1.6940   -2.4810    0.0000 H   0  0  0

+   -1.5366    2.6074    0.0000 H   0  0  0

+    1.4290    3.2595    0.0000 H   0  0  0

+    2.6243   -2.6685    0.0000 H   0  0  0

+    3.9322   -0.2643    0.0000 H   0  0  0

+    0.4953   -3.7858    0.0000 H   0  0  0

+    3.7138    2.1301    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  5  7  2  0

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+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+773-76-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.3383    1.1836   -0.0022 C   0  0  0

+   -1.1722    0.0381   -0.0018 C   0  0  0

+    1.0614    1.0125   -0.0014 C   0  0  0

+   -0.8832    2.4035    0.0021 N   0  0  0

+   -0.5958   -1.2436   -0.0001 C   0  0  0

+   -2.5686    0.2118   -0.0027 C   0  0  0

+    1.5900   -0.2583   -0.0002 C   0  0  0

+    1.8829    2.0952   -0.0013 O   0  0  0

+   -2.1838    2.5692    0.0068 C   0  0  0

+    0.7599   -1.3776    0.0011 C   0  0  0

+   -1.6093   -2.6531    0.0009 Cl  0  0  0

+   -3.0600    1.4865   -0.0038 C   0  0  0

+    3.3131   -0.4695    0.0003 Cl  0  0  0

+   -3.2120   -0.6115    0.0000 H   0  0  0

+    2.5145    2.9276    0.0000 H   0  0  0

+   -2.5732    3.5388    0.0000 H   0  0  0

+    1.1832   -2.3329    0.0000 H   0  0  0

+   -4.0922    1.6491    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

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+  7 10  1  0

+  9 12  2  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-62-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.6930   -0.2824   -0.1926 C   0  0  0

+   -0.5166    0.6479   -0.0821 C   0  0  0

+    1.9629    0.4860    0.1785 C   0  0  0

+   -1.7675   -0.1089   -0.4476 C   0  0  0

+    3.1726   -0.4443    0.0680 C   0  0  0

+   -2.6605   -0.2239    0.3572 O   0  0  0

+   -0.0893   -1.0744    0.0000 H   0  0  0

+    1.3824   -1.1565    0.0000 H   0  0  0

+    0.2658    1.4398    0.0000 H   0  0  0

+   -1.2060    1.5220    0.0000 H   0  0  0

+    2.7452    1.2780    0.0000 H   0  0  0

+    1.2735    1.3600    0.0000 H   0  0  0

+   -1.4004   -1.1598    0.0000 H   0  0  0

+    2.4940   -1.3267    0.0000 H   0  0  0

+    4.0550   -1.1229    0.0000 H   0  0  0

+    3.8512    0.4381    0.0000 H   0  0  0

+  1  2  1  0

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+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23043-62-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.8913    0.3828    0.0039 C   0  0  0

+   -0.7463   -1.0285    0.0025 C   0  0  0

+    0.2515    1.2086    0.0031 C   0  0  0

+   -2.1782    0.9503    0.0003 C   0  0  0

+    0.4584   -1.6007    0.0003 N   0  0  0

+   -1.9057   -1.8335    0.0028 C   0  0  0

+    1.5108    0.5825    0.0008 C   0  0  0

+    0.1382    2.5838    0.0040 N   0  0  0

+   -3.2763    0.1381   -0.0046 C   0  0  0

+    1.5762   -0.8807   -0.0001 C   0  0  0

+   -3.1340   -1.2555    0.0045 C   0  0  0

+    2.7052    1.3221   -0.0005 C   0  0  0

+   -4.5553    0.7033   -0.0078 N   0  0  0

+    2.8445   -1.4955   -0.0025 C   0  0  0

+    3.8975    0.6669   -0.0031 C   0  0  0

+    3.9640   -0.7249   -0.0030 C   0  0  0

+   -2.2942    1.9936    0.0000 H   0  0  0

+   -1.8181   -2.8795    0.0000 H   0  0  0

+    1.0011    3.1815    0.0000 H   0  0  0

+   -0.8109    3.0322    0.0000 H   0  0  0

+   -3.9905   -1.8623    0.0000 H   0  0  0

+    2.6779    2.3714    0.0000 H   0  0  0

+   -4.6679    1.7469    0.0000 H   0  0  0

+   -5.4028    0.0840    0.0000 H   0  0  0

+    2.9239   -2.5422    0.0000 H   0  0  0

+    4.7879    1.2227    0.0000 H   0  0  0

+    4.9045   -1.1910    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+ 12 15  2  0

+ 14 16  2  0

+  7 10  1  0

+  9 11  1  0

+ 15 16  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-65-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.3983   -0.2946    0.0023 C   0  0  0

+    0.5618   -1.2983    0.0012 C   0  0  0

+   -0.0055    1.0380    0.0015 C   0  0  0

+   -1.7555   -0.6243   -0.0017 N   0  0  0

+    1.9031   -0.9688   -0.0007 C   0  0  0

+    1.3372    1.3604   -0.0003 C   0  0  0

+   -2.7330    0.4002   -0.0005 O   0  0  0

+    2.2906    0.3584   -0.0014 C   0  0  0

+    0.2712   -2.2964    0.0000 H   0  0  0

+   -0.7216    1.7916    0.0000 H   0  0  0

+   -2.0480   -1.6218    0.0000 H   0  0  0

+    2.6221   -1.7196    0.0000 H   0  0  0

+    1.6318    2.3573    0.0000 H   0  0  0

+   -3.4506    1.1523    0.0000 H   0  0  0

+    3.3008    0.6037    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  6  8  1  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+612-57-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -3.2480    0.3517   -0.0008 Cl  0  0  0

+   -1.5611   -0.0580   -0.0011 C   0  0  0

+   -0.6279    0.9347    0.0007 C   0  0  0

+   -1.1784   -1.3992    0.0027 C   0  0  0

+    0.7367    0.6040    0.0004 C   0  0  0

+    0.1350   -1.7542    0.0026 C   0  0  0

+    1.1273   -0.7580   -0.0016 C   0  0  0

+    1.7321    1.5995    0.0017 C   0  0  0

+    2.4254   -1.0777   -0.0023 N   0  0  0

+    3.0392    1.2037    0.0009 C   0  0  0

+    3.3549   -0.1533   -0.0011 C   0  0  0

+   -0.9261    1.9368    0.0000 H   0  0  0

+   -1.9125   -2.1436    0.0000 H   0  0  0

+    0.4055   -2.7641    0.0000 H   0  0  0

+    1.4778    2.6136    0.0000 H   0  0  0

+    3.8023    1.9184    0.0000 H   0  0  0

+    4.3597   -0.4420    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  4  2  0

+  7  5  2  0

+  8  5  1  0

+  9  7  1  0

+ 10  8  2  0

+ 11  9  2  0

+  6  7  1  0

+ 10 11  1  0

+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  8 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+191-30-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 43                          1 V2000

+    0.2341    0.9107    0.0021 C   0  0  0

+   -0.6608   -0.1674    0.0010 C   0  0  0

+    1.6328    0.6982    0.0012 C   0  0  0

+   -0.2830    2.2814   -0.0020 C   0  0  0

+   -0.1467   -1.5428    0.0003 C   0  0  0

+   -2.0528    0.0825    0.0011 C   0  0  0

+    2.1597   -0.6097   -0.0007 C   0  0  0

+    2.5124    1.8043    0.0018 C   0  0  0

+   -1.6531    2.4998   -0.0070 C   0  0  0

+    0.6581    3.4003   -0.0011 C   0  0  0

+    1.2458   -1.7628    0.0004 C   0  0  0

+   -1.0180   -2.6351   -0.0001 C   0  0  0

+   -2.5400    1.4138    0.0025 C   0  0  0

+   -2.9661   -0.9843   -0.0008 C   0  0  0

+    3.5404   -0.7962   -0.0022 C   0  0  0

+    1.9866    3.1669    0.0036 C   0  0  0

+    3.8931    1.5804    0.0003 C   0  0  0

+    1.7379   -3.0685    0.0004 C   0  0  0

+   -0.5104   -3.9143   -0.0003 C   0  0  0

+   -3.9323    1.6350    0.0020 C   0  0  0

+   -4.3037   -0.7318   -0.0012 C   0  0  0

+    4.3902    0.2937   -0.0018 C   0  0  0

+    0.8612   -4.1302    0.0002 C   0  0  0

+   -4.7854    0.5761    0.0002 C   0  0  0

+   -2.0272    3.4818    0.0000 H   0  0  0

+    0.2990    4.3879    0.0000 H   0  0  0

+   -2.0574   -2.4804    0.0000 H   0  0  0

+   -2.6175   -1.9757    0.0000 H   0  0  0

+    3.9371   -1.7693    0.0000 H   0  0  0

+    2.6541    3.9785    0.0000 H   0  0  0

+    4.5550    2.3966    0.0000 H   0  0  0

+    2.7745   -3.2410    0.0000 H   0  0  0

+   -1.1667   -4.7350    0.0000 H   0  0  0

+   -4.3099    2.6157    0.0000 H   0  0  0

+   -4.9825   -1.5340    0.0000 H   0  0  0

+    5.4297    0.1400    0.0000 H   0  0  0

+    1.2336   -5.1129    0.0000 H   0  0  0

+   -5.8224    0.7463    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 18 23  2  0

+ 20 24  2  0

+  7 11  1  0

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+ 10 16  2  0

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+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+14901-07-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    0.6175    0.1251    0.1808 C   0  0  0

+    1.4173   -1.1288   -0.0219 C   0  0  0

+    1.1197    1.3422    0.0648 C   0  0  0

+   -0.7976   -0.0071    0.5199 C   0  0  0

+    2.7116   -0.8120   -0.7738 C   0  0  0

+    1.7577   -1.7390    1.3392 C   0  0  0

+    0.5924   -2.1310   -0.8319 C   0  0  0

+    2.5504    1.6225   -0.2930 C   0  0  0

+    0.2041    2.5149    0.3046 C   0  0  0

+   -1.7407    0.0979   -0.4506 C   0  0  0

+    3.4015    0.3689   -0.0803 C   0  0  0

+   -3.1043   -0.0296   -0.1239 C   0  0  0

+   -4.1514    0.0870   -1.2014 C   0  0  0

+   -3.4367   -0.2335    1.0265 O   0  0  0

+   -0.8066   -1.0196    0.0000 H   0  0  0

+    2.6952   -1.8244    0.0000 H   0  0  0

+    3.6868   -1.0845    0.0000 H   0  0  0

+    0.8734   -2.2323    0.0000 H   0  0  0

+    2.2510   -2.6233    0.0000 H   0  0  0

+    2.6420   -1.2457    0.0000 H   0  0  0

+   -0.1894   -1.4875    0.0000 H   0  0  0

+   -0.0511   -2.9128    0.0000 H   0  0  0

+    1.3742   -2.7745    0.0000 H   0  0  0

+    3.4568    2.0739    0.0000 H   0  0  0

+    2.2244    2.5811    0.0000 H   0  0  0

+    1.0022    3.1380    0.0000 H   0  0  0

+   -0.4190    3.3130    0.0000 H   0  0  0

+   -0.5940    1.8918    0.0000 H   0  0  0

+   -1.7318    1.1104    0.0000 H   0  0  0

+    4.1906   -0.2656    0.0000 H   0  0  0

+    4.1458    1.0554    0.0000 H   0  0  0

+   -4.0393    1.0933    0.0000 H   0  0  0

+   -5.1577    0.1991    0.0000 H   0  0  0

+   -4.2635   -0.9193    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

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+ 10 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 13 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97461-38-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+   -1.2385    0.0627    0.0610 C   0  0  0

+   -2.3839   -0.6448   -0.0322 O   0  0  0

+   -1.5741    1.3985    0.1476 C   0  0  0

+    0.0724   -0.4705    0.0739 C   0  0  0

+   -3.4291    0.1935   -0.0077 C   0  0  0

+   -2.9747    1.4619    0.1022 C   0  0  0

+    1.1419    0.3598    0.1727 C   0  0  0

+   -4.8525   -0.2054   -0.0876 N   0  3  0

+    2.4506   -0.1725    0.1856 C   0  0  0

+   -5.7255    0.6434   -0.0563 O   0  0  0

+   -5.1507   -1.3823   -0.1848 O   0  5  0

+    3.5142    0.6531    0.2839 O   0  0  0

+    2.6192   -1.3754    0.1079 O   0  0  0

+    4.6772   -0.1757    0.3347 C   0  0  0

+    5.6761    0.2815   -0.7302 C   0  0  0

+    5.3211   -0.0666    1.7183 C   0  0  0

+    5.0322    0.1726   -2.1138 C   0  0  0

+   -0.9353    2.1806    0.0000 H   0  0  0

+    0.2102   -1.4709    0.0000 H   0  0  0

+   -3.5372    2.3006    0.0000 H   0  0  0

+    1.0041    1.3602    0.0000 H   0  0  0

+    4.4513   -1.1599    0.0000 H   0  0  0

+    6.4451   -0.3730    0.0000 H   0  0  0

+    5.9443    1.2550    0.0000 H   0  0  0

+    5.4898   -1.0622    0.0000 H   0  0  0

+    6.3167    0.1021    0.0000 H   0  0  0

+    5.1524    0.9290    0.0000 H   0  0  0

+    4.8638    1.1683    0.0000 H   0  0  0

+    4.0365    0.0042    0.0000 H   0  0  0

+    5.2006   -0.8231    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1300-72-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+   -0.1808   -1.6416   -0.0897 S   0  0  0

+   -1.4006   -0.3820    0.0837 C   0  0  0

+    0.7295   -1.4479    0.9841 O   0  0  0

+   -0.8978   -2.8395   -0.3543 O   0  0  0

+    0.6058   -1.3417   -1.3578 O   0  0  0

+   -1.2239    0.8412   -0.5352 C   0  0  0

+   -2.5373   -0.6191    0.8342 C   0  0  0

+   -2.1810    1.8295   -0.3990 C   0  0  0

+   -3.4942    0.3689    0.9702 C   0  0  0

+   -3.3146    1.5944    0.3559 C   0  0  0

+   -1.9885    3.1630   -1.0742 C   0  0  0

+   -4.3582    2.6716    0.5038 C   0  0  0

+   10.6560    1.2610    0.2455 Na  0  3  0

+   -0.3013    1.1397    0.0000 H   0  0  0

+   -2.8219   -1.5461    0.0000 H   0  0  0

+   -4.4171    0.0713    0.0000 H   0  0  0

+   -1.0287    3.0245    0.0000 H   0  0  0

+   -1.8500    4.1228    0.0000 H   0  0  0

+   -2.9483    3.3015    0.0000 H   0  0  0

+   -3.6617    3.3463    0.0000 H   0  0  0

+   -5.0329    3.3681    0.0000 H   0  0  0

+   -5.0547    1.9969    0.0000 H   0  0  0

+    1.5119   -0.9962    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  2  0

+  1  5  1  0

+  2  6  2  0

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+  6 14  1  0

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+  9 16  1  0

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+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+  5 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59652-29-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 44                          1 V2000

+   -0.5401   -1.9953   -0.0449 C   0  0  0

+   -1.2438   -2.4107    1.0979 C   0  0  0

+    0.7202   -2.5242   -0.2950 C   0  0  0

+   -1.3144   -1.0986   -0.6881 O   0  0  0

+   -2.5135   -1.6750    1.0653 C   0  0  0

+   -0.6793   -3.3429    1.9672 C   0  0  0

+    1.2623   -3.4450    0.5759 C   0  0  0

+    1.4925   -2.0921   -1.5148 C   0  0  0

+   -2.4731   -0.9086   -0.0331 C   0  0  0

+    0.5623   -3.8512    1.7028 C   0  0  0

+    1.1541   -3.0161   -2.6864 C   0  0  0

+   -3.5698    0.0263   -0.4736 C   0  0  0

+   -3.3366    1.4096    0.1372 C   0  0  0

+   -3.5651    0.1281   -1.8990 O   0  0  0

+   -4.4057    2.3210   -0.2921 N   0  0  0

+   -4.1234    3.6236    0.3257 C   0  0  0

+   -2.7575    4.1264   -0.1459 C   0  0  0

+   -5.2046    4.6264   -0.0820 C   0  0  0

+   -4.1142    3.4745    1.8484 C   0  0  0

+   12.5367    2.2223    0.1161 Cl  0  0  0

+   -3.2913   -2.0964    0.0000 H   0  0  0

+   -1.2542   -4.0152    0.0000 H   0  0  0

+    2.1180   -3.6694    0.0000 H   0  0  0

+    2.3753   -2.1487    0.0000 H   0  0  0

+    1.2968   -1.2294    0.0000 H   0  0  0

+    0.6229   -4.7337    0.0000 H   0  0  0

+    0.3235   -2.7119    0.0000 H   0  0  0

+    0.8499   -3.8467    0.0000 H   0  0  0

+    1.9847   -3.3203    0.0000 H   0  0  0

+   -4.3813   -0.3258    0.0000 H   0  0  0

+   -2.5046    1.1091    0.0000 H   0  0  0

+   -2.8922    2.1745    0.0000 H   0  0  0

+   -3.5243    1.0118    0.0000 H   0  0  0

+   -5.2438    2.0379    0.0000 H   0  0  0

+   -2.4519    3.2963    0.0000 H   0  0  0

+   -1.9274    4.4320    0.0000 H   0  0  0

+   -3.0631    4.9565    0.0000 H   0  0  0

+   -4.6031    5.2750    0.0000 H   0  0  0

+   -5.8532    5.2279    0.0000 H   0  0  0

+   -5.8061    3.9778    0.0000 H   0  0  0

+   -4.9971    3.4200    0.0000 H   0  0  0

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+   -3.2313    3.5290    0.0000 H   0  0  0

+   13.4213    2.2223    0.0000 H   0  0  0

+  1  2  2  0

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+  5  9  2  0

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+ 17 35  1  0

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+ 18 39  1  0

+ 18 40  1  0

+ 19 41  1  0

+ 19 42  1  0

+ 19 43  1  0

+ 20 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7149-26-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 43                          1 V2000

+   -0.8949   -1.6530    0.7254 C   0  0  0

+    0.0789   -0.5869    0.8784 O   0  0  0

+   -2.0465   -1.1690   -0.1580 C   0  0  0

+   -0.2363   -2.8465    0.0829 C   0  0  0

+   -1.4381   -2.0487    2.0999 C   0  0  0

+    0.7880   -0.1640   -0.1867 C   0  0  0

+   -2.2611    0.3301    0.0600 C   0  0  0

+   -0.9666   -3.8466   -0.3443 C   0  0  0

+    2.0762    0.5221    0.0115 C   0  0  0

+    0.3646   -0.3487   -1.3107 O   0  0  0

+   -3.3954    0.8069   -0.8102 C   0  0  0

+    3.2508   -0.0045   -0.5492 C   0  0  0

+    2.1363    1.7049    0.7543 C   0  0  0

+   -4.2296    1.7118   -0.3614 C   0  0  0

+    4.4597    0.6526   -0.3546 C   0  0  0

+    3.2048   -1.1755   -1.2935 N   0  0  0

+    3.3441    2.3414    0.9359 C   0  0  0

+   -5.6997    1.3966   -0.2591 C   0  0  0

+   -3.7191    3.0679    0.0526 C   0  0  0

+    4.5029    1.8157    0.3858 C   0  0  0

+   -2.9914   -1.1332    0.0000 H   0  0  0

+   -2.2509   -2.0923    0.0000 H   0  0  0

+    0.7074   -2.9063    0.0000 H   0  0  0

+   -1.9949   -1.2844    0.0000 H   0  0  0

+   -2.2024   -2.6055    0.0000 H   0  0  0

+   -0.8813   -2.8130    0.0000 H   0  0  0

+   -1.3162    0.2943    0.0000 H   0  0  0

+   -2.0567    1.2534    0.0000 H   0  0  0

+   -1.9068   -3.7455    0.0000 H   0  0  0

+   -0.5841   -4.7114    0.0000 H   0  0  0

+   -3.9386    0.0329    0.0000 H   0  0  0

+    1.3393    2.2138    0.0000 H   0  0  0

+    5.2634    0.1543    0.0000 H   0  0  0

+    2.3679   -1.6158    0.0000 H   0  0  0

+    4.0045   -1.6801    0.0000 H   0  0  0

+    3.3162    3.2866    0.0000 H   0  0  0

+   -5.8979    2.3212    0.0000 H   0  0  0

+   -6.6243    1.1984    0.0000 H   0  0  0

+   -5.5015    0.4720    0.0000 H   0  0  0

+   -2.8341    2.7347    0.0000 H   0  0  0

+   -3.3859    3.9529    0.0000 H   0  0  0

+   -4.6041    3.4011    0.0000 H   0  0  0

+    5.3071    2.3131    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

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+  4  8  2  0

+  6  9  1  0

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+  9 12  2  0

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+ 11 14  2  0

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+ 14 18  1  0

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+  3 21  1  0

+  3 22  1  0

+  4 23  1  0

+  5 24  1  0

+  5 25  1  0

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+  7 27  1  0

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+ 18 38  1  0

+ 18 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 19 42  1  0

+ 20 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1767-28-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -0.0010   -0.3684   -0.0125 C   0  0  0

+   -1.1521    0.2458    0.0111 C   0  0  0

+    1.2545    0.4057    0.0053 C   0  0  0

+    0.0627   -1.8405   -0.0512 C   0  0  0

+   -2.4112   -0.5203   -0.0060 C   0  0  0

+   -1.2071    1.7191    0.0559 C   0  0  0

+    2.5210   -0.3467   -0.0224 C   0  0  0

+    1.2108    1.7161    0.0449 C   0  0  0

+   -1.1912   -2.6125   -0.0639 C   0  0  0

+    1.2364   -2.4273   -0.0737 C   0  0  0

+   -2.3553   -1.9911   -0.0514 C   0  0  0

+   -3.5521    0.1279    0.0192 C   0  0  0

+   -0.0934    2.4120    0.0710 C   0  0  0

+   -2.5373    2.3523    0.0817 C   0  0  0

+    2.4894   -1.6616   -0.0615 C   0  0  0

+    3.7067    0.3090   -0.0082 N   0  3  0

+   -3.6129    1.5944    0.0639 C   0  0  0

+   -4.7149   -0.5810    0.0029 O   0  0  0

+    3.9049    1.2258   -0.7852 O   0  0  0

+    4.5742   -0.0184    0.7815 O   0  5  0

+    2.0778    2.2560    0.0000 H   0  0  0

+   -1.1598   -3.6334    0.0000 H   0  0  0

+    1.2798   -3.4478    0.0000 H   0  0  0

+   -3.2211   -2.5330    0.0000 H   0  0  0

+   -0.1273    3.4328    0.0000 H   0  0  0

+   -2.6238    3.3700    0.0000 H   0  0  0

+    3.3742   -2.1719    0.0000 H   0  0  0

+   -4.5291    2.0458    0.0000 H   0  0  0

+   -5.5870   -1.1127    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  8 21  1  0

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+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91085-62-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    2.1443   -0.3387    0.0003 C   0  0  0

+    0.7502   -0.9110    0.0006 C   0  0  0

+    2.7836   -0.0756    1.1971 C   0  0  0

+    2.7860   -0.0823   -1.1972 C   0  0  0

+   -0.4586    0.4415   -0.0002 S   0  0  0

+    4.0626    0.4494    1.1968 C   0  0  0

+    4.0646    0.4426   -1.1975 C   0  0  0

+   -1.9563   -0.4866    0.0003 C   0  0  0

+    4.7019    0.7112   -0.0003 C   0  0  0

+   -3.1222    0.1389   -0.0001 C   0  0  0

+   -1.9022   -2.2218    0.0013 Cl  0  0  0

+   -3.1764    1.8740   -0.0011 Cl  0  0  0

+   -0.0960   -1.5101    0.0000 H   0  0  0

+    1.2498   -1.8194    0.0000 H   0  0  0

+    2.3895    0.8833    0.0000 H   0  0  0

+    3.1752   -1.0432    0.0000 H   0  0  0

+    3.6693    1.4087    0.0000 H   0  0  0

+    4.4628   -0.5146    0.0000 H   0  0  0

+    5.6593    1.1090    0.0000 H   0  0  0

+   -4.0035   -0.4072    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+  4  7  2  0

+  5  8  1  0

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+  7  9  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67028-20-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+   -0.4302    0.1152   -0.0021 C   0  0  0

+   -1.8330   -0.3297   -0.0017 C   0  0  0

+   -0.1579    1.5079    0.0006 C   0  0  0

+    0.5458   -0.7794    0.0003 N   0  0  0

+   -2.8653    0.6309    0.0016 C   0  0  0

+   -2.1532   -1.6891   -0.0049 C   0  0  0

+    1.1623    1.9608    0.0003 C   0  0  0

+   -1.2583    2.4691    0.0044 C   0  0  0

+    1.8255   -0.4161    0.0001 C   0  0  0

+   -2.5400    2.0544    0.0039 C   0  0  0

+   -4.2004    0.2051    0.0021 C   0  0  0

+   -3.4739   -2.0770   -0.0048 C   0  0  0

+    2.1836    1.0050   -0.0032 C   0  0  0

+    2.8620   -1.3696    0.0036 C   0  0  0

+   -4.4891   -1.1288   -0.0006 C   0  0  0

+    3.5426    1.3692   -0.0038 C   0  0  0

+    4.1562   -0.9542    0.0039 C   0  0  0

+    2.5381   -2.8414    0.0074 C   0  0  0

+    4.4942    0.3978   -0.0071 C   0  0  0

+   -1.3921   -2.4099    0.0000 H   0  0  0

+    1.3817    2.9858    0.0000 H   0  0  0

+   -1.0474    3.4959    0.0000 H   0  0  0

+   -3.3132    2.7622    0.0000 H   0  0  0

+   -4.9762    0.9101    0.0000 H   0  0  0

+   -3.7157   -3.0970    0.0000 H   0  0  0

+   -5.4896   -1.4418    0.0000 H   0  0  0

+    3.8191    2.3803    0.0000 H   0  0  0

+    4.9214   -1.6707    0.0000 H   0  0  0

+    1.5143   -2.6161    0.0000 H   0  0  0

+    2.3128   -3.8652    0.0000 H   0  0  0

+    3.5619   -3.0667    0.0000 H   0  0  0

+    5.5059    0.6724    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 16 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+134-31-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+  -11.7755    0.9134   -0.1724 C   0  0  0

+  -12.6687   -0.0340    0.3855 C   0  0  0

+  -10.5327    0.4877   -0.6694 C   0  0  0

+  -12.1545    2.2682   -0.2104 C   0  0  0

+  -12.2875   -1.3918    0.4290 C   0  0  0

+  -13.8513    0.3658    0.8603 N   0  0  0

+  -10.1977   -0.8308   -0.6106 C   0  0  0

+  -13.3762    2.6101    0.2965 C   0  0  0

+  -11.0710   -1.7678   -0.0645 C   0  0  0

+  -13.1259   -2.3198    0.9593 O   0  0  0

+  -14.2102    1.6263    0.8226 C   0  0  0

+    2.5296    0.5021   -0.9401 C   0  0  0

+    1.6364   -0.4453   -0.3823 C   0  0  0

+    3.7724    0.0764   -1.4371 C   0  0  0

+    2.1506    1.8569   -0.9781 C   0  0  0

+    2.0175   -1.8031   -0.3387 C   0  0  0

+    0.4537   -0.0455    0.0925 N   0  0  0

+    4.1074   -1.2421   -1.3784 C   0  0  0

+    0.9289    2.1988   -0.4713 C   0  0  0

+    3.2341   -2.1791   -0.8322 C   0  0  0

+    1.1792   -2.7311    0.1916 O   0  0  0

+    0.0949    1.2150    0.0549 C   0  0  0

+   14.9083    0.3685    0.4745 S   0  0  0

+   13.9486   -0.6495    1.0739 O   0  0  0

+   16.1527   -0.3864    0.0295 O   0  0  0

+   14.2881    0.8279   -0.7186 O   0  0  0

+   15.3225    1.1920    1.5559 O   0  0  0

+   -9.8181    1.1465    0.0000 H   0  0  0

+  -11.4672    2.9554    0.0000 H   0  0  0

+   -9.2562   -1.0719    0.0000 H   0  0  0

+  -13.6610    3.5394    0.0000 H   0  0  0

+  -10.8208   -2.7070    0.0000 H   0  0  0

+  -13.7775   -3.0410    0.0000 H   0  0  0

+  -15.1602    1.8317    0.0000 H   0  0  0

+    4.4870    0.7352    0.0000 H   0  0  0

+    2.8379    2.5441    0.0000 H   0  0  0

+    5.0489   -1.4832    0.0000 H   0  0  0

+    0.6441    3.1281    0.0000 H   0  0  0

+    3.4844   -3.1183    0.0000 H   0  0  0

+    0.5277   -3.4523    0.0000 H   0  0  0

+   -0.8551    1.4204    0.0000 H   0  0  0

+   13.2819   -1.3567    0.0000 H   0  0  0

+   16.9837   -0.8905    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+ 12 13  1  0

+ 12 14  1  0

+ 12 15  2  0

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+ 23 24  1  0

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+ 23 27  2  0

+  7  9  1  0

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+ 18 20  1  0

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+  3 28  1  0

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+ 14 35  1  0

+ 15 36  1  0

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+ 19 38  1  0

+ 20 39  1  0

+ 21 40  1  0

+ 22 41  1  0

+ 24 42  1  0

+ 25 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+49852-84-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.7692    0.1906    0.1132 C   0  0  0

+   -2.1588   -0.0061    0.0267 C   0  0  0

+   -0.2343    1.4808   -0.0505 C   0  0  0

+    0.1103   -0.9487    0.3791 C   0  0  0

+   -3.0029    1.0998   -0.2246 C   0  0  0

+   -2.7036   -1.2995    0.1905 C   0  0  0

+    1.2142    1.6505    0.0454 C   0  0  0

+   -1.0948    2.5665   -0.2995 C   0  0  0

+    1.4789   -0.7548    0.4639 C   0  0  0

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+   -2.4365    2.3842   -0.3842 C   0  0  0

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+   -1.8232   -2.4357    0.4507 C   0  0  0

+   -4.0869   -1.4644    0.0994 C   0  0  0

+    2.0363    0.5236    0.2983 C   0  0  0

+    1.8004    2.9126   -0.1105 C   0  0  0

+    2.3813   -1.9301    0.7383 C   0  0  0

+   -4.9040   -0.3755   -0.1473 C   0  0  0

+    3.4312    0.7034    0.3870 C   0  0  0

+    3.1535    3.0484   -0.0181 C   0  0  0

+    2.8843   -2.6790   -0.8228 Cl  0  0  0

+    3.9657    1.9446    0.2302 C   0  0  0

+   -0.7043    3.5362    0.0000 H   0  0  0

+    0.1336   -3.1164    0.0000 H   0  0  0

+   -3.0652    3.2194    0.0000 H   0  0  0

+   -5.0309    1.7140    0.0000 H   0  0  0

+   -2.2262   -3.4003    0.0000 H   0  0  0

+   -4.4980   -2.4256    0.0000 H   0  0  0

+    1.1947    3.7646    0.0000 H   0  0  0

+    3.4226   -1.8372    0.0000 H   0  0  0

+    2.8014   -0.9728    0.0000 H   0  0  0

+   -5.9409   -0.5085    0.0000 H   0  0  0

+    4.0607   -0.1312    0.0000 H   0  0  0

+    3.5781    4.0037    0.0000 H   0  0  0

+    5.0043    2.0634    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 18  1  0

+ 20 22  1  0

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+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+486-66-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -1.8043    0.5595    0.0168 C   0  0  0

+   -2.2575   -0.7528    0.2430 C   0  0  0

+   -0.3590    0.8243    0.1435 C   0  0  0

+   -2.7045    1.5693   -0.3221 C   0  0  0

+   -1.3786   -1.7197    0.5766 O   0  0  0

+   -3.6117   -1.0309    0.1210 C   0  0  0

+    0.5173   -0.3590    0.2242 C   0  0  0

+    0.0865    1.9584    0.1800 O   0  0  0

+   -4.0341    1.2788   -0.4386 C   0  0  0

+   -0.0564   -1.5739    0.4332 C   0  0  0

+   -4.4936   -0.0178   -0.2159 C   0  0  0

+    1.9877   -0.2274    0.0800 C   0  0  0

+   -5.8178   -0.2914   -0.3349 O   0  0  0

+    2.6514   -0.8971   -0.9463 C   0  0  0

+    2.7079    0.5712    0.9671 C   0  0  0

+    4.0190   -0.7723   -1.0781 C   0  0  0

+    4.0748    0.6920    0.8301 C   0  0  0

+    4.7338    0.0193   -0.1900 C   0  0  0

+    6.0810    0.1403   -0.3225 O   0  0  0

+   -2.3914    2.5342    0.0000 H   0  0  0

+   -3.9366   -1.9919    0.0000 H   0  0  0

+   -4.7051    2.0397    0.0000 H   0  0  0

+    0.5328   -2.3997    0.0000 H   0  0  0

+   -6.8113   -0.4967    0.0000 H   0  0  0

+    2.3041   -1.8503    0.0000 H   0  0  0

+    2.2552    1.4791    0.0000 H   0  0  0

+    4.4727   -1.6797    0.0000 H   0  0  0

+    4.4262    1.6436    0.0000 H   0  0  0

+    7.0914    0.2311    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+ 11 13  1  0

+ 12 14  2  0

+ 12 15  1  0

+ 14 16  1  0

+ 15 17  2  0

+ 16 18  2  0

+ 18 19  1  0

+  7 10  2  0

+  9 11  1  0

+ 17 18  1  0

+  4 20  1  0

+  6 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120-78-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+   -4.2644   -0.1064   -0.5307 C   0  0  0

+   -3.9687   -0.8650    0.6246 C   0  0  0

+   -3.3117    0.7701   -0.9158 N   0  0  0

+   -5.5185   -0.3532   -1.1358 C   0  0  0

+   -2.3556   -0.2672    1.0688 S   0  0  0

+   -4.8345   -1.7953    1.1413 C   0  0  0

+   -2.1787    0.9131   -0.2614 C   0  0  0

+   -6.3792   -1.2816   -0.6100 C   0  0  0

+   -6.0515   -2.0147    0.5210 C   0  0  0

+   -0.8302    1.9926   -0.6092 S   0  0  0

+    0.8303    1.9923    0.6100 S   0  0  0

+    2.1792    0.9138    0.2611 C   0  0  0

+    3.3123    0.7705    0.9154 N   0  0  0

+    2.3539   -0.2696   -1.0667 S   0  0  0

+    4.2658   -0.1045    0.5288 C   0  0  0

+    3.9697   -0.8631   -0.6265 C   0  0  0

+    5.5178   -0.3552    1.1367 C   0  0  0

+    4.8352   -1.7939   -1.1431 C   0  0  0

+    6.3772   -1.2855    0.6122 C   0  0  0

+    6.0542   -2.0101   -0.5257 C   0  0  0

+   -5.9812    0.4764    0.0000 H   0  0  0

+   -4.3792   -2.6290    0.0000 H   0  0  0

+   -7.3164   -1.1269    0.0000 H   0  0  0

+   -6.4952   -2.8546    0.0000 H   0  0  0

+    5.9826    0.4732    0.0000 H   0  0  0

+    4.3809   -2.6281    0.0000 H   0  0  0

+    7.3144   -1.1311    0.0000 H   0  0  0

+    6.4995   -2.8491    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  6  9  2  0

+  7 10  1  0

+ 10 11  1  0

+ 11 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

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+ 15 17  1  0

+ 16 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+  5  7  1  0

+  8  9  1  0

+ 15 16  2  0

+ 19 20  1  0

+  4 21  1  0

+  6 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 19 27  1  0

+ 20 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71382-49-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 43                          1 V2000

+    1.5935    2.2345   -0.2483 C   0  0  0

+    0.6912    1.0262   -0.1484 C   0  0  0

+    3.1116    2.0030   -0.2495 C   0  0  0

+    2.3885    2.3482    0.9817 N   0  0  0

+    1.2447   -0.2553   -0.0616 C   0  0  0

+   -0.6612    1.2063   -0.1439 C   0  0  0

+    3.6129    0.5820   -0.1525 C   0  0  0

+    2.7128   -0.4733   -0.0636 C   0  0  0

+    0.4125   -1.3654    0.0301 C   0  0  0

+   -1.5155    0.1061   -0.0522 C   0  0  0

+    4.9720    0.3384   -0.1518 C   0  0  0

+    3.1982   -1.7811    0.0258 C   0  0  0

+   -0.9756   -1.1979    0.0355 C   0  0  0

+   -2.9724    0.2663   -0.0434 C   0  0  0

+    5.4449   -0.9583   -0.0634 C   0  0  0

+    4.5567   -2.0152    0.0266 C   0  0  0

+   -1.8414   -2.3138    0.1286 C   0  0  0

+   -3.7823   -0.8878    0.0523 C   0  0  0

+   -3.5692    1.5260   -0.1267 C   0  0  0

+   -3.1812   -2.1654    0.1356 C   0  0  0

+   -5.1770   -0.7451    0.0617 C   0  0  0

+   -4.9309    1.6316   -0.1148 C   0  0  0

+   -5.7308    0.4988   -0.0213 C   0  0  0

+    1.0600    3.1332    0.0000 H   0  0  0

+    3.8888    2.7017    0.0000 H   0  0  0

+    2.5464    3.3813    0.0000 H   0  0  0

+   -1.0576    2.1733    0.0000 H   0  0  0

+    0.8230   -2.3265    0.0000 H   0  0  0

+    5.6446    1.1382    0.0000 H   0  0  0

+    2.5305   -2.5851    0.0000 H   0  0  0

+    6.4741   -1.1398    0.0000 H   0  0  0

+    4.9157   -2.9967    0.0000 H   0  0  0

+   -1.4341   -3.2762    0.0000 H   0  0  0

+   -2.9766    2.3868    0.0000 H   0  0  0

+   -3.7890   -3.0156    0.0000 H   0  0  0

+   -5.7901   -1.5914    0.0000 H   0  0  0

+   -5.3754    2.5774    0.0000 H   0  0  0

+   -6.7709    0.6010    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  5  9  1  0

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+  7 11  1  0

+  8 12  1  0

+  9 13  2  0

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+ 13 17  1  0

+ 14 18  2  0

+ 14 19  1  0

+ 17 20  2  0

+ 18 21  1  0

+ 19 22  2  0

+ 21 23  2  0

+  3  4  1  0

+  7  8  2  0

+ 10 13  1  0

+ 15 16  1  0

+ 18 20  1  0

+ 22 23  1  0

+  1 24  1  0

+  3 25  1  0

+  4 26  1  0

+  6 27  1  0

+  9 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-41-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+    0.0224   -0.4012    0.0544 C   0  0  0

+   -1.2641    0.3834    0.0362 C   0  0  0

+    1.2073    0.5276    0.1210 C   0  0  0

+    0.0386   -1.3439    1.1863 N   0  0  0

+    0.1166   -1.2993   -1.1631 C   0  0  0

+   -1.7814    0.8347   -1.1633 C   0  0  0

+   -1.9298    0.6470    1.2190 C   0  0  0

+    2.2363    0.4017   -0.7930 C   0  0  0

+    1.2622    1.5094    1.0929 C   0  0  0

+    0.1270   -2.5780    0.6580 C   0  0  0

+    0.1718   -2.5578   -0.6842 N   0  0  0

+    0.1372   -0.9567   -2.3259 O   0  0  0

+   -2.9616    1.5546   -1.1800 C   0  0  0

+   -3.1096    1.3666    1.2023 C   0  0  0

+    3.3233    1.2539   -0.7319 C   0  0  0

+    2.3488    2.3613    1.1540 C   0  0  0

+    0.1632   -3.5958    1.3212 O   0  0  0

+   -3.6241    1.8230    0.0029 C   0  0  0

+    3.3810    2.2316    0.2433 C   0  0  0

+   -0.7245   -1.3778    0.0000 H   0  0  0

+   -1.3298    1.4508    0.0000 H   0  0  0

+   -2.2705   -0.0366    0.0000 H   0  0  0

+    2.4412   -0.3341    0.0000 H   0  0  0

+    0.5850    1.8627    0.0000 H   0  0  0

+    0.8223   -2.9581    0.0000 H   0  0  0

+   -2.6182    2.2369    0.0000 H   0  0  0

+   -3.5637    0.7524    0.0000 H   0  0  0

+    4.0000    0.8995    0.0000 H   0  0  0

+    2.1451    3.0975    0.0000 H   0  0  0

+   -4.2732    2.2257    0.0000 H   0  0  0

+    3.9684    2.7198    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  2  0

+  3  9  1  0

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+  5 11  1  0

+  5 12  2  0

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+  7 14  2  0

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+  9 16  2  0

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+ 15 19  2  0

+ 10 11  1  0

+ 14 18  1  0

+ 16 19  1  0

+  4 20  1  0

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+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-75-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 54                          1 V2000

+    0.7125   -2.1993   -0.1881 C   0  0  0

+   -0.6470   -2.0171    0.1287 C   0  0  0

+    1.5074   -1.0758   -0.7281 C   0  0  0

+    1.3054   -3.4426    0.0156 C   0  0  0

+   -1.2888   -0.7012   -0.0775 C   0  0  0

+   -1.3836   -3.0837    0.6370 C   0  0  0

+    2.6254   -0.6750   -0.0924 O   0  0  0

+    1.1525   -0.5142   -1.7448 O   0  0  0

+    0.5595   -4.4885    0.5261 C   0  0  0

+   -2.6153   -0.5620    0.1106 O   0  0  0

+   -0.6199    0.2542   -0.4165 O   0  0  0

+   -0.7793   -4.3122    0.8276 C   0  0  0

+    3.4061    0.4285   -0.6228 C   0  0  0

+   -3.2456    0.7303   -0.0919 C   0  0  0

+    4.6148    0.6788    0.2812 C   0  0  0

+   -4.7458    0.6151    0.1858 C   0  0  0

+    5.4375    1.8414   -0.2776 C   0  0  0

+   -5.4100    1.9768   -0.0276 C   0  0  0

+    6.6463    2.0917    0.6264 C   0  0  0

+   -6.9101    1.8616    0.2501 C   0  0  0

+    7.4689    3.2544    0.0675 C   0  0  0

+   -7.5743    3.2233    0.0367 C   0  0  0

+    8.6777    3.5047    0.9715 C   0  0  0

+   -9.0745    3.1081    0.3144 C   0  0  0

+    2.3293   -3.5322    0.0000 H   0  0  0

+   -2.4086   -3.0081    0.0000 H   0  0  0

+    0.9693   -5.4310    0.0000 H   0  0  0

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+   -5.7188    0.2839    0.0000 H   0  0  0

+   -4.5392   -0.3917    0.0000 H   0  0  0

+    5.5085    2.8667    0.0000 H   0  0  0

+    4.4694    2.1866    0.0000 H   0  0  0

+   -4.4370    2.3080    0.0000 H   0  0  0

+   -5.6166    2.9836    0.0000 H   0  0  0

+    6.5753    1.0664    0.0000 H   0  0  0

+    7.6144    1.7466    0.0000 H   0  0  0

+   -7.8831    1.5304    0.0000 H   0  0  0

+   -6.7035    0.8548    0.0000 H   0  0  0

+    7.5399    4.2797    0.0000 H   0  0  0

+    6.5008    3.5995    0.0000 H   0  0  0

+   -6.6013    3.5545    0.0000 H   0  0  0

+   -7.7809    4.2301    0.0000 H   0  0  0

+    8.8861    2.4983    0.0000 H   0  0  0

+    9.6841    3.7131    0.0000 H   0  0  0

+    8.4693    4.5111    0.0000 H   0  0  0

+   -9.1532    4.1329    0.0000 H   0  0  0

+  -10.0993    3.0294    0.0000 H   0  0  0

+   -8.9958    2.0833    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

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+  7 13  1  0

+ 10 14  1  0

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+ 20 22  1  0

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+  9 12  1  0

+  4 25  1  0

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+  9 27  1  0

+ 12 28  1  0

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+ 23 49  1  0

+ 23 50  1  0

+ 23 51  1  0

+ 24 52  1  0

+ 24 53  1  0

+ 24 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33757-42-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.7011   -0.2364   -0.1701 C   0  0  0

+   -1.7856    0.6441    0.0637 C   0  0  0

+    0.5831    0.3037   -0.4013 C   0  0  0

+   -0.9043   -1.5562   -0.1749 N   0  0  0

+   -1.5691    2.0318    0.0619 C   0  0  0

+   -3.0648    0.1037    0.2940 C   0  0  0

+    0.7554    1.6701   -0.3949 C   0  0  0

+    1.6705   -0.5416   -0.6352 N   0  0  0

+   -2.0953   -2.0635    0.0337 C   0  0  0

+   -0.3198    2.5238   -0.1645 C   0  0  0

+   -3.2024   -1.2553    0.2811 C   0  0  0

+    2.7801   -0.4377    0.1227 C   0  0  0

+    3.9999   -1.2573   -0.2109 C   0  0  0

+    2.7969    0.3154    1.0732 O   0  0  0

+   -2.3728    2.6754    0.0000 H   0  0  0

+   -3.8932    0.7153    0.0000 H   0  0  0

+    1.7089    2.0589    0.0000 H   0  0  0

+    1.3823   -1.5301    0.0000 H   0  0  0

+   -2.2124   -3.0865    0.0000 H   0  0  0

+   -0.1680    3.5422    0.0000 H   0  0  0

+   -4.1427   -1.6748    0.0000 H   0  0  0

+    3.4256   -2.1120    0.0000 H   0  0  0

+    4.8546   -1.8316    0.0000 H   0  0  0

+    4.5742   -0.4026    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+  8 12  1  0

+ 12 13  1  0

+ 12 14  2  0

+  7 10  1  0

+  9 11  2  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-97-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -0.9679    0.7045    0.0000 C   0  0  0

+   -0.9680   -0.7044    0.0000 C   0  0  0

+    0.3188    1.1081    0.0000 C   0  0  0

+    0.3187   -1.1081    0.0000 C   0  0  0

+    1.1131    0.0000    0.0000 N   0  0  0

+   -1.7920    1.3098    0.0000 H   0  0  0

+   -1.7922   -1.3096    0.0000 H   0  0  0

+    0.6428    2.0779    0.0000 H   0  0  0

+    0.6427   -2.0780    0.0000 H   0  0  0

+    2.1356    0.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  3  5  1  0

+  4  5  1  0

+  1  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19900-72-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 48                          1 V2000

+    1.2246   -0.0678   -0.6815 C   0  0  0

+    1.3109   -1.0670    0.2702 C   0  0  0

+   -0.0028    0.0399   -1.5492 C   0  0  0

+    2.2597    0.8365   -0.8352 C   0  0  0

+    2.4345   -1.1687    1.0671 C   0  0  0

+    0.1777   -2.0460    0.4386 C   0  0  0

+   -1.2302    0.1056   -0.6772 C   0  0  0

+    3.3835    0.7439   -0.0383 C   0  0  0

+    2.1612    1.9239   -1.8739 C   0  0  0

+    3.4783   -0.2657    0.9116 C   0  0  0

+    0.3785   -3.2271   -0.5130 C   0  0  0

+   -1.3221    1.0662    0.3135 C   0  0  0

+   -2.2642   -0.7911   -0.8731 C   0  0  0

+    4.6157   -0.3653    1.7160 N   0  0  0

+   -2.4453    1.1291    1.1143 C   0  0  0

+   -0.1950    2.0451    0.5197 C   0  0  0

+   -3.3906   -0.7338   -0.0757 C   0  0  0

+   -2.1625   -1.8319   -1.9583 C   0  0  0

+   -3.4837    0.2261    0.9239 C   0  0  0

+   -0.3066    3.1748   -0.5061 C   0  0  0

+   -4.6210    0.2866    1.7323 N   0  0  0

+    0.4786    0.7438    0.0000 H   0  0  0

+   -0.3805    0.8045    0.0000 H   0  0  0

+    2.6958   -1.9805    0.0000 H   0  0  0

+   -0.2543   -1.3107    0.0000 H   0  0  0

+   -0.6235   -2.3382    0.0000 H   0  0  0

+    3.9831    1.3503    0.0000 H   0  0  0

+    3.0105    2.0008    0.0000 H   0  0  0

+    2.0843    2.7732    0.0000 H   0  0  0

+    1.3119    1.8470    0.0000 H   0  0  0

+   -0.4622   -3.3700    0.0000 H   0  0  0

+    0.5214   -4.0678    0.0000 H   0  0  0

+    1.2192   -3.0842    0.0000 H   0  0  0

+    4.9760   -1.1382    0.0000 H   0  0  0

+    5.1049    0.3332    0.0000 H   0  0  0

+   -2.7216    1.9359    0.0000 H   0  0  0

+    0.2210    1.3007    0.0000 H   0  0  0

+    0.6187    2.3004    0.0000 H   0  0  0

+   -3.9796   -1.3505    0.0000 H   0  0  0

+   -3.0112   -1.9148    0.0000 H   0  0  0

+   -2.0796   -2.6806    0.0000 H   0  0  0

+   -1.3138   -1.7490    0.0000 H   0  0  0

+    0.5421    3.2586    0.0000 H   0  0  0

+   -0.3904    4.0235    0.0000 H   0  0  0

+   -1.1553    3.0910    0.0000 H   0  0  0

+   -5.0076    1.0467    0.0000 H   0  0  0

+   -5.0860   -0.4282    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

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+  7 12  1  0

+  7 13  2  0

+ 10 14  1  0

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+ 12 16  1  0

+ 13 17  1  0

+ 13 18  1  0

+ 15 19  1  0

+ 16 20  1  0

+ 19 21  1  0

+  8 10  1  0

+ 17 19  2  0

+  3 22  1  0

+  3 23  1  0

+  5 24  1  0

+  6 25  1  0

+  6 26  1  0

+  8 27  1  0

+  9 28  1  0

+  9 29  1  0

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+ 18 42  1  0

+ 20 43  1  0

+ 20 44  1  0

+ 20 45  1  0

+ 21 46  1  0

+ 21 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107-16-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+   -0.7120   -0.1546    0.0000 C   0  0  0

+    0.6627   -0.6810    0.0000 C   0  0  0

+   -1.7728    0.2516    0.0000 N   0  0  0

+    1.5893    0.4069    0.0000 O   0  0  0

+    0.1688   -1.6322    0.0000 H   0  0  0

+    1.5519   -1.2793    0.0000 H   0  0  0

+    2.2843    1.2228    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  3  0

+  2  4  1  0

+  2  5  1  0

+  2  6  1  0

+  4  7  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-54-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    1.2305    0.1400   -0.0011 C   0  0  0

+    0.0000    1.0101    0.0005 C   0  0  0

+    2.5992    0.7705   -0.0008 C   0  0  0

+    1.1196   -1.0625    0.0023 O   0  0  0

+   -1.2305    0.1400   -0.0002 C   0  0  0

+   -2.5992    0.7705    0.0011 C   0  0  0

+   -1.1196   -1.0625   -0.0019 O   0  0  0

+    0.7527    1.8532    0.0000 H   0  0  0

+   -0.7527    1.8532    0.0000 H   0  0  0

+    3.0721   -0.2560    0.0000 H   0  0  0

+    3.6257    1.2434    0.0000 H   0  0  0

+    2.1263    1.7970    0.0000 H   0  0  0

+   -2.1263    1.7970    0.0000 H   0  0  0

+   -3.6257    1.2434    0.0000 H   0  0  0

+   -3.0721   -0.2560    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  5  7  2  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  3 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+10184-51-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -1.9513   -1.8599    0.0017 N   0  0  0

+   -1.2166   -0.6840    0.0026 C   0  0  0

+    0.1876   -0.7142    0.0010 C   0  0  0

+   -1.8249    0.4979   -0.0006 N   0  3  0

+    0.8778    0.5102    0.0014 C   0  0  0

+    1.1194   -1.6977   -0.0011 N   0  0  0

+   -3.0420    0.5442   -0.0035 O   0  0  0

+   -1.1331    1.6230   -0.0003 C   0  5  0

+    2.2134    0.1912   -0.0004 N   0  0  0

+    0.1841    1.6427    0.0030 N   0  0  0

+    2.3084   -1.1686   -0.0019 C   0  0  0

+    3.3310    1.1384   -0.0011 C   0  0  0

+   -2.9668   -1.8245    0.0000 H   0  0  0

+   -1.4742   -2.7570    0.0000 H   0  0  0

+    3.1793   -1.6920    0.0000 H   0  0  0

+    3.9880    0.3632    0.0000 H   0  0  0

+    4.1062    1.7954    0.0000 H   0  0  0

+    2.6740    1.9136    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  9  5  1  0

+ 10  5  2  0

+ 11  6  2  0

+ 12  9  1  0

+  8 10  1  0

+  9 11  1  0

+  1 13  1  0

+  1 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 12 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53175-28-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+   -0.2462   -0.1676   -0.0024 C   0  0  0

+   -1.2936   -0.9958   -0.0017 C   0  0  0

+   -0.4584    1.2806    0.0005 C   0  0  0

+    1.3671   -0.8085    0.0006 Cl  0  0  0

+   -2.6942   -0.4395    0.0020 C   0  0  0

+    0.4932    2.0331   -0.0001 O   0  0  0

+   -1.1345   -2.0820    0.0000 H   0  0  0

+   -1.4786    1.6858    0.0000 H   0  0  0

+   -2.2890    0.5807    0.0000 H   0  0  0

+   -3.7144   -0.0343    0.0000 H   0  0  0

+   -3.0994   -1.4597    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  2  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87-51-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -0.7267   -0.1402   -0.3196 C   0  0  0

+   -1.6940    0.7820    0.1194 C   0  0  0

+    0.4923    0.6355   -0.5603 C   0  0  0

+   -1.0578   -1.4911   -0.4434 C   0  0  0

+   -1.0942    2.0212    0.1392 N   0  0  0

+   -2.9732    0.3320    0.4302 C   0  0  0

+    0.2076    1.9145   -0.2687 C   0  0  0

+    1.8153    0.0993   -1.0433 C   0  0  0

+   -2.3214   -1.9106   -0.1370 C   0  0  0

+   -3.2770   -1.0057    0.3053 C   0  0  0

+    2.6596   -0.2958    0.1407 C   0  0  0

+    3.8878   -0.8027   -0.0500 O   0  0  0

+    2.2310   -0.1564    1.2618 O   0  0  0

+   -0.3226   -2.1696    0.0000 H   0  0  0

+   -1.5905    2.8899    0.0000 H   0  0  0

+   -3.7201    0.9976    0.0000 H   0  0  0

+    0.8649    2.6688    0.0000 H   0  0  0

+    2.6254    0.6863    0.0000 H   0  0  0

+    1.6945    1.0924    0.0000 H   0  0  0

+   -2.5386   -2.8872    0.0000 H   0  0  0

+   -4.2343   -1.2962    0.0000 H   0  0  0

+    4.8126   -1.1844    0.0000 H   0  0  0

+  1  2  2  0

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+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2016-88-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+   -1.6493    0.1204   -0.0396 C   0  0  0

+   -2.7411    1.0489   -0.3792 C   0  0  0

+   -0.5099    0.5902    0.6333 C   0  0  0

+   -1.7433   -1.1694   -0.3658 N   0  0  0

+   -3.8141    1.1519    0.4298 N   0  0  0

+   -2.6743    1.7225   -1.3893 O   0  0  0

+    0.4710   -0.2515    0.9371 N   0  0  0

+   -0.4094    1.9256    0.9780 N   0  0  0

+   -0.7691   -1.9983   -0.0624 C   0  0  0

+   -4.8915    1.9272    0.0516 C   0  0  0

+    0.3713   -1.5316    0.6045 C   0  0  0

+   -0.8964   -3.6763   -0.4885 Cl  0  0  0

+   -5.9232    2.1470    0.9330 N   0  0  0

+   -4.9307    2.4506   -1.1401 N   0  0  0

+    1.3938   -2.4089    0.9208 N   0  0  0

+   11.4662    1.3261   -0.2225 Cl  0  0  0

+   -4.1531    0.2506    0.0000 H   0  0  0

+    0.4583    2.3431    0.0000 H   0  0  0

+   -1.2049    2.4683    0.0000 H   0  0  0

+   -6.2203    3.0630    0.0000 H   0  0  0

+   -6.5679    1.4317    0.0000 H   0  0  0

+   -5.0026    3.4109    0.0000 H   0  0  0

+    1.2162   -3.3554    0.0000 H   0  0  0

+    2.3023   -2.0895    0.0000 H   0  0  0

+   12.4292    1.3261    0.0000 H   0  0  0

+  1  2  1  0

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+  5 17  1  0

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+ 13 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2735-04-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.0760   -0.2671   -0.0030 C   0  0  0

+   -0.1299   -0.9483   -0.0031 C   0  0  0

+    1.0867    1.1256   -0.0006 C   0  0  0

+    2.2480   -0.9572    0.0004 O   0  0  0

+   -1.3240   -0.2428   -0.0008 C   0  0  0

+   -0.1098    1.8267    0.0017 C   0  0  0

+    2.3060    1.8182   -0.0001 N   0  0  0

+    1.9098   -2.3456    0.0034 C   0  0  0

+   -1.3117    1.1440    0.0011 C   0  0  0

+   -2.5081   -0.9117   -0.0008 O   0  0  0

+   -3.5405    0.0763    0.0018 C   0  0  0

+   -0.1400   -1.9884    0.0000 H   0  0  0

+   -0.1028    2.8668    0.0000 H   0  0  0

+    3.2031    1.2918    0.0000 H   0  0  0

+    2.3133    2.8583    0.0000 H   0  0  0

+    0.8992   -2.0994    0.0000 H   0  0  0

+    1.6636   -3.3562    0.0000 H   0  0  0

+    2.9204   -2.5918    0.0000 H   0  0  0

+   -2.2083    1.6712    0.0000 H   0  0  0

+   -2.8213    0.8278    0.0000 H   0  0  0

+   -4.2920    0.7955    0.0000 H   0  0  0

+   -4.2597   -0.6752    0.0000 H   0  0  0

+  1  2  1  0

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+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21416-67-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -2.4250   -0.4099   -0.3392 N   0  0  0

+   -3.5705   -1.3148   -0.4991 C   0  0  0

+   -2.6189    0.2990    0.9322 C   0  0  0

+   -1.2372   -1.2580   -0.1727 C   0  0  0

+   -4.8453   -0.5132   -0.5378 C   0  0  0

+   -3.9023    1.0860    0.8806 C   0  0  0

+    0.0000   -0.3746    0.0001 C   0  0  0

+   -4.9416    0.6415    0.1485 N   0  0  0

+   -5.7879   -0.9088   -1.1894 O   0  0  0

+   -3.9999    2.1235    1.5001 O   0  0  0

+    1.2372   -1.2579    0.1735 C   0  0  0

+    2.4250   -0.4097    0.3394 N   0  0  0

+    3.5705   -1.3144    0.5000 C   0  0  0

+    2.6189    0.2984   -0.9324 C   0  0  0

+    4.8453   -0.5129    0.5381 C   0  0  0

+    3.9023    1.0855   -0.8813 C   0  0  0

+    4.9416    0.6414   -0.1489 N   0  0  0

+    5.7879   -0.9081    1.1900 O   0  0  0

+    3.9999    2.1225   -1.5014 O   0  0  0

+   -4.1840   -2.0813    0.0000 H   0  0  0

+   -2.8785   -2.0113    0.0000 H   0  0  0

+   -1.6371    0.2937    0.0000 H   0  0  0

+   -2.3497    1.2432    0.0000 H   0  0  0

+   -1.8922   -1.9894    0.0000 H   0  0  0

+   -0.5822   -1.9894    0.0000 H   0  0  0

+    0.6549    0.3569    0.0000 H   0  0  0

+   -0.6550    0.3568    0.0000 H   0  0  0

+   -5.7829    1.1477    0.0000 H   0  0  0

+    0.5823   -1.9894    0.0000 H   0  0  0

+    1.8922   -1.9893    0.0000 H   0  0  0

+    2.8785   -2.0109    0.0000 H   0  0  0

+    4.1840   -2.0809    0.0000 H   0  0  0

+    2.3498    1.2426    0.0000 H   0  0  0

+    1.6371    0.2933    0.0000 H   0  0  0

+    5.7828    1.1478    0.0000 H   0  0  0

+  1  2  1  0

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+  6  8  1  0

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+ 11 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+ 17 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6223-35-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+   -0.9080    0.2300   -0.1674 C   0  0  0

+   -1.8868   -0.8832   -0.1847 C   0  0  0

+    0.2487   -0.2526   -0.7783 C   0  0  0

+   -1.0753    1.5163    0.3539 C   0  0  0

+   -1.2502   -1.9583   -0.8051 C   0  0  0

+   -3.1929   -0.8892    0.3117 C   0  0  0

+    0.0289   -1.5658   -1.1555 C   0  0  0

+    1.7377    0.6557   -1.0283 S   0  0  0

+   -2.2002    2.0363    0.9724 C   0  0  0

+    0.1049    2.4450    0.2278 C   0  0  0

+   -1.8539   -3.3169   -1.0517 C   0  0  0

+   -3.8645    0.1514    0.9334 C   0  0  0

+    1.4139    1.6792   -1.9594 O   0  0  0

+    2.2844    0.8648    0.2665 O   0  0  0

+    2.7158   -0.2627   -1.7468 O   0  0  0

+   -3.4187    1.4288    1.2271 C   0  0  0

+   -5.2756   -0.1558    1.3642 C   0  0  0

+   -6.1101   -0.5397    0.1406 C   0  0  0

+   -5.2636   -1.3186    2.3585 C   0  0  0

+   11.8760   -0.8972    1.8706 Na  0  3  0

+   -3.6641   -1.7588    0.0000 H   0  0  0

+    0.7729   -2.2176    0.0000 H   0  0  0

+   -2.2148    3.0253    0.0000 H   0  0  0

+    0.7166    1.6677    0.0000 H   0  0  0

+    0.8822    3.0567    0.0000 H   0  0  0

+   -0.5068    3.2223    0.0000 H   0  0  0

+   -2.7578   -2.9153    0.0000 H   0  0  0

+   -2.2555   -4.2208    0.0000 H   0  0  0

+   -0.9500   -3.7185    0.0000 H   0  0  0

+   -4.1610    2.0825    0.0000 H   0  0  0

+   -5.5893    0.7822    0.0000 H   0  0  0

+   -6.5235    0.3589    0.0000 H   0  0  0

+   -7.0087   -0.9531    0.0000 H   0  0  0

+   -5.6967   -1.4383    0.0000 H   0  0  0

+   -6.2526   -1.3288    0.0000 H   0  0  0

+   -5.2534   -2.3076    0.0000 H   0  0  0

+   -4.2746   -1.3084    0.0000 H   0  0  0

+    3.4369   -0.9397    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  8 13  2  0

+  8 14  2  0

+  8 15  1  0

+  9 16  1  0

+ 12 17  1  0

+ 17 18  1  0

+ 17 19  1  0

+  5  7  2  0

+ 12 16  2  0

+  6 21  1  0

+  7 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 15 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81-14-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 39                          1 V2000

+   -0.8686    0.0001   -0.0084 C   0  0  0

+   -0.1801   -1.2007    0.0030 C   0  0  0

+   -0.1804    1.2007    0.0022 C   0  0  0

+   -2.3752    0.0001   -0.0388 C   0  0  0

+    1.1983   -1.2090    0.0246 C   0  0  0

+   -0.9259   -2.4793   -0.0085 N   0  3  0

+    1.1984    1.2091    0.0248 C   0  0  0

+   -0.9263    2.4791   -0.0102 N   0  3  0

+   -2.9143    0.0004    1.3931 C   0  0  0

+   -2.8706    1.2491   -0.7706 C   0  0  0

+   -2.8705   -1.2494   -0.7699 C   0  0  0

+    1.9012    0.0002    0.0355 C   0  0  0

+    1.9459   -2.5175    0.0370 C   0  0  0

+   -0.9644   -3.1527   -1.0227 O   0  0  0

+   -1.5011   -2.8579    0.9961 O   0  5  0

+    1.9459    2.5176    0.0373 C   0  0  0

+   -1.5131    2.8515    0.9901 O   0  0  0

+   -0.9532    3.1587   -1.0206 O   0  5  0

+    3.3727    0.0003    0.0591 C   0  0  0

+    4.1052    0.0150    1.3760 C   0  0  0

+    3.9957   -0.0115   -0.9811 O   0  0  0

+   -2.9137    1.0345    0.0000 H   0  0  0

+   -3.9484    0.0010    0.0000 H   0  0  0

+   -2.9149   -1.0337    0.0000 H   0  0  0

+   -1.9093    1.6304    0.0000 H   0  0  0

+   -3.2519    2.2104    0.0000 H   0  0  0

+   -3.8319    0.8678    0.0000 H   0  0  0

+   -3.8318   -0.8683    0.0000 H   0  0  0

+   -3.2516   -2.2107    0.0000 H   0  0  0

+   -1.9092   -1.6305    0.0000 H   0  0  0

+    1.0480   -3.0305    0.0000 H   0  0  0

+    2.4589   -3.4154    0.0000 H   0  0  0

+    2.8438   -2.0045    0.0000 H   0  0  0

+    2.8438    2.0046    0.0000 H   0  0  0

+    2.4589    3.4155    0.0000 H   0  0  0

+    1.0480    3.0306    0.0000 H   0  0  0

+    4.1259   -1.0189    0.0000 H   0  0  0

+    5.1391    0.0357    0.0000 H   0  0  0

+    4.0845    1.0489    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  6 14  2  0

+  6 15  1  0

+  7 16  1  0

+  8 17  2  0

+  8 18  1  0

+ 12 19  1  0

+ 19 20  1  0

+ 19 21  2  0

+  7 12  2  0

+  9 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 11 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 16 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51775-36-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.4878    0.1752   -0.5369 C   0  0  1

+   -1.0520    0.2101   -0.2365 C   0  0  0

+    1.0448    0.9141    0.7177 C   0  0  0

+    0.8027   -1.3268   -0.2630 C   0  0  1

+    0.9263    0.7315   -1.8930 C   0  0  0

+   -0.9591   -0.4264    1.1949 C   0  0  2

+   -1.5957    1.6396   -0.1941 C   0  0  0

+   -1.8452   -0.6697   -1.2049 C   0  0  0

+    0.0872    0.5159    1.8639 C   0  0  0

+    2.7222    0.3608    1.0797 Cl  0  0  0

+    1.0115    2.6986    0.4624 Cl  0  0  0

+   -0.1549   -1.7250    0.8831 C   0  0  2

+    0.4185   -2.2989   -1.7321 Cl  0  0  0

+    2.7183    0.6026   -2.0445 Cl  0  0  0

+   -3.3003    1.6171    0.3928 Cl  0  0  0

+   -3.5580   -0.7788   -0.6523 Cl  0  0  0

+    0.8069   -2.1988    2.3326 Cl  0  0  0

+    1.8996   -1.4201    0.0000 H   0  0  0

+    1.2203    1.7923    0.0000 H   0  0  0

+   -0.0557    1.2290    0.0000 H   0  0  0

+   -1.9933   -0.8036    0.0000 H   0  0  0

+   -0.5282    1.9084    0.0000 H   0  0  0

+   -1.7383    2.7311    0.0000 H   0  0  0

+   -2.0662   -1.7481    0.0000 H   0  0  0

+   -0.8627   -1.1662    0.0000 H   0  0  0

+    0.1054    1.6166    0.0000 H   0  0  0

+   -0.9147    0.9719    0.0000 H   0  0  0

+   -0.8947   -2.5401    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  7 15  1  0

+  8 16  1  0

+ 12 17  1  0

+  6  9  1  0

+  6 12  1  0

+  4 18  1  0

+  5 19  1  0

+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+634-66-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.6922   -0.3035   -0.0018 C   0  0  0

+   -0.6922   -0.3035   -0.0010 C   0  0  0

+    1.3835    0.8957   -0.0010 C   0  0  0

+    1.5607   -1.8067    0.0033 Cl  0  0  0

+   -1.3835    0.8957    0.0006 C   0  0  0

+   -1.5607   -1.8067   -0.0026 Cl  0  0  0

+    0.6910    2.0935    0.0006 C   0  0  0

+    3.1195    0.8968   -0.0015 Cl  0  0  0

+   -0.6910    2.0935    0.0015 C   0  0  0

+   -3.1195    0.8968    0.0011 Cl  0  0  0

+    1.2098    2.9928    0.0000 H   0  0  0

+   -1.2098    2.9928    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7  9  2  0

+  7 11  1  0

+  9 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5742-17-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+   -2.9322   -0.2207    0.0458 C   0  0  0

+   -3.8878    0.7187   -0.3180 C   0  0  0

+   -1.7029    0.1965    0.5327 C   0  0  0

+   -3.2037   -1.5478   -0.0699 O   0  0  0

+   -3.6115    2.0672   -0.1940 C   0  0  0

+   -5.4282    0.1998   -0.9274 Cl  0  0  0

+   -1.4307    1.5459    0.6551 C   0  0  0

+   -2.0406   -2.2477    0.3764 C   0  0  0

+   -2.3836    2.4807    0.2923 C   0  0  0

+   -2.2772   -3.7324    0.2729 C   0  0  0

+   -2.0386    4.1751    0.4471 Cl  0  0  0

+   -1.3145   -4.5927    0.6402 O   0  0  0

+   -3.3336   -4.1484   -0.1405 O   0  0  0

+   12.7656   -0.1849   -0.5195 C   0  0  0

+   11.7127    0.8503   -0.9204 C   0  0  0

+   14.0211    0.5322   -0.0189 C   0  0  0

+   12.2306   -1.0389    0.5493 N   0  0  0

+   -0.9392   -0.4751    0.0000 H   0  0  0

+   -4.3734    2.7409    0.0000 H   0  0  0

+   -0.4585    1.8445    0.0000 H   0  0  0

+   -1.0649   -2.5345    0.0000 H   0  0  0

+   -1.6317   -1.3165    0.0000 H   0  0  0

+   -0.5562   -5.2704    0.0000 H   0  0  0

+   13.4700   -0.9185    0.0000 H   0  0  0

+   12.4257    1.5755    0.0000 H   0  0  0

+   10.9875    1.5633    0.0000 H   0  0  0

+   10.9997    0.1251    0.0000 H   0  0  0

+   14.5255   -0.3509    0.0000 H   0  0  0

+   14.9042    1.0366    0.0000 H   0  0  0

+   13.5167    1.4153    0.0000 H   0  0  0

+   11.2142   -1.0022    0.0000 H   0  0  0

+   12.7070   -1.9374    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 10 13  2  0

+ 14 15  1  0

+ 14 16  1  0

+ 14 17  1  0

+  7  9  2  0

+  3 18  1  0

+  5 19  1  0

+  7 20  1  0

+  8 21  1  0

+  8 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90-05-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.5244    0.0558    0.0019 C   0  0  0

+    0.4567   -0.9309    0.0007 C   0  0  0

+   -0.1585    1.3923    0.0015 C   0  0  0

+   -1.8395   -0.2907   -0.0023 O   0  0  0

+    1.7953   -0.5727   -0.0008 C   0  0  0

+    0.1027   -2.2440    0.0007 O   0  0  0

+    1.1787    1.7429   -0.0001 C   0  0  0

+   -2.5875    0.9269    0.0002 C   0  0  0

+    2.1535    0.7625   -0.0012 C   0  0  0

+   -0.8877    2.1295    0.0000 H   0  0  0

+    2.5283   -1.3061    0.0000 H   0  0  0

+   -0.1672   -3.2452    0.0000 H   0  0  0

+    1.4512    2.7434    0.0000 H   0  0  0

+   -1.7040    1.4697    0.0000 H   0  0  0

+   -3.1303    1.8104    0.0000 H   0  0  0

+   -3.4710    0.3841    0.0000 H   0  0  0

+    3.1555    1.0293    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

+  4  8  1  0

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+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  8 15  1  0

+  8 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+77500-04-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.5689   -0.3292    0.0016 C   0  0  0

+   -0.8784   -0.1302    0.0010 C   0  0  0

+    1.4011    0.7932    0.0009 C   0  0  0

+    1.3637   -1.4235   -0.0025 N   0  0  0

+   -1.3835    1.1944   -0.0004 C   0  0  0

+   -1.7222   -1.1605    0.0012 N   0  0  0

+    2.6978    0.3091    0.0017 N   0  0  0

+    0.8544    2.0790   -0.0005 C   0  0  0

+    2.6216   -1.0524    0.0006 C   0  0  0

+   -0.4875    2.2803   -0.0015 C   0  0  0

+   -2.7055    1.3922   -0.0010 N   0  0  0

+   -3.0198   -0.9411    0.0002 C   0  0  0

+    3.9243    1.1104    0.0006 C   0  0  0

+    3.7031   -1.9090   -0.0017 N   0  0  0

+   -3.5196    0.3596   -0.0003 C   0  0  0

+   -3.9741   -2.1074    0.0004 C   0  0  0

+    1.4889    2.8985    0.0000 H   0  0  0

+   -0.8584    3.2481    0.0000 H   0  0  0

+    4.4912    0.2427    0.0000 H   0  0  0

+    4.7920    1.6773    0.0000 H   0  0  0

+    3.3574    1.9781    0.0000 H   0  0  0

+    3.5520   -2.9343    0.0000 H   0  0  0

+    4.6666   -1.5272    0.0000 H   0  0  0

+   -4.5443    0.5149    0.0000 H   0  0  0

+   -4.7762   -1.4511    0.0000 H   0  0  0

+   -4.6304   -2.9095    0.0000 H   0  0  0

+   -3.1720   -2.7637    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+  7  9  1  0

+  8 10  2  0

+ 12 15  2  0

+  8 17  1  0

+ 10 18  1  0

+ 13 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+549-49-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 52                          1 V2000

+   -3.0412   -1.7810    0.3758 C   0  0  0

+   -2.5018   -0.6076    0.9357 C   0  0  0

+   -2.1661   -2.8371    0.0184 C   0  0  0

+   -4.4214   -1.9197    0.1614 C   0  0  0

+   -3.3924    0.5418    1.3318 C   0  0  2

+   -1.1487   -0.5398    1.1104 C   0  0  0

+   -2.7015   -4.0112   -0.5413 C   0  0  0

+   -0.8508   -2.7059    0.2157 N   0  0  0

+   -4.9063   -3.0741   -0.3847 C   0  0  0

+   -2.7716    1.8561    0.8542 C   0  0  1

+   -3.5305    0.5692    2.7538 O   0  0  0

+   -0.3451   -1.6146    0.7373 C   0  0  0

+   -4.0435   -4.1185   -0.7318 C   0  0  0

+   -6.2425   -3.2093   -0.5926 O   0  0  0

+   -2.3189    1.6980   -0.5218 N   0  0  0

+   -3.8095    2.9717    0.9713 C   0  0  0

+   -6.4424   -4.5029   -1.1660 C   0  0  0

+   -1.7058    2.9358   -0.9834 C   0  0  0

+   -3.4482    1.3545   -1.3748 C   0  0  0

+   -4.0458    3.5759   -0.4202 C   0  0  1

+   -2.7003    4.0959   -0.9458 C   0  0  1

+   -4.5142    2.4497   -1.3526 C   0  0  0

+   -2.1831    5.1712   -0.0253 C   0  0  0

+   -1.9539    6.3751   -0.4881 C   0  0  0

+   11.9532   -0.3265   -0.1049 Br  0  0  0

+   -5.0198   -1.1104    0.0000 H   0  0  0

+   -3.9217   -0.3143    0.0000 H   0  0  0

+   -0.7206    0.3711    0.0000 H   0  0  0

+   -2.1238   -4.8354    0.0000 H   0  0  0

+   -2.2211    2.6987    0.0000 H   0  0  0

+   -4.5178    0.7651    0.0000 H   0  0  0

+    0.6560   -1.5101    0.0000 H   0  0  0

+   -4.4357   -5.0454    0.0000 H   0  0  0

+   -4.8157    2.9971    0.0000 H   0  0  0

+   -4.2230    2.0541    0.0000 H   0  0  0

+   -7.4371   -4.3492    0.0000 H   0  0  0

+   -6.5961   -5.4976    0.0000 H   0  0  0

+   -5.4477   -4.6566    0.0000 H   0  0  0

+   -0.8717    2.3725    0.0000 H   0  0  0

+   -1.0361    3.6871    0.0000 H   0  0  0

+   -4.2714    0.7754    0.0000 H   0  0  0

+   -3.0067    0.4500    0.0000 H   0  0  0

+   -4.7484    4.2966    0.0000 H   0  0  0

+   -3.3831    4.8353    0.0000 H   0  0  0

+   -5.3831    2.9577    0.0000 H   0  0  0

+   -5.1345    1.6570    0.0000 H   0  0  0

+   -1.2271    4.8563    0.0000 H   0  0  0

+   -1.0035    6.7065    0.0000 H   0  0  0

+   -2.7161    7.0325    0.0000 H   0  0  0

+   12.9597   -0.3265    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  9 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 14 17  1  0

+ 15 18  1  0

+ 15 19  1  0

+ 16 20  1  0

+ 18 21  1  0

+ 19 22  1  0

+ 21 23  1  0

+ 23 24  2  0

+  8 12  1  0

+  9 13  1  0

+ 20 21  1  0

+ 20 22  1  0

+  4 26  1  0

+  5 27  1  0

+  6 28  1  0

+  7 29  1  0

+ 10 30  1  0

+ 11 31  1  0

+ 12 32  1  0

+ 13 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 17 38  1  0

+ 18 39  1  0

+ 18 40  1  0

+ 19 41  1  0

+ 19 42  1  0

+ 20 43  1  0

+ 21 44  1  0

+ 22 45  1  0

+ 22 46  1  0

+ 23 47  1  0

+ 24 48  1  0

+ 24 49  1  0

+ 25 50  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+522-19-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -0.2702    0.5746   -0.1739 C   0  0  0

+   -0.2619   -0.8195    0.0778 C   0  0  0

+    0.9579    1.2613   -0.2731 C   0  0  0

+   -1.4930    1.2498   -0.3262 C   0  0  0

+   -1.4938   -1.5031    0.1763 C   0  0  0

+    0.8926   -1.4775    0.2192 N   0  0  0

+    2.1262    0.5219   -0.1163 C   0  0  0

+    0.9985    2.5952   -0.5125 O   0  0  0

+   -2.6654    0.5559   -0.2303 C   0  0  0

+   -2.6636   -0.8173    0.0291 C   0  0  0

+   -1.5136   -2.8403    0.4168 O   0  0  0

+    2.0587   -0.8663    0.1323 C   0  0  0

+    3.5574    0.8496   -0.1464 C   0  0  0

+    1.4693    3.2157    0.6856 C   0  0  0

+   -3.8477    1.2104   -0.3778 O   0  0  0

+   -1.0018   -3.4783   -0.7550 C   0  0  0

+    3.3305   -1.3078    0.2366 O   0  0  0

+    4.2067   -0.2997    0.0741 C   0  0  0

+   -4.1923    1.7353    0.9059 C   0  0  0

+   -1.5082    2.2632    0.0000 H   0  0  0

+   -3.5427   -1.3217    0.0000 H   0  0  0

+    3.9667    1.7768    0.0000 H   0  0  0

+    2.2767    2.6031    0.0000 H   0  0  0

+    2.0819    4.0231    0.0000 H   0  0  0

+    0.6619    3.8283    0.0000 H   0  0  0

+   -1.7924   -4.1125    0.0000 H   0  0  0

+   -0.3676   -4.2689    0.0000 H   0  0  0

+   -0.2112   -2.8441    0.0000 H   0  0  0

+    5.2151   -0.4015    0.0000 H   0  0  0

+   -3.3450    2.2915    0.0000 H   0  0  0

+   -4.7485    2.5826    0.0000 H   0  0  0

+   -5.0396    1.1791    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  1  0

+ 12 17  1  0

+ 13 18  2  0

+ 15 19  1  0

+  7 12  2  0

+  9 10  1  0

+ 17 18  1  0

+  4 20  1  0

+ 10 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+36239-01-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.8210   -0.4914    0.3074 N   0  0  0

+   -0.1838    0.2037    1.1157 C   0  0  0

+    1.9763    0.1842   -0.1070 N   0  3  0

+    0.6206   -1.8946   -0.0627 C   0  0  0

+   -1.1581    0.8319    0.2415 O   0  0  0

+    2.1453    1.3494    0.2049 O   0  0  0

+    2.8117   -0.3937   -0.7791 O   0  5  0

+   -2.2551    0.1567   -0.1359 C   0  0  0

+   -3.2663    0.8087   -1.0432 C   0  0  0

+   -2.4317   -0.9740    0.2518 O   0  0  0

+    0.6276    0.5985    0.0000 H   0  0  0

+   -0.1298    1.1045    0.0000 H   0  0  0

+   -0.2727   -1.7670    0.0000 H   0  0  0

+    0.4930   -2.7879    0.0000 H   0  0  0

+    1.5139   -2.0222    0.0000 H   0  0  0

+   -2.7773    1.5671    0.0000 H   0  0  0

+   -4.0247    1.2977    0.0000 H   0  0  0

+   -3.7553    0.0503    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  5  8  1  0

+  8  9  1  0

+  8 10  2  0

+  2 11  1  0

+  2 12  1  0

+  4 13  1  0

+  4 14  1  0

+  4 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+594-72-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.1533   -0.0862    0.3677 C   0  0  0

+   -1.1890    0.3196   -0.0565 N   0  3  0

+    0.1716   -0.2804    1.8852 C   0  0  0

+    0.5969   -1.6349   -0.4418 Cl  0  0  0

+    1.3399    1.1921   -0.0890 Cl  0  0  0

+   -1.3523    1.3847   -0.6242 O   0  0  0

+   -2.1417   -0.4083    0.1586 O   0  5  0

+   -0.7996   -0.3719    0.0000 H   0  0  0

+    0.2631   -1.2516    0.0000 H   0  0  0

+    1.1428   -0.1889    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+137-26-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+   -2.1505   -0.1731   -0.0015 C   0  0  0

+   -3.3774    0.3848   -0.0003 N   0  0  0

+   -0.9375    0.4243    1.0486 S   0  0  0

+   -1.8071   -1.4836   -1.0482 S   0  0  0

+   -3.6730    1.5023    0.8997 C   0  0  0

+   -4.4154   -0.1264   -0.8989 C   0  0  0

+    0.9377   -0.4284    1.0467 S   0  0  0

+    2.1511    0.1744    0.0001 C   0  0  0

+    3.3780   -0.3835   -0.0011 N   0  0  0

+    1.8060    1.4857   -1.0450 S   0  0  0

+    3.6733   -1.5056    0.8932 C   0  0  0

+    4.4163    0.1323   -0.8967 C   0  0  0

+   -2.6958    1.7608    0.0000 H   0  0  0

+   -3.9315    2.4795    0.0000 H   0  0  0

+   -4.6502    1.2438    0.0000 H   0  0  0

+   -4.8620    0.7804    0.0000 H   0  0  0

+   -5.3222   -0.5730    0.0000 H   0  0  0

+   -3.9688   -1.0332    0.0000 H   0  0  0

+    2.6957   -1.7629    0.0000 H   0  0  0

+    3.9306   -2.4832    0.0000 H   0  0  0

+    4.6509   -1.2483    0.0000 H   0  0  0

+    4.8660   -0.7730    0.0000 H   0  0  0

+    5.3216    0.5820    0.0000 H   0  0  0

+    3.9666    1.0376    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  7  8  1  0

+  8  9  1  0

+  8 10  2  0

+  9 11  1  0

+  9 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+939-99-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.0659   -0.0001    0.1284 C   0  0  0

+   -0.3868   -1.1971    0.2557 C   0  0  0

+   -0.3864    1.1972    0.2560 C   0  0  0

+   -2.5459    0.0000   -0.1556 C   0  0  0

+    0.9721   -1.1972    0.5106 C   0  0  0

+    0.9720    1.1972    0.5108 C   0  0  0

+   -3.0044    1.3190   -0.2402 F   0  0  0

+   -2.7883   -0.6566   -1.3669 F   0  0  0

+   -3.2189   -0.6623    0.8767 F   0  0  0

+    1.6514   -0.0002    0.6381 C   0  0  0

+    3.1326   -0.0003    0.9154 C   0  0  0

+    4.0362    0.0001   -0.6449 Cl  0  0  0

+   -0.9063   -2.0890    0.0000 H   0  0  0

+   -0.9058    2.0892    0.0000 H   0  0  0

+    1.4915   -2.0892    0.0000 H   0  0  0

+    1.4914    2.0892    0.0000 H   0  0  0

+    2.6166   -0.8943    0.0000 H   0  0  0

+    3.6489   -0.8941    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  2  0

+ 10 11  1  0

+ 11 12  1  0

+  6 10  1  0

+  2 13  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1732-23-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.3254    0.0148   -0.0018 C   0  0  0

+   -0.9795    0.0151   -0.0014 C   0  0  0

+    1.0684    1.2890   -0.0005 C   0  0  0

+    1.0749   -1.2544    0.0026 C   0  0  0

+   -1.7220    1.2897    0.0003 C   0  0  0

+   -1.7297   -1.2537   -0.0022 C   0  0  0

+    2.5403    1.2212   -0.0004 C   0  0  0

+    0.4127    2.4251    0.0009 C   0  0  0

+    2.3869   -1.2197    0.0026 C   0  0  0

+    0.3321   -2.5258    0.0063 C   0  0  0

+   -1.0657    2.4254    0.0014 C   0  0  0

+   -3.1938    1.2226    0.0014 C   0  0  0

+   -0.9875   -2.5255   -0.0046 C   0  0  0

+   -3.0416   -1.2184   -0.0012 C   0  0  0

+    3.1318    0.0458   -0.0015 C   0  0  0

+   -3.7860    0.0474    0.0006 C   0  0  0

+    4.4861    0.0012   -0.0018 N   0  0  0

+    3.1395    2.1453    0.0000 H   0  0  0

+    0.9635    3.3788    0.0000 H   0  0  0

+    2.9461   -2.1685    0.0000 H   0  0  0

+    0.8802   -3.4811    0.0000 H   0  0  0

+   -1.6161    3.3794    0.0000 H   0  0  0

+   -3.7926    2.1470    0.0000 H   0  0  0

+   -1.5361   -3.4805    0.0000 H   0  0  0

+   -3.6013   -2.1669    0.0000 H   0  0  0

+   -4.8868    0.0117    0.0000 H   0  0  0

+    5.0051   -0.9702    0.0000 H   0  0  0

+    5.0679    0.9364    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+ 12 16  2  0

+ 15 17  1  0

+  8 11  1  0

+  9 15  1  0

+ 10 13  2  0

+ 14 16  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1135-14-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.8913    0.8357    0.0078 C   0  0  0

+   -0.6238    1.7349    0.0378 S   0  0  0

+    1.4407    0.4409   -1.2052 C   0  0  0

+    1.5394    0.5266    1.1973 C   0  0  0

+   -1.7727    0.3991    0.0239 C   0  0  0

+    2.6283   -0.2633   -1.2285 C   0  0  0

+    2.7265   -0.1774    1.1736 C   0  0  0

+   -3.1290    0.6487   -0.1470 C   0  0  0

+   -1.3240   -0.9074    0.1782 C   0  0  0

+    3.2731   -0.5768   -0.0393 C   0  0  0

+   -4.0265   -0.4008   -0.1573 C   0  0  0

+   -2.2271   -1.9516    0.1668 C   0  0  0

+    4.4767   -1.2910   -0.0631 N   0  0  0

+   -3.5771   -1.6988    0.0022 C   0  0  0

+    0.8742   -0.4254    0.0000 H   0  0  0

+    2.0267    1.4398    0.0000 H   0  0  0

+    2.1376   -1.1747    0.0000 H   0  0  0

+    3.2965    0.6866    0.0000 H   0  0  0

+   -3.4748    1.6243    0.0000 H   0  0  0

+   -0.3077   -1.1040    0.0000 H   0  0  0

+   -5.0436   -0.2083    0.0000 H   0  0  0

+   -1.8855   -2.9287    0.0000 H   0  0  0

+    4.4643   -2.3260    0.0000 H   0  0  0

+    5.3793   -0.7842    0.0000 H   0  0  0

+   -4.2528   -2.4829    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  2  0

+  5  9  1  0

+  6 10  2  0

+  8 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+  7 10  1  0

+ 12 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+501-52-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.9689   -0.0029    0.3467 C   0  0  0

+   -0.4851   -0.0064    0.7426 C   0  0  0

+    1.6357    1.1956    0.1756 C   0  0  0

+    1.6375   -1.1986    0.1602 C   0  0  0

+   -1.3562    0.0045   -0.5151 C   0  0  0

+    2.9696    1.1988   -0.1877 C   0  0  0

+    2.9710   -1.1954   -0.2029 C   0  0  0

+   -2.8102    0.0010   -0.1192 C   0  0  0

+    3.6365    0.0035   -0.3797 C   0  0  0

+   -3.7632    0.0092   -1.0645 O   0  0  0

+   -3.1182   -0.0092    1.0491 O   0  0  0

+   -1.0051   -0.8915    0.0000 H   0  0  0

+    0.0259   -0.8967    0.0000 H   0  0  0

+    1.1143    2.0799    0.0000 H   0  0  0

+    1.1192   -2.0847    0.0000 H   0  0  0

+   -0.8362    0.8896    0.0000 H   0  0  0

+   -1.8672    0.8948    0.0000 H   0  0  0

+    3.4883    2.0847    0.0000 H   0  0  0

+    3.4928   -2.0795    0.0000 H   0  0  0

+    4.6631    0.0046    0.0000 H   0  0  0

+   -4.7897    0.0180    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  6  9  2  0

+  8 10  1  0

+  8 11  2  0

+  7  9  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  9 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64625-66-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -1.1723   -0.1314    0.2890 C   0  0  0

+   -1.7645   -1.4873    0.5392 C   0  0  1

+    0.2318   -0.0011    0.1753 C   0  0  0

+   -1.9544    0.9714    0.1753 C   0  0  0

+   -3.2205   -1.6608    0.1517 C   0  0  2

+   -2.1549   -2.1565   -0.6615 O   0  0  0

+    0.8050    1.3264   -0.0617 C   0  0  0

+    1.0635   -1.1144    0.2874 C   0  0  0

+   -3.4525    0.8338    0.2885 C   0  0  1

+   -1.4043    2.2374   -0.0485 C   0  0  0

+   -3.9005   -0.4350   -0.4350 C   0  0  1

+    2.1849    1.4856   -0.1773 C   0  0  0

+   -0.0677    2.4306   -0.1678 C   0  0  0

+    2.4433   -0.9558    0.1734 C   0  0  0

+   -3.8209    0.7555    1.6669 O   0  0  0

+   -3.5820   -0.3328   -1.8243 O   0  0  0

+    3.0165    0.3731   -0.0645 C   0  0  0

+    2.7734    2.8512   -0.4219 C   0  0  0

+    3.3152   -2.0607    0.2826 C   0  0  0

+    4.4183    0.4972   -0.1750 C   0  0  0

+    4.6543   -1.8711    0.1670 C   0  0  0

+    5.1996   -0.6068   -0.0594 C   0  0  0

+   -0.8357   -1.9590    0.0000 H   0  0  0

+   -3.9305   -2.4231    0.0000 H   0  0  0

+    0.6508   -2.0709    0.0000 H   0  0  0

+   -3.6087    1.8638    0.0000 H   0  0  0

+   -2.0366    3.0653    0.0000 H   0  0  0

+   -4.9386   -0.5219    0.0000 H   0  0  0

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+   -4.8399    0.5389    0.0000 H   0  0  0

+   -2.5901   -0.0145    0.0000 H   0  0  0

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+    3.1857    3.8079    0.0000 H   0  0  0

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+    2.9278   -3.0277    0.0000 H   0  0  0

+    4.8557    1.4427    0.0000 H   0  0  0

+    5.2865   -2.6991    0.0000 H   0  0  0

+    6.2357   -0.4983    0.0000 H   0  0  0

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+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92569-05-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.2839   -0.9914   -0.0105 N   0  0  0

+    1.5329   -0.3853    0.0575 C   0  0  0

+   -0.8885   -0.3787    0.1998 C   0  0  0

+    0.0394   -2.4056   -0.3309 C   0  0  0

+    3.1012   -1.0865   -0.1963 S   0  0  0

+    1.8307    0.8711    0.3256 N   0  0  0

+   -1.9519   -1.1837    0.0749 N   0  0  0

+   -0.9793    0.8006    0.4790 O   0  0  0

+   -1.4947   -2.5383   -0.2693 C   0  0  0

+    4.0653    0.3905    0.0895 C   0  0  0

+    3.0823    1.2864    0.3497 C   0  0  0

+   -3.2369   -0.8106    0.2362 C   0  0  0

+    5.5327    0.5833    0.0490 N   0  3  0

+   -3.5828    0.6461    0.4074 C   0  0  0

+   -4.1146   -1.6469    0.2435 O   0  0  0

+    6.0092    1.6811    0.2754 O   0  0  0

+    6.2634   -0.3559   -0.2107 O   0  5  0

+   -2.7639    1.6130   -0.8753 Cl  0  0  0

+   -5.3681    0.8597    0.2733 Cl  0  0  0

+    0.0399   -3.4075    0.0000 H   0  0  0

+    1.0377   -2.4910    0.0000 H   0  0  0

+   -2.4665   -2.7821    0.0000 H   0  0  0

+   -1.3291   -3.5264    0.0000 H   0  0  0

+    3.2905    2.2665    0.0000 H   0  0  0

+   -2.6084    0.4130    0.0000 H   0  0  0

+  1  2  1  0

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+  4 20  1  0

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+  9 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+115-53-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 50                          1 V2000

+    0.7879    0.1612   -1.1178 C   0  0  1

+   -0.3309    0.5111   -0.1696 C   0  0  0

+    2.0792   -0.0663   -0.3315 C   0  0  1

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+   -1.1523    1.4085    1.8883 C   0  0  0

+   -2.7000    0.5611    0.2711 C   0  0  0

+   -1.8728   -0.3327   -1.7738 O   0  0  0

+    2.5079    2.3598   -0.3693 N   0  0  0

+    1.1159   -2.2708    0.2712 C   0  0  0

+   -0.6639   -3.0239   -1.0454 O   0  0  0

+   -2.4508    1.1500    1.5000 C   0  0  0

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+   -5.2317   -0.0525    0.0000 H   0  0  0

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+ 24 46  1  0

+ 24 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+131-91-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.5381    0.2979    0.1078 C   0  0  0

+   -1.1708   -0.9529   -0.0736 C   0  0  0

+    0.9313    0.3454    0.1915 C   0  0  0

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+   -2.5708   -1.0088   -0.1546 C   0  0  0

+    1.6500   -0.8728    0.0857 C   0  0  0

+    1.5650    1.4954    0.3606 N   0  0  0

+   -2.6808    1.3673    0.1319 C   0  0  0

+    0.9677   -2.0727   -0.0915 C   0  0  0

+   -3.3022    0.1389   -0.0578 C   0  0  0

+    2.9996   -0.8683    0.1575 O   0  0  0

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+   -0.8599   -3.0438    0.0000 H   0  0  0

+   -3.0498   -1.9250    0.0000 H   0  0  0

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+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64099-28-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.1033    0.2823   -0.0030 C   0  0  0

+   -0.3555   -1.1083   -0.0015 C   0  0  0

+    1.3160    0.5982   -0.0009 C   0  0  0

+   -1.2285    1.1371   -0.0008 C   0  0  0

+    1.2750   -1.8037    0.0024 S   0  0  0

+   -1.6353   -1.6216   -0.0027 C   0  0  0

+    2.1923   -0.3628    0.0020 N   0  0  0

+    1.7257    1.8938   -0.0025 O   0  0  0

+   -2.4987    0.6083    0.0026 C   0  0  0

+   -2.7080   -0.7712   -0.0055 C   0  0  0

+    3.1546    1.8752    0.0003 C   0  0  0

+   -3.6016    1.4704    0.0052 N   0  0  0

+   -1.0949    2.1785    0.0000 H   0  0  0

+   -1.7864   -2.6606    0.0000 H   0  0  0

+   -3.6850   -1.1557    0.0000 H   0  0  0

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+    3.1683    2.9250    0.0000 H   0  0  0

+   -3.4552    2.5100    0.0000 H   0  0  0

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+  1  2  2  0

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+ 12 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3811-71-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 74                          1 V2000

+   -1.9446   -2.0720   -0.0223 N   0  0  0

+   -2.4079   -3.2649   -0.1847 N   0  0  0

+   -0.5976   -1.8699    0.0733 C   0  0  0

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+   -0.0944   -0.5765    0.2494 C   0  0  0

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+ 41 68  1  0

+ 45 69  1  0

+ 46 70  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+128714-75-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.0681   -0.2051   -0.0047 C   0  0  0

+   -1.2554   -0.6815   -0.0126 C   0  0  0

+    0.3083    1.1897    0.0274 C   0  0  0

+    1.1436   -1.1228   -0.0346 C   0  0  0

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+   -3.6572   -0.2598    0.0031 C   0  0  0

+   -2.0704    1.6088    0.0438 C   0  0  0

+   -0.4293   -2.9680   -0.0676 C   0  0  0

+   -2.8889   -2.5420   -0.0521 C   0  0  0

+    2.7725    0.7526    0.0112 C   0  0  0

+    1.9689    3.0406    0.0670 C   0  0  0

+    3.6494   -1.5836   -0.0574 N   0  3  0

+   -3.9133   -1.6209   -0.0295 C   0  0  0

+   -4.7885    0.6953    0.0287 N   0  3  0

+    4.0986    1.2310    0.0197 C   0  0  0

+    3.2845    3.4896    0.0748 C   0  0  0

+    4.1096   -1.9484   -1.1245 O   0  0  0

+    4.1946   -2.0745    1.1537 O   0  5  0

+   -5.7156    0.5206    0.7990 O   0  0  0

+   -4.7924    1.8116   -0.8424 O   0  5  0

+    4.3368    2.5903    0.0513 C   0  0  0

+   -0.5826    3.1097    0.0000 H   0  0  0

+    1.6778   -3.1793    0.0000 H   0  0  0

+   -2.8680    2.2923    0.0000 H   0  0  0

+   -0.6113   -4.0025    0.0000 H   0  0  0

+   -3.1013   -3.5707    0.0000 H   0  0  0

+    1.1780    3.7319    0.0000 H   0  0  0

+   -4.9083   -1.9575    0.0000 H   0  0  0

+    4.9027    0.5551    0.0000 H   0  0  0

+    3.4820    4.5213    0.0000 H   0  0  0

+    5.3253    2.9456    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

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+  9 17  1  0

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+ 15 20  1  0

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+ 14 31  1  0

+ 16 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 26 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6027-98-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+   -5.6482   -1.3090   -0.3385 C   0  0  0

+   -6.5463   -0.2466   -0.3772 C   0  0  0

+   -4.6272   -0.9633    0.5175 C   0  0  0

+   -5.6456   -2.6424   -1.0411 C   0  0  0

+   -6.0298    0.7610    0.4855 C   0  0  0

+   -7.7528   -0.0516   -1.0696 C   0  0  0

+   -4.8584    0.2943    1.0158 N   0  0  0

+   -3.5242   -1.9016    0.7674 C   0  0  0

+   -4.1939   -3.0764   -1.2516 C   0  0  0

+   -6.7069    1.9643    0.6632 C   0  0  0

+   -8.3986    1.1407   -0.8770 C   0  0  0

+   -3.3685   -2.8834   -0.0696 N   0  0  0

+   -2.6069   -1.7312    1.9508 C   0  0  0

+   -7.8964    2.1276   -0.0348 C   0  0  0

+   -8.5905    3.2867    0.1087 O   0  0  0

+   -9.7538    3.1761   -0.7139 C   0  0  0

+    6.7748   -0.7416    0.6151 O   0  0  0

+   15.3883    0.0267    0.1474 O   0  0  0

+   24.0017    0.7950   -0.3203 Cl  0  0  0

+   -6.5725   -2.5536    0.0000 H   0  0  0

+   -5.8242   -3.5563    0.0000 H   0  0  0

+   -8.2918   -0.8109    0.0000 H   0  0  0

+   -4.1383    0.8847    0.0000 H   0  0  0

+   -4.7505   -3.8229    0.0000 H   0  0  0

+   -3.6837   -3.8553    0.0000 H   0  0  0

+   -6.1832    2.7342    0.0000 H   0  0  0

+   -9.3297    1.1287    0.0000 H   0  0  0

+   -2.4368   -2.6467    0.0000 H   0  0  0

+   -1.6914   -1.5611    0.0000 H   0  0  0

+   -2.7770   -0.8157    0.0000 H   0  0  0

+   -9.8419    4.1031    0.0000 H   0  0  0

+  -10.6808    3.0880    0.0000 H   0  0  0

+   -9.6657    2.2491    0.0000 H   0  0  0

+    5.8436   -0.7416    0.0000 H   0  0  0

+    7.7060   -0.7416    0.0000 H   0  0  0

+   14.4571    0.0267    0.0000 H   0  0  0

+   16.3195    0.0267    0.0000 H   0  0  0

+   24.9329    0.7950    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  2  0

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+  5  7  1  0

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+  4 20  1  0

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+ 16 31  1  0

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+ 16 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 19 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+85-91-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.0435   -0.4203   -0.0195 C   0  0  0

+   -1.0748    0.4282    0.0081 C   0  0  0

+    1.4033    0.1456   -0.0297 C   0  0  0

+   -0.1419   -1.8059   -0.0314 C   0  0  0

+   -2.3523   -0.1186    0.0174 C   0  0  0

+   -0.9051    1.8060    0.0265 N   0  0  0

+    2.4727   -0.6682    0.0724 O   0  0  0

+    1.5610    1.3464   -0.1301 O   0  0  0

+   -1.4160   -2.3287   -0.0161 C   0  0  0

+   -2.5181   -1.4879   -0.0004 C   0  0  0

+   -2.0748    2.6877    0.0552 C   0  0  0

+    3.8132   -0.1103    0.0624 C   0  0  0

+    0.6828   -2.4423    0.0000 H   0  0  0

+   -3.1857    0.5064    0.0000 H   0  0  0

+    0.0539    2.2128    0.0000 H   0  0  0

+   -1.5522   -3.3614    0.0000 H   0  0  0

+   -3.4778   -1.8929    0.0000 H   0  0  0

+   -1.4478    3.5195    0.0000 H   0  0  0

+   -2.9066    3.3147    0.0000 H   0  0  0

+   -2.7018    1.8559    0.0000 H   0  0  0

+    4.2135   -1.0720    0.0000 H   0  0  0

+    4.7749    0.2900    0.0000 H   0  0  0

+    3.4129    0.8514    0.0000 H   0  0  0

+  1  2  2  0

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+ 11 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107210-40-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 62                          1 V2000

+   -0.2016    0.4366    0.4509 C   0  0  0

+   -1.5695    0.0672    0.0653 C   0  0  0

+    0.7732   -0.6413    0.6663 C   0  0  0

+    0.1344    1.7704    0.5946 C   0  0  0

+   -2.5377    1.1556   -0.1479 C   0  0  0

+   -1.9124   -1.1921   -0.0833 N   0  0  0

+    0.2768   -2.0160    0.4716 C   0  0  0

+    2.0491   -0.3879    1.0216 N   0  0  0

+   -0.8237    2.7746    0.3738 C   0  0  0

+    1.5143    2.1434    0.9835 N   0  3  0

+   -3.8208    0.8841   -0.5067 N   0  0  0

+   -2.1033    2.4894    0.0282 C   0  0  0

+   -1.0756   -2.2162    0.0968 C   0  0  0

+    1.1223   -3.1043    0.6511 C   0  0  0

+    2.8289   -0.3253   -0.2218 C   0  0  0

+    2.2229    2.7539    0.2034 O   0  0  0

+    2.0094    1.7901    2.2622 O   0  5  0

+   -4.6801    1.4363    0.5491 C   0  0  0

+   -4.0928    1.6623   -1.7225 C   0  0  0

+   -1.5396   -3.5341   -0.0871 C   0  0  0

+    0.6379   -4.3955    0.4628 C   0  0  0

+    4.3157   -0.1952    0.1148 C   0  0  0

+   -5.2671    0.2928    1.3790 C   0  0  0

+   -3.7012    0.8405   -2.9523 C   0  0  0

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+    5.1280   -0.1300   -1.1801 C   0  0  0

+   -4.2209   -0.3526    2.1077 O   0  0  0

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+    7.2746    0.0521   -2.1366 C   0  0  0

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+   -5.7697   -0.5718    0.0000 H   0  0  0

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+   -1.0397   -5.5348    0.0000 H   0  0  0

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+    5.6997   -0.9505    0.0000 H   0  0  0

+   -3.3698   -0.8776    0.0000 H   0  0  0

+   -5.1717   -1.0874    0.0000 H   0  0  0

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+    7.1954    1.0490    0.0000 H   0  0  0

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+  1  2  1  0

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+ 30 55  1  0

+ 30 56  1  0

+ 30 57  1  0

+ 31 58  1  0

+ 31 59  1  0

+ 31 60  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94-82-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.6562   -0.2081   -0.0034 C   0  0  0

+   -1.7610   -1.0484   -0.0013 C   0  0  0

+   -0.8337    1.1675   -0.0035 C   0  0  0

+    0.5980   -0.7326    0.0003 O   0  0  0

+   -3.0355   -0.5126    0.0007 C   0  0  0

+   -1.5426   -2.7706   -0.0006 Cl  0  0  0

+   -2.1090    1.6988   -0.0015 C   0  0  0

+    1.5068    0.3702   -0.0031 C   0  0  0

+   -3.2095    0.8599    0.0006 C   0  0  0

+    2.9443   -0.1537    0.0008 C   0  0  0

+   -4.8107    1.5306    0.0026 Cl  0  0  0

+    3.9174    1.0269   -0.0029 C   0  0  0

+    5.3333    0.5109    0.0009 C   0  0  0

+    6.3619    1.3733   -0.0014 O   0  0  0

+    5.5426   -0.6791    0.0061 O   0  0  0

+   -0.0070    1.7989    0.0000 H   0  0  0

+   -3.8640   -1.1417    0.0000 H   0  0  0

+   -2.2421    2.7305    0.0000 H   0  0  0

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+    2.4799   -1.0845    0.0000 H   0  0  0

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+    4.3818    1.9577    0.0000 H   0  0  0

+    3.0450    1.5935    0.0000 H   0  0  0

+    7.1590    2.0416    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  2  5  1  0

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+  8 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146795-29-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.9532   -0.3401    0.0603 C   0  0  0

+   -2.0329    0.6144    0.0313 C   0  0  0

+    0.4526    0.0913    0.1182 C   0  0  0

+   -1.2964   -1.6762    0.0371 C   0  0  0

+   -3.2858    0.1214   -0.0216 C   0  0  0

+    1.4388   -0.8270    0.1440 N   0  0  0

+    0.7245    1.2767    0.1427 O   0  0  0

+   -3.0266   -1.6407   -0.0220 S   0  0  0

+   -4.5661    0.8636   -0.0600 N   0  3  0

+    2.7749   -0.4207    0.0659 C   0  0  0

+   -5.6208    0.2562   -0.1070 O   0  0  0

+   -4.5648    2.0815   -0.0445 O   0  5  0

+    3.7851   -1.3678   -0.0431 C   0  0  0

+    3.0939    0.9306    0.0915 C   0  0  0

+    5.1032   -0.9634   -0.1200 C   0  0  0

+    4.4144    1.3285    0.0142 C   0  0  0

+    5.4180    0.3830   -0.0885 C   0  0  0

+    6.8576    0.8207   -0.1726 C   0  0  0

+   -1.8528    1.6357    0.0000 H   0  0  0

+   -0.6693   -2.5021    0.0000 H   0  0  0

+    1.2051   -1.8374    0.0000 H   0  0  0

+    3.5510   -2.3781    0.0000 H   0  0  0

+    2.3386    1.6412    0.0000 H   0  0  0

+    5.8610   -1.6713    0.0000 H   0  0  0

+    4.6523    2.3379    0.0000 H   0  0  0

+    7.1593   -0.1715    0.0000 H   0  0  0

+    7.8498    1.1224    0.0000 H   0  0  0

+    6.5559    1.8129    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  9 11  2  0

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+  5  8  1  0

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+  2 19  1  0

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+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53-19-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.8365   -0.5606   -0.3932 C   0  0  0

+   -1.7548    0.4013    0.3157 C   0  0  0

+    0.5832   -0.0647   -0.2948 C   0  0  0

+   -0.9412   -1.9404    0.2594 C   0  0  0

+   -2.5246    1.2886   -0.4148 C   0  0  0

+   -1.8323    0.3932    1.6958 C   0  0  0

+    1.4929   -0.3724   -1.2889 C   0  0  0

+    0.9737    0.7025    0.7871 C   0  0  0

+   -0.5792   -3.2134   -0.9652 Cl  0  0  0

+    0.2429   -2.0558    1.6142 Cl  0  0  0

+   -3.3675    2.1716    0.2368 C   0  0  0

+   -2.4328    1.2949   -2.1484 Cl  0  0  0

+   -2.6744    1.2754    2.3462 C   0  0  0

+    2.7952    0.0825   -1.1994 C   0  0  0

+    2.2753    1.1579    0.8777 C   0  0  0

+   -3.4398    2.1664    1.6169 C   0  0  0

+    3.1878    0.8458   -0.1146 C   0  0  0

+    4.8231    1.4174   -0.0015 Cl  0  0  0

+   -1.6767   -0.8609    0.0000 H   0  0  0

+   -1.8290   -2.0301    0.0000 H   0  0  0

+   -2.1402   -0.4443    0.0000 H   0  0  0

+    1.4973   -1.2647    0.0000 H   0  0  0

+    0.3865    1.3743    0.0000 H   0  0  0

+   -3.0462    3.0040    0.0000 H   0  0  0

+   -3.3358    0.6764    0.0000 H   0  0  0

+    3.3808   -0.5907    0.0000 H   0  0  0

+    2.2722    2.0502    0.0000 H   0  0  0

+   -4.2635    2.5095    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

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+  8 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3787-28-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.6357    0.1795   -0.0021 C   0  0  0

+   -0.7014    0.0554   -0.0008 C   0  0  0

+    1.2265    1.4639   -0.0013 C   0  0  0

+    1.6389   -1.2373    0.0025 Cl  0  0  0

+   -1.7045    1.4722    0.0019 Cl  0  0  0

+   -1.4268   -1.5218   -0.0018 Cl  0  0  0

+    2.4353    1.5761   -0.0024 O   0  0  0

+    0.5440    2.4279    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+524-15-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.2683    0.9717    0.1442 C   0  0  0

+   -0.8684   -0.3057    0.0232 C   0  0  0

+    1.1385    1.0670    0.1949 C   0  0  0

+   -1.0768    2.1184    0.2175 C   0  0  0

+   -0.1152   -1.4072   -0.0419 N   0  0  0

+   -2.2767   -0.3946   -0.0269 C   0  0  0

+    1.8689   -0.1149    0.1222 C   0  0  0

+    1.7566    2.2679    0.3098 O   0  0  0

+   -2.4316    1.9933    0.1717 C   0  0  0

+    1.2026   -1.3543    0.0027 C   0  0  0

+   -3.0296    0.7417    0.0414 C   0  0  0

+   -2.8799   -1.6066   -0.1433 O   0  0  0

+    3.3019   -0.4361    0.1398 C   0  0  0

+    2.1005    2.6837   -1.0134 C   0  0  0

+    2.1562   -2.3087   -0.0441 O   0  0  0

+   -4.2884   -1.3664   -0.1669 C   0  0  0

+    3.3857   -1.7677    0.0351 C   0  0  0

+   -0.6485    3.0467    0.0000 H   0  0  0

+   -3.0161    2.8321    0.0000 H   0  0  0

+   -4.0494    0.6705    0.0000 H   0  0  0

+    4.0795    0.2276    0.0000 H   0  0  0

+    2.8883    2.0321    0.0000 H   0  0  0

+    2.7521    3.4715    0.0000 H   0  0  0

+    1.3127    3.3353    0.0000 H   0  0  0

+   -4.1165   -0.3586    0.0000 H   0  0  0

+   -5.2962   -1.1945    0.0000 H   0  0  0

+   -4.4603   -2.3742    0.0000 H   0  0  0

+    4.2590   -2.2992    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  7 10  1  0

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+ 14 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+65176-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 48                          1 V2000

+   -0.7589    0.0475   -0.1159 C   0  0  0

+   -2.0383   -0.4239    0.1614 C   0  0  0

+   -0.5621    1.4373   -0.1515 C   0  0  0

+    0.2117   -0.8399   -0.3615 O   0  0  0

+   -3.1024    0.4416    0.3578 C   0  0  0

+   -2.5644   -1.8354    0.3233 C   0  0  0

+   -1.6323    2.3192    0.0305 C   0  0  0

+    0.8104    1.9399   -0.3625 C   0  0  0

+    1.4690   -0.4314   -0.1521 C   0  0  0

+   -4.2553   -0.2410    0.5952 O   0  0  0

+   -2.8944    1.8219    0.2881 C   0  0  0

+   -3.9488   -1.5841    0.9995 C   0  0  0

+   -2.9833   -2.3572   -1.0384 C   0  0  0

+   -1.4311    3.6588   -0.0463 O   0  0  0

+    1.8593    0.9167   -0.1721 C   0  0  0

+    1.0557    3.0938   -0.6665 O   0  0  0

+    2.4500   -1.3953    0.0967 C   0  0  0

+   -4.7958   -2.4827    0.2579 O   0  0  0

+   -4.2542   -2.6861   -0.9636 C   0  0  0

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+    3.5597    2.5935   -0.0789 O   0  0  0

+    4.7084   -1.9758    0.5297 O   0  0  0

+    2.2242   -3.2286   -1.1718 C   0  0  0

+    5.9582   -1.2988    0.6770 C   0  0  0

+   -1.6726   -2.3420    0.0000 H   0  0  0

+   -3.6967    2.4608    0.0000 H   0  0  0

+   -4.9385   -1.3147    0.0000 H   0  0  0

+   -2.4265   -3.2186    0.0000 H   0  0  0

+   -4.3085   -3.7103    0.0000 H   0  0  0

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+   -3.1495    3.3596    0.0000 H   0  0  0

+    5.1467    0.5654    0.0000 H   0  0  0

+    3.8329    3.5821    0.0000 H   0  0  0

+    1.2250   -3.4599    0.0000 H   0  0  0

+    2.4555   -4.2278    0.0000 H   0  0  0

+    3.2234   -2.9973    0.0000 H   0  0  0

+    6.4467   -2.2007    0.0000 H   0  0  0

+    6.8601   -0.8103    0.0000 H   0  0  0

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+  1  2  1  0

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+ 27 39  1  0

+ 27 40  1  0

+ 27 41  1  0

+ 28 42  1  0

+ 28 43  1  0

+ 28 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-76-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    0.8752   -0.1936    0.0379 C   0  0  0

+   -0.4677   -0.8181   -0.3463 C   0  0  0

+    2.0141   -1.0612   -0.5016 C   0  0  0

+    0.9751    1.2102   -0.5625 C   0  0  0

+   -1.6066    0.0495    0.1932 C   0  0  0

+    2.8410   -1.6015    0.6668 C   0  0  0

+    1.8065    2.0247    0.2665 O   0  0  0

+   -2.9494   -0.5751   -0.1910 C   0  0  0

+   -4.0883    0.2925    0.3485 C   0  0  0

+    1.8537    0.2485    0.0000 H   0  0  0

+   -1.2473   -1.5565    0.0000 H   0  0  0

+    0.1358   -1.7063    0.0000 H   0  0  0

+    1.0338   -1.4993    0.0000 H   0  0  0

+    1.9291   -2.1316    0.0000 H   0  0  0

+    0.4668    2.1561    0.0000 H   0  0  0

+   -0.0749    0.9853    0.0000 H   0  0  0

+   -0.8270    0.7880    0.0000 H   0  0  0

+   -2.2101    0.9376    0.0000 H   0  0  0

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+    3.4284   -0.7026    0.0000 H   0  0  0

+    2.5735    2.7761    0.0000 H   0  0  0

+   -3.7290   -1.3136    0.0000 H   0  0  0

+   -2.3459   -1.4632    0.0000 H   0  0  0

+   -3.4376    1.1467    0.0000 H   0  0  0

+   -4.9425    0.9432    0.0000 H   0  0  0

+   -4.7390   -0.5617    0.0000 H   0  0  0

+  1  2  1  0

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+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+  9 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20983-67-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.9089   -1.1947   -0.0245 C   0  0  0

+   -0.3283   -1.8433   -0.0415 N   0  0  0

+    1.4994   -0.8531    1.1860 C   0  0  0

+    1.5542   -0.8948   -1.2174 C   0  0  0

+   -1.5095   -1.0961   -0.0283 C   0  0  0

+    2.7224   -0.2124    1.1993 C   0  0  0

+    2.7775   -0.2538   -1.1969 C   0  0  0

+   -2.7348   -1.7340    0.1158 C   0  0  0

+   -1.4597    0.2867   -0.1536 C   0  0  0

+    3.3598    0.0893    0.0094 C   0  0  0

+   -3.9004   -0.9930    0.1290 C   0  0  0

+   -2.6281    1.0224   -0.1397 C   0  0  0

+    4.6707    0.7766    0.0275 N   0  3  0

+   -3.8481    0.3835   -0.0012 C   0  0  0

+    5.2331    1.0430   -1.0195 O   0  0  0

+    5.1868    1.0758    1.0894 O   0  5  0

+   -5.3151    1.3116    0.0153 Cl  0  0  0

+   -0.3703   -2.8780    0.0000 H   0  0  0

+    0.9998    0.0539    0.0000 H   0  0  0

+    2.0129   -1.8232    0.0000 H   0  0  0

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+    3.2808   -1.1588    0.0000 H   0  0  0

+   -2.7795   -2.7686    0.0000 H   0  0  0

+   -0.5443    0.7708    0.0000 H   0  0  0

+   -4.8173   -1.4742    0.0000 H   0  0  0

+   -2.5869    2.0571    0.0000 H   0  0  0

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+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13552-44-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 32                          1 V2000

+   -5.7958   -1.4091    0.5014 C   0  0  0

+   -6.7719   -0.3388    0.9172 C   0  0  0

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+   -4.9689    2.9769    0.9568 C   0  0  0

+   -3.0987   -4.3658   -0.6474 N   0  0  0

+   -5.2952    3.4846   -0.2946 C   0  0  0

+   -4.8123    4.7338   -0.6908 N   0  0  0

+    9.2689   -0.0931   -0.6266 Cl  0  0  0

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+   -7.5578    0.1142    0.0000 H   0  0  0

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+   -3.3732   -5.2303    0.0000 H   0  0  0

+   -2.2127   -4.1713    0.0000 H   0  0  0

+   -3.9161    4.8736    0.0000 H   0  0  0

+   -5.3815    5.4401    0.0000 H   0  0  0

+   10.1760   -0.0931    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26289-39-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 51                          1 V2000

+    1.4559    0.3964    0.5213 S   0  0  0

+    0.8220   -1.2011   -0.0592 C   0  0  0

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+   -2.3138   -3.1194    0.2350 N   0  0  0

+   -0.6598   -3.1619   -1.2429 O   0  0  0

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+   -1.8557   -4.5580    0.0000 H   0  0  0

+   -5.3567    1.7007    0.0000 H   0  0  0

+   -4.4486    0.9549    0.0000 H   0  0  0

+   -5.6861    2.3063    0.0000 H   0  0  0

+   -5.1653   -6.7945    0.0000 H   0  0  0

+   -3.1689    4.0456    0.0000 H   0  0  0

+   -4.4872    5.1187    0.0000 H   0  0  0

+   -8.3709    2.4720    0.0000 H   0  0  0

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+ 26 47  1  0

+ 28 48  1  0

+ 30 49  1  0

+ 30 50  1  0

+ 32 51  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-70-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    1.7528    0.2557   -0.0849 C   0  0  0

+    0.4450   -0.2589   -0.6895 C   0  0  0

+    2.8951   -0.6129   -0.5452 C   0  0  0

+    1.9926    1.6968   -0.5397 C   0  0  0

+    1.6673    0.2142    1.3409 O   0  0  0

+   -0.7147    0.6230   -0.2223 C   0  0  0

+    3.6235   -1.2566    0.3330 C   0  0  0

+   -2.0029    0.1160   -0.8178 C   0  0  0

+   -3.0158   -0.1723   -0.0387 C   0  0  0

+   -3.5433   -1.5827    0.0204 C   0  0  0

+   -3.6535    0.9065    0.7983 C   0  0  0

+   -0.3285   -0.9633    0.0000 H   0  0  0

+    0.9979   -1.1470    0.0000 H   0  0  0

+    3.5585    0.1960    0.0000 H   0  0  0

+    3.0246    1.5251    0.0000 H   0  0  0

+    2.1643    2.7288    0.0000 H   0  0  0

+    0.9606    1.8685    0.0000 H   0  0  0

+    0.7261   -0.2426    0.0000 H   0  0  0

+    0.0587    1.3274    0.0000 H   0  0  0

+   -1.2676    1.5111    0.0000 H   0  0  0

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+   -2.5634   -1.9492    0.0000 H   0  0  0

+   -2.7529    1.4389    0.0000 H   0  0  0

+   -4.1859    1.8071    0.0000 H   0  0  0

+   -4.5541    0.3741    0.0000 H   0  0  0

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+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+87619-82-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+    0.1735   -0.2878    0.0618 C   0  0  0

+   -0.9791    0.3574   -0.1804 C   0  0  0

+    1.7099    0.5558   -0.1182 S   0  0  0

+    0.1494   -1.9508    0.5590 Cl  0  0  0

+   -2.2480   -0.3814   -0.1800 C   0  0  0

+   -0.9688    2.0648   -0.4941 Cl  0  0  0

+    3.2634   -0.3137    0.2083 C   0  0  0

+   -3.3822    0.2405    0.1497 C   0  0  0

+   -2.2732   -2.0635   -0.6082 Cl  0  0  0

+    4.4387    0.6388   -0.0200 C   0  0  1

+   -4.9030   -0.5786   -0.0230 Cl  0  0  0

+   -3.3364    1.8684    0.7510 Cl  0  0  0

+    5.7322   -0.0851    0.2518 C   0  0  0

+    4.4242    1.1097   -1.4114 N   0  0  0

+    6.2582   -0.0788    1.4867 O   0  0  0

+    6.2958   -0.6713   -0.6419 O   0  0  0

+    2.5888   -1.2260    0.0000 H   0  0  0

+    4.0833   -1.0980    0.0000 H   0  0  0

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+  7 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 14 20  1  0

+ 14 21  1  0

+ 15 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+145439-03-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.4850   -0.4397   -0.2722 C   0  0  0

+   -1.4594    0.5314   -0.0665 C   0  0  0

+    0.7761   -0.2644   -0.8827 C   0  0  0

+   -1.0054   -1.6163    0.2520 N   0  0  0

+   -2.4920   -0.0628    0.5422 N   0  0  0

+   -1.3756    1.8675   -0.4252 N   0  0  0

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+    0.9169   -0.5025   -2.0682 O   0  0  0

+   -2.2263   -1.3282    0.7367 C   0  0  0

+   -0.3480   -2.9254    0.2723 C   0  0  0

+   -2.4910    2.7737   -0.1404 C   0  0  0

+    1.7040    0.3150    1.1230 N   0  0  0

+    3.0993    0.4667   -0.8084 C   0  0  0

+    2.6136    0.8060    1.7672 O   0  0  0

+   -0.4964    2.2527    0.0000 H   0  0  0

+   -2.9134   -1.9985    0.0000 H   0  0  0

+   -1.2058   -3.3562    0.0000 H   0  0  0

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+ 11 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1576-67-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -3.6168   -2.4601    0.0012 C   0  0  0

+   -2.8292   -1.1753    0.0016 C   0  0  0

+   -1.4642   -1.2202    0.0004 C   0  0  0

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+    0.7328   -0.0309   -0.0003 C   0  0  0

+   -1.4115    1.2088    0.0014 C   0  0  0

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+    1.4642   -1.2202   -0.0003 C   0  0  0

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+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110004-69-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 55                          1 V2000

+   -1.3755    0.7468    0.9034 C   0  0  0

+   -2.3469   -0.1383    0.4110 C   0  0  0

+   -1.4772    2.1082    0.5379 C   0  0  0

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+ 25 48  1  0

+ 27 49  1  0

+ 30 50  1  0

+ 30 51  1  0

+ 30 52  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5344-87-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    1.2074   -0.4383   -0.8679 N   0  0  0

+    0.1588   -0.2009   -0.0550 C   0  0  0

+    2.5070   -0.1533   -0.4346 C   0  0  0

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+   -1.8578   -1.6336    0.1161 C   0  0  0

+   -2.3299    1.1813   -0.1380 Br  0  0  0

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+   -1.9688   -1.3859    1.6219 C   0  0  0

+   -3.2504   -1.8936   -0.4620 C   0  0  0

+   -0.9655   -2.8506   -0.1361 C   0  0  0

+    5.0768    0.4111    0.4217 C   0  0  0

+    1.2041   -1.4227    0.0000 H   0  0  0

+   -0.6694   -1.2017    0.0000 H   0  0  0

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+   -0.1716   -2.2685    0.0000 H   0  0  0

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+ 14 30  1  0

+ 15 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+138-42-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -2.5370    0.0089   -0.0700 S   0  0  0

+   -2.9155   -1.1804   -0.7493 O   0  0  0

+   -2.9151    1.3262   -0.4452 O   0  0  0

+   -3.0134   -0.1652    1.3650 O   0  0  0

+   -0.7752    0.0054   -0.0442 C   0  0  0

+   -0.0818    1.2010   -0.0441 C   0  0  0

+   -0.0866   -1.1931   -0.0183 C   0  0  0

+    1.3007    1.1983   -0.0239 C   0  0  0

+    1.2954   -1.1958    0.0020 C   0  0  0

+    1.9892    0.0001   -0.0038 C   0  0  0

+    3.4692   -0.0028    0.0179 N   0  3  0

+    4.0760   -1.0587    0.0356 O   0  0  0

+    4.0803    1.0508    0.0179 O   0  5  0

+   -3.9869   -0.5210    0.0000 H   0  0  0

+   -0.5983    2.0996    0.0000 H   0  0  0

+   -0.6067   -2.0897    0.0000 H   0  0  0

+    1.8207    2.0949    0.0000 H   0  0  0

+    1.8118   -2.0945    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  2  0

+  4  1  1  0

+  5  1  1  0

+  6  5  2  0

+  7  5  1  0

+  8  6  1  0

+  9  7  2  0

+ 10  8  2  0

+ 11 10  1  0

+ 12 11  2  0

+ 13 11  1  0

+  9 10  1  0

+  4 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98-57-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    2.3616    0.0000   -0.0225 S   0  0  0

+    0.5996    0.0000   -0.0115 C   0  0  0

+    2.7858    0.0043    1.7412 C   0  0  0

+    2.6728   -1.2449   -0.6328 O   0  0  0

+    2.6728    1.2419   -0.6389 O   0  0  0

+   -0.0912    1.1972   -0.0102 C   0  0  0

+   -0.0915   -1.1975   -0.0101 C   0  0  0

+   -1.4735    1.1979   -0.0020 C   0  0  0

+   -1.4734   -1.1981   -0.0020 C   0  0  0

+   -2.1655    0.0001    0.0047 C   0  0  0

+   -3.9014    0.0001    0.0149 Cl  0  0  0

+    2.7963   -1.0324    0.0000 H   0  0  0

+    3.8225    0.0148    0.0000 H   0  0  0

+    2.7753    1.0410    0.0000 H   0  0  0

+    0.4275    2.0948    0.0000 H   0  0  0

+    0.4271   -2.0952    0.0000 H   0  0  0

+   -1.9915    2.0959    0.0000 H   0  0  0

+   -1.9915   -2.0961    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  7  9  2  0

+  8 10  2  0

+ 10 11  1  0

+  9 10  1  0

+  3 12  1  0

+  3 13  1  0

+  3 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+38914-97-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 52                          1 V2000

+   -5.4737    1.1350    0.2609 C   0  0  0

+   -6.1067    1.2909   -0.9883 C   0  0  0

+   -5.1110    2.3014    0.9627 C   0  0  0

+   -5.2229   -0.1163    0.7811 N   0  0  0

+   -6.3529    2.5968   -1.4876 C   0  0  0

+   -6.4964    0.1724   -1.7449 C   0  0  0

+   -5.3917    3.5726    0.3958 C   0  0  0

+   -4.4759    2.2232    2.2140 C   0  0  0

+   -3.8908   -0.5123    0.3048 C   0  0  0

+   -5.9919    3.6721   -0.7890 N   0  0  0

+   -6.9871    2.7384   -2.7389 C   0  0  0

+   -7.1056    0.3519   -2.9482 C   0  0  0

+   -5.0233    4.7318    1.1091 C   0  0  0

+   -4.1362    3.3658    2.8699 C   0  0  0

+   -3.5468   -1.9006    0.8483 C   0  0  0

+   -7.3501    1.6333   -3.4420 C   0  0  0

+   -4.4109    4.6167    2.3169 C   0  0  0

+   -2.1594   -2.3130    0.3522 C   0  0  0

+   -1.8291   -3.6459    0.8740 N   0  0  0

+   -0.4928   -3.9798    0.3633 C   0  0  0

+   -1.7022   -3.5092    2.3311 C   0  0  0

+   -0.5868   -5.2051   -0.5482 C   0  0  0

+   -2.3622   -4.7081    3.0151 C   0  0  0

+    1.0534   -5.6150   -1.1750 Cl  0  0  0

+   12.9537    0.3749    0.1766 Cl  0  0  0

+   21.3550    2.3614   -0.5114 Cl  0  0  0

+   -5.9016   -0.7358    0.0000 H   0  0  0

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+   -3.7711    5.2763    0.0000 H   0  0  0

+   -1.2425   -2.2527    0.0000 H   0  0  0

+   -2.0570   -1.3998    0.0000 H   0  0  0

+    0.4180   -4.1013    0.0000 H   0  0  0

+   -0.3204   -3.0772    0.0000 H   0  0  0

+   -0.7850   -3.5655    0.0000 H   0  0  0

+   -2.0436   -2.6561    0.0000 H   0  0  0

+   -1.4976   -5.0835    0.0000 H   0  0  0

+   -0.7592   -6.1077    0.0000 H   0  0  0

+   -3.1672   -4.2650    0.0000 H   0  0  0

+   -2.8053   -5.5131    0.0000 H   0  0  0

+   -1.5572   -5.1512    0.0000 H   0  0  0

+   13.8726    0.3749    0.0000 H   0  0  0

+   22.2739    2.3614    0.0000 H   0  0  0

+  1  2  1  0

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+  7 10  2  0

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+ 22 47  1  0

+ 23 48  1  0

+ 23 49  1  0

+ 23 50  1  0

+ 25 51  1  0

+ 26 52  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64000-73-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -0.1405    0.5328   -0.0188 C   0  0  0

+   -1.3744    1.1100   -0.3166 N   0  0  0

+    0.9107    1.3500    0.5839 C   0  0  0

+    0.0585   -0.7339   -0.2777 N   0  0  0

+   -2.4352    0.3001   -0.9208 C   0  0  0

+   -1.6101    2.5263   -0.0252 C   0  0  0

+    2.1800    0.8705    0.6356 C   0  0  0

+    1.3014   -1.3203    0.0227 N   0  0  0

+   -3.2855   -0.3321    0.1829 C   0  0  0

+    2.4140   -0.4709    0.0735 C   0  0  0

+   -4.3933   -1.1780   -0.4481 C   0  0  0

+   -2.4607   -1.1625    1.0028 O   0  0  0

+    3.5957   -0.8479   -0.3509 N   0  0  0

+    4.6811    0.0348   -0.2769 N   0  0  0

+    0.7586    2.3580    0.0000 H   0  0  0

+   -2.3132   -0.7120    0.0000 H   0  0  0

+   -1.4960   -0.0963    0.0000 H   0  0  0

+   -0.6045    2.6937    0.0000 H   0  0  0

+   -1.7775    3.5319    0.0000 H   0  0  0

+   -2.6157    2.3589    0.0000 H   0  0  0

+    2.9655    1.5203    0.0000 H   0  0  0

+    1.4089   -2.3341    0.0000 H   0  0  0

+   -3.8990    0.4821    0.0000 H   0  0  0

+   -5.0120   -0.3678    0.0000 H   0  0  0

+   -5.2035   -1.7967    0.0000 H   0  0  0

+   -3.7746   -1.9882    0.0000 H   0  0  0

+   -1.7423   -1.8858    0.0000 H   0  0  0

+    5.6336   -0.3285    0.0000 H   0  0  0

+    4.5195    1.0414    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  8 10  1  0

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+ 11 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2381-15-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.6070    0.0032   -0.0024 C   0  0  0

+   -2.0075   -0.4440   -0.0016 C   0  0  0

+   -0.3299    1.4407    0.0000 C   0  0  0

+    0.4320   -0.9123    0.0002 C   0  0  0

+   -3.0386    0.5186    0.0015 C   0  0  0

+   -2.3270   -1.8028   -0.0035 C   0  0  0

+    0.9827    1.8987   -0.0002 C   0  0  0

+   -1.4477    2.3831    0.0032 C   0  0  0

+    1.7543   -0.4576   -0.0007 C   0  0  0

+   -2.7201    1.9429    0.0035 C   0  0  0

+   -4.3735    0.0901    0.0024 C   0  0  0

+   -3.6474   -2.1921   -0.0022 C   0  0  0

+    2.0350    0.9799   -0.0028 C   0  0  0

+    2.8361   -1.3605    0.0026 C   0  0  0

+   -4.6620   -1.2435    0.0001 C   0  0  0

+    3.3782    1.4081   -0.0031 C   0  0  0

+    4.1081   -0.8824    0.0022 C   0  0  0

+    4.3758    0.4856   -0.0056 C   0  0  0

+    5.2586   -1.8558    0.0063 C   0  0  0

+    0.2283   -1.9405    0.0000 H   0  0  0

+   -1.5654   -2.5231    0.0000 H   0  0  0

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+   -1.2562    3.4137    0.0000 H   0  0  0

+   -3.5020    2.6410    0.0000 H   0  0  0

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+   -3.8890   -3.2121    0.0000 H   0  0  0

+    2.6608   -2.3940    0.0000 H   0  0  0

+   -5.6625   -1.5563    0.0000 H   0  0  0

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+    5.3722    0.8110    0.0000 H   0  0  0

+    4.5815   -2.6560    0.0000 H   0  0  0

+    6.0588   -2.5329    0.0000 H   0  0  0

+    5.9357   -1.0556    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  3  7  2  0

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+  8 10  2  0

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+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+41340-25-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+    1.9779    0.2948   -0.4169 C   0  0  0

+    0.4875    0.3866   -0.1976 C   0  0  0

+    2.4939    1.6105   -0.6344 O   0  0  0

+    2.6412   -0.3184    0.8179 C   0  0  0

+    2.2633   -0.5767   -1.6416 C   0  0  0

+   -0.1178    1.5425    0.1693 C   0  0  0

+   -0.4471   -0.6021   -0.3198 N   0  0  0

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+    2.0402   -1.6733    1.0902 C   0  0  0

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+   -1.6876   -0.1028   -0.0368 C   0  0  0

+    2.3608   -2.3365    2.2124 O   0  0  0

+    1.2698   -2.1626    0.2985 O   0  0  0

+   -2.6300    2.0674    0.6193 C   0  0  0

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+   -4.9552   -0.2821    0.0000 H   0  0  0

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+ 20 38  1  0

+ 20 39  1  0

+ 21 40  1  0

+ 21 41  1  0

+ 21 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+77-90-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 62 61                          1 V2000

+   -0.0052    0.5734    0.1638 C   0  0  0

+   -1.2548    0.6567    1.0428 C   0  0  0

+    1.2437    0.6499    1.0443 C   0  0  0

+   -0.0083   -0.7307   -0.5914 C   0  0  0

+   -0.0016    1.6783   -0.7783 O   0  0  0

+   -2.4849    0.5814    0.1756 C   0  0  0

+    2.4745    0.5678    0.1785 C   0  0  0

+   -0.0119   -1.8940    0.0782 O   0  0  0

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+   -0.0149   -3.1505   -0.6494 C   0  0  0

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+   -5.3707   -0.2263    0.0000 H   0  0  0

+   -4.4125   -0.2288    0.0000 H   0  0  0

+    4.3980   -0.2529    0.0000 H   0  0  0

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+   -0.8178   -3.8502    0.0000 H   0  0  0

+   -0.8204   -4.7747    0.0000 H   0  0  0

+   -5.6578    1.4353    0.0000 H   0  0  0

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+    5.6511    1.4044    0.0000 H   0  0  0

+    0.7773   -6.1032    0.0000 H   0  0  0

+    0.7799   -5.1787    0.0000 H   0  0  0

+   -7.8691   -0.2193    0.0000 H   0  0  0

+   -6.9110   -0.2220    0.0000 H   0  0  0

+    6.8965   -0.2598    0.0000 H   0  0  0

+    7.8547   -0.2623    0.0000 H   0  0  0

+   -0.9499   -6.7999    0.0000 H   0  0  0

+   -0.0286   -7.7272    0.0000 H   0  0  0

+    0.8987   -6.8059    0.0000 H   0  0  0

+   -8.5760    1.5754    0.0000 H   0  0  0

+   -9.5598    0.7146    0.0000 H   0  0  0

+   -8.6990   -0.2692    0.0000 H   0  0  0

+    8.6831   -0.3167    0.0000 H   0  0  0

+    9.5492    0.6624    0.0000 H   0  0  0

+    8.5701    1.5285    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+ 15 20  1  0

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+ 19 22  1  0

+ 20 23  1  0

+ 21 24  1  0

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+ 23 26  1  0

+ 24 27  1  0

+ 25 28  1  0

+  2 29  1  0

+  2 30  1  0

+  3 31  1  0

+  3 32  1  0

+ 15 33  1  0

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+ 27 57  1  0

+ 27 58  1  0

+ 27 59  1  0

+ 28 60  1  0

+ 28 61  1  0

+ 28 62  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1955-45-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.7119   -0.1470    0.0020 C   0  0  0

+   -0.8029   -0.1241   -0.0543 C   0  0  0

+    0.6123    1.2374    0.6651 C   0  0  0

+    1.2773   -1.2308    0.9221 C   0  0  0

+    1.3794   -0.1236   -1.3745 C   0  0  0

+   -0.6875    1.2247   -0.0049 O   0  0  0

+   -1.6980   -0.9334   -0.1156 O   0  0  0

+    1.5859    1.2872    0.0000 H   0  0  0

+    0.5826    2.2118    0.0000 H   0  0  0

+    0.4130   -1.6817    0.0000 H   0  0  0

+    1.7282   -2.0951    0.0000 H   0  0  0

+    2.1416   -0.7799    0.0000 H   0  0  0

+    1.4136   -1.0979    0.0000 H   0  0  0

+    2.3537   -0.0894    0.0000 H   0  0  0

+    1.3452    0.8507    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  6  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53609-64-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+    0.0057   -0.5538   -0.6621 N   0  0  0

+   -1.2519    0.0601   -1.0953 C   0  0  0

+    1.2840    0.0723   -1.0088 C   0  0  0

+   -0.0126   -1.6428    0.0292 N   0  0  0

+   -1.9855    0.6315    0.1196 C   0  0  0

+    1.9693    0.5717    0.2647 C   0  0  0

+    1.0330   -2.1532    0.3893 O   0  0  0

+   -3.2050    1.4279   -0.3491 C   0  0  0

+   -2.4119   -0.4385    0.9653 O   0  0  0

+    3.3927    1.0248   -0.0662 C   0  0  0

+    1.2321    1.6716    0.8022 O   0  0  0

+   -2.0900   -0.3496    0.0000 H   0  0  0

+   -1.2516   -0.8728    0.0000 H   0  0  0

+    1.2746   -0.8605    0.0000 H   0  0  0

+    2.1134   -0.3548    0.0000 H   0  0  0

+   -1.4434    1.3907    0.0000 H   0  0  0

+    2.3909   -0.2604    0.0000 H   0  0  0

+   -2.6949    2.2090    0.0000 H   0  0  0

+   -3.9861    1.9380    0.0000 H   0  0  0

+   -3.7151    0.6468    0.0000 H   0  0  0

+   -2.7572   -1.3051    0.0000 H   0  0  0

+    3.6757    0.1359    0.0000 H   0  0  0

+    4.2816    1.3078    0.0000 H   0  0  0

+    3.1097    1.9137    0.0000 H   0  0  0

+    0.7127    2.4465    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  6 11  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  3 15  1  0

+  5 16  1  0

+  6 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-89-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.0549    0.6533   -0.3869 C   0  0  0

+   -1.3002    0.5679    0.3183 C   0  0  0

+    0.7798    1.9265    0.0540 C   0  0  0

+    1.0502   -0.7860    0.0472 Cl  0  0  0

+   -1.9773   -0.6212   -0.0936 O   0  0  0

+   -0.5078    1.5546    0.0000 H   0  0  0

+   -1.1618    1.6214    0.0000 H   0  0  0

+   -2.3074    0.9063    0.0000 H   0  0  0

+    1.7032    1.4008    0.0000 H   0  0  0

+    1.3055    2.8499    0.0000 H   0  0  0

+   -0.1436    2.4522    0.0000 H   0  0  0

+   -2.5031   -1.5445    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+34798-80-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -1.0101    0.9751   -1.0910 C   0  0  0

+   -2.5393    0.9356   -1.0666 C   0  0  0

+   -3.0272    1.4076    0.2336 N   0  0  0

+   -2.5902    0.4368    1.2426 C   0  0  0

+   -1.0637    0.4489    1.3454 C   0  0  0

+   -0.4647    0.0429   -0.0047 C   0  0  0

+   -0.8500   -1.3794   -0.3204 C   0  0  0

+   -1.6496   -1.9571    0.3761 O   0  0  0

+   -0.2375   -2.0808   -1.5053 C   0  0  0

+    1.0368    0.1581    0.0518 C   0  0  0

+    1.6625    1.2876   -0.4425 C   0  0  0

+    3.0396    1.3933   -0.3906 C   0  0  0

+    3.7915    0.3695    0.1554 C   0  0  0

+    3.1660   -0.7596    0.6495 C   0  0  0

+    1.7880   -0.8628    0.6029 C   0  0  0

+   -0.1118    1.3148    0.0000 H   0  0  0

+   -1.1949    1.9175    0.0000 H   0  0  0

+   -3.3614    0.4392    0.0000 H   0  0  0

+   -2.2697    0.0138    0.0000 H   0  0  0

+   -3.5793    2.1934    0.0000 H   0  0  0

+   -3.5119    0.1671    0.0000 H   0  0  0

+   -2.4502   -0.5133    0.0000 H   0  0  0

+   -0.3007    1.0322    0.0000 H   0  0  0

+   -1.3752    1.3574    0.0000 H   0  0  0

+   -0.9609   -2.7125    0.0000 H   0  0  0

+    0.3942   -2.8042    0.0000 H   0  0  0

+    0.4859   -1.4491    0.0000 H   0  0  0

+    1.1436    2.0958    0.0000 H   0  0  0

+    3.4403    2.2661    0.0000 H   0  0  0

+    4.7499    0.4307    0.0000 H   0  0  0

+    3.6841   -1.5682    0.0000 H   0  0  0

+    1.3869   -1.7354    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  3  1  0

+  5  4  1  0

+  6  1  1  0

+  7  6  1  0

+  8  7  2  0

+  9  7  1  0

+ 10  6  1  0

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+ 12 11  2  0

+ 13 12  1  0

+ 14 13  2  0

+ 15 10  2  0

+  5  6  1  0

+ 14 15  1  0

+  1 16  1  0

+  1 17  1  0

+  2 18  1  0

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+  9 25  1  0

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+  9 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119631-00-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -4.0993    0.7388    0.0019 C   0  0  0

+   -4.4569   -0.6047    0.0000 C   0  0  0

+   -2.7610    1.1001    0.0024 C   0  0  0

+   -5.0889    1.7249   -0.0026 N   0  0  0

+   -3.4818   -1.5852   -0.0013 C   0  0  0

+   -5.9127   -0.9940   -0.0001 C   0  0  0

+   -1.7760    0.1104    0.0011 C   0  0  0

+   -2.1470   -1.2376   -0.0007 C   0  0  0

+   -0.4540    0.4582    0.0016 N   0  0  0

+    0.4540   -0.4581    0.0004 N   0  0  0

+    1.7760   -0.1103    0.0009 C   0  0  0

+    2.7613   -1.1002   -0.0004 C   0  0  0

+    2.1468    1.2374   -0.0030 C   0  0  0

+    4.0992   -0.7390    0.0002 C   0  0  0

+    3.4821    1.5851   -0.0024 C   0  0  0

+    4.4568    0.6049    0.0016 C   0  0  0

+    5.0887   -1.7251   -0.0011 N   0  0  0

+    5.9127    0.9942    0.0017 C   0  0  0

+   -2.4909    2.1072    0.0000 H   0  0  0

+   -4.8208    2.7326    0.0000 H   0  0  0

+   -6.0956    1.4532    0.0000 H   0  0  0

+   -3.7566   -2.5910    0.0000 H   0  0  0

+   -6.1821    0.0133    0.0000 H   0  0  0

+   -6.9200   -1.2634    0.0000 H   0  0  0

+   -5.6433   -2.0013    0.0000 H   0  0  0

+   -1.4148   -1.9800    0.0000 H   0  0  0

+    2.4912   -2.1073    0.0000 H   0  0  0

+    1.4146    1.9798    0.0000 H   0  0  0

+    3.7569    2.5909    0.0000 H   0  0  0

+    4.8206   -2.7327    0.0000 H   0  0  0

+    6.0954   -1.4535    0.0000 H   0  0  0

+    6.1821   -0.0131    0.0000 H   0  0  0

+    6.9200    1.2636    0.0000 H   0  0  0

+    5.6433    2.0015    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  7  8  1  0

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+ 12 27  1  0

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+ 15 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97-77-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 35                          1 V2000

+    3.3712   -0.2757    0.0005 N   0  0  0

+    2.1281    0.2448   -0.0081 C   0  0  0

+    4.3925    0.2517   -0.9078 C   0  0  0

+    3.7030   -1.3649    0.9224 C   0  0  0

+    0.9347   -0.3716    1.0534 S   0  0  0

+    1.7424    1.5223   -1.0804 S   0  0  0

+    5.1430    1.3953   -0.2224 C   0  0  0

+    3.4215   -2.7085    0.2467 C   0  0  0

+   -0.9655    0.4240    1.0403 S   0  0  0

+   -2.1611   -0.2321    0.0054 C   0  0  0

+   -3.4042    0.2884   -0.0032 N   0  0  0

+   -1.7775   -1.5494   -1.0186 S   0  0  0

+   -4.4273   -0.2730   -0.8888 C   0  0  0

+   -3.7324    1.4156    0.8731 C   0  0  0

+   -5.0257   -1.5262   -0.2466 C   0  0  0

+   -3.2270    2.7151    0.2433 C   0  0  0

+    4.5177   -0.7513    0.0000 H   0  0  0

+    5.3770    0.0230    0.0000 H   0  0  0

+    4.5579   -1.9041    0.0000 H   0  0  0

+    4.5065   -0.7517    0.0000 H   0  0  0

+    5.9880    0.8407    0.0000 H   0  0  0

+    5.6976    2.2403    0.0000 H   0  0  0

+    4.2980    1.9499    0.0000 H   0  0  0

+    2.4322   -2.5012    0.0000 H   0  0  0

+    3.2142   -3.6978    0.0000 H   0  0  0

+    4.4108   -2.9158    0.0000 H   0  0  0

+   -4.6143    0.7203    0.0000 H   0  0  0

+   -5.4296   -0.1423    0.0000 H   0  0  0

+   -4.5206    2.0483    0.0000 H   0  0  0

+   -4.5729    0.8542    0.0000 H   0  0  0

+   -5.9378   -1.0907    0.0000 H   0  0  0

+   -5.4612   -2.4383    0.0000 H   0  0  0

+   -4.1136   -1.9617    0.0000 H   0  0  0

+   -2.2850    2.3487    0.0000 H   0  0  0

+   -2.8606    3.6571    0.0000 H   0  0  0

+   -4.1690    3.0815    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 13 27  1  0

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+ 15 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 16 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90-41-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.8170    0.1871   -0.0011 C   0  0  0

+   -0.6651    0.2397   -0.0018 C   0  0  0

+    1.5155    0.1605    1.2050 C   0  0  0

+    1.5165    0.1584   -1.2061 C   0  0  0

+   -1.4110   -0.9452    0.0001 C   0  0  0

+   -1.3215    1.4676    0.0013 C   0  0  0

+    2.8945    0.1116    1.1997 C   0  0  0

+    2.8959    0.1096   -1.1993 C   0  0  0

+   -2.7971   -0.8855   -0.0002 C   0  0  0

+   -0.7633   -2.1804    0.0028 N   0  0  0

+   -2.7014    1.5115    0.0010 C   0  0  0

+    3.5838    0.0891    0.0004 C   0  0  0

+   -3.4367    0.3393   -0.0024 C   0  0  0

+    1.4774   -0.8747    0.0000 H   0  0  0

+    1.4770   -0.8767    0.0000 H   0  0  0

+   -0.7749    2.3475    0.0000 H   0  0  0

+    2.8592   -0.9237    0.0000 H   0  0  0

+    2.8622   -0.9257    0.0000 H   0  0  0

+   -3.3529   -1.7597    0.0000 H   0  0  0

+   -1.3173   -3.0557    0.0000 H   0  0  0

+    0.2717   -2.2225    0.0000 H   0  0  0

+   -3.1883    2.4258    0.0000 H   0  0  0

+    4.6192    0.0568    0.0000 H   0  0  0

+   -4.4718    0.3802    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

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+  3 14  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+66734-13-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 73 76                          1 V2000

+    1.6688   -0.6887    0.1348 C   0  0  2

+    0.3381   -0.0546   -0.2574 C   0  0  2

+    1.7035   -0.6434    1.6829 C   0  0  1

+    2.8145    0.1060   -0.4367 C   0  0  0

+    1.7273   -2.0632   -0.3297 O   0  0  0

+   -0.5812   -0.3803    0.9504 C   0  0  1

+   -0.3374   -0.6189   -1.4924 C   0  0  0

+    0.5028    1.4604   -0.3939 C   0  0  0

+    0.3371   -0.0587    2.1345 C   0  0  0

+    1.8569   -2.0634    2.2314 C   0  0  0

+    3.9130    0.6019    0.4681 C   0  0  0

+    2.8525    0.3455   -1.6197 O   0  0  0

+    2.8976   -2.5888   -0.7246 C   0  0  0

+   -1.8137    0.4953    0.8179 C   0  0  1

+   -1.6486    0.1586   -1.6882 C   0  0  1

+    4.8915    1.3347   -0.3154 O   0  0  0

+    2.9425   -3.9814   -1.2990 C   0  0  0

+    3.9149   -1.9455   -0.6196 O   0  0  0

+   -2.5496    0.0633   -0.4604 C   0  0  2

+   -2.7271    0.2945    2.0287 C   0  0  1

+   -1.3532    1.5306   -1.9569 O   0  0  0

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+    4.3850   -4.3353   -1.6661 C   0  0  0

+   -3.7733    0.9627   -0.6591 C   0  0  2

+   -3.9479    1.2124    1.9096 C   0  0  0

+   -3.2709   -1.4234    2.0928 Cl  0  0  0

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+   -4.6203    0.9333    0.5785 C   0  0  0

+   -4.5073    0.5860   -1.9004 C   0  0  0

+   -3.2723    2.3958   -0.8490 C   0  0  0

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+   -6.6008    0.3547   -0.7057 C   0  0  0

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+   -4.1987   -0.2783    0.0000 H   0  0  0

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+   -4.1386    2.6986    0.0000 H   0  0  0

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+   -5.7305   -0.6070    0.0000 H   0  0  0

+  1  2  1  0

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+ 32 69  1  0

+ 32 70  1  0

+ 32 71  1  0

+ 33 72  1  0

+ 34 73  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+632-21-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+   -0.0001   -0.7647   -0.0008 C   0  0  0

+   -1.2181   -0.0107   -0.4686 C   0  0  0

+    1.2184   -0.0118    0.4679 C   0  0  0

+   -0.0022   -1.9723    0.0033 O   0  0  0

+   -2.6962   -0.9848   -0.1266 Cl  0  0  0

+   -1.3213    1.5643    0.4029 Cl  0  0  0

+    2.6959   -0.9865    0.1248 Cl  0  0  0

+    1.3225    1.5640   -0.4021 Cl  0  0  0

+   -0.2033    0.5989    0.0000 H   0  0  0

+    0.2041    0.5985    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  2  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+298-81-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    0.6514   -0.1126   -0.0914 C   0  0  0

+   -0.5148   -0.8590   -0.1871 C   0  0  0

+    0.5811    1.2855    0.0760 C   0  0  0

+    1.8589   -0.7199   -0.1521 O   0  0  0

+   -1.7524   -0.2285   -0.1180 C   0  0  0

+   -0.4472   -2.2081   -0.3491 O   0  0  0

+   -0.6575    1.9231    0.1459 C   0  0  0

+    1.8265    2.0533    0.1753 C   0  0  0

+    3.0005   -0.0214   -0.0616 C   0  0  0

+   -1.8194    1.1683    0.0492 C   0  0  0

+   -3.0217   -0.6831   -0.1789 O   0  0  0

+   -0.4336   -2.7811    0.9599 C   0  0  0

+    3.0027    1.3804    0.1012 C   0  0  0

+    4.0635   -0.6126   -0.1217 O   0  0  0

+   -3.2528    1.4910    0.0808 C   0  0  0

+   -3.9004    0.3280   -0.0620 C   0  0  0

+   -0.7092    2.9492    0.0000 H   0  0  0

+    1.8096    3.0805    0.0000 H   0  0  0

+   -1.4607   -2.8055    0.0000 H   0  0  0

+   -0.4092   -3.8082    0.0000 H   0  0  0

+    0.5935   -2.7567    0.0000 H   0  0  0

+    3.8918    1.8951    0.0000 H   0  0  0

+   -3.6723    2.4288    0.0000 H   0  0  0

+   -4.9223    0.2217    0.0000 H   0  0  0

+  1  2  2  0

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+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98600-98-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+    0.2352   -0.2032   -0.1216 C   0  0  0

+   -1.1995   -0.4717   -0.2112 C   0  0  0

+    0.6675    1.1893    0.0441 C   0  0  0

+    1.1708   -1.2267   -0.1841 C   0  0  0

+   -2.0899    0.5862   -0.1364 C   0  0  0

+   -1.7090   -1.8428   -0.3778 C   0  0  0

+    2.0243    1.4938    0.1330 C   0  0  0

+   -0.3153    2.1994    0.1107 C   0  0  0

+    2.5300   -0.9233   -0.0947 C   0  0  0

+   -1.6341    1.8913    0.0227 C   0  0  0

+   -3.5684    0.3048   -0.2310 C   0  0  2

+   -2.9753   -2.1108   -0.0773 C   0  0  0

+    2.9656    0.4675    0.0643 C   0  0  0

+    0.1041    3.6367    0.2818 C   0  0  0

+    3.5082   -1.9382   -0.1543 C   0  0  0

+   -3.8868   -1.0310    0.4370 C   0  0  1

+   -3.9567    0.2545   -1.6054 O   0  0  0

+    4.3480    0.7393    0.1507 C   0  0  0

+    4.8222   -1.6080   -0.0650 C   0  0  0

+   -3.7260   -0.9064    1.8515 O   0  0  0

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+    0.8571   -2.2221    0.0000 H   0  0  0

+   -1.0273   -2.6331    0.0000 H   0  0  0

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+   -3.7331    1.3354    0.0000 H   0  0  0

+   -3.3141   -3.0980    0.0000 H   0  0  0

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+   -2.9010   -0.2671    0.0000 H   0  0  0

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+  8 10  2  0

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+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+150-13-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.5586    0.0198   -0.0011 C   0  0  0

+   -2.0323    0.0413   -0.0006 C   0  0  0

+    0.1597    1.2198    0.0005 C   0  0  0

+    0.1245   -1.2006    0.0026 C   0  0  0

+   -2.7230   -1.1159   -0.0021 O   0  0  0

+   -2.6245    1.1024    0.0013 O   0  0  0

+    1.5253    1.1993    0.0004 C   0  0  0

+    1.5009   -1.2140    0.0025 C   0  0  0

+    2.2077   -0.0144   -0.0012 C   0  0  0

+    3.5977   -0.0285   -0.0017 N   0  0  0

+   -0.3480    2.1313    0.0000 H   0  0  0

+   -0.4076   -2.0981    0.0000 H   0  0  0

+   -3.2578   -2.0118    0.0000 H   0  0  0

+    2.0589    2.0959    0.0000 H   0  0  0

+    2.0142   -2.1224    0.0000 H   0  0  0

+    4.1102   -0.9374    0.0000 H   0  0  0

+    4.1285    0.8698    0.0000 H   0  0  0

+  1  2  1  0

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+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2243-61-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -0.2394    0.7083   -0.0021 C   0  0  0

+   -0.2393   -0.7084   -0.0014 C   0  0  0

+    0.9886    1.4022   -0.0008 C   0  0  0

+   -1.4633    1.3969    0.0017 C   0  0  0

+    0.9889   -1.4020    0.0006 C   0  0  0

+   -1.4631   -1.3971   -0.0022 C   0  0  0

+    2.1715    0.6961    0.0011 C   0  0  0

+    1.0052    2.7999   -0.0020 N   0  0  0

+   -2.6307    0.6966    0.0061 C   0  0  0

+    2.1716   -0.6957    0.0018 C   0  0  0

+    1.0058   -2.7998    0.0009 N   0  0  0

+   -2.6306   -0.6970   -0.0036 C   0  0  0

+   -1.4779    2.4451    0.0000 H   0  0  0

+   -1.4776   -2.4453    0.0000 H   0  0  0

+    3.0832    1.2137    0.0000 H   0  0  0

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+    0.1043   -3.3349    0.0000 H   0  0  0

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+   -3.5428   -1.2137    0.0000 H   0  0  0

+  1  2  1  0

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+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+22071-15-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    0.3977   -0.8133   -0.3381 C   0  0  0

+   -0.7757   -0.8050    0.4199 C   0  0  0

+    1.6883   -1.1530    0.2958 C   0  0  0

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+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2039-87-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.3739    0.6348    0.0020 C   0  0  0

+   -0.3673   -0.5484    0.0001 C   0  0  0

+    1.7682    0.5774    0.0021 C   0  0  0

+   -0.3151    1.9424   -0.0024 C   0  0  0

+    0.2834   -1.7668   -0.0016 C   0  0  0

+   -2.1023   -0.4884    0.0005 Cl  0  0  0

+    2.4053   -0.6462    0.0004 C   0  0  0

+    0.3916    3.0641   -0.0006 C   0  0  0

+    1.6655   -1.8155   -0.0014 C   0  0  0

+    2.3247    1.4534    0.0000 H   0  0  0

+   -1.3521    1.9825    0.0000 H   0  0  0

+   -0.2659   -2.6473    0.0000 H   0  0  0

+    3.4421   -0.6898    0.0000 H   0  0  0

+    1.4286    3.0240    0.0000 H   0  0  0

+   -0.0922    3.9822    0.0000 H   0  0  0

+    2.1500   -2.7332    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  5  9  2  0

+  7  9  1  0

+  3 10  1  0

+  4 11  1  0

+  5 12  1  0

+  7 13  1  0

+  8 14  1  0

+  8 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+120388-69-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+    0.3073   -0.0831   -0.0011 C   0  0  0

+   -1.0363    0.3320   -0.0005 C   0  0  0

+    1.3368    0.8746    0.0002 C   0  0  0

+    0.6159   -1.5131    0.0031 C   0  0  0

+   -2.0620   -0.6359   -0.0014 C   0  0  0

+   -1.3423    1.7132    0.0004 C   0  0  0

+    2.7228    0.4035   -0.0004 C   0  0  0

+    1.0099    2.2392    0.0026 C   0  0  0

+    1.9437   -1.9273    0.0021 C   0  0  0

+   -0.4562   -2.4359    0.0075 C   0  0  0

+   -3.4546   -0.1647   -0.0008 C   0  0  0

+   -1.7447   -2.0007   -0.0024 C   0  0  0

+   -0.2909    2.6467    0.0008 C   0  0  0

+   -2.6907    2.1286    0.0006 C   0  0  0

+    2.9887   -0.9898   -0.0023 C   0  0  0

+    3.7876    1.3096    0.0003 C   0  0  0

+   -3.7037    1.2322    0.0007 C   0  0  0

+   -4.4585   -1.0285   -0.0020 N   0  0  0

+    4.3288   -1.4278   -0.0028 C   0  0  0

+    5.0723    0.8494   -0.0007 C   0  0  0

+   -5.6082   -0.6260   -0.0014 O   0  0  0

+    5.3399   -0.5168   -0.0016 C   0  0  0

+    1.7801    2.9584    0.0000 H   0  0  0

+    2.1679   -2.9569    0.0000 H   0  0  0

+   -0.2546   -3.4702    0.0000 H   0  0  0

+   -2.5251   -2.7087    0.0000 H   0  0  0

+   -0.5118    3.6770    0.0000 H   0  0  0

+   -2.9132    3.1586    0.0000 H   0  0  0

+    3.5984    2.3462    0.0000 H   0  0  0

+   -4.6989    1.5786    0.0000 H   0  0  0

+    4.5472   -2.4586    0.0000 H   0  0  0

+    5.8713    1.5363    0.0000 H   0  0  0

+    6.3395   -0.8503    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  7 15  2  0

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+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 22 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+114480-41-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+    0.2518    0.1453   -0.0041 C   0  0  0

+    0.1407   -1.2487   -0.0024 C   0  0  0

+    1.5852    0.7398   -0.0018 C   0  0  0

+   -0.9960    0.6506   -0.0024 N   0  0  0

+   -1.2154   -1.5239   -0.0052 N   0  0  0

+    1.2862   -2.0473    0.0015 C   0  0  0

+    2.7166   -0.1112    0.0021 C   0  0  0

+    1.7720    2.1281   -0.0038 C   0  0  0

+   -1.8685   -0.3272    0.0002 C   0  0  0

+   -1.8335   -2.8521   -0.0051 C   0  0  0

+    2.5311   -1.5071    0.0036 C   0  0  0

+    1.1361   -3.5468    0.0038 C   0  0  0

+    3.9432    0.4198    0.0038 N   0  0  0

+    3.0542    2.6074   -0.0019 C   0  0  0

+   -3.2443   -0.1690    0.0029 N   0  0  0

+    4.1247    1.7191    0.0019 C   0  0  0

+   -3.7805    1.0675    0.0024 C   0  0  0

+   -5.2776    1.2396    0.0053 C   0  0  0

+   -3.0581    2.0416   -0.0004 O   0  0  0

+    0.9601    2.7759    0.0000 H   0  0  0

+   -2.7752   -2.4139    0.0000 H   0  0  0

+   -2.2717   -3.7938    0.0000 H   0  0  0

+   -0.8918   -3.2903    0.0000 H   0  0  0

+    3.3600   -2.1330    0.0000 H   0  0  0

+    0.1026   -3.4433    0.0000 H   0  0  0

+    1.0326   -4.5803    0.0000 H   0  0  0

+    2.1696   -3.6503    0.0000 H   0  0  0

+    3.2273    3.6315    0.0000 H   0  0  0

+   -3.8630   -1.0033    0.0000 H   0  0  0

+    5.0932    2.0944    0.0000 H   0  0  0

+   -5.1590    2.2715    0.0000 H   0  0  0

+   -6.3095    1.3582    0.0000 H   0  0  0

+   -5.3962    0.2077    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+  5  9  1  0

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+ 14 16  1  0

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+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80-70-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -0.0105   -0.4649   -0.1987 C   0  0  0

+   -1.1809    0.2354   -0.0257 N   0  0  0

+    1.1887    0.0995    0.1667 N   0  0  0

+   -0.0383   -1.6659   -0.7043 N   0  0  0

+   -2.2198   -0.2835    0.8674 C   0  0  0

+   -1.3892    1.5005   -0.7345 C   0  0  0

+    2.1205    0.5698   -0.8613 C   0  0  0

+    1.5348    0.2307    1.5842 C   0  0  0

+   -0.0591   -2.5666    0.0000 H   0  0  0

+   -2.6224    0.5225    0.0000 H   0  0  0

+   -3.0258   -0.6861    0.0000 H   0  0  0

+   -1.8172   -1.0895    0.0000 H   0  0  0

+   -0.5002    1.6469    0.0000 H   0  0  0

+   -1.5356    2.3895    0.0000 H   0  0  0

+   -2.2782    1.3541    0.0000 H   0  0  0

+    2.5265   -0.2345    0.0000 H   0  0  0

+    2.9248    0.9758    0.0000 H   0  0  0

+    1.7145    1.3741    0.0000 H   0  0  0

+    1.8542   -0.6118    0.0000 H   0  0  0

+    2.3773    0.5501    0.0000 H   0  0  0

+    1.2154    1.0732    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  2  1  0

+  6  2  1  0

+  7  3  1  0

+  8  3  1  0

+  4  9  1  0

+  5 10  1  0

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+  5 12  1  0

+  6 13  1  0

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+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80734-02-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 59                          1 V2000

+   -1.6715   -1.8431   -1.2313 N   0  0  0

+   -2.7996   -1.1877   -1.9083 C   0  0  1

+   -0.6296   -0.9772   -0.6979 C   0  0  2

+   -2.5406   -2.4109   -0.3613 C   0  0  0

+   -3.7541   -1.6421   -0.8109 C   0  0  1

+   -2.4275    0.6022   -1.7423 S   0  0  0

+   -0.6527    0.4566   -1.2692 C   0  0  0

+    0.7194   -1.5982   -0.9540 C   0  0  0

+   -2.3910   -3.2572    0.4944 O   0  0  0

+   -3.9992   -0.5322    0.1135 N   0  0  0

+   -0.2792    1.4846   -0.1994 C   0  0  0

+    0.2587    0.5799   -2.4919 C   0  0  0

+    1.7836   -1.2127   -0.2324 O   0  0  0

+    0.8431   -2.4432   -1.8087 O   0  0  0

+   -5.1779   -0.4420    0.7607 C   0  0  0

+    3.1037   -1.7236   -0.5557 C   0  0  0

+   -5.4300    0.6996    1.7116 C   0  0  0

+   -6.0357   -1.2797    0.5779 O   0  0  0

+    4.0953   -1.2384    0.4702 C   0  0  0

+   -6.0416    1.8537    0.9599 C   0  0  0

+   -6.3503    0.2616    2.7695 N   0  0  0

+    4.4519    0.0519    0.6830 O   0  0  0

+    4.7641   -1.9978    1.3230 C   0  0  0

+   -5.3957    3.0751    0.9241 C   0  0  0

+   -7.2461    1.6891    0.3014 C   0  0  0

+    5.3551    0.0726    1.6764 C   0  0  0

+    5.5528   -1.1936    2.0771 O   0  0  0

+    4.6656   -3.4973    1.4365 C   0  0  0

+   -5.9568    4.1339    0.2345 C   0  0  0

+   -7.8071    2.7476   -0.3880 C   0  0  0

+    5.8952    1.0614    2.1332 O   0  0  0

+   -7.1637    3.9710   -0.4191 C   0  0  0

+   15.3180    2.6968   -0.6782 Cl  0  0  0

+   -3.5064   -0.6326    0.0000 H   0  0  0

+   -1.4463   -0.6020    0.0000 H   0  0  0

+   -4.4898   -2.1582    0.0000 H   0  0  0

+   -3.4100    0.1465    0.0000 H   0  0  0

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+   -1.1239    1.7915    0.0000 H   0  0  0

+    0.3792   -0.3107    0.0000 H   0  0  0

+    1.1493    0.7004    0.0000 H   0  0  0

+    0.1382    1.4705    0.0000 H   0  0  0

+    2.5829   -2.4560    0.0000 H   0  0  0

+    3.6853   -2.4087    0.0000 H   0  0  0

+   -4.5865    1.0097    0.0000 H   0  0  0

+   -7.0905    0.7713    0.0000 H   0  0  0

+   -6.4216   -0.6343    0.0000 H   0  0  0

+   -4.4970    3.0755    0.0000 H   0  0  0

+   -7.6562    0.8894    0.0000 H   0  0  0

+    3.7688   -3.4384    0.0000 H   0  0  0

+    4.6067   -4.3941    0.0000 H   0  0  0

+    5.5624   -3.5562    0.0000 H   0  0  0

+   -5.5461    4.9333    0.0000 H   0  0  0

+   -8.7058    2.7462    0.0000 H   0  0  0

+   -7.6788    4.7074    0.0000 H   0  0  0

+   16.2167    2.6968    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  8 13  1  0

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+ 29 32  2  0

+  4  5  1  0

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+ 26 27  1  0

+ 30 32  1  0

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+ 10 37  1  0

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+ 16 44  1  0

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+ 21 47  1  0

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+ 24 49  1  0

+ 25 50  1  0

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+ 28 52  1  0

+ 28 53  1  0

+ 29 54  1  0

+ 30 55  1  0

+ 32 56  1  0

+ 33 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6317-18-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.0000   -0.5357    0.0000 C   0  0  0

+   -1.4778    0.5093    0.0000 S   0  0  0

+    1.4778    0.5093    0.0000 S   0  0  0

+   -3.1218   -0.2480    0.0000 C   0  0  0

+    3.1218   -0.2480    0.0000 C   0  0  0

+   -4.1536   -0.7233    0.0000 N   0  0  0

+    4.1536   -0.7233    0.0000 N   0  0  0

+   -0.9040   -1.5484    0.0000 H   0  0  0

+    0.9040   -1.5484    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  3  0

+  5  7  3  0

+  1  8  1  0

+  1  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-79-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.4316    0.4292    0.0031 C   0  0  0

+   -0.8009   -0.9186    0.0011 C   0  0  0

+    0.9214    0.7757    0.0026 C   0  0  0

+   -1.4668    1.4819   -0.0004 C   0  0  0

+    0.1732   -1.8982   -0.0014 C   0  0  0

+   -2.4797   -1.3608    0.0011 Cl  0  0  0

+    1.8837   -0.2134    0.0001 C   0  0  0

+   -1.1073    2.7803    0.0015 O   0  0  0

+   -2.6428    1.1773   -0.0051 O   0  0  0

+    1.5105   -1.5476   -0.0019 C   0  0  0

+    3.5660    0.2152   -0.0005 Cl  0  0  0

+    1.2028    1.7759    0.0000 H   0  0  0

+   -0.0998   -2.9007    0.0000 H   0  0  0

+   -0.8300    3.7817    0.0000 H   0  0  0

+    2.2392   -2.2883    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  5 10  2  0

+  7 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  8 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+581-50-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.7117    0.0246   -0.0184 C   0  0  0

+   -0.7716   -0.0008   -0.0128 C   0  0  0

+    1.4007    1.1689   -0.4294 C   0  0  0

+    1.4406   -1.0902    0.3915 C   0  0  0

+   -1.4444   -1.1503   -0.4220 C   0  0  0

+   -1.4463    1.0690    0.3869 N   0  0  0

+    2.7849    1.1420   -0.4164 C   0  0  0

+    2.7575   -1.0687    0.3868 N   0  0  0

+   -2.8283   -1.1592   -0.4109 C   0  0  0

+   -2.7636    1.0870    0.4073 C   0  0  0

+    3.4352   -0.0055   -0.0012 C   0  0  0

+   -3.4948   -0.0168    0.0096 C   0  0  0

+    0.9205    2.0381    0.0000 H   0  0  0

+    0.9753   -1.9674    0.0000 H   0  0  0

+   -0.9477   -2.0102    0.0000 H   0  0  0

+    3.2932    1.9951    0.0000 H   0  0  0

+   -3.3201   -2.0219    0.0000 H   0  0  0

+   -3.2275    1.9650    0.0000 H   0  0  0

+    4.4279   -0.0313    0.0000 H   0  0  0

+   -4.4874    0.0115    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

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+ 10 12  2  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  7 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+82389-36-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+   -0.8336   -2.6297    0.4201 C   0  0  0

+   -2.0893   -2.1499   -0.3106 C   0  0  0

+    0.2538   -1.5954    0.2823 C   0  0  0

+   -1.9486   -2.0598    1.1086 O   0  0  0

+   -1.8264   -0.8006   -0.9282 C   0  0  0

+    0.2812   -0.5055    1.1332 C   0  0  0

+    1.2251   -1.7411   -0.6907 C   0  0  0

+   -2.5321    0.3889   -0.4252 C   0  0  0

+   -1.0335   -0.6950   -1.8394 O   0  0  0

+    1.2762    0.4440    1.0096 C   0  0  0

+    2.2232   -0.7949   -0.8196 C   0  0  0

+   -2.3578    1.6271   -1.0521 C   0  0  0

+   -3.3847    0.2860    0.6783 C   0  0  0

+    2.2502    0.3035    0.0295 C   0  0  0

+   -3.0223    2.7367   -0.5750 C   0  0  0

+   -4.0424    1.4053    1.1436 C   0  0  0

+    3.2598    1.2638   -0.0984 N   0  0  0

+   -3.8603    2.6279    0.5215 C   0  0  0

+    4.5453    0.9236    0.1216 C   0  0  0

+    5.6210    1.9783    0.0833 C   0  0  0

+    4.8362   -0.2314    0.3505 O   0  0  0

+   -0.6491   -3.5506    0.0000 H   0  0  0

+   -2.9105   -2.6057    0.0000 H   0  0  0

+   -0.5775   -0.1252    0.0000 H   0  0  0

+    1.5070   -2.6369    0.0000 H   0  0  0

+    0.9903    1.3386    0.0000 H   0  0  0

+    3.0814   -1.1764    0.0000 H   0  0  0

+   -1.4373    1.8136    0.0000 H   0  0  0

+   -3.8014   -0.5556    0.0000 H   0  0  0

+   -2.6129    3.5819    0.0000 H   0  0  0

+   -4.9643    1.2264    0.0000 H   0  0  0

+    3.0267    2.1736    0.0000 H   0  0  0

+   -4.5181    3.2982    0.0000 H   0  0  0

+    6.2785    1.3077    0.0000 H   0  0  0

+    6.2916    2.6358    0.0000 H   0  0  0

+    4.9635    2.6489    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 12 15  2  0

+ 13 16  1  0

+ 14 17  1  0

+ 15 18  1  0

+ 17 19  1  0

+ 19 20  1  0

+ 19 21  2  0

+  2  4  1  0

+ 11 14  2  0

+ 16 18  2  0

+  1 22  1  0

+  2 23  1  0

+  6 24  1  0

+  7 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+103-11-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 32                          1 V2000

+    0.8989    0.5257   -0.1146 C   0  0  0

+   -0.2985   -0.3783   -0.4146 C   0  0  0

+    2.1623   -0.0808   -0.7285 C   0  0  0

+    0.6547    1.9116   -0.7152 C   0  0  0

+   -1.4975    0.1973    0.1680 O   0  0  0

+    3.1699   -0.3907    0.3804 C   0  0  0

+    0.7566    2.9695    0.3854 C   0  0  0

+   -2.6822   -0.4307    0.0300 C   0  0  0

+    4.4730   -0.8966   -0.2415 C   0  0  0

+   -3.8957    0.1518    0.6196 C   0  0  0

+   -2.7468   -1.4787   -0.5821 O   0  0  0

+    5.4807   -1.2065    0.8673 C   0  0  0

+   -5.0653   -0.4682    0.4834 C   0  0  0

+    1.6969    1.1309    0.0000 H   0  0  0

+   -0.8693   -1.2013    0.0000 H   0  0  0

+    0.4238   -1.0721    0.0000 H   0  0  0

+    1.3646   -0.6864    0.0000 H   0  0  0

+    2.3372   -1.0670    0.0000 H   0  0  0

+   -0.2097    2.4175    0.0000 H   0  0  0

+   -0.1675    1.3396    0.0000 H   0  0  0

+    3.9354    0.2552    0.0000 H   0  0  0

+    2.9697    0.5907    0.0000 H   0  0  0

+    1.7536    2.8735    0.0000 H   0  0  0

+    0.8526    3.9665    0.0000 H   0  0  0

+   -0.2404    3.0655    0.0000 H   0  0  0

+    3.7075   -1.5425    0.0000 H   0  0  0

+    4.6732   -1.8780    0.0000 H   0  0  0

+   -3.9157    1.1532    0.0000 H   0  0  0

+    5.1863   -2.1638    0.0000 H   0  0  0

+    6.4380   -1.5009    0.0000 H   0  0  0

+    5.7751   -0.2492    0.0000 H   0  0  0

+   -5.9140    0.0636    0.0000 H   0  0  0

+   -5.1015   -1.4691    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

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+  9 12  1  0

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+  1 14  1  0

+  2 15  1  0

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+  3 17  1  0

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+  4 19  1  0

+  4 20  1  0

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+  6 22  1  0

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+  7 25  1  0

+  9 26  1  0

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+ 10 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59230-81-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+   -0.2824   -0.8548   -0.2240 C   0  0  0

+    0.3203   -2.1164    0.2101 C   0  0  0

+    0.5151    0.2312   -0.5435 C   0  0  0

+   -1.7476   -0.7661   -0.3067 C   0  0  0

+    1.7022   -2.2334    0.3056 C   0  0  0

+   -0.5476   -3.2456    0.5405 C   0  0  0

+    1.9057    0.1193   -0.4498 C   0  0  0

+   -0.1124    1.5266   -0.9901 C   0  0  0

+   -2.5267   -1.8919    0.0324 C   0  0  0

+   -2.3732    0.4133   -0.7143 C   0  0  0

+    2.5120   -1.1410   -0.0148 C   0  0  0

+    2.3234   -3.5315    0.7529 C   0  0  0

+   -1.8864   -3.1354    0.4496 C   0  0  0

+    2.7478    1.2037   -0.7668 C   0  0  0

+   -0.4585    2.6618    0.5773 Br  0  0  0

+   -3.9238   -1.8053   -0.0471 C   0  0  0

+   -3.7471    0.4673   -0.7818 C   0  0  0

+    3.9168   -1.2236    0.0700 C   0  0  0

+    4.0950    1.0585   -0.6640 C   0  0  0

+   -4.5135   -0.6422   -0.4485 C   0  0  0

+    4.6724   -0.1407   -0.2500 C   0  0  0

+   -0.1305   -4.1879    0.0000 H   0  0  0

+   -1.1270    1.7070    0.0000 H   0  0  0

+   -0.7342    0.7049    0.0000 H   0  0  0

+   -1.8248    1.2857    0.0000 H   0  0  0

+    1.3939   -3.9763    0.0000 H   0  0  0

+    2.7682   -4.4610    0.0000 H   0  0  0

+    3.2529   -3.0867    0.0000 H   0  0  0

+   -2.4586   -3.9924    0.0000 H   0  0  0

+    2.3450    2.1522    0.0000 H   0  0  0

+   -4.4900   -2.6663    0.0000 H   0  0  0

+   -4.2078    1.3891    0.0000 H   0  0  0

+    4.3663   -2.1508    0.0000 H   0  0  0

+    4.6893    1.9003    0.0000 H   0  0  0

+   -5.5416   -0.5726    0.0000 H   0  0  0

+    5.6996   -0.2233    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+ 14 19  2  0

+ 16 20  2  0

+ 18 21  2  0

+  7 11  2  0

+  9 13  1  0

+ 17 20  1  0

+ 19 21  1  0

+  6 22  1  0

+  8 23  1  0

+  8 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 12 27  1  0

+ 12 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+124-04-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    3.1337    0.0006   -0.0012 C   0  0  0

+    1.7957    0.6940   -0.0001 C   0  0  0

+    4.2645    0.7238   -0.0006 O   0  0  0

+    3.1886   -1.2064    0.0023 O   0  0  0

+    0.6792   -0.3520   -0.0012 C   0  0  0

+   -0.6792    0.3520    0.0000 C   0  0  0

+   -1.7957   -0.6940   -0.0011 C   0  0  0

+   -3.1337   -0.0006    0.0001 C   0  0  0

+   -4.2645   -0.7238   -0.0006 O   0  0  0

+   -3.1886    1.2064    0.0016 O   0  0  0

+    2.4259    1.6323    0.0000 H   0  0  0

+    0.9347    1.4262    0.0000 H   0  0  0

+    5.2167    1.3328    0.0000 H   0  0  0

+    0.0490   -1.2903    0.0000 H   0  0  0

+    1.5402   -1.0842    0.0000 H   0  0  0

+   -0.0490    1.2903    0.0000 H   0  0  0

+   -1.5402    1.0842    0.0000 H   0  0  0

+   -2.4259   -1.6323    0.0000 H   0  0  0

+   -0.9347   -1.4262    0.0000 H   0  0  0

+   -5.2167   -1.3328    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  1  0

+  8 10  2  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  9 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99-73-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.2027   -0.2953    0.0061 C   0  0  0

+    0.6160   -1.4293    0.0059 C   0  0  0

+    0.3773    0.9779    0.0037 C   0  0  0

+   -1.6666   -0.4406    0.0027 C   0  0  0

+    1.9870   -1.2854    0.0033 C   0  0  0

+    1.7494    1.1062    0.0011 C   0  0  0

+   -2.5453    0.7838    0.0030 C   0  0  0

+   -2.1663   -1.5454   -0.0002 O   0  0  0

+    2.5541   -0.0218    0.0009 C   0  0  0

+   -4.4333    0.2354   -0.0020 Br  0  0  0

+    4.4358    0.1650   -0.0020 Br  0  0  0

+    0.1878   -2.3869    0.0000 H   0  0  0

+   -0.2307    1.8327    0.0000 H   0  0  0

+    2.6023   -2.1350    0.0000 H   0  0  0

+    2.1857    2.0602    0.0000 H   0  0  0

+   -1.6294    1.2952    0.0000 H   0  0  0

+   -2.9499    1.7516    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+  9 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+27032-78-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -2.2059    0.9556   -0.0003 O   0  0  0

+   -1.1805    0.3031   -0.0013 C   0  0  0

+    0.0000    0.9382    0.0001 N   0  0  0

+   -1.2562   -1.0437    0.0018 N   0  0  0

+    1.1805    0.3031   -0.0004 C   0  0  0

+    0.0000   -1.8118    0.0010 C   0  0  0

+    2.2059    0.9556    0.0014 O   0  0  0

+    1.2562   -1.0437   -0.0024 N   0  0  0

+    0.0000    1.9467    0.0000 H   0  0  0

+   -2.1494   -1.5120    0.0000 H   0  0  0

+   -0.6547   -2.5789    0.0000 H   0  0  0

+    0.6547   -2.5789    0.0000 H   0  0  0

+    2.1494   -1.5120    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  5  1  0

+  6  8  1  0

+  3  9  1  0

+  4 10  1  0

+  6 11  1  0

+  6 12  1  0

+  8 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5623-11-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+    0.8431   -0.1185    0.0719 C   0  0  0

+   -0.3831    0.4861    0.3937 C   0  0  0

+    1.9732    0.6864   -0.1512 C   0  0  0

+    0.9449   -1.5814   -0.0248 C   0  0  0

+   -0.4655    1.8670    0.4876 C   0  0  0

+   -1.5118   -0.2985    0.6180 N   0  0  0

+    1.8653    2.0664   -0.0513 C   0  0  0

+    3.1925    0.1035   -0.4697 N   0  0  0

+    1.2616   -2.3085    1.0653 O   0  0  0

+    0.7436   -2.1358   -1.0878 O   0  0  0

+    0.6531    2.6488    0.2660 C   0  0  0

+   -2.6409   -0.0704   -0.0817 C   0  0  0

+   -3.8994   -0.8301    0.2501 C   0  0  0

+   -2.6442    0.7462   -0.9783 O   0  0  0

+   -1.3877    2.3132    0.0000 H   0  0  0

+   -1.3042   -1.3017    0.0000 H   0  0  0

+    2.7105    2.6452    0.0000 H   0  0  0

+    3.2720   -0.9179    0.0000 H   0  0  0

+    4.0373    0.6830    0.0000 H   0  0  0

+    1.6707   -3.2477    0.0000 H   0  0  0

+    0.5702    3.6699    0.0000 H   0  0  0

+   -4.4288    0.0469    0.0000 H   0  0  0

+   -4.7764   -1.3595    0.0000 H   0  0  0

+   -3.3700   -1.7071    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  5 11  2  0

+  6 12  1  0

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+ 12 14  2  0

+  7 11  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4436-24-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.3843   -0.1627    0.3890 C   0  0  0

+   -1.0533   -0.3609    0.7953 C   0  0  0

+    0.9216    1.1101    0.3479 C   0  0  0

+    1.1673   -1.2545    0.0629 C   0  0  0

+   -1.9468   -0.3007   -0.4452 C   0  0  0

+    2.2405    1.2920   -0.0250 C   0  0  0

+    2.4858   -1.0726   -0.3098 C   0  0  0

+   -3.4063   -0.5020   -0.0327 C   0  0  0

+   -2.8634    0.7884   -0.3196 O   0  0  0

+    3.0216    0.2010   -0.3565 C   0  0  0

+   -1.5707   -1.2587    0.0000 H   0  0  0

+   -0.4747   -1.2204    0.0000 H   0  0  0

+    0.2911    1.9323    0.0000 H   0  0  0

+    0.7583   -2.2065    0.0000 H   0  0  0

+   -1.9107   -1.3362    0.0000 H   0  0  0

+    2.6499    2.2439    0.0000 H   0  0  0

+    3.1169   -1.8944    0.0000 H   0  0  0

+   -4.4175   -0.2761    0.0000 H   0  0  0

+   -3.4492   -1.5373    0.0000 H   0  0  0

+    4.0513    0.3164    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

+  7 10  1  0

+  8  9  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-11-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 55                          1 V2000

+    1.6930   -0.3089   -0.0034 C   0  0  0

+    0.4248    0.5470    0.0060 C   0  0  0

+    2.9226    0.6015    0.0066 C   0  0  0

+   -0.8049   -0.3633   -0.0040 C   0  0  0

+    4.1908   -0.2544   -0.0028 C   0  0  0

+   -2.0731    0.4925    0.0054 C   0  0  0

+    5.4205    0.6559    0.0072 C   0  0  0

+   -3.3028   -0.4178   -0.0046 C   0  0  0

+    6.6887   -0.1999   -0.0022 C   0  0  0

+   -4.5710    0.4380    0.0048 C   0  0  0

+    7.9184    0.7104    0.0078 C   0  0  0

+   -5.8006   -0.4723   -0.0052 C   0  0  0

+    9.1675   -0.1326   -0.0014 C   0  0  0

+   -7.0688    0.3836    0.0042 C   0  0  0

+   10.3741    0.4555    0.0050 O   0  0  0

+    9.0829   -1.3378   -0.0146 O   0  0  0

+   -8.2985   -0.5268   -0.0058 C   0  0  0

+   -9.5667    0.3291    0.0036 C   0  0  0

+  -10.7964   -0.5813   -0.0064 C   0  0  0

+  -12.0646    0.2746    0.0030 C   0  0  0

+    0.9477   -1.1814    0.0000 H   0  0  0

+    2.4757   -1.1480    0.0000 H   0  0  0

+    1.1701    1.4195    0.0000 H   0  0  0

+   -0.3578    1.3862    0.0000 H   0  0  0

+    3.6679    1.4740    0.0000 H   0  0  0

+    2.1399    1.4406    0.0000 H   0  0  0

+   -1.5502   -1.2358    0.0000 H   0  0  0

+   -0.0223   -1.2025    0.0000 H   0  0  0

+    3.4455   -1.1269    0.0000 H   0  0  0

+    4.9734   -1.0936    0.0000 H   0  0  0

+   -1.3278    1.3650    0.0000 H   0  0  0

+   -2.8557    1.3317    0.0000 H   0  0  0

+    6.1658    1.5284    0.0000 H   0  0  0

+    4.6379    1.4951    0.0000 H   0  0  0

+   -4.0481   -1.2903    0.0000 H   0  0  0

+   -2.5202   -1.2570    0.0000 H   0  0  0

+    5.9434   -1.0724    0.0000 H   0  0  0

+    7.4713   -1.0391    0.0000 H   0  0  0

+   -3.8257    1.3105    0.0000 H   0  0  0

+   -5.3536    1.2771    0.0000 H   0  0  0

+    8.6637    1.5829    0.0000 H   0  0  0

+    7.1358    1.5496    0.0000 H   0  0  0

+   -6.5459   -1.3448    0.0000 H   0  0  0

+   -5.0180   -1.3115    0.0000 H   0  0  0

+   -6.3235    1.2561    0.0000 H   0  0  0

+   -7.8514    1.2228    0.0000 H   0  0  0

+   11.4056    0.9582    0.0000 H   0  0  0

+   -9.0438   -1.3993    0.0000 H   0  0  0

+   -7.5159   -1.3660    0.0000 H   0  0  0

+   -8.8214    1.2016    0.0000 H   0  0  0

+  -10.3493    1.1683    0.0000 H   0  0  0

+  -11.5417   -1.4538    0.0000 H   0  0  0

+  -10.0138   -1.4205    0.0000 H   0  0  0

+  -11.4227    1.2257    0.0000 H   0  0  0

+  -13.0157    0.9165    0.0000 H   0  0  0

+  -12.7065   -0.6765    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 13 16  2  0

+ 14 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+  1 21  1  0

+  1 22  1  0

+  2 23  1  0

+  2 24  1  0

+  3 25  1  0

+  3 26  1  0

+  4 27  1  0

+  4 28  1  0

+  5 29  1  0

+  5 30  1  0

+  6 31  1  0

+  6 32  1  0

+  7 33  1  0

+  7 34  1  0

+  8 35  1  0

+  8 36  1  0

+  9 37  1  0

+  9 38  1  0

+ 10 39  1  0

+ 10 40  1  0

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+ 12 44  1  0

+ 14 45  1  0

+ 14 46  1  0

+ 15 47  1  0

+ 17 48  1  0

+ 17 49  1  0

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+ 18 51  1  0

+ 19 52  1  0

+ 19 53  1  0

+ 20 54  1  0

+ 20 55  1  0

+ 20 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119-64-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    0.0234    0.6878    0.0329 C   0  0  0

+    0.0234   -0.6876   -0.0337 C   0  0  0

+    1.2299    1.3749    0.0622 C   0  0  0

+   -1.2462    1.4967    0.0843 C   0  0  0

+    1.2298   -1.3748   -0.0623 C   0  0  0

+   -1.2461   -1.4967   -0.0850 C   0  0  0

+    2.4275    0.6904    0.0309 C   0  0  0

+   -2.4348    0.6614   -0.3869 C   0  0  0

+    2.4275   -0.6905   -0.0302 C   0  0  0

+   -2.4343   -0.6616    0.3879 C   0  0  0

+    1.2307    2.4162    0.0000 H   0  0  0

+   -0.5773    2.2947    0.0000 H   0  0  0

+   -1.9506    2.2636    0.0000 H   0  0  0

+    1.2305   -2.4161    0.0000 H   0  0  0

+   -1.9504   -2.2636    0.0000 H   0  0  0

+   -0.5771   -2.2947    0.0000 H   0  0  0

+    3.3282    1.2130    0.0000 H   0  0  0

+   -2.8484    1.6170    0.0000 H   0  0  0

+   -3.4544    0.4500    0.0000 H   0  0  0

+    3.3281   -1.2132    0.0000 H   0  0  0

+   -3.4540   -0.4507    0.0000 H   0  0  0

+   -2.8477   -1.6173    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7  9  2  0

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+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4097-53-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -0.9443    0.0008   -0.0033 C   0  0  0

+   -2.4279    0.0016   -0.0024 C   0  0  0

+   -0.2455    1.2043   -0.0775 C   0  0  0

+   -0.2466   -1.2034    0.0761 C   0  0  0

+   -3.1283   -0.9707   -0.7142 C   0  0  0

+   -3.1262    0.9710    0.7146 C   0  0  0

+    1.1337    1.2004   -0.0776 C   0  0  0

+    1.1323   -1.2010    0.0756 C   0  0  0

+   -4.5082   -0.9654   -0.7095 C   0  0  0

+   -4.5066    0.9667    0.7123 C   0  0  0

+    1.8258   -0.0006   -0.0038 C   0  0  0

+    1.8767    2.4782   -0.1570 N   0  3  0

+    1.8739   -2.4792    0.1598 N   0  3  0

+   -5.1964    0.0026   -0.0001 C   0  0  0

+    3.1845   -0.0014   -0.0046 O   0  0  0

+    1.5167    3.4341    0.5064 O   0  0  0

+    2.8480    2.5736   -0.8857 O   0  5  0

+    1.5145   -3.4366   -0.5019 O   0  0  0

+    2.8436   -2.5737    0.8907 O   0  5  0

+   -0.7603    2.1014    0.0000 H   0  0  0

+   -0.7623   -2.1000    0.0000 H   0  0  0

+   -2.6586   -1.8922    0.0000 H   0  0  0

+   -2.6562    1.8923    0.0000 H   0  0  0

+   -4.9843   -1.8836    0.0000 H   0  0  0

+   -4.9809    1.8858    0.0000 H   0  0  0

+   -6.2307    0.0042    0.0000 H   0  0  0

+    4.2188   -0.0020    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  1  0

+  7 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 12 17  1  0

+ 13 18  2  0

+ 13 19  1  0

+  8 11  1  0

+ 10 14  2  0

+  3 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5776-38-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -2.4059    1.1970   -0.1656 C   0  0  0

+   -3.2194    0.1731    0.3593 C   0  0  0

+   -1.0938    0.8932   -0.6112 C   0  0  0

+   -2.8976    2.5089   -0.2377 C   0  0  0

+   -2.7497   -1.1165    0.4423 N   0  3  0

+   -4.5073    0.4817    0.7945 C   0  0  0

+   -0.6345   -0.4453   -0.5147 C   0  0  0

+   -0.2910    1.8676   -1.1222 N   0  0  0

+   -4.1594    2.7853    0.2002 C   0  0  0

+   -1.4823   -1.4376    0.0174 C   0  0  0

+   -3.6131   -2.1645    0.9923 C   0  0  0

+   -4.9686    1.7757    0.7079 C   0  0  0

+    0.6557   -0.7894   -0.9446 C   0  0  0

+   -1.0215   -2.7501    0.1086 C   0  0  0

+    1.0816   -2.0813   -0.8456 C   0  0  0

+    0.2492   -3.0619   -0.3189 C   0  0  0

+   10.6935    0.6908    0.4239 Cl  0  0  0

+   -2.2445    3.2627    0.0000 H   0  0  0

+   -5.1737   -0.2603    0.0000 H   0  0  0

+    0.6927    1.7032    0.0000 H   0  0  0

+   -0.6405    2.8017    0.0000 H   0  0  0

+   -4.4918    3.7257    0.0000 H   0  0  0

+   -4.3829   -1.5303    0.0000 H   0  0  0

+   -4.2473   -2.9343    0.0000 H   0  0  0

+   -2.8433   -2.7987    0.0000 H   0  0  0

+   -5.9522    1.9411    0.0000 H   0  0  0

+    1.3403   -0.0641    0.0000 H   0  0  0

+   -1.6917   -3.4887    0.0000 H   0  0  0

+    2.0605   -2.2723    0.0000 H   0  0  0

+    0.5565   -4.0108    0.0000 H   0  0  0

+   11.6909    0.6908    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+ 10 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+  7 10  1  0

+  9 12  1  0

+ 15 16  1  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+610-67-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.8786    0.0757   -0.0029 C   0  0  0

+   -0.4700    0.4001   -0.0010 C   0  0  0

+    1.8292    1.0784   -0.0021 C   0  0  0

+    1.2990   -1.3434    0.0003 N   0  3  0

+   -0.8609    1.7314    0.0017 C   0  0  0

+   -1.4069   -0.5844   -0.0023 O   0  0  0

+    1.4371    2.4041    0.0006 C   0  0  0

+    2.4834   -1.6277   -0.0013 O   0  0  0

+    0.4606   -2.2269    0.0047 O   0  5  0

+    0.0932    2.7301    0.0025 C   0  0  0

+   -2.6826    0.0595    0.0003 C   0  0  0

+   -3.7878   -0.9985   -0.0010 C   0  0  0

+    2.8376    0.8364    0.0000 H   0  0  0

+   -1.8686    1.9764    0.0000 H   0  0  0

+    2.1520    3.1553    0.0000 H   0  0  0

+   -0.1985    3.7252    0.0000 H   0  0  0

+   -2.1137    0.9265    0.0000 H   0  0  0

+   -3.4798    0.7227    0.0000 H   0  0  0

+   -4.5049   -0.2494    0.0000 H   0  0  0

+   -4.5369   -1.7156    0.0000 H   0  0  0

+   -3.0707   -1.7476    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  1  0

+ 11 12  1  0

+  7 10  1  0

+  3 13  1  0

+  5 14  1  0

+  7 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91540-29-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 44                          1 V2000

+    0.0494    1.0694    1.1304 C   0  0  0

+   -0.3078   -0.4232    1.1959 C   0  0  0

+   -0.8624    0.4545    0.1566 N   0  0  0

+    1.3321    1.4603    0.4357 C   0  0  0

+    0.6453   -1.4076    0.5609 C   0  0  0

+   -2.2264    0.7995    0.5791 C   0  0  0

+    2.1508    0.4843   -0.1211 C   0  0  0

+    1.6857    2.7925    0.3581 C   0  0  0

+    1.8051   -0.9569   -0.0592 C   0  0  0

+    0.3565   -2.7570    0.6002 C   0  0  0

+   -3.2329    0.1871   -0.3970 C   0  0  0

+    3.3337    0.8675   -0.7593 C   0  0  0

+    2.8578    3.1638   -0.2751 C   0  0  0

+    2.6735   -1.8847   -0.6409 C   0  0  0

+    1.2208   -3.6690    0.0223 C   0  0  0

+   -4.6535    0.5465    0.0431 C   0  0  0

+    3.6792    2.2001   -0.8323 C   0  0  0

+    2.3773   -3.2303   -0.5973 C   0  0  0

+   -5.6600   -0.0659   -0.9331 C   0  0  0

+   -7.0806    0.2934   -0.4930 C   0  0  0

+   -0.3615    1.9320    0.0000 H   0  0  0

+   -1.0588   -1.0138    0.0000 H   0  0  0

+   -1.7629    1.6350    0.0000 H   0  0  0

+   -2.9154    1.4614    0.0000 H   0  0  0

+    0.9943    3.4519    0.0000 H   0  0  0

+   -0.5633   -3.0154    0.0000 H   0  0  0

+   -3.6965   -0.6483    0.0000 H   0  0  0

+   -2.5439   -0.4748    0.0000 H   0  0  0

+    4.0291    0.2123    0.0000 H   0  0  0

+    3.1210    4.0823    0.0000 H   0  0  0

+    3.5949   -1.6318    0.0000 H   0  0  0

+    1.0078   -4.6004    0.0000 H   0  0  0

+   -4.1899    1.3819    0.0000 H   0  0  0

+   -5.3425    1.2084    0.0000 H   0  0  0

+    4.6103    2.4143    0.0000 H   0  0  0

+    3.1003   -3.8549    0.0000 H   0  0  0

+   -6.1235   -0.9014    0.0000 H   0  0  0

+   -4.9710   -0.7278    0.0000 H   0  0  0

+   -6.8463    1.2197    0.0000 H   0  0  0

+   -8.0069    0.5277    0.0000 H   0  0  0

+   -7.3149   -0.6329    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

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+  7 12  1  0

+  8 13  2  0

+  9 14  1  0

+ 10 15  2  0

+ 11 16  1  0

+ 12 17  2  0

+ 14 18  2  0

+ 16 19  1  0

+ 19 20  1  0

+  2  3  1  0

+  7  9  1  0

+ 13 17  1  0

+ 15 18  1  0

+  1 21  1  0

+  2 22  1  0

+  6 23  1  0

+  6 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 11 28  1  0

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+ 13 30  1  0

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+ 15 32  1  0

+ 16 33  1  0

+ 16 34  1  0

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+ 18 36  1  0

+ 19 37  1  0

+ 19 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+ 20 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10540-29-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 59                          1 V2000

+   -1.9961    0.1877    0.1689 C   0  0  0

+   -2.4203   -1.0751    0.4208 C   0  0  0

+   -0.5536    0.4610   -0.0131 C   0  0  0

+   -2.9766    1.2917    0.0700 C   0  0  0

+   -1.5312   -2.2160    0.1555 C   0  0  0

+   -3.8029   -1.3095    0.9726 C   0  0  0

+   -0.0402    0.6871   -1.2911 C   0  0  0

+    0.2966    0.4991    1.0937 C   0  0  0

+   -3.2433    2.0935    1.1804 C   0  0  0

+   -3.6342    1.5390   -1.1359 C   0  0  0

+   -0.8589   -2.8436    1.2097 C   0  0  0

+   -1.3579   -2.6832   -1.1515 C   0  0  0

+   -4.7367   -1.7438   -0.1589 C   0  0  0

+    1.3046    0.9414   -1.4567 C   0  0  0

+    1.6398    0.7539    0.9200 C   0  0  0

+   -4.1586    3.1212    1.0816 C   0  0  0

+   -4.5471    2.5696   -1.2215 C   0  0  0

+   -0.0276   -3.9129    0.9527 C   0  0  0

+   -0.5228   -3.7539   -1.3918 C   0  0  0

+    2.1480    0.9727   -0.3540 C   0  0  0

+   -4.8113    3.3575   -0.1150 C   0  0  0

+    0.1428   -4.3659   -0.3442 C   0  0  0

+    3.4728    1.2232   -0.5212 O   0  0  0

+    4.0667    1.1899    0.7781 C   0  0  0

+    5.5669    1.4659    0.6604 C   0  0  0

+    6.2194    0.3419   -0.0244 N   0  0  0

+    6.9125    0.9036   -1.1915 C   0  0  0

+    7.2597   -0.1591    0.8837 C   0  0  0

+   -3.5871   -0.5192    0.0000 H   0  0  0

+   -4.4289   -0.7811    0.0000 H   0  0  0

+   -0.2830    1.4695    0.0000 H   0  0  0

+    0.3915   -0.3146    0.0000 H   0  0  0

+   -2.5342    2.5036    0.0000 H   0  0  0

+   -4.0986    0.8642    0.0000 H   0  0  0

+   -0.2541   -2.2910    0.0000 H   0  0  0

+   -2.0733   -3.0823    0.0000 H   0  0  0

+   -5.0822   -1.0010    0.0000 H   0  0  0

+   -5.4795   -2.0893    0.0000 H   0  0  0

+   -4.3912   -2.4866    0.0000 H   0  0  0

+    1.2130    1.7555    0.0000 H   0  0  0

+    1.8795   -0.0294    0.0000 H   0  0  0

+   -3.6993    3.7995    0.0000 H   0  0  0

+   -5.2563    2.1596    0.0000 H   0  0  0

+    0.6872   -3.5128    0.0000 H   0  0  0

+   -1.1251   -4.3092    0.0000 H   0  0  0

+   -5.3836    3.9436    0.0000 H   0  0  0

+    0.6010   -5.0450    0.0000 H   0  0  0

+    3.6737    0.4711    0.0000 H   0  0  0

+    4.5468    0.5262    0.0000 H   0  0  0

+    6.3178    1.7934    0.0000 H   0  0  0

+    5.3275    2.2493    0.0000 H   0  0  0

+    7.4283    0.2672    0.0000 H   0  0  0

+    7.5489    1.4194    0.0000 H   0  0  0

+    6.3967    1.5400    0.0000 H   0  0  0

+    6.9043   -0.8972    0.0000 H   0  0  0

+    7.9978   -0.5145    0.0000 H   0  0  0

+    7.6151    0.5790    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 24 25  1  0

+ 25 26  1  0

+ 26 27  1  0

+ 26 28  1  0

+ 15 20  1  0

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+ 19 22  2  0

+  6 29  1  0

+  6 30  1  0

+  7 31  1  0

+  8 32  1  0

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+ 27 52  1  0

+ 27 53  1  0

+ 27 54  1  0

+ 28 55  1  0

+ 28 56  1  0

+ 28 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18031-40-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -1.1688   -0.0481    0.3954 C   0  0  1

+   -0.4305   -1.0863   -0.4582 C   0  0  0

+   -0.6516    1.3432    0.0238 C   0  0  0

+   -2.6472   -0.1260    0.1140 C   0  0  0

+    1.0352   -1.1218   -0.0207 C   0  0  0

+    0.8491    1.3597    0.0477 C   0  0  0

+   -3.1625    0.1169   -1.2812 C   0  0  0

+   -3.4844   -0.4050    1.0822 C   0  0  0

+    1.5948    0.2703    0.0240 C   0  0  0

+    3.0487    0.4290    0.0429 C   0  0  0

+    3.7660   -0.5493    0.0226 O   0  0  0

+   -0.0813    0.0953    0.0000 H   0  0  0

+   -1.4391   -1.5175    0.0000 H   0  0  0

+   -0.2234   -2.1635    0.0000 H   0  0  0

+   -0.5298    2.4333    0.0000 H   0  0  0

+   -1.7187    1.5971    0.0000 H   0  0  0

+    0.8783   -2.2074    0.0000 H   0  0  0

+    2.0944   -1.4068    0.0000 H   0  0  0

+    1.3554    2.3328    0.0000 H   0  0  0

+   -2.6948    1.1091    0.0000 H   0  0  0

+   -4.1547    0.5846    0.0000 H   0  0  0

+   -3.6302   -0.8753    0.0000 H   0  0  0

+   -4.3051    0.3228    0.0000 H   0  0  0

+   -3.7044   -1.4796    0.0000 H   0  0  0

+    3.4907    1.4329    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  2  0

+  6  9  2  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  3 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+  8 24  1  0

+ 10 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33942-93-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+   -0.6120   -0.0273   -0.0017 C   0  0  0

+   -2.0450   -0.3627   -0.0016 C   0  0  0

+   -0.2331    1.3402    0.0005 C   0  0  0

+    0.2921   -0.9945    0.0017 N   0  0  0

+   -3.0002    0.6747    0.0007 C   0  0  0

+   -2.4691   -1.6933   -0.0034 C   0  0  0

+    1.1180    1.6900    0.0004 C   0  0  0

+   -1.2562    2.3835    0.0032 C   0  0  0

+    1.5959   -0.7310    0.0018 C   0  0  0

+   -2.5661    2.0688    0.0024 C   0  0  0

+   -4.3641    0.3531    0.0008 C   0  0  0

+   -3.8157   -1.9782   -0.0027 C   0  0  0

+    2.0626    0.6583   -0.0021 C   0  0  0

+    2.5558   -1.7616    0.0062 C   0  0  0

+   -4.7548   -0.9546   -0.0013 C   0  0  0

+    3.4456    0.9166   -0.0023 C   0  0  0

+    3.8782   -1.4472    0.0069 C   0  0  0

+    4.3195   -0.1253   -0.0047 C   0  0  0

+    5.8000    0.1561   -0.0049 C   0  0  0

+   -1.7659   -2.4707    0.0000 H   0  0  0

+    1.4158    2.6951    0.0000 H   0  0  0

+   -0.9668    3.3910    0.0000 H   0  0  0

+   -3.2824    2.8341    0.0000 H   0  0  0

+   -5.0832    1.1158    0.0000 H   0  0  0

+   -4.1354   -2.9765    0.0000 H   0  0  0

+    2.2523   -2.7650    0.0000 H   0  0  0

+   -5.7764   -1.1895    0.0000 H   0  0  0

+    3.7992    1.9034    0.0000 H   0  0  0

+    4.5858   -2.2206    0.0000 H   0  0  0

+    5.9957   -0.8737    0.0000 H   0  0  0

+    6.8298    0.3518    0.0000 H   0  0  0

+    5.6043    1.1859    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 19 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+920-66-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    1.2492   -0.1056   -0.0583 C   0  0  0

+    0.0000    0.5725   -0.6245 C   0  0  0

+    1.2492    0.0065    1.3362 F   0  0  0

+    1.2492   -1.4577   -0.4175 F   0  0  0

+    2.3915    0.5144   -0.5760 F   0  0  0

+   -1.2492   -0.1056   -0.0583 C   0  0  0

+    0.0000    1.9536   -0.2576 O   0  0  0

+   -2.3915    0.5144   -0.5760 F   0  0  0

+   -1.2492   -1.4577   -0.4175 F   0  0  0

+   -1.2492    0.0065    1.3362 F   0  0  0

+    0.0000   -0.4416    0.0000 H   0  0  0

+    0.0000    2.9677    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

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+  6  8  1  0

+  6  9  1  0

+  6 10  1  0

+  2 11  1  0

+  7 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+22349-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.4166   -0.3938   -0.0021 C   0  0  0

+   -1.0372   -0.2061   -0.0014 C   0  0  0

+    1.2483    0.7486   -0.0006 C   0  0  0

+    0.9896   -1.6669    0.0014 C   0  0  0

+   -1.5515    1.1100    0.0009 C   0  0  0

+   -1.9147   -1.2920   -0.0034 C   0  0  0

+    0.6715    2.0400    0.0022 C   0  0  0

+    2.6403    0.5806   -0.0013 C   0  0  0

+    2.3491   -1.7973    0.0011 C   0  0  0

+    0.1118   -2.8919    0.0061 C   0  0  0

+   -0.6657    2.2126    0.0019 C   0  0  0

+   -2.9406    1.3010    0.0016 C   0  0  0

+   -3.2628   -1.0729   -0.0031 C   0  0  0

+    3.1706   -0.6761   -0.0034 C   0  0  0

+    3.5473    1.7841   -0.0001 C   0  0  0

+   -3.7726    0.2202    0.0001 C   0  0  0

+   -1.5401   -2.2722    0.0000 H   0  0  0

+    1.2978    2.8820    0.0000 H   0  0  0

+    2.7783   -2.7548    0.0000 H   0  0  0

+   -0.7412   -2.2807    0.0000 H   0  0  0

+   -0.4994   -3.7449    0.0000 H   0  0  0

+    0.9648   -3.5031    0.0000 H   0  0  0

+   -1.0577    3.1860    0.0000 H   0  0  0

+   -3.3386    2.2719    0.0000 H   0  0  0

+   -3.9211   -1.8900    0.0000 H   0  0  0

+    4.2128   -0.7981    0.0000 H   0  0  0

+    4.3853    1.1525    0.0000 H   0  0  0

+    4.1789    2.6221    0.0000 H   0  0  0

+    2.7093    2.4157    0.0000 H   0  0  0

+   -4.8116    0.3669    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 12 16  2  0

+  7 11  2  0

+  9 14  1  0

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+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+590-86-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.1489   -0.5443   -0.4817 C   0  0  0

+   -1.0372   -0.0372    0.3410 C   0  0  0

+    1.3548    0.3172   -0.2082 C   0  0  0

+   -1.3457    1.4101   -0.0476 C   0  0  0

+   -2.2615   -0.9118    0.0634 C   0  0  0

+    2.3575   -0.1756    0.2501 O   0  0  0

+   -0.4650   -1.4689    0.0000 H   0  0  0

+    0.9470   -1.3156    0.0000 H   0  0  0

+   -0.1801    0.6679    0.0000 H   0  0  0

+    1.2642    1.4234    0.0000 H   0  0  0

+   -0.2602    1.6415    0.0000 H   0  0  0

+   -1.5771    2.4956    0.0000 H   0  0  0

+   -2.4312    1.1787    0.0000 H   0  0  0

+   -2.9066   -0.0087    0.0000 H   0  0  0

+   -3.1646   -1.5569    0.0000 H   0  0  0

+   -1.6164   -1.8149    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+189-55-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 43                          1 V2000

+    0.7023   -0.4536   -0.0018 C   0  0  0

+   -0.7023   -0.4536   -0.0017 C   0  0  0

+    1.3981    0.7695   -0.0008 C   0  0  0

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+   -1.3981    0.7695   -0.0004 C   0  0  0

+   -1.4288   -1.7244   -0.0023 C   0  0  0

+    2.8611    0.7369   -0.0009 C   0  0  0

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+    0.6744   -2.9783    0.0078 C   0  0  0

+   -2.8611    0.7369   -0.0002 C   0  0  0

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+    5.6325    0.6441   -0.0012 C   0  0  0

+   -5.6325    0.6441    0.0003 C   0  0  0

+    1.2020    2.8917    0.0000 H   0  0  0

+    3.3358   -2.6343    0.0000 H   0  0  0

+    1.1929   -3.8953    0.0000 H   0  0  0

+   -1.2020    2.8917    0.0000 H   0  0  0

+   -3.3358   -2.6343    0.0000 H   0  0  0

+   -1.1929   -3.8954    0.0000 H   0  0  0

+    3.1140    2.8533    0.0000 H   0  0  0

+   -3.1140    2.8533    0.0000 H   0  0  0

+    5.4571   -1.4459    0.0000 H   0  0  0

+    5.5246    2.7617    0.0000 H   0  0  0

+   -5.4571   -1.4459    0.0000 H   0  0  0

+   -5.5246    2.7617    0.0000 H   0  0  0

+    6.6858    0.6252    0.0000 H   0  0  0

+   -6.6858    0.6252    0.0000 H   0  0  0

+  1  2  2  0

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+ 16 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+ 23 37  1  0

+ 24 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1488-25-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 14                          1 V2000

+   -0.9268    0.7700    0.4631 C   0  0  0

+   -0.9269   -0.7700    0.4631 C   0  0  0

+   -1.3544    0.0000   -0.6622 O   0  0  0

+    0.3784    1.4571    0.1271 C   0  0  0

+    0.3783   -1.4572    0.1270 C   0  0  0

+    1.4507    0.7309   -0.1491 C   0  0  0

+    1.4507   -0.7309   -0.1491 C   0  0  0

+   -1.6496    1.5092    0.0000 H   0  0  0

+   -1.6498   -1.5091    0.0000 H   0  0  0

+    0.4356    2.4894    0.0000 H   0  0  0

+    0.4355   -2.4895    0.0000 H   0  0  0

+    2.3640    1.2154    0.0000 H   0  0  0

+    2.3640   -1.2154    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  4  6  2  0

+  5  7  2  0

+  2  3  1  0

+  6  7  1  0

+  1  8  1  0

+  2  9  1  0

+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1874-24-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.2273    0.0836   -0.0039 C   0  0  0

+   -1.3648   -0.6427   -0.0036 O   0  0  0

+   -0.5792    1.4180   -0.0010 C   0  0  0

+    1.0910   -0.4313   -0.0015 C   0  0  0

+   -2.4207    0.1824   -0.0005 C   0  0  0

+   -1.9814    1.4608    0.0011 C   0  0  0

+    2.1509    0.4168   -0.0021 C   0  0  0

+   -3.8400   -0.2385    0.0012 N   0  3  0

+    3.4670   -0.0972    0.0003 C   0  0  0

+   -4.7237    0.5997    0.0039 O   0  0  0

+   -4.1240   -1.4229   -0.0001 O   0  5  0

+    4.5211    0.7463   -0.0004 O   0  0  0

+    3.6504   -1.3004    0.0030 O   0  0  0

+    5.6983   -0.0638    0.0025 C   0  0  0

+    0.0531    2.2132    0.0000 H   0  0  0

+    1.2441   -1.4357    0.0000 H   0  0  0

+   -2.5589    2.2966    0.0000 H   0  0  0

+    1.9978    1.4212    0.0000 H   0  0  0

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+  1  2  1  0

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+  8 11  1  0

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+  9 13  2  0

+ 12 14  1  0

+  5  6  2  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+ 14 19  1  0

+ 14 20  1  0

+ 14 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+41830-80-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 39                          1 V2000

+   -5.1355    0.0077   -0.0794 C   0  0  0

+   -6.2583    0.9244   -0.3233 C   0  0  0

+   -3.9456    0.5098    0.4891 C   0  0  0

+   -5.2585   -1.2803   -0.3921 N   0  0  0

+   -6.1176    2.2871    0.0182 C   0  0  0

+   -7.4545    0.4726   -0.8833 C   0  0  0

+   -2.9004   -0.3202    0.7210 O   0  0  0

+   -3.8282    1.8548    0.8173 C   0  0  0

+   -4.2590   -2.1252   -0.1809 C   0  0  0

+   -4.8598    2.7474    0.6044 C   0  0  0

+   -7.1798    3.1688   -0.2099 C   0  0  0

+   -8.4829    1.3632   -1.0955 C   0  0  0

+   -3.0082   -1.6308    0.4040 C   0  0  0

+   -4.3899   -3.4962   -0.5141 C   0  0  0

+   -4.7031    4.0773    0.9453 N   0  0  0

+   -8.3402    2.7040   -0.7597 C   0  0  0

+   -1.9763   -2.4884    0.6257 C   0  0  0

+   -3.3631   -4.3449   -0.2934 C   0  0  0

+   -2.1123   -3.8531    0.2870 C   0  0  0

+   -1.1082   -4.6912    0.5015 N   0  0  0

+   11.8046    0.5219   -0.1256 Cl  0  0  0

+   10.5672    1.5323   -0.3945 O   0  0  0

+   12.8440    1.2124    0.4240 O   0  0  0

+   11.4096   -0.4627    0.7309 O   0  0  0

+   12.2018   -0.0344   -1.3055 O   0  0  0

+   -7.6307   -0.5164    0.0000 H   0  0  0

+   -2.8973    2.2323    0.0000 H   0  0  0

+   -7.0238    4.1611    0.0000 H   0  0  0

+   -9.4174    0.9948    0.0000 H   0  0  0

+   -5.3181   -3.8804    0.0000 H   0  0  0

+   -3.7803    4.4743    0.0000 H   0  0  0

+   -5.5083    4.6779    0.0000 H   0  0  0

+   -9.1412    3.3103    0.0000 H   0  0  0

+   -1.0468   -2.1074    0.0000 H   0  0  0

+   -3.5212   -5.3369    0.0000 H   0  0  0

+   -0.3370   -5.3349    0.0000 H   0  0  0

+    9.7891    2.1676    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 21 22  1  0

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+  8 10  1  0

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+ 18 19  1  0

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+ 11 28  1  0

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+ 14 30  1  0

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+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 20 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+606-22-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    1.2019   -0.3759    0.0235 C   0  0  0

+   -0.0001    0.3203   -0.0006 C   0  0  0

+    2.4849    0.3618    0.0524 N   0  3  0

+    1.1983   -1.7567    0.0261 C   0  0  0

+   -1.2017   -0.3758   -0.0277 C   0  0  0

+   -0.0003    1.7170    0.0021 N   0  0  0

+    3.3322    0.1435   -0.7950 O   0  0  0

+    2.6934    1.1871    0.9236 O   0  5  0

+   -0.0001   -2.4467    0.0048 C   0  0  0

+   -2.4849    0.3617   -0.0529 N   0  3  0

+   -1.1980   -1.7570   -0.0307 C   0  0  0

+   -3.3307    0.1414    0.7953 O   0  0  0

+   -2.6949    1.1890   -0.9218 O   0  5  0

+    2.0951   -2.2768    0.0000 H   0  0  0

+    0.8974    2.2355    0.0000 H   0  0  0

+   -0.8982    2.2352    0.0000 H   0  0  0

+   -0.0001   -3.4834    0.0000 H   0  0  0

+   -2.0948   -2.2771    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  9 11  2  0

+  4 14  1  0

+  6 15  1  0

+  6 16  1  0

+  9 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+76-44-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    0.9939   -2.0655    1.6636 Cl  0  0  0

+    0.3609   -0.8307    0.5123 C   0  0  0

+    1.1452   -0.6661   -0.8266 C   0  0  0

+   -1.0953   -1.0578   -0.0353 C   0  0  0

+    0.2448    0.6018    1.0457 C   0  0  0

+    0.1511    0.1016   -1.7421 C   0  0  0

+    2.2696    0.3537   -0.5858 C   0  0  0

+   -1.2057   -2.4856   -1.1308 Cl  0  0  0

+   -2.3259   -1.1175    1.2811 Cl  0  0  0

+   -1.1151    0.3046   -0.8189 C   0  0  0

+    1.0921    1.2463    2.4170 Cl  0  0  0

+   -0.6092    1.2625    0.2850 C   0  0  0

+    0.7637    1.4563   -1.9727 C   0  0  0

+    3.8232   -0.3031   -1.2228 Cl  0  0  0

+    1.8964    1.5928   -1.3539 C   0  0  0

+   -2.6613    0.7463   -1.6344 Cl  0  0  0

+   -1.0755    2.9224    0.4870 Cl  0  0  0

+    1.6096   -1.5764    0.0000 H   0  0  0

+   -0.2546   -0.8363    0.0000 H   0  0  0

+    3.0300    1.0365    0.0000 H   0  0  0

+    0.1592    2.2802    0.0000 H   0  0  0

+    2.4557    2.4481    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

+  5  2  1  0

+  6  3  1  0

+  7  3  1  0

+  8  4  1  0

+  9  4  1  0

+ 10  4  1  0

+ 11  5  1  0

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+ 16 10  1  0

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+  6 10  1  0

+ 10 12  1  0

+ 13 15  2  0

+  3 18  1  0

+  6 19  1  0

+  7 20  1  0

+ 13 21  1  0

+ 15 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5557-27-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 38                          1 V2000

+    1.5023    0.6316   -0.2337 C   0  0  0

+    1.4595   -0.7644   -0.1211 C   0  0  0

+    0.4507    1.3790   -0.5877 O   0  0  0

+    2.7189    1.2747    0.0316 C   0  0  0

+    0.1670   -1.4424   -0.3629 C   0  0  0

+    2.6003   -1.4988    0.2161 C   0  0  0

+   -0.7626    0.8451   -0.4143 C   0  0  0

+    3.8386    0.5447    0.3772 C   0  0  0

+    2.7973    2.6305   -0.0525 O   0  0  0

+   -0.9989   -0.5366   -0.3329 C   0  0  0

+    0.0730   -2.6393   -0.5682 O   0  0  0

+    3.7899   -0.8363    0.4675 C   0  0  0

+    2.5420   -2.8529    0.2969 O   0  0  0

+   -1.8573    1.7036   -0.3120 C   0  0  0

+    4.1434    2.9870    0.2685 C   0  0  0

+   -2.2978   -1.0450   -0.2172 C   0  0  0

+   -3.1379    1.1997   -0.1692 C   0  0  0

+   -3.3665   -0.1713   -0.1300 C   0  0  0

+   -2.5071   -2.3853   -0.1913 O   0  0  0

+   -4.1860    2.0558   -0.0659 O   0  0  0

+   -2.3305   -2.8047    1.1633 C   0  0  0

+   -4.3621    2.3271    1.3260 C   0  0  0

+    4.7498    1.0178    0.0000 H   0  0  0

+    4.6657   -1.3720    0.0000 H   0  0  0

+    2.4978   -3.8786    0.0000 H   0  0  0

+   -1.7089    2.7195    0.0000 H   0  0  0

+    4.4062    1.9946    0.0000 H   0  0  0

+    5.1358    3.2498    0.0000 H   0  0  0

+    3.8806    3.9794    0.0000 H   0  0  0

+   -4.3273   -0.5331    0.0000 H   0  0  0

+   -3.2767   -3.2031    0.0000 H   0  0  0

+   -1.9321   -3.7509    0.0000 H   0  0  0

+   -1.3843   -2.4063    0.0000 H   0  0  0

+   -3.5010    2.8861    0.0000 H   0  0  0

+   -4.9211    3.1882    0.0000 H   0  0  0

+   -5.2232    1.7681    0.0000 H   0  0  0

+  1  2  2  0

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+ 21 31  1  0

+ 21 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 22 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+548-39-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    0.3417   -0.0019   -0.0019 C   0  0  0

+   -0.9553   -0.5561   -0.0011 C   0  0  0

+    0.5120    1.4012   -0.0006 C   0  0  0

+    1.4705   -0.8512    0.0019 C   0  0  0

+   -2.1151    0.3478    0.0007 C   0  0  0

+   -1.1083   -1.9392   -0.0024 C   0  0  0

+   -0.6614    2.2700    0.0006 C   0  0  0

+    1.8039    1.9294   -0.0009 C   0  0  0

+    1.2802   -2.2438    0.0064 C   0  0  0

+    2.7565   -0.2824    0.0015 C   0  0  0

+   -1.9087    1.7464    0.0014 C   0  0  0

+   -3.2475   -0.1060    0.0010 O   0  0  0

+    0.0063   -2.7652   -0.0044 C   0  0  0

+    2.9042    1.0862   -0.0025 C   0  0  0

+   -2.0711   -2.3593    0.0000 H   0  0  0

+   -0.5357    3.3129    0.0000 H   0  0  0

+    1.9431    2.9706    0.0000 H   0  0  0

+    2.1107   -2.8871    0.0000 H   0  0  0

+    3.6047   -0.9021    0.0000 H   0  0  0

+   -2.7386    2.3904    0.0000 H   0  0  0

+   -0.1243   -3.8075    0.0000 H   0  0  0

+    3.8698    1.4998    0.0000 H   0  0  0

+  1  2  2  0

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+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1838-94-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.1852   -0.0219   -0.5731 C   0  0  0

+   -2.1069    0.3270    0.2899 C   0  0  0

+    0.2295   -0.2580   -0.1106 C   0  0  0

+    0.5879   -1.7092    0.2156 C   0  0  0

+    1.3279    0.6342   -0.6921 C   0  0  0

+    0.8608    0.7716    0.6533 O   0  0  0

+   -1.4415   -0.9715    0.0000 H   0  0  0

+   -2.2653    1.2977    0.0000 H   0  0  0

+   -2.8684   -0.2955    0.0000 H   0  0  0

+   -0.3670   -1.9450    0.0000 H   0  0  0

+    0.8237   -2.6641    0.0000 H   0  0  0

+    1.5428   -1.4734    0.0000 H   0  0  0

+    2.0879    0.0098    0.0000 H   0  0  0

+    1.7881    1.5034    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

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+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3081-14-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 58                          1 V2000

+   -1.3954    1.3435   -0.0205 C   0  0  0

+   -2.7949    1.3485   -0.0577 N   0  0  0

+   -0.6955    2.5416   -0.0685 C   0  0  0

+   -0.7075    0.1405    0.0701 C   0  0  0

+   -3.5005    0.7048   -1.1685 C   0  0  0

+    0.6852    2.5367   -0.0314 C   0  0  0

+    0.6727    0.1356    0.1071 C   0  0  0

+   -4.7500   -0.0013   -0.6383 C   0  0  0

+   -3.9097    1.7634   -2.1946 C   0  0  0

+    1.3731    1.3337    0.0539 C   0  0  0

+   -4.3408   -1.0599    0.3877 C   0  0  0

+    2.7726    1.3288    0.0914 N   0  0  0

+   -5.5903   -1.7660    0.9180 C   0  0  0

+    3.4735    0.6536    1.1864 C   0  0  0

+   -6.3272   -2.4383   -0.2422 C   0  0  0

+   -5.1812   -2.8246    1.9440 C   0  0  0

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+    4.2871   -2.3638    0.0000 H   0  0  0

+    4.9018   -3.6927    0.0000 H   0  0  0

+    6.2307   -3.0780    0.0000 H   0  0  0

+  1  2  1  0

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+ 21 54  1  0

+ 21 55  1  0

+ 22 56  1  0

+ 22 57  1  0

+ 22 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+161697-01-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+    0.3130    0.3727   -0.1200 C   0  0  0

+    0.0940   -1.0287   -0.1106 C   0  0  0

+   -0.7319    1.2040   -0.2092 N   0  0  0

+    1.6250    0.8659   -0.0411 C   0  0  0

+   -1.1542   -1.5012   -0.1911 N   0  0  0

+    1.1933   -1.9017   -0.0172 C   0  0  0

+   -1.9486    0.7143   -0.2872 C   0  0  0

+    2.6791   -0.0168    0.0441 C   0  0  0

+    1.8786    2.3514   -0.0491 C   0  0  0

+   -2.1635   -0.6649   -0.2780 C   0  0  0

+    2.4531   -1.3998    0.0632 C   0  0  0

+   -3.1244    1.6515   -0.3878 C   0  0  0

+    3.9833    0.4707    0.1221 N   0  0  0

+   -3.5692   -1.2005   -0.3686 C   0  0  0

+   -3.1275    2.5967    0.8153 C   0  0  0

+    5.1096   -0.4617    0.2129 C   0  0  0

+   -3.8589   -2.0810    0.8486 C   0  0  0

+    1.0412   -2.9361    0.0000 H   0  0  0

+    2.9093    2.1754    0.0000 H   0  0  0

+    2.0546    3.3821    0.0000 H   0  0  0

+    0.8479    2.5274    0.0000 H   0  0  0

+    3.2682   -2.0547    0.0000 H   0  0  0

+   -4.1443    1.8818    0.0000 H   0  0  0

+   -3.5769    0.7089    0.0000 H   0  0  0

+    4.1570    1.5017    0.0000 H   0  0  0

+   -3.7117   -0.1647    0.0000 H   0  0  0

+   -4.6105   -1.1059    0.0000 H   0  0  0

+   -2.0819    2.6001    0.0000 H   0  0  0

+   -3.1309    3.6423    0.0000 H   0  0  0

+   -4.1731    2.5933    0.0000 H   0  0  0

+    4.4429   -1.2671    0.0000 H   0  0  0

+    5.9150   -1.1284    0.0000 H   0  0  0

+    5.7763    0.3437    0.0000 H   0  0  0

+   -4.8521   -1.7542    0.0000 H   0  0  0

+   -4.1857   -3.0742    0.0000 H   0  0  0

+   -2.8657   -2.4078    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+ 10 14  1  0

+ 12 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+  7 10  1  0

+  8 11  1  0

+  6 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+94-52-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -1.2062    0.6122   -0.0026 C   0  0  0

+   -1.6286   -0.7278   -0.0018 C   0  0  0

+    0.1608    0.9021   -0.0019 C   0  0  0

+   -2.3262    1.3799    0.0015 N   0  0  0

+   -0.6877   -1.7487    0.0004 C   0  0  0

+   -3.0087   -0.6923   -0.0027 N   0  0  0

+    1.0723   -0.1154   -0.0005 C   0  0  0

+   -3.3797    0.6165    0.0047 C   0  0  0

+    0.6556   -1.4391    0.0017 C   0  0  0

+    2.5191    0.1972    0.0002 N   0  3  0

+    3.3372   -0.7052    0.0014 O   0  0  0

+    2.8917    1.3568   -0.0005 O   0  5  0

+    0.4818    1.8849    0.0000 H   0  0  0

+   -0.9931   -2.7365    0.0000 H   0  0  0

+   -3.6427   -1.5090    0.0000 H   0  0  0

+   -4.3565    0.9552    0.0000 H   0  0  0

+    1.3574   -2.1983    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  7 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  8  1  0

+  7  9  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+79-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.4702   -0.0035   -0.0014 C   0  0  0

+   -0.6829    0.6836    0.0008 O   0  0  0

+    1.7856    0.7319    0.0000 C   0  0  0

+    0.4536   -1.2116    0.0005 O   0  0  0

+   -1.9502   -0.0250   -0.0005 C   0  0  0

+    2.2969   -0.1827    0.0000 H   0  0  0

+    2.7002    1.2432    0.0000 H   0  0  0

+    1.2743    1.6465    0.0000 H   0  0  0

+   -2.4616    0.8896    0.0000 H   0  0  0

+   -2.8648   -0.5364    0.0000 H   0  0  0

+   -1.4388   -0.9396    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+99-07-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.6455    0.1113   -0.0032 C   0  0  0

+   -0.3781   -0.8266   -0.0028 C   0  0  0

+    0.3427    1.4672   -0.0009 C   0  0  0

+    1.9778   -0.3077   -0.0001 N   0  0  0

+   -1.6988   -0.4069   -0.0001 C   0  0  0

+   -0.9753    1.8814    0.0018 C   0  0  0

+    3.0572    0.6828   -0.0005 C   0  0  0

+    2.2960   -1.7378    0.0036 C   0  0  0

+   -1.9953    0.9492    0.0022 C   0  0  0

+   -2.7031   -1.3223   -0.0001 O   0  0  0

+   -0.1539   -1.8433    0.0000 H   0  0  0

+    1.1095    2.1716    0.0000 H   0  0  0

+   -1.2005    2.8979    0.0000 H   0  0  0

+    3.7611   -0.0843    0.0000 H   0  0  0

+    3.8243    1.3867    0.0000 H   0  0  0

+    2.3533    1.4499    0.0000 H   0  0  0

+    1.2797   -1.9639    0.0000 H   0  0  0

+    2.5221   -2.7541    0.0000 H   0  0  0

+    3.3123   -1.5117    0.0000 H   0  0  0

+   -2.9876    1.2644    0.0000 H   0  0  0

+   -3.4726   -2.0237    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6  9  2  0

+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-64-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -0.0355    0.0000    0.0000 C   0  0  0

+   -0.5455   -1.4422    0.0297 C   0  0  0

+   -0.5455    0.6953   -1.2638 C   0  0  0

+   -0.5455    0.7468    1.2341 C   0  0  0

+    1.4335    0.0000    0.0000 N   0  0  0

+   -1.3846   -1.1455    0.0000 H   0  0  0

+   -0.8422   -2.2813    0.0000 H   0  0  0

+    0.2936   -1.7389    0.0000 H   0  0  0

+    0.1721    1.2217    0.0000 H   0  0  0

+   -1.0719    1.4129    0.0000 H   0  0  0

+   -1.2631    0.1689    0.0000 H   0  0  0

+    0.1895    1.2487    0.0000 H   0  0  0

+   -1.0474    1.4818    0.0000 H   0  0  0

+   -1.2805    0.2449    0.0000 H   0  0  0

+    1.8785   -0.7708    0.0000 H   0  0  0

+    1.8785    0.7708    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+124-40-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.0000   -0.5538    0.0000 N   0  0  0

+   -1.1786    0.3230    0.0000 C   0  0  0

+    1.1786    0.3230    0.0000 C   0  0  0

+    0.0000   -1.6555    0.0000 H   0  0  0

+   -0.5210    1.2069    0.0000 H   0  0  0

+   -2.0625    0.9806    0.0000 H   0  0  0

+   -1.8362   -0.5609    0.0000 H   0  0  0

+    1.8362   -0.5609    0.0000 H   0  0  0

+    2.0625    0.9806    0.0000 H   0  0  0

+    0.5210    1.2069    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+622-79-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.4698   -0.2706   -0.4191 C   0  0  0

+    1.3578   -1.2384    0.0125 C   0  0  0

+    0.8517    1.0576   -0.4402 C   0  0  0

+   -0.9123   -0.6645   -0.8726 C   0  0  0

+    2.6273   -0.8778    0.4230 C   0  0  0

+    2.1216    1.4183   -0.0297 C   0  0  0

+   -1.8263   -0.6437    0.2722 N   0  0  0

+    3.0093    0.4508    0.4018 C   0  0  0

+   -2.7218    0.0356    0.2641 N   0  3  0

+   -3.6173    0.7148    0.2560 N   0  5  0

+    1.0889   -2.1885    0.0000 H   0  0  0

+    0.1546    1.7570    0.0000 H   0  0  0

+   -1.3384   -1.5553    0.0000 H   0  0  0

+   -0.2753   -1.4190    0.0000 H   0  0  0

+    3.3244   -1.5771    0.0000 H   0  0  0

+    2.3905    2.3684    0.0000 H   0  0  0

+    3.9705    0.6771    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  2  0

+  9 10  2  0

+  6  8  2  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  8 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1845-30-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.9237    0.6972   -0.3844 C   0  0  0

+   -0.3939    1.2516    0.1832 C   0  0  1

+    0.9740   -0.1902    0.8738 C   0  0  1

+    0.7518   -0.0884   -1.6860 C   0  0  0

+    2.0485    1.7320   -0.4541 C   0  0  0

+   -1.5144    0.2609   -0.0633 C   0  0  0

+    0.1971    0.9333    1.5764 C   0  0  0

+    0.0946   -1.4257    0.6571 C   0  0  1

+   -1.2708   -1.0076    0.1697 C   0  0  0

+   -2.8623    0.7169   -0.5597 C   0  0  0

+    0.7049   -2.2807   -0.3118 O   0  0  0

+   -0.5635    2.2836    0.0000 H   0  0  0

+    1.9788   -0.4802    0.0000 H   0  0  0

+   -0.2699    0.1352    0.0000 H   0  0  0

+    0.5282   -1.1101    0.0000 H   0  0  0

+    1.7735   -0.3120    0.0000 H   0  0  0

+    2.7566    0.9623    0.0000 H   0  0  0

+    2.8182    2.4401    0.0000 H   0  0  0

+    1.3404    2.5017    0.0000 H   0  0  0

+    1.2133    1.1805    0.0000 H   0  0  0

+    0.3303    1.9706    0.0000 H   0  0  0

+   -0.5165   -2.2744    0.0000 H   0  0  0

+   -2.0490   -1.7064    0.0000 H   0  0  0

+   -2.5271    1.7076    0.0000 H   0  0  0

+   -3.8530    1.0521    0.0000 H   0  0  0

+   -3.1975   -0.2738    0.0000 H   0  0  0

+    1.3125   -3.1319    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  6  9  2  0

+  6 10  1  0

+  8 11  1  0

+  3  7  1  0

+  8  9  1  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  5 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+150-68-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -2.3918   -0.2271   -0.0448 C   0  0  0

+   -3.7110    0.0295    0.0564 N   0  0  0

+   -1.5116    0.7904   -0.1256 N   0  0  0

+   -1.9953   -1.3764   -0.0582 O   0  0  0

+   -4.6677   -1.0765    0.1443 C   0  0  0

+   -4.1883    1.4144    0.0787 C   0  0  0

+   -0.1365    0.5316   -0.0807 C   0  0  0

+    0.7675    1.5839   -0.0157 C   0  0  0

+    0.3256   -0.7775   -0.0955 C   0  0  0

+    2.1234    1.3259    0.0284 C   0  0  0

+    1.6829   -1.0301   -0.0512 C   0  0  0

+    2.5817    0.0201    0.0078 C   0  0  0

+    4.2869   -0.3007    0.0634 Cl  0  0  0

+   -1.8536    1.7703    0.0000 H   0  0  0

+   -5.4527   -0.3975    0.0000 H   0  0  0

+   -5.3467   -1.8615    0.0000 H   0  0  0

+   -3.8827   -1.7555    0.0000 H   0  0  0

+   -3.2070    1.7526    0.0000 H   0  0  0

+   -4.5265    2.3957    0.0000 H   0  0  0

+   -5.1696    1.0762    0.0000 H   0  0  0

+    0.4248    2.5636    0.0000 H   0  0  0

+   -0.3492   -1.5662    0.0000 H   0  0  0

+    2.8005    2.1126    0.0000 H   0  0  0

+    2.0285   -2.0088    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  7  8  1  0

+  7  9  2  0

+  8 10  2  0

+  9 11  1  0

+ 10 12  1  0

+ 12 13  1  0

+ 11 12  2  0

+  3 14  1  0

+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+  6 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-40-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.0016   -0.3481   -0.1760 P   0  0  0

+   -1.3134   -0.5856    0.7220 O   0  0  0

+    0.0070    1.1634   -0.7304 O   0  0  0

+    1.3157   -0.5955    0.7208 O   0  0  0

+   -0.0025   -1.2918   -1.3161 O   0  0  0

+   -2.4265   -0.6098   -0.1738 C   0  0  0

+   -0.0131    2.0223    0.4114 C   0  0  0

+    2.4314   -0.5937   -0.1721 C   0  0  0

+   -3.7152   -0.8333    0.6199 C   0  0  0

+   -0.0091    3.4817   -0.0480 C   0  0  0

+    3.7193   -0.8252    0.6206 C   0  0  0

+   -1.9981    0.2729    0.0000 H   0  0  0

+   -3.0166    0.1741    0.0000 H   0  0  0

+   -0.8657    2.5078    0.0000 H   0  0  0

+   -0.8555    1.5193    0.0000 H   0  0  0

+    3.0186    0.1923    0.0000 H   0  0  0

+    1.9911    0.2831    0.0000 H   0  0  0

+   -3.8829    0.1334    0.0000 H   0  0  0

+   -4.6819   -1.0010    0.0000 H   0  0  0

+   -3.5475   -1.8000    0.0000 H   0  0  0

+    0.9721    3.4790    0.0000 H   0  0  0

+   -0.0064    4.4629    0.0000 H   0  0  0

+   -0.9903    3.4844    0.0000 H   0  0  0

+    3.5457   -1.7909    0.0000 H   0  0  0

+    4.6850   -0.9988    0.0000 H   0  0  0

+    3.8929    0.1405    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  7 10  1  0

+  8 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1124-33-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.6201    0.0001   -0.0009 C   0  0  0

+   -2.1001    0.0000   -0.0007 N   0  3  0

+    0.0893    1.1912    0.0010 C   0  0  0

+    0.0896   -1.1914    0.0030 C   0  0  0

+   -2.7091   -1.0548   -0.0023 O   0  0  0

+   -2.7091    1.0548    0.0010 O   0  5  0

+    1.4708    1.1526    0.0007 C   0  0  0

+    1.4706   -1.1527    0.0027 C   0  0  0

+    2.1136    0.0001   -0.0012 N   0  3  0

+    3.5296    0.0001   -0.0019 O   0  5  0

+   -0.4101    2.0993    0.0000 H   0  0  0

+   -0.4098   -2.0995    0.0000 H   0  0  0

+    2.0080    2.0388    0.0000 H   0  0  0

+    2.0079   -2.0389    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  7  9  2  0

+  9 10  1  0

+  8  9  1  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93-72-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    0.5722    0.2298   -0.6465 C   0  0  0

+    0.1168    1.4511   -0.1694 C   0  0  0

+   -0.2922   -0.8528   -0.7129 C   0  0  0

+    1.8624    0.0965   -1.0536 O   0  0  0

+   -1.1973    1.5864    0.2389 C   0  0  0

+    1.1966    2.8077   -0.0847 Cl  0  0  0

+   -1.6054   -0.7137   -0.3038 C   0  0  0

+    2.6566   -0.0342    0.1271 C   0  0  0

+   -2.0580    0.5056    0.1720 C   0  0  0

+   -2.6879   -2.0684   -0.3865 Cl  0  0  0

+    2.8282   -1.4943    0.4581 C   0  0  0

+    4.0289    0.6000   -0.1086 C   0  0  0

+   -3.7074    0.6779    0.6852 Cl  0  0  0

+    3.5431   -1.8592    1.5339 O   0  0  0

+    2.3223   -2.3367   -0.2451 O   0  0  0

+    0.0897   -1.7670    0.0000 H   0  0  0

+   -1.5812    2.4998    0.0000 H   0  0  0

+    2.5233    0.9476    0.0000 H   0  0  0

+    4.4445   -0.2994    0.0000 H   0  0  0

+    4.9283    1.0156    0.0000 H   0  0  0

+    3.6133    1.4994    0.0000 H   0  0  0

+    4.4256   -2.3096    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+  8 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 11 14  1  0

+ 11 15  2  0

+  7  9  1  0

+  3 16  1  0

+  5 17  1  0

+  8 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+10567-95-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 38                          1 V2000

+   -0.2069   -0.3423   -0.0022 C   0  0  0

+   -1.6226   -0.7446   -0.0018 C   0  0  0

+    0.1073    1.0416   -0.0008 C   0  0  0

+    0.7417   -1.2659    0.0016 N   0  0  0

+   -2.6254    0.2467    0.0001 C   0  0  0

+   -1.9836   -2.0937   -0.0028 C   0  0  0

+    1.4405    1.4544   -0.0011 C   0  0  0

+   -0.9637    2.0356    0.0015 C   0  0  0

+    2.0317   -0.9413    0.0014 C   0  0  0

+   -2.2573    1.6597    0.0020 C   0  0  0

+   -3.9727   -0.1387    0.0005 C   0  0  0

+   -3.3154   -2.4416   -0.0019 C   0  0  0

+    2.4325    0.4683   -0.0033 C   0  0  0

+    1.8002    2.9179    0.0002 C   0  0  0

+    3.0389   -1.9257    0.0063 C   0  0  0

+   -3.3377    2.7103    0.0039 C   0  0  0

+   -4.3015   -1.4632   -0.0009 C   0  0  0

+    3.8019    0.7913   -0.0037 C   0  0  0

+    4.3451   -1.5495    0.0066 C   0  0  0

+    4.7238   -0.2084   -0.0057 C   0  0  0

+   -1.2440   -2.8377    0.0000 H   0  0  0

+   -0.7218    3.0564    0.0000 H   0  0  0

+   -4.7275    0.5899    0.0000 H   0  0  0

+   -3.5881   -3.4546    0.0000 H   0  0  0

+    2.8189    2.6675    0.0000 H   0  0  0

+    2.0506    3.9366    0.0000 H   0  0  0

+    0.7815    3.1683    0.0000 H   0  0  0

+    2.7827   -2.9430    0.0000 H   0  0  0

+   -2.6064    3.4624    0.0000 H   0  0  0

+   -4.0898    3.4416    0.0000 H   0  0  0

+   -4.0690    1.9582    0.0000 H   0  0  0

+   -5.3117   -1.7460    0.0000 H   0  0  0

+    4.1090    1.7944    0.0000 H   0  0  0

+    5.0888   -2.2894    0.0000 H   0  0  0

+    5.7441    0.0357    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  7 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  2  0

+ 13 18  1  0

+ 15 19  2  0

+ 18 20  2  0

+  8 10  2  0

+  9 13  1  0

+ 12 17  1  0

+ 19 20  1  0

+  6 21  1  0

+  8 22  1  0

+ 11 23  1  0

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+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80266-02-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 52                          1 V2000

+    2.4583    0.1545   -0.3213 C   0  0  0

+    1.4454    1.0210   -0.7602 C   0  0  0

+    3.4798    0.6525    0.6027 C   0  0  0

+    2.4906   -1.1884   -0.7612 C   0  0  0

+    1.4614    2.3509   -0.2819 C   0  0  0

+    0.4666    0.5890   -1.6303 N   0  0  0

+    3.4574    1.9174    1.0305 N   0  0  0

+    4.4903   -0.2173    1.0386 C   0  0  0

+    3.4639   -2.0231   -0.3396 C   0  0  0

+    2.5180    2.7719    0.6408 C   0  0  0

+    0.4858    3.2780   -0.6716 C   0  0  0

+   -0.7218    0.0387   -1.1309 C   0  0  0

+    4.5017   -1.5531    0.5783 C   0  0  0

+    2.5129    4.1050    1.1054 C   0  0  0

+    0.5362    4.5520   -0.1870 C   0  0  0

+   -1.7111   -0.3979   -2.0097 C   0  0  0

+   -0.9114   -0.0769    0.2387 C   0  0  0

+    5.4512   -2.3833    0.9829 N   0  0  0

+    1.5380    4.9576    0.6901 C   0  0  0

+   -2.8841   -0.9416   -1.5138 C   0  0  0

+   -1.5252   -0.2898   -3.3523 O   0  0  0

+   -2.0823   -0.6197    0.7316 C   0  0  0

+    5.4615   -3.4462    0.6176 N   0  3  0

+   -3.0721   -1.0507   -0.1424 C   0  0  0

+   -2.6990   -0.8150   -3.9755 C   0  0  0

+    5.4719   -4.5091    0.2522 N   0  5  0

+   -4.2571   -1.5995    0.3593 N   0  0  0

+   -5.2442   -0.6912    1.3304 S   0  0  0

+   -5.8807    0.5777    0.2011 C   0  0  0

+   -6.2567   -1.6158    1.7032 O   0  0  0

+   -4.3370   -0.1426    2.2765 O   0  0  0

+    1.6242   -1.5994    0.0000 H   0  0  0

+    0.0715    1.4628    0.0000 H   0  0  0

+    5.3602    0.1862    0.0000 H   0  0  0

+    3.3284   -2.9724    0.0000 H   0  0  0

+   -0.4027    2.9173    0.0000 H   0  0  0

+    3.3853    4.5030    0.0000 H   0  0  0

+   -0.2482    5.1036    0.0000 H   0  0  0

+   -0.4594   -0.9226    0.0000 H   0  0  0

+    1.6973    5.9032    0.0000 H   0  0  0

+   -3.3269   -0.0910    0.0000 H   0  0  0

+   -1.6892   -1.4944    0.0000 H   0  0  0

+   -3.0907    0.0603    0.0000 H   0  0  0

+   -3.5743   -1.2067    0.0000 H   0  0  0

+   -2.3073   -1.6903    0.0000 H   0  0  0

+   -4.4052   -2.5469    0.0000 H   0  0  0

+   -5.0235    1.0077    0.0000 H   0  0  0

+   -6.3107    1.4349    0.0000 H   0  0  0

+   -6.7379    0.1477    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 11 15  2  0

+ 12 16  2  0

+ 12 17  1  0

+ 13 18  1  0

+ 14 19  2  0

+ 16 20  1  0

+ 16 21  1  0

+ 17 22  2  0

+ 18 23  2  0

+ 20 24  2  0

+ 21 25  1  0

+ 23 26  2  0

+ 24 27  1  0

+ 27 28  1  0

+ 28 29  1  0

+ 28 30  2  0

+ 28 31  2  0

+  7 10  2  0

+  9 13  1  0

+ 15 19  1  0

+ 22 24  1  0

+  4 32  1  0

+  6 33  1  0

+  8 34  1  0

+  9 35  1  0

+ 11 36  1  0

+ 14 37  1  0

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+ 19 40  1  0

+ 20 41  1  0

+ 22 42  1  0

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+ 25 44  1  0

+ 25 45  1  0

+ 27 46  1  0

+ 29 47  1  0

+ 29 48  1  0

+ 29 49  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-22-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+    0.6159   -0.4159    0.0000 C   0  0  0

+   -0.6159    0.4159    0.0000 C   0  0  0

+    1.7018    0.1130    0.0000 O   0  0  0

+   -1.7018   -0.1130    0.0000 O   0  0  0

+    0.5522   -1.3196    0.0000 H   0  0  0

+   -0.5522    1.3196    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  1  5  1  0

+  2  6  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6757-06-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    1.5703   -3.4811   -0.8110 O   0  0  0

+    1.4050   -2.2812   -0.0527 C   0  0  0

+    1.4427   -1.0659   -0.9995 C   0  0  0

+   -0.0190   -2.2458    0.5535 C   0  0  0

+    0.1441   -0.4511   -0.9575 O   0  0  0

+    2.4502   -0.1118   -0.5295 N   0  0  0

+    0.0535   -2.5113    1.9557 O   0  0  0

+   -0.4314   -0.7689    0.3279 C   0  0  0

+    2.0664    1.1290   -0.1892 C   0  0  0

+    3.7598   -0.5118   -0.4436 C   0  0  0

+   -1.9559   -0.6725    0.2420 C   0  0  0

+    0.8924    1.4325   -0.2788 O   0  0  0

+    2.9501    2.0452    0.2483 N   0  0  0

+    4.7013    0.3487   -0.0143 C   0  0  0

+   -2.3361    0.6892    0.0340 O   0  0  0

+    4.2909    1.7100    0.3542 C   0  0  0

+   -3.9439    0.7164   -0.0462 P   0  0  0

+    5.1691    2.5838    0.7766 N   0  0  0

+   -4.3961   -0.1328   -1.1708 O   0  0  0

+   -4.5595    0.1553    1.3315 O   0  0  0

+   -4.4440    2.2287   -0.2809 O   0  0  0

+    1.7068   -4.4723    0.0000 H   0  0  0

+    2.4041   -2.2283    0.0000 H   0  0  0

+    2.3555   -1.4755    0.0000 H   0  0  0

+   -0.9834   -2.5121    0.0000 H   0  0  0

+    0.3171   -3.4765    0.0000 H   0  0  0

+   -0.6504    0.2074    0.0000 H   0  0  0

+    3.9801   -1.4878    0.0000 H   0  0  0

+   -2.9436   -0.8324    0.0000 H   0  0  0

+   -1.9072   -1.6719    0.0000 H   0  0  0

+    2.6743    3.0070    0.0000 H   0  0  0

+    5.6659    0.0830    0.0000 H   0  0  0

+    5.8784    3.2895    0.0000 H   0  0  0

+   -5.2990   -0.5187    0.0000 H   0  0  0

+   -4.7581    3.1787    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  1  0

+  8  4  1  0

+  9  6  1  0

+ 10  6  1  0

+ 11  8  1  0

+ 12  9  2  0

+ 13  9  1  0

+ 14 10  2  0

+ 15 11  1  0

+ 16 13  1  0

+ 17 15  1  0

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+  5  8  1  0

+ 14 16  1  0

+  1 22  1  0

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+ 11 30  1  0

+ 13 31  1  0

+ 14 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122349-91-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -0.2407    0.7698    0.0041 C   0  0  0

+   -0.1863   -0.6471    0.0020 C   0  0  0

+    0.9580    1.5009    0.0035 C   0  0  0

+   -1.4252    1.3903    0.0011 N   0  0  0

+   -1.3899   -1.3746    0.0025 C   0  0  0

+    1.0590   -1.2985   -0.0011 C   0  0  0

+    2.1628    0.8324    0.0009 C   0  0  0

+   -2.5490    0.7141   -0.0039 C   0  0  0

+   -2.5657   -0.6779    0.0051 C   0  0  0

+   -1.3833   -2.8816   -0.0002 C   0  0  0

+    2.2049   -0.5678   -0.0021 C   0  0  0

+    3.3536    1.5579    0.0004 N   0  0  0

+   -3.8564    1.4636   -0.0072 C   0  0  0

+    3.5371   -1.2724   -0.0054 C   0  0  0

+    0.9364    2.5513    0.0000 H   0  0  0

+    1.1040   -2.3482    0.0000 H   0  0  0

+   -3.4816   -1.1926    0.0000 H   0  0  0

+   -2.4339   -2.8862    0.0000 H   0  0  0

+   -1.3787   -3.9322    0.0000 H   0  0  0

+   -0.3327   -2.8770    0.0000 H   0  0  0

+    4.2756    1.0542    0.0000 H   0  0  0

+    3.3288    2.6082    0.0000 H   0  0  0

+   -3.3339    2.3751    0.0000 H   0  0  0

+   -4.7679    1.9861    0.0000 H   0  0  0

+   -4.3789    0.5521    0.0000 H   0  0  0

+    3.0459   -2.2011    0.0000 H   0  0  0

+    4.4658   -1.7636    0.0000 H   0  0  0

+    4.0283   -0.3437    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+ 11 14  1  0

+  7 11  1  0

+  8  9  2  0

+  3 15  1  0

+  6 16  1  0

+  9 17  1  0

+ 10 18  1  0

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+ 10 20  1  0

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+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67-63-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.0795    0.0000    0.3823 C   0  0  0

+    0.8035   -1.2490   -0.1243 C   0  0  0

+    0.8029    1.2494   -0.1243 C   0  0  0

+   -1.2655   -0.0003   -0.1004 O   0  0  0

+   -0.4610   -0.9382    0.0000 H   0  0  0

+   -0.1332   -1.7920    0.0000 H   0  0  0

+    1.3465   -2.1858    0.0000 H   0  0  0

+    1.7402   -0.7060    0.0000 H   0  0  0

+    1.7399    0.7069    0.0000 H   0  0  0

+    1.3454    2.1864    0.0000 H   0  0  0

+   -0.1341    1.7919    0.0000 H   0  0  0

+   -2.3483   -0.0005    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+28342-33-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 48                          1 V2000

+    0.6175   -0.0433   -0.0100 C   0  0  0

+   -0.2125   -1.1634    0.0157 C   0  0  0

+    2.0184   -0.2276    0.0262 C   0  0  0

+    0.0916    1.2317   -0.0755 N   0  0  0

+   -1.6745   -0.9733   -0.0264 C   0  0  0

+    0.3339   -2.4568    0.0802 C   0  0  0

+    2.5483   -1.5388    0.0879 C   0  0  0

+    2.8913    0.8711    0.0008 C   0  0  0

+   -1.2325    1.4633   -0.1213 C   0  0  0

+    1.0091    2.3736   -0.0964 C   0  0  0

+   -2.1795    0.3438   -0.0900 C   0  0  0

+   -2.5508   -2.0524   -0.0052 C   0  0  0

+    1.6764   -2.6455    0.1156 C   0  0  0

+    3.9405   -1.7184    0.1198 C   0  0  0

+    4.2414    0.6681    0.0320 C   0  0  0

+   -1.6467    2.6067   -0.1794 O   0  0  0

+   -3.5616    0.5531   -0.1316 C   0  0  0

+   -3.9127   -1.8317   -0.0469 C   0  0  0

+    4.7682   -0.6322    0.0912 C   0  0  0

+    5.2809    1.5545    0.0167 O   0  0  0

+   -4.4192   -0.5402   -0.1093 C   0  0  0

+   -4.0614    1.8140   -0.1928 O   0  0  0

+    6.1312   -0.5450    0.1102 O   0  0  0

+    6.4393    0.7831   -0.3503 C   0  0  0

+   -5.7645   -0.3438   -0.1491 O   0  0  0

+   -4.3951    2.1914    1.1445 C   0  0  0

+   -6.3719   -1.6368   -0.1131 C   0  0  0

+   -0.3015   -3.2834    0.0000 H   0  0  0

+    2.5093    1.8412    0.0000 H   0  0  0

+    1.8218    1.7206    0.0000 H   0  0  0

+    1.6621    3.1863    0.0000 H   0  0  0

+    0.1964    3.0266    0.0000 H   0  0  0

+   -2.1796   -3.0266    0.0000 H   0  0  0

+    2.0650   -3.6129    0.0000 H   0  0  0

+    4.3423   -2.6804    0.0000 H   0  0  0

+   -4.5673   -2.6431    0.0000 H   0  0  0

+    7.4194    0.4278    0.0000 H   0  0  0

+    6.9093    1.7137    0.0000 H   0  0  0

+   -3.6141    2.8820    0.0000 H   0  0  0

+   -5.0857    2.9724    0.0000 H   0  0  0

+   -5.1761    1.5008    0.0000 H   0  0  0

+   -7.3155   -1.1935    0.0000 H   0  0  0

+   -6.8152   -2.5804    0.0000 H   0  0  0

+   -5.4283   -2.0801    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

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+  7 14  1  0

+  8 15  2  0

+  9 16  2  0

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+ 12 18  2  0

+ 14 19  2  0

+ 15 20  1  0

+ 17 21  2  0

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+ 19 23  1  0

+ 20 24  1  0

+ 21 25  1  0

+ 22 26  1  0

+ 25 27  1  0

+  7 13  1  0

+  9 11  1  0

+ 15 19  1  0

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+ 23 24  1  0

+  6 28  1  0

+  8 29  1  0

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+ 24 37  1  0

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+ 26 39  1  0

+ 26 40  1  0

+ 26 41  1  0

+ 27 42  1  0

+ 27 43  1  0

+ 27 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96910-71-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+   -1.5559   -0.5359    0.0749 C   0  0  1

+   -0.4544   -1.5659   -0.0615 C   0  0  1

+   -1.1290    0.8933   -0.0503 C   0  0  0

+   -1.3938   -1.3110   -1.2378 C   0  0  0

+   -2.7487   -0.8243    0.9496 C   0  0  0

+    0.9496   -1.0671   -0.2496 C   0  0  1

+   -0.6080   -2.8974    0.6762 C   0  0  0

+    0.0447    1.2447   -0.5430 C   0  0  0

+   -2.0484    1.9422    0.3900 C   0  0  0

+   -3.8657   -0.7009    0.5074 O   0  0  0

+    1.0548    0.2469   -1.0337 C   0  0  1

+    1.6327   -0.7454    1.0954 C   0  0  0

+   -1.7705    3.1088    0.2064 O   0  0  0

+    2.4585    0.7861   -0.6620 C   0  0  0

+    0.9393    0.0224   -2.4403 O   0  0  0

+    2.8187    0.1613    0.6983 C   0  0  0

+    3.0117    1.2604    1.7451 C   0  0  0

+    4.0959   -0.6716    0.5719 C   0  0  0

+   -2.3472   -1.3579    0.0000 H   0  0  0

+   -1.4966   -2.2600    0.0000 H   0  0  0

+   -2.6880   -1.7769    0.0000 H   0  0  0

+    1.3132   -1.9497    0.0000 H   0  0  0

+   -1.5562   -2.7880    0.0000 H   0  0  0

+   -0.7174   -3.8456    0.0000 H   0  0  0

+    0.3402   -3.0068    0.0000 H   0  0  0

+    0.2755    2.1709    0.0000 H   0  0  0

+   -2.9749    1.7126    0.0000 H   0  0  0

+    1.6207   -1.6998    0.0000 H   0  0  0

+    2.4857   -1.1737    0.0000 H   0  0  0

+    3.3091    1.2191    0.0000 H   0  0  0

+    2.0703    1.6581    0.0000 H   0  0  0

+    0.5026   -0.8264    0.0000 H   0  0  0

+    3.9518    1.0953    0.0000 H   0  0  0

+    3.1768    2.2005    0.0000 H   0  0  0

+    2.0716    1.4255    0.0000 H   0  0  0

+    3.5745   -1.4711    0.0000 H   0  0  0

+    4.8954   -1.1930    0.0000 H   0  0  0

+    4.6173    0.1279    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

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+  2  4  1  0

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+ 14 16  1  0

+  4 19  1  0

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+ 12 28  1  0

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+ 14 30  1  0

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+ 15 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-59-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -1.3084   -0.1965    0.0136 C   0  0  0

+   -0.4571   -1.4094   -0.3590 C   0  0  0

+   -0.7423    1.0467   -0.6876 C   0  0  0

+   -2.7520   -0.4261   -0.4381 C   0  0  0

+   -1.2708    0.0091    1.5293 C   0  0  0

+    0.9968   -1.1521   -0.0952 C   0  0  0

+    0.6669    1.2523   -0.1712 C   0  0  0

+    1.5158    0.0668   -0.0124 C   0  0  0

+    1.9129   -2.3350    0.0851 C   0  0  0

+    1.0795    2.3602    0.1018 O   0  0  0

+   -1.4225   -1.8954    0.0000 H   0  0  0

+   -0.1163   -2.4351    0.0000 H   0  0  0

+   -0.6928    2.1264    0.0000 H   0  0  0

+   -1.7930    1.3000    0.0000 H   0  0  0

+   -2.9218    0.6413    0.0000 H   0  0  0

+   -3.8194   -0.5959    0.0000 H   0  0  0

+   -2.5822   -1.4935    0.0000 H   0  0  0

+   -0.2076   -0.1853    0.0000 H   0  0  0

+   -1.0764    1.0723    0.0000 H   0  0  0

+   -2.3340    0.2035    0.0000 H   0  0  0

+    2.5902    0.1849    0.0000 H   0  0  0

+    1.0584   -2.9968    0.0000 H   0  0  0

+    2.5747   -3.1895    0.0000 H   0  0  0

+    2.7674   -1.6732    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  3  7  1  0

+  6  8  2  0

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+  7  8  1  0

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+  5 19  1  0

+  5 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+  9 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57-66-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+    0.3082   -0.2664    0.6212 C   0  0  0

+   -1.3959   -0.3048    1.0677 S   0  0  0

+    1.0690    0.8541    0.9036 C   0  0  0

+    0.8809   -1.3595   -0.0052 C   0  0  0

+   -2.2566    0.2980   -0.2122 N   0  0  0

+   -1.7420   -1.6804    1.1521 O   0  0  0

+   -1.5424    0.6459    2.1136 O   0  0  0

+    2.4039    0.8906    0.5572 C   0  0  0

+    2.2143   -1.3364   -0.3570 C   0  0  0

+   -2.7377   -0.6042   -1.2614 C   0  0  0

+   -2.5372    1.7335   -0.2952 C   0  0  0

+    2.9868   -0.2065   -0.0797 C   0  0  0

+   -4.0373   -1.2702   -0.8050 C   0  0  0

+   -1.4013    2.4325   -1.0450 C   0  0  0

+    4.4155   -0.1743   -0.4540 C   0  0  0

+   -4.5397   -2.2125   -1.9007 C   0  0  0

+   -1.6943    3.9317   -1.1317 C   0  0  0

+    4.9748   -1.2347   -1.0685 O   0  0  0

+    5.0859    0.8082   -0.2077 O   0  0  0

+    0.5887    1.7316    0.0000 H   0  0  0

+    0.3705   -2.2198    0.0000 H   0  0  0

+    2.9075    1.7549    0.0000 H   0  0  0

+    2.6888   -2.2170    0.0000 H   0  0  0

+   -2.5858   -1.5929    0.0000 H   0  0  0

+   -1.7516   -0.7722    0.0000 H   0  0  0

+   -2.9561    2.6419    0.0000 H   0  0  0

+   -3.4890    1.4259    0.0000 H   0  0  0

+   -4.1892   -0.2815    0.0000 H   0  0  0

+   -5.0234   -1.1023    0.0000 H   0  0  0

+   -0.9824    1.5241    0.0000 H   0  0  0

+   -0.4495    2.7401    0.0000 H   0  0  0

+   -5.4224   -1.7419    0.0000 H   0  0  0

+   -5.0103   -3.0952    0.0000 H   0  0  0

+   -3.6570   -2.6831    0.0000 H   0  0  0

+   -0.7126    4.1236    0.0000 H   0  0  0

+   -1.8862    4.9134    0.0000 H   0  0  0

+   -2.6760    3.7398    0.0000 H   0  0  0

+    5.4415   -2.1195    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+ 16 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 17 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-30-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.0001   -0.0187   -0.0122 C   0  0  0

+   -1.2088    0.6837   -0.0004 C   0  0  0

+    1.2084    0.6840   -0.0008 C   0  0  0

+    0.0004   -1.4942   -0.0306 C   0  0  0

+   -1.2006    2.0641    0.0225 C   0  0  0

+   -2.7160   -0.1776   -0.0138 Cl  0  0  0

+    1.1997    2.0648    0.0221 C   0  0  0

+    2.7159   -0.1768   -0.0148 Cl  0  0  0

+    0.0035   -2.1824    1.1277 O   0  0  0

+   -0.0023   -2.0886   -1.0902 O   0  0  0

+   -0.0004    2.7524    0.0337 C   0  0  0

+   -2.0969    2.5869    0.0000 H   0  0  0

+    2.0958    2.5879    0.0000 H   0  0  0

+    0.0082   -3.2201    0.0000 H   0  0  0

+   -0.0006    3.7901    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

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+  5 11  1  0

+  7 11  2  0

+  5 12  1  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106-42-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.3823    0.0001    0.0019 C   0  0  0

+   -0.6911   -1.1972    0.0013 C   0  0  0

+   -0.6913    1.1971    0.0014 C   0  0  0

+   -2.8893    0.0001   -0.0034 C   0  0  0

+    0.6911   -1.1972    0.0003 C   0  0  0

+    0.6913    1.1971    0.0004 C   0  0  0

+    1.3823    0.0001   -0.0002 C   0  0  0

+    2.8893    0.0001   -0.0018 C   0  0  0

+   -1.2096   -2.0951    0.0000 H   0  0  0

+   -1.2098    2.0950    0.0000 H   0  0  0

+   -2.8893    1.0370    0.0000 H   0  0  0

+   -3.9262    0.0001    0.0000 H   0  0  0

+   -2.8893   -1.0368    0.0000 H   0  0  0

+    1.2096   -2.0951    0.0000 H   0  0  0

+    1.2098    2.0950    0.0000 H   0  0  0

+    2.8893   -1.0368    0.0000 H   0  0  0

+    3.9262    0.0001    0.0000 H   0  0  0

+    2.8893    1.0370    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  2  5  2  0

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+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23246-96-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 50                          1 V2000

+   -3.2088    0.2254    0.7001 C   0  0  1

+   -2.7790   -1.0090   -0.1172 C   0  0  2

+   -2.0242    1.1498    0.8272 C   0  0  0

+   -4.2057    0.9576   -0.1591 N   0  0  0

+   -1.3509   -0.9981   -0.3663 O   0  0  0

+   -3.5337   -0.8741   -1.4693 C   0  0  0

+   -0.6718    0.7547    1.3588 C   0  0  0

+   -2.3523    2.3558    0.4394 C   0  0  0

+   -3.7011    0.6735   -1.5498 C   0  0  0

+   -3.8115    2.3789    0.0612 C   0  0  0

+   -0.5652   -1.9875    0.0969 C   0  0  0

+    0.2996    0.7129    0.2832 O   0  0  0

+    0.8252   -2.1044   -0.3623 C   0  0  0

+   -1.0074   -2.7869    0.8984 O   0  0  0

+    1.5829    1.0239    0.5404 C   0  0  0

+    1.3375   -1.2067   -1.4584 C   0  0  0

+    1.6339   -3.0047    0.1912 C   0  0  0

+    2.6155    0.8750   -0.5485 C   0  0  2

+    1.9057    1.4192    1.6356 O   0  0  0

+    2.6259   -0.5585   -1.0202 C   0  0  0

+    1.6075   -3.2259    1.6817 C   0  0  0

+    3.9953    1.2437    0.0002 C   0  0  0

+    2.2882    1.7377   -1.6396 O   0  0  0

+    3.7474   -1.2349   -1.0491 C   0  0  0

+    3.9796    2.5972    0.4583 O   0  0  0

+   -3.9973   -0.3570    0.0000 H   0  0  0

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+   -4.5139   -0.8867    0.0000 H   0  0  0

+   -3.6140   -1.8511    0.0000 H   0  0  0

+   -1.3237    0.0225    0.0000 H   0  0  0

+   -0.2899   -0.1482    0.0000 H   0  0  0

+   -1.7509    3.1299    0.0000 H   0  0  0

+   -2.7256    0.5765    0.0000 H   0  0  0

+   -3.4058    1.6083    0.0000 H   0  0  0

+   -3.7129    3.3542    0.0000 H   0  0  0

+   -4.7750    2.5598    0.0000 H   0  0  0

+    1.2028   -0.2357    0.0000 H   0  0  0

+    0.3749   -1.0212    0.0000 H   0  0  0

+    2.5685   -2.7089    0.0000 H   0  0  0

+    0.6341   -3.1097    0.0000 H   0  0  0

+    1.4913   -4.1993    0.0000 H   0  0  0

+    2.5809   -3.3421    0.0000 H   0  0  0

+    4.1688    0.2789    0.0000 H   0  0  0

+    4.9712    1.3365    0.0000 H   0  0  0

+    1.9405    2.6543    0.0000 H   0  0  0

+    3.7287   -2.2150    0.0000 H   0  0  0

+    4.6056   -0.7611    0.0000 H   0  0  0

+    3.9682    3.5774    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  1  0

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+  6  9  1  0

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+ 18 20  1  0

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+  6 28  1  0

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+ 16 37  1  0

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+ 21 40  1  0

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+ 22 43  1  0

+ 22 44  1  0

+ 23 45  1  0

+ 24 46  1  0

+ 24 47  1  0

+ 25 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.2198    0.4270   -0.2904 C   0  0  0

+    0.2775   -0.8250   -0.6277 C   0  0  0

+    0.6325    1.3997    0.2143 C   0  0  0

+   -1.5812    0.7104   -0.4649 N   0  0  0

+    1.6195   -1.1025   -0.4613 C   0  0  0

+    1.9750    1.1225    0.3810 C   0  0  0

+   -2.5125   -0.0826    0.1009 C   0  0  0

+    2.4725   -0.1293    0.0437 C   0  0  0

+   -3.9735    0.1449   -0.1903 C   0  0  0

+   -2.1748   -0.9795    0.8444 O   0  0  0

+    3.8325   -0.4102    0.2120 N   0  0  0

+   -0.3721   -1.5989    0.0000 H   0  0  0

+    0.3110    2.3575    0.0000 H   0  0  0

+   -1.8312    1.6893    0.0000 H   0  0  0

+    1.9408   -2.0604    0.0000 H   0  0  0

+    2.6244    1.8965    0.0000 H   0  0  0

+   -3.8180    1.1432    0.0000 H   0  0  0

+   -4.9718    0.3004    0.0000 H   0  0  0

+   -4.1290   -0.8534    0.0000 H   0  0  0

+    4.1502   -1.3693    0.0000 H   0  0  0

+    4.5042    0.3445    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  7  9  1  0

+  7 10  2  0

+  8 11  1  0

+  6  8  2  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71-23-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.6718   -0.5310    0.0000 C   0  0  0

+   -0.4330    0.5275    0.0000 C   0  0  0

+    2.0380    0.1578    0.0000 C   0  0  0

+   -1.7090   -0.1158    0.0000 O   0  0  0

+   -0.2106   -1.2645    0.0000 H   0  0  0

+    1.3009   -1.4907    0.0000 H   0  0  0

+    0.4494    1.2610    0.0000 H   0  0  0

+   -1.0621    1.4872    0.0000 H   0  0  0

+    2.5546   -0.8669    0.0000 H   0  0  0

+    3.0627    0.6744    0.0000 H   0  0  0

+    1.5214    1.1825    0.0000 H   0  0  0

+   -2.7337   -0.6324    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1929-82-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.0046    0.4781   -0.0041 C   0  0  0

+   -1.0679   -0.3024   -0.0029 N   0  0  0

+   -0.1369    1.8532   -0.0031 C   0  0  0

+    1.3709   -0.1375   -0.0002 C   0  0  0

+   -2.2912    0.1922   -0.0008 C   0  0  0

+   -1.4071    2.4107   -0.0009 C   0  0  0

+    2.6139    1.1685   -0.0029 Cl  0  0  0

+    1.5703   -1.1539    1.4756 Cl  0  0  0

+    1.5743   -1.1637   -1.4686 Cl  0  0  0

+   -2.5010    1.5601    0.0002 C   0  0  0

+   -3.6526   -0.8850    0.0001 Cl  0  0  0

+    0.7039    2.4618    0.0000 H   0  0  0

+   -1.5351    3.4407    0.0000 H   0  0  0

+   -3.4653    1.9440    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 10  2  0

+  3 12  1  0

+  6 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110-02-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  9                          1 V2000

+   -1.2982    0.6911    0.0000 C   0  0  0

+   -1.2982   -0.6911    0.0000 C   0  0  0

+   -0.1128    1.3485    0.0000 C   0  0  0

+   -0.1128   -1.3485    0.0000 C   0  0  0

+    1.0572    0.0000    0.0000 S   0  0  0

+   -2.1915    1.2171    0.0000 H   0  0  0

+   -2.1915   -1.2171    0.0000 H   0  0  0

+    0.0676    2.3693    0.0000 H   0  0  0

+    0.0676   -2.3693    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  2  0

+  3  5  1  0

+  4  5  1  0

+  1  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80-40-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    0.3957   -0.3382   -0.0045 C   0  0  0

+   -1.3227   -0.7279   -0.0152 S   0  0  0

+    1.0464   -0.1148    1.1948 C   0  0  0

+    1.0943   -0.2614   -1.1946 C   0  0  0

+   -2.0635    0.4651    0.5717 O   0  0  0

+   -1.6982   -0.7799   -1.3847 O   0  0  0

+   -1.4852   -1.7828    0.9229 O   0  0  0

+    2.3942    0.1910    1.2032 C   0  0  0

+    2.4426    0.0444   -1.1862 C   0  0  0

+   -1.8907    1.5494   -0.3430 C   0  0  0

+    3.0918    0.2734    0.0123 C   0  0  0

+   -2.6151    2.7870    0.1904 C   0  0  0

+    4.5615    0.6067    0.0215 C   0  0  0

+    0.8213    0.6773    0.0000 H   0  0  0

+    1.2306   -1.0735    0.0000 H   0  0  0

+    2.2546    1.0026    0.0000 H   0  0  0

+    2.6710   -0.7468    0.0000 H   0  0  0

+   -1.1501    1.1894    0.0000 H   0  0  0

+   -1.3313    2.1537    0.0000 H   0  0  0

+   -1.9044    3.2030    0.0000 H   0  0  0

+   -3.0311    3.4977    0.0000 H   0  0  0

+   -3.3258    2.3710    0.0000 H   0  0  0

+    4.7436   -0.1964    0.0000 H   0  0  0

+    5.3646    0.7888    0.0000 H   0  0  0

+    4.3794    1.4098    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  2  7  2  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  8 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+  9 11  2  0

+  3 14  1  0

+  4 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77-79-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.5999    0.0000    0.0118 S   0  0  0

+    0.6094   -1.3738   -0.2278 C   0  0  0

+    0.6094    1.3738   -0.2278 C   0  0  0

+   -1.5366    0.0000   -1.0567 O   0  0  0

+   -1.0584    0.0000    1.3568 O   0  0  0

+    1.9199   -0.6440    0.0121 C   0  0  0

+    1.9199    0.6440    0.0121 C   0  0  0

+   -0.2858   -2.0552    0.0000 H   0  0  0

+    1.2253   -2.3152    0.0000 H   0  0  0

+    1.2253    2.3152    0.0000 H   0  0  0

+   -0.2858    2.0552    0.0000 H   0  0  0

+    2.8898   -1.2140    0.0000 H   0  0  0

+    2.8898    1.2140    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  6  7  2  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  6 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96-67-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.5745   -0.0083    0.0326 C   0  0  0

+   -0.5915   -0.7525    0.0292 C   0  0  0

+    0.5135    1.3748    0.0093 C   0  0  0

+    2.1376   -0.8204    0.0738 S   0  0  0

+   -1.8198   -0.1194    0.0027 C   0  0  0

+   -0.7246    2.0140   -0.0175 C   0  0  0

+    1.6591    2.1079    0.0131 O   0  0  0

+    2.6828   -0.8305   -1.3472 O   0  0  0

+    2.9985    0.0364    0.8115 O   0  0  0

+    1.8594   -2.1774    0.3903 O   0  0  0

+   -1.8894    1.2613   -0.0207 C   0  0  0

+   -3.0637   -0.9215   -0.0013 N   0  3  0

+   -0.7923    3.4118   -0.0406 N   0  0  0

+   -4.1470   -0.3651   -0.0247 O   0  0  0

+   -3.0041   -2.1378    0.0189 O   0  5  0

+   -0.5437   -1.7888    0.0000 H   0  0  0

+    2.5329    2.6671    0.0000 H   0  0  0

+    3.7201   -0.8497    0.0000 H   0  0  0

+   -2.8128    1.7343    0.0000 H   0  0  0

+    0.0800    3.9734    0.0000 H   0  0  0

+   -1.7148    3.8864    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  2  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+ 12 14  2  0

+ 12 15  1  0

+  6 11  2  0

+  2 16  1  0

+  7 17  1  0

+  8 18  1  0

+ 11 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20589-63-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.4975    0.2657    0.0212 C   0  0  0

+    0.0187   -1.0486   -0.0173 C   0  0  0

+    0.3697    1.3804    0.0471 C   0  0  0

+   -1.8967    0.4681    0.0280 C   0  0  0

+    1.4199   -1.2507   -0.0301 C   0  0  0

+   -0.8744   -2.1441   -0.0429 C   0  0  0

+    1.7709    1.1783    0.0345 C   0  0  0

+   -0.1760    2.6839    0.0849 C   0  0  0

+   -2.7562   -0.6443   -0.0032 C   0  0  0

+   -2.4056    1.7784    0.0662 C   0  0  0

+    2.2871   -0.1359   -0.0041 C   0  0  0

+    1.9664   -2.5539   -0.0692 C   0  0  0

+   -2.2333   -1.9309   -0.0305 C   0  0  0

+    2.6633    2.2743    0.0596 C   0  0  0

+   -1.5397    2.8641    0.0963 C   0  0  0

+   -4.2232   -0.4439    0.0036 N   0  3  0

+    3.6864   -0.3374   -0.0174 C   0  0  0

+    3.3302   -2.7334   -0.0817 C   0  0  0

+    4.0223    2.0618    0.0464 C   0  0  0

+   -4.9235   -1.0960    0.7572 O   0  0  0

+   -4.8121    0.5059   -0.8660 O   0  5  0

+    4.1958   -1.6474   -0.0559 C   0  0  0

+    4.5455    0.7755    0.0087 C   0  0  0

+   -0.4974   -3.1288    0.0000 H   0  0  0

+    0.4645    3.5215    0.0000 H   0  0  0

+   -3.4480    1.9374    0.0000 H   0  0  0

+    1.3263   -3.3919    0.0000 H   0  0  0

+   -2.8883   -2.7573    0.0000 H   0  0  0

+    2.2858    3.2588    0.0000 H   0  0  0

+   -1.9338    3.8421    0.0000 H   0  0  0

+    3.7247   -3.7112    0.0000 H   0  0  0

+    4.6769    2.8884    0.0000 H   0  0  0

+    5.2382   -1.8061    0.0000 H   0  0  0

+    5.5903    0.6330    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  7 14  2  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  2  0

+ 12 18  1  0

+ 14 19  1  0

+ 16 20  2  0

+ 16 21  1  0

+ 17 22  1  0

+ 17 23  1  0

+  7 11  1  0

+  9 13  2  0

+ 10 15  2  0

+ 18 22  2  0

+ 19 23  2  0

+  6 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 22 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+642-83-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.2929    0.0607    0.9792 C   0  0  1

+   -0.5792   -1.0811    0.3792 C   0  0  1

+    1.7214   -0.4115    0.6355 C   0  0  1

+   -0.0183    1.2389    0.1893 O   0  0  0

+   -1.7431   -0.2792   -0.2471 C   0  0  2

+    0.2365   -1.6254   -0.6989 O   0  0  0

+    1.5369   -1.4938   -0.4050 C   0  0  0

+    2.4702    0.6911    0.0595 O   0  0  0

+   -1.1523    1.0894   -0.5040 C   0  0  0

+   -2.8255   -0.1665    0.7141 O   0  0  0

+    2.4292   -2.1429   -0.8974 O   0  0  0

+    3.8002    0.7594    0.2273 C   0  0  0

+   -1.6346    1.9259   -1.2302 O   0  0  0

+   -4.0955   -0.0816    0.2879 C   0  0  0

+    4.5773    1.9038   -0.3706 C   0  0  0

+    4.3743   -0.0967    0.8576 O   0  0  0

+   -5.2189    0.0353    1.2856 C   0  0  0

+   -4.3379   -0.0990   -0.8956 O   0  0  0

+   -0.6034    0.2396    0.0000 H   0  0  0

+   -1.0921   -1.8376    0.0000 H   0  0  0

+    2.5692   -0.7528    0.0000 H   0  0  0

+   -2.0595   -1.1366    0.0000 H   0  0  0

+    5.3334    1.3904    0.0000 H   0  0  0

+    5.0907    2.6599    0.0000 H   0  0  0

+    3.8212    2.4172    0.0000 H   0  0  0

+   -5.1243    0.9443    0.0000 H   0  0  0

+   -6.1279    0.1299    0.0000 H   0  0  0

+   -5.3135   -0.8737    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  7 11  2  0

+  8 12  1  0

+  9 13  2  0

+ 10 14  1  0

+ 12 15  1  0

+ 12 16  2  0

+ 14 17  1  0

+ 14 18  2  0

+  5  9  1  0

+  6  7  1  0

+  1 19  1  0

+  2 20  1  0

+  3 21  1  0

+  5 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6795-27-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -2.1794    0.7080   -0.0020 C   0  0  0

+   -2.3681   -0.6917   -0.0012 C   0  0  0

+   -0.9351    1.2123   -0.0019 N   0  3  0

+   -3.3007    1.5540    0.0029 C   0  0  0

+   -1.2774   -1.5194   -0.0008 N   0  3  0

+   -3.6624   -1.2107   -0.0014 C   0  0  0

+    0.1177    0.3956   -0.0010 C   0  0  0

+   -0.7684    2.4188   -0.0029 O   0  5  0

+   -4.5525    1.0153    0.0084 C   0  0  0

+   -0.0522   -0.9888   -0.0011 C   0  0  0

+   -1.4473   -2.9251    0.0004 O   0  5  0

+   -4.7338   -0.3642   -0.0022 C   0  0  0

+    1.4780    0.9619   -0.0008 C   0  0  0

+    2.5094    0.1734    0.0000 N   0  0  0

+    3.8028    0.7118    0.0002 N   0  0  0

+    4.8735   -0.1068    0.0011 C   0  0  0

+    6.2648    0.4724    0.0012 C   0  0  0

+    4.7173   -1.3097    0.0017 O   0  0  0

+   -3.1778    2.5735    0.0000 H   0  0  0

+   -3.8094   -2.2270    0.0000 H   0  0  0

+   -5.3715    1.6348    0.0000 H   0  0  0

+    0.7702   -1.6038    0.0000 H   0  0  0

+   -5.6853   -0.7506    0.0000 H   0  0  0

+    1.6102    1.9803    0.0000 H   0  0  0

+    3.9351    1.7301    0.0000 H   0  0  0

+    6.6595   -0.4756    0.0000 H   0  0  0

+    7.2128    0.8671    0.0000 H   0  0  0

+    5.8701    1.4204    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+ 13 14  2  0

+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 16 18  2  0

+  7 10  1  0

+  9 12  1  0

+  4 19  1  0

+  6 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 15 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+874-86-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -2.2721    0.0049   -0.9117 C   0  0  0

+   -3.2177   -0.0032    0.6234 Cl  0  0  0

+   -0.7989    0.0031   -0.5943 C   0  0  0

+   -0.1259   -1.1976   -0.4556 C   0  0  0

+   -0.1244    1.2026   -0.4484 C   0  0  0

+    1.2229   -1.2065   -0.1655 C   0  0  0

+    1.2240    1.2083   -0.1584 C   0  0  0

+    1.9085   -0.0001   -0.0118 C   0  0  0

+    3.3085   -0.0017    0.2893 C   0  0  0

+    4.4191   -0.0031    0.5283 N   0  0  0

+   -1.7578    0.8999    0.0000 H   0  0  0

+   -2.7929    0.8961    0.0000 H   0  0  0

+   -0.6506   -2.0865    0.0000 H   0  0  0

+   -0.6475    2.0925    0.0000 H   0  0  0

+    1.7391   -2.1004    0.0000 H   0  0  0

+    1.7419    2.1012    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

+  9  8  1  0

+ 10  9  3  0

+  7  8  1  0

+  1 11  1  0

+  1 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64-02-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 35                          1 V2000

+   -5.6616   -1.4751    0.0755 N   0  0  0

+   -6.9525   -0.7976    0.2555 C   0  0  0

+   -4.7584   -0.9428    1.1045 C   0  0  0

+   -5.8798   -2.8917    0.3973 C   0  0  0

+   -6.7966    0.6903   -0.0650 C   0  0  0

+   -3.3294   -1.1305    0.6643 C   0  0  0

+   -6.3070   -3.6292   -0.8456 C   0  0  0

+   -8.0876    1.3678    0.1150 N   0  0  0

+   -2.4134   -0.8668    1.4313 O   0  0  0

+   -3.0852   -1.5465   -0.4601 O   0  0  0

+   -6.6509   -4.8010   -0.7737 O   0  0  0

+   -6.3098   -3.0559   -1.9265 O   0  0  0

+   -8.4015    1.3041    1.5487 C   0  0  0

+   -7.8694    2.7844   -0.2068 C   0  0  0

+   -9.8891    1.4452    1.7439 C   0  0  0

+   -8.1664    3.0197   -1.6654 C   0  0  0

+  -10.6344    1.4626    0.7739 O   0  0  0

+  -10.3515    1.5424    2.8725 O   0  0  0

+   -8.0528    4.1417   -2.1395 O   0  0  0

+   -8.5212    2.0886   -2.3754 O   0  0  0

+    7.7853   -0.2269    0.1059 Na  0  3  0

+   16.4404    0.0682    0.0620 Na  0  3  0

+   25.0955    0.3633    0.0181 Na  0  3  0

+   33.7506    0.6584   -0.0257 Na  0  3  0

+   -7.7180   -0.6178    0.0000 H   0  0  0

+   -7.2273   -1.5343    0.0000 H   0  0  0

+   -4.4284   -0.2291    0.0000 H   0  0  0

+   -5.3413   -0.4151    0.0000 H   0  0  0

+   -5.4063   -3.5194    0.0000 H   0  0  0

+   -5.1173   -2.6997    0.0000 H   0  0  0

+   -6.0311    0.5105    0.0000 H   0  0  0

+   -6.5218    1.4270    0.0000 H   0  0  0

+   -8.7921    0.6217    0.0000 H   0  0  0

+   -7.9411    0.6667    0.0000 H   0  0  0

+   -7.1243    2.5332    0.0000 H   0  0  0

+   -7.4941    3.4753    0.0000 H   0  0  0

+   -2.6871   -2.2246    0.0000 H   0  0  0

+   -6.3136   -2.2696    0.0000 H   0  0  0

+  -11.1210    1.7041    0.0000 H   0  0  0

+   -8.8012    1.3538    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

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+ 14 16  1  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  2 25  1  0

+  2 26  1  0

+  3 27  1  0

+  3 28  1  0

+  4 29  1  0

+  4 30  1  0

+  5 31  1  0

+  5 32  1  0

+ 13 33  1  0

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+ 14 35  1  0

+ 14 36  1  0

+ 10 37  1  0

+ 12 38  1  0

+ 18 39  1  0

+ 20 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+54-05-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 49                          1 V2000

+   -1.9078   -0.0131    0.1009 C   0  0  0

+   -2.7577   -1.1277    0.2985 C   0  0  0

+   -0.5438   -0.1199    0.4623 C   0  0  0

+   -2.4284    1.1709   -0.4401 C   0  0  0

+   -2.2667   -2.2581    0.8191 N   0  0  0

+   -4.1127   -1.0248   -0.0594 C   0  0  0

+   -0.1066   -1.3223    0.9964 C   0  0  0

+    0.3278    0.9440    0.2875 N   0  0  0

+   -3.7482    1.2374   -0.7706 C   0  0  0

+   -1.0031   -2.3692    1.1578 C   0  0  0

+   -4.5860    0.1383   -0.5879 C   0  0  0

+    1.0995    1.4531    1.4240 C   0  0  0

+   -6.2610    0.2579   -1.0283 Cl  0  0  0

+    2.4998    1.8503    0.9526 C   0  0  0

+    0.3936    2.6762    2.0127 C   0  0  0

+    3.2057    0.6272    0.3638 C   0  0  0

+    4.6060    1.0244   -0.1076 C   0  0  0

+    5.2838   -0.1500   -0.6729 N   0  0  0

+    6.6149    0.2976   -1.1037 C   0  0  0

+    5.4930   -1.0909    0.4356 C   0  0  0

+    6.7808    0.0361   -2.6020 C   0  0  0

+    5.0797   -2.4969   -0.0040 C   0  0  0

+   -1.8461    2.0158    0.0000 H   0  0  0

+   -4.7173   -1.8539    0.0000 H   0  0  0

+    0.9030   -1.5057    0.0000 H   0  0  0

+   -0.3594    1.7060    0.0000 H   0  0  0

+   -4.1802    2.1682    0.0000 H   0  0  0

+   -0.6154   -3.3193    0.0000 H   0  0  0

+    1.5271    0.5203    0.0000 H   0  0  0

+    3.4277    2.2884    0.0000 H   0  0  0

+    2.1395    2.8111    0.0000 H   0  0  0

+    1.2823    3.1891    0.0000 H   0  0  0

+   -0.1193    3.5649    0.0000 H   0  0  0

+   -0.4951    2.1633    0.0000 H   0  0  0

+    2.2778    0.1891    0.0000 H   0  0  0

+    3.5660   -0.3336    0.0000 H   0  0  0

+    5.5339    1.4625    0.0000 H   0  0  0

+    4.2457    1.9852    0.0000 H   0  0  0

+    7.5227    0.7760    0.0000 H   0  0  0

+    6.2109    1.2408    0.0000 H   0  0  0

+    6.3153   -1.7047    0.0000 H   0  0  0

+    6.3546   -0.5336    0.0000 H   0  0  0

+    5.9143   -0.5136    0.0000 H   0  0  0

+    7.3305   -0.8304    0.0000 H   0  0  0

+    7.6473    0.5858    0.0000 H   0  0  0

+    4.0952   -2.2075    0.0000 H   0  0  0

+    4.7903   -3.4814    0.0000 H   0  0  0

+    6.0642   -2.7863    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  2  0

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+ 14 16  1  0

+ 16 17  1  0

+ 17 18  1  0

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+  7 10  2  0

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+ 21 44  1  0

+ 21 45  1  0

+ 22 46  1  0

+ 22 47  1  0

+ 22 48  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+607-57-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.4991   -0.4949   -0.0007 C   0  0  0

+   -1.9809   -0.4162   -0.0004 C   0  0  0

+    0.0335    0.7916    0.0002 C   0  0  0

+    0.3626   -1.5929    0.0037 C   0  0  0

+   -2.3743    0.9190    0.0005 C   0  0  0

+   -2.9544   -1.4171   -0.0014 C   0  0  0

+   -1.1224    1.7617    0.0010 C   0  0  0

+    1.3993    0.9782    0.0001 C   0  0  0

+    1.7283   -1.3967    0.0023 C   0  0  0

+   -3.7132    1.2491    0.0005 C   0  0  0

+   -4.2911   -1.0777   -0.0014 C   0  0  0

+    2.2479   -0.1150   -0.0008 C   0  0  0

+   -4.6724    0.2522   -0.0004 C   0  0  0

+    3.7142    0.0878   -0.0008 N   0  3  0

+    4.4620   -0.8736   -0.0016 O   0  0  0

+    4.1729    1.2161   -0.0001 O   0  5  0

+   -0.0236   -2.5561    0.0000 H   0  0  0

+   -2.6723   -2.4158    0.0000 H   0  0  0

+   -0.3841    2.4910    0.0000 H   0  0  0

+   -1.7796    2.5648    0.0000 H   0  0  0

+    1.7914    1.9390    0.0000 H   0  0  0

+    2.3680   -2.2139    0.0000 H   0  0  0

+   -4.0015    2.2460    0.0000 H   0  0  0

+   -5.0136   -1.8226    0.0000 H   0  0  0

+   -5.6796    0.5024    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+72076-98-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 33                          1 V2000

+   -0.2602   -0.0912    0.0016 C   0  0  0

+   -1.6160    0.1970   -0.0009 C   0  0  0

+    0.6852    0.9481    0.0056 C   0  0  0

+    0.1215   -1.4496    0.0058 C   0  0  0

+   -2.5177   -0.8776   -0.0076 C   0  0  0

+   -2.0690    1.5340    0.0029 C   0  0  0

+    2.0952    0.5663    0.0006 C   0  0  0

+    0.2270    2.2777    0.0130 C   0  0  0

+   -1.4454   -2.2939    0.0064 S   0  0  0

+    1.4239   -1.8039    0.0070 C   0  0  0

+   -3.8630   -0.6283   -0.0140 C   0  0  0

+   -1.1045    2.5652    0.0126 C   0  0  0

+   -3.4515    1.7533   -0.0038 C   0  0  0

+    2.4320   -0.8122   -0.0001 C   0  0  0

+    3.1122    1.5256   -0.0051 C   0  0  0

+   -4.3152    0.6913   -0.0123 C   0  0  0

+    3.7883   -1.1817   -0.0034 C   0  0  0

+    4.4175    1.1302   -0.0100 C   0  0  0

+    4.7529   -0.2206   -0.0089 C   0  0  0

+    0.9253    3.0646    0.0000 H   0  0  0

+    1.6901   -2.8218    0.0000 H   0  0  0

+   -4.5503   -1.4248    0.0000 H   0  0  0

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+    2.8713    2.5497    0.0000 H   0  0  0

+   -5.3510    0.8758    0.0000 H   0  0  0

+    4.0576   -2.1988    0.0000 H   0  0  0

+    5.1801    1.8550    0.0000 H   0  0  0

+    5.7663   -0.5032    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17418-58-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+    0.8048    0.7364    0.1897 C   0  0  0

+    0.7297   -0.6753    0.2187 C   0  0  0

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+    3.3338    0.5939   -0.0642 C   0  0  0

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+   -1.6140    0.8389    0.1282 C   0  0  0

+   -0.3057    2.8752    0.1167 N   0  0  0

+    3.2584   -0.8111   -0.0352 C   0  0  0

+    1.9290   -2.6540    0.5344 O   0  0  0

+   -1.6815   -0.5395    0.1672 C   0  0  0

+   -0.5960   -2.6574    0.2351 O   0  0  0

+    4.5472    1.2141   -0.3424 C   0  0  0

+   -2.7568    1.5693    0.0837 O   0  0  0

+    4.3981   -1.5679   -0.2854 C   0  0  0

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+    0.6072    3.3487    0.0000 H   0  0  0

+   -1.1722    3.4290    0.0000 H   0  0  0

+   -2.5983   -1.0055    0.0000 H   0  0  0

+   -0.6552   -3.6841    0.0000 H   0  0  0

+    4.6123    2.2404    0.0000 H   0  0  0

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+    6.4635   -1.4894    0.0000 H   0  0  0

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+   -3.4335   -0.4542    0.0000 H   0  0  0

+   -6.2176    0.0398    0.0000 H   0  0  0

+   -4.5508   -1.4162    0.0000 H   0  0  0

+   -6.6236   -1.7916    0.0000 H   0  0  0

+  1  2  1  0

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+ 20 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+ 23 36  1  0

+ 24 37  1  0

+ 25 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141511-30-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 46                          1 V2000

+   -0.2630   -0.0490    0.0691 C   0  0  0

+   -1.7434   -0.1291    0.0573 C   0  0  0

+    0.3435    1.2078    0.1076 C   0  0  0

+    0.5130   -1.2049    0.0482 C   0  0  0

+   -2.4790    0.9992   -0.3045 C   0  0  0

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+   -0.5051    2.4495    0.1537 C   0  0  0

+    1.8875   -1.1085    0.0572 C   0  0  0

+   -1.7674    2.2693   -0.6846 C   0  0  0

+   -3.8578    0.9417   -0.3133 C   0  0  0

+   -3.7775   -1.3536    0.3860 C   0  0  0

+    2.4940    0.1489    0.0829 C   0  0  0

+    2.7361   -2.3510    0.0442 C   0  0  0

+   -4.5047   -0.2314    0.0312 C   0  0  0

+    3.9743    0.2307    0.0819 C   0  0  0

+    4.0037   -2.1287   -0.7757 C   0  0  0

+   -5.9839   -0.2864    0.0204 N   0  3  0

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+    4.6253    1.3919    0.4858 C   0  0  0

+   -6.5572   -1.3175    0.3231 O   0  0  0

+   -6.6277    0.6995   -0.2911 O   0  5  0

+    6.0915   -0.8194   -0.3294 C   0  0  0

+    6.0054    1.4393    0.4804 C   0  0  0

+    6.7354    0.3362    0.0751 C   0  0  0

+    0.0584   -2.1347    0.0000 H   0  0  0

+   -1.8576   -2.1910    0.0000 H   0  0  0

+    2.1729    2.2343    0.0000 H   0  0  0

+    0.4282    2.8968    0.0000 H   0  0  0

+   -0.8054    3.4400    0.0000 H   0  0  0

+   -1.6891    3.3013    0.0000 H   0  0  0

+   -2.7582    2.5684    0.0000 H   0  0  0

+   -4.4025    1.8217    0.0000 H   0  0  0

+   -4.2567   -2.2710    0.0000 H   0  0  0

+    1.8075   -2.8080    0.0000 H   0  0  0

+    3.0572   -3.3349    0.0000 H   0  0  0

+    3.9456   -3.1621    0.0000 H   0  0  0

+    4.9967   -2.4206    0.0000 H   0  0  0

+    4.0869    2.2758    0.0000 H   0  0  0

+    6.6346   -1.7004    0.0000 H   0  0  0

+    6.4796    2.3593    0.0000 H   0  0  0

+    7.7696    0.3757    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

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+  7 13  2  0

+  9 14  1  0

+ 11 15  2  0

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+ 15 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+ 18 21  2  0

+ 18 22  1  0

+ 19 23  1  0

+ 20 24  2  0

+ 23 25  2  0

+  8 10  1  0

+  9 13  1  0

+ 12 15  1  0

+ 17 19  1  0

+ 24 25  1  0

+  4 26  1  0

+  6 27  1  0

+  7 28  1  0

+  8 29  1  0

+  8 30  1  0

+ 10 31  1  0

+ 10 32  1  0

+ 11 33  1  0

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+ 14 35  1  0

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+ 17 37  1  0

+ 17 38  1  0

+ 20 39  1  0

+ 23 40  1  0

+ 24 41  1  0

+ 25 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+130-15-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.3121    0.7032   -0.0021 C   0  0  0

+   -0.3121   -0.7032   -0.0016 C   0  0  0

+    0.9771    1.4277   -0.0008 C   0  0  0

+   -1.5183    1.3934    0.0018 C   0  0  0

+    0.9771   -1.4277    0.0003 C   0  0  0

+   -1.5183   -1.3934   -0.0024 C   0  0  0

+    2.2428    0.6699    0.0011 C   0  0  0

+    0.9938    2.6424   -0.0017 O   0  0  0

+   -2.7134    0.6908    0.0063 C   0  0  0

+    2.2428   -0.6698    0.0017 C   0  0  0

+    0.9938   -2.6424    0.0012 O   0  0  0

+   -2.7134   -0.6908   -0.0037 C   0  0  0

+   -1.5244    2.4357    0.0000 H   0  0  0

+   -1.5244   -2.4357    0.0000 H   0  0  0

+    3.1496    1.1839    0.0000 H   0  0  0

+   -3.6181    1.2084    0.0000 H   0  0  0

+    3.1496   -1.1837    0.0000 H   0  0  0

+   -3.6181   -1.2084    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  5 11  2  0

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+  7 10  2  0

+  9 12  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+54083-22-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 82 87                          1 V2000

+    0.8312    1.2707   -0.4481 C   0  0  0

+    1.1678   -0.0173   -0.7805 C   0  0  0

+    1.8241    2.1754   -0.0500 C   0  0  0

+   -0.5874    1.7774   -0.4984 C   0  0  0

+    0.1444   -1.0388   -1.2059 C   0  0  2

+    2.5062   -0.4290   -0.7288 C   0  0  0

+    3.1595    1.7808    0.0082 C   0  0  0

+    1.4831    3.4455    0.2811 O   0  0  0

+   -1.5748    0.6128   -0.5185 C   0  0  2

+   -1.1541   -0.3564   -1.6299 C   0  0  0

+   -0.1222   -1.9212   -0.1140 O   0  0  0

+    3.5057    0.4587   -0.3364 C   0  0  0

+    2.8314   -1.7025   -1.0632 O   0  0  0

+    4.2036    2.7324    0.4250 C   0  0  0

+   -2.9636    1.1291   -0.7938 C   0  0  0

+   -1.5522   -0.0597    0.7421 O   0  0  0

+    0.1934   -3.2407   -0.5628 C   0  0  1

+    4.9132    0.0259   -0.2804 C   0  0  0

+    5.6152    2.2985    0.4787 C   0  0  0

+    3.9049    3.8725    0.7238 O   0  0  0

+   -3.9009    0.9287    0.0548 N   0  0  0

+   -3.2490    1.8814   -2.0680 C   0  0  0

+    0.4785   -4.1358    0.6453 C   0  0  0

+   -0.9057   -3.7660   -1.3047 O   0  0  0

+    5.9588    0.9770    0.1383 C   0  0  0

+    5.2118   -1.1147   -0.5789 O   0  0  0

+    6.6084    3.1904    0.8698 C   0  0  0

+   -5.1920    1.4087   -0.2011 N   0  0  0

+   -0.7561   -4.1569    1.5537 C   0  0  1

+   -2.0742   -3.6328   -0.4977 C   0  0  2

+    7.2968    0.5750    0.1949 C   0  0  0

+    7.9303    2.7790    0.9185 C   0  0  0

+   -6.1787    1.1976    0.6923 C   0  0  0

+   -1.9747   -4.5600    0.7157 C   0  0  1

+   -0.5558   -5.1369    2.6295 N   0  0  0

+   -3.3085   -4.0029   -1.3226 C   0  0  0

+    8.2738    1.4828    0.5918 C   0  0  0

+    7.6409   -0.6944   -0.1352 O   0  0  0

+   -7.5408    1.7040    0.4223 C   0  0  0

+   -5.9485    0.5907    1.7203 O   0  0  0

+   -1.8224   -5.9100    0.2724 O   0  0  0

+    9.0579   -0.7924    0.0217 C   0  0  0

+   -8.5650    1.4872    1.3455 C   0  0  0

+   -7.8072    2.4064   -0.7545 C   0  0  0

+   -9.8341    1.9630    1.0875 C   0  0  0

+   -9.0805    2.8767   -1.0000 C   0  0  0

+  -10.0926    2.6537   -0.0830 C   0  0  0

+   -0.1403    2.6727    0.0000 H   0  0  0

+   -1.4227    2.3285    0.0000 H   0  0  0

+    1.0028   -1.5532    0.0000 H   0  0  0

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+   -2.1486   -0.4680    0.0000 H   0  0  0

+   -1.3392   -1.3398    0.0000 H   0  0  0

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+   -8.6400    0.4893    0.0000 H   0  0  0

+   -7.1027    3.1171    0.0000 H   0  0  0

+  -10.5419    1.2556    0.0000 H   0  0  0

+   -9.0120    3.8751    0.0000 H   0  0  0

+  -10.9718    3.1316    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 44 79  1  0

+ 45 80  1  0

+ 46 81  1  0

+ 47 82  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+872-05-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+    0.5813   -0.3545   -0.1337 C   0  0  0

+   -0.6560    0.5404   -0.0380 C   0  0  0

+    1.8401    0.4933    0.0600 C   0  0  0

+   -1.9148   -0.3074   -0.2318 C   0  0  0

+    3.0774   -0.4016   -0.0356 C   0  0  0

+   -3.1521    0.5875   -0.1361 C   0  0  0

+    4.3362    0.4463    0.1581 C   0  0  0

+   -4.3920   -0.2476   -0.3269 C   0  0  0

+    5.5735   -0.4486    0.0625 C   0  0  0

+   -5.2935   -0.3078    0.6216 C   0  0  0

+   -0.1892   -1.1924    0.0000 H   0  0  0

+    1.3233   -1.2177    0.0000 H   0  0  0

+    0.1145    1.3783    0.0000 H   0  0  0

+   -1.3980    1.4036    0.0000 H   0  0  0

+    2.6106    1.3312    0.0000 H   0  0  0

+    1.0981    1.3565    0.0000 H   0  0  0

+   -2.6853   -1.1453    0.0000 H   0  0  0

+   -1.1728   -1.1706    0.0000 H   0  0  0

+    2.3070   -1.2395    0.0000 H   0  0  0

+    3.8194   -1.2648    0.0000 H   0  0  0

+   -2.3816    1.4254    0.0000 H   0  0  0

+   -3.8941    1.4507    0.0000 H   0  0  0

+    5.1066    1.2842    0.0000 H   0  0  0

+    3.5942    1.3095    0.0000 H   0  0  0

+   -4.0235   -1.3246    0.0000 H   0  0  0

+    4.9064   -1.3709    0.0000 H   0  0  0

+    6.4958   -1.1157    0.0000 H   0  0  0

+    6.2406    0.4737    0.0000 H   0  0  0

+   -5.9271    0.6379    0.0000 H   0  0  0

+   -5.7957   -1.3293    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

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+  8 25  1  0

+  9 26  1  0

+  9 27  1  0

+  9 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1746-01-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+   -1.1780    0.6957   -0.0059 C   0  0  0

+   -1.1780   -0.6957   -0.0023 C   0  0  0

+    0.0000    1.3762   -0.0065 O   0  0  0

+   -2.3784    1.3864   -0.0030 C   0  0  0

+    0.0000   -1.3762    0.0005 O   0  0  0

+   -2.3784   -1.3864   -0.0012 C   0  0  0

+    1.1780    0.6957   -0.0036 C   0  0  0

+   -3.5757    0.6921    0.0034 C   0  0  0

+    1.1779   -0.6957   -0.0001 C   0  0  0

+   -3.5758   -0.6921   -0.0037 C   0  0  0

+    2.3784    1.3864   -0.0038 C   0  0  0

+   -5.0799    1.5587    0.0076 Cl  0  0  0

+    2.3784   -1.3864    0.0023 C   0  0  0

+   -5.0800   -1.5587   -0.0029 Cl  0  0  0

+    3.5757    0.6921   -0.0004 C   0  0  0

+    3.5757   -0.6921    0.0012 C   0  0  0

+    5.0800    1.5587   -0.0006 Cl  0  0  0

+    5.0800   -1.5587    0.0043 Cl  0  0  0

+   -2.3802    2.4248    0.0000 H   0  0  0

+   -2.3801   -2.4248    0.0000 H   0  0  0

+    2.3802    2.4248    0.0000 H   0  0  0

+    2.3802   -2.4248    0.0000 H   0  0  0

+  1  2  2  0

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+  7  9  2  0

+  8 10  1  0

+ 15 16  1  0

+  4 19  1  0

+  6 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2784-27-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -0.4920   -0.4168   -0.0546 C   0  0  0

+    0.9845   -0.1156   -0.0380 C   0  0  0

+   -1.2912    0.8591   -0.1211 C   0  0  0

+   -0.8284   -1.2986   -1.1857 N   0  0  0

+   -0.8843   -1.2289    1.1637 C   0  0  0

+    1.6240    0.1357    1.1616 C   0  0  0

+    1.6984   -0.0965   -1.2222 C   0  0  0

+   -2.3056    1.0877    0.7900 C   0  0  0

+   -1.0062    1.8033   -1.0894 C   0  0  0

+   -1.3300   -2.4291   -0.6564 C   0  0  0

+   -1.3640   -2.3942    0.6858 N   0  0  0

+   -0.7863   -0.8991    2.3262 O   0  0  0

+    2.9777    0.4117    1.1795 C   0  0  0

+    3.0518    0.1789   -1.2096 C   0  0  0

+   -3.0386    2.2579    0.7289 C   0  0  0

+   -1.7394    2.9739   -1.1505 C   0  0  0

+   -1.7102   -3.3745   -1.3188 O   0  0  0

+    3.6951    0.4366   -0.0075 C   0  0  0

+   -2.7573    3.1998   -0.2432 C   0  0  0

+    5.0266    0.7082    0.0075 O   0  0  0

+   -0.1146   -1.5929    0.0000 H   0  0  0

+    1.4049    0.8760    0.0000 H   0  0  0

+    1.7860   -0.8636    0.0000 H   0  0  0

+   -2.7519    0.4577    0.0000 H   0  0  0

+   -0.2410    1.9058    0.0000 H   0  0  0

+   -2.1220   -2.5407    0.0000 H   0  0  0

+    2.8869    1.1784    0.0000 H   0  0  0

+    3.2732   -0.5607    0.0000 H   0  0  0

+   -3.8037    2.1542    0.0000 H   0  0  0

+   -1.2941    3.6046    0.0000 H   0  0  0

+   -3.1483    3.8655    0.0000 H   0  0  0

+    5.7831    0.8625    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

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+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+84-15-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -1.2533    0.6987   -0.0439 C   0  0  0

+   -1.2524   -0.7020    0.0484 C   0  0  0

+    0.0277    1.4432   -0.0940 C   0  0  0

+   -2.4640    1.3845   -0.0940 C   0  0  0

+    0.0295   -1.4450    0.0967 C   0  0  0

+   -2.4622   -1.3896    0.0947 C   0  0  0

+    0.8771    1.3011   -1.1900 C   0  0  0

+    0.3848    2.2925    0.9524 C   0  0  0

+   -3.6543    0.6870   -0.0528 C   0  0  0

+    0.3897   -2.2877   -0.9534 C   0  0  0

+    0.8821   -1.2991    1.1903 C   0  0  0

+   -3.6534   -0.6938    0.0498 C   0  0  0

+    2.0684    1.9968   -1.2311 C   0  0  0

+    1.5783    2.9829    0.9004 C   0  0  0

+    1.5844   -2.9770   -0.9028 C   0  0  0

+    2.0739   -1.9932    1.2298 C   0  0  0

+    2.4201    2.8335   -0.1875 C   0  0  0

+    2.4235   -2.8327    0.1871 C   0  0  0

+   -2.4716    2.4189    0.0000 H   0  0  0

+   -2.4683   -2.4240    0.0000 H   0  0  0

+    1.0637    0.2836    0.0000 H   0  0  0

+   -0.3914    2.9763    0.0000 H   0  0  0

+   -4.5520    1.2010    0.0000 H   0  0  0

+   -0.3841   -2.9742    0.0000 H   0  0  0

+    1.0662   -0.2812    0.0000 H   0  0  0

+   -4.5504   -1.2090    0.0000 H   0  0  0

+    2.8460    1.3147    0.0000 H   0  0  0

+    1.3988    4.0016    0.0000 H   0  0  0

+    1.4028   -3.9954    0.0000 H   0  0  0

+    2.8523   -1.3119    0.0000 H   0  0  0

+    3.3286    3.3282    0.0000 H   0  0  0

+    3.3298   -3.3313    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  1  0

+ 11 16  2  0

+ 13 17  2  0

+ 15 18  2  0

+  9 12  1  0

+ 14 17  1  0

+ 16 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+104-82-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.3027    0.0025   -0.5558 C   0  0  0

+    0.3628   -1.1957   -0.3741 C   0  0  0

+    0.3643    1.1986   -0.3695 C   0  0  0

+   -1.7537    0.0043   -0.9629 C   0  0  0

+    1.6951   -1.1974   -0.0063 C   0  0  0

+    1.6969    1.1969   -0.0015 C   0  0  0

+   -2.7916   -0.0020    0.5114 Cl  0  0  0

+    2.3623   -0.0009    0.1800 C   0  0  0

+    3.8150   -0.0027    0.5806 C   0  0  0

+   -0.1589   -2.0809    0.0000 H   0  0  0

+   -0.1555    2.0849    0.0000 H   0  0  0

+   -1.2410    0.8947    0.0000 H   0  0  0

+   -2.2707    0.8922    0.0000 H   0  0  0

+    2.2149   -2.0837    0.0000 H   0  0  0

+    2.2185    2.0821    0.0000 H   0  0  0

+    3.8137   -1.0302    0.0000 H   0  0  0

+    4.8425   -0.0040    0.0000 H   0  0  0

+    3.8163    1.0248    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  6  8  2  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90594-13-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    0.2993   -0.4900   -0.0007 C   0  0  0

+   -1.0815   -0.4444   -0.0005 N   0  0  0

+    0.7352    0.8490    0.0003 C   0  0  0

+    1.1765   -1.4812    0.0031 N   0  0  0

+   -1.4471    0.8786    0.0007 C   0  0  0

+   -2.0314   -1.4249   -0.0015 C   0  0  0

+   -0.3581    1.6335    0.0011 N   0  0  0

+    2.1114    1.1150   -0.0001 C   0  0  0

+    2.4732   -1.2581    0.0018 C   0  0  0

+   -2.8174    1.2195    0.0008 C   0  0  0

+   -3.3441   -1.1125   -0.0015 C   0  0  0

+    2.9848    0.0386   -0.0015 C   0  0  0

+   -3.7516    0.2320   -0.0003 C   0  0  0

+    4.3673    0.2516   -0.0020 N   0  0  0

+   -1.7422   -2.4164    0.0000 H   0  0  0

+    2.4647    2.0855    0.0000 H   0  0  0

+    3.1248   -2.0594    0.0000 H   0  0  0

+   -3.1074    2.2107    0.0000 H   0  0  0

+   -4.0519   -1.8646    0.0000 H   0  0  0

+   -4.7568    0.4692    0.0000 H   0  0  0

+    5.0139   -0.5538    0.0000 H   0  0  0

+    4.7415    1.2142    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+ 10 13  2  0

+ 12 14  1  0

+  5  7  2  0

+  9 12  1  0

+ 11 13  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 13 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146795-35-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -1.1308   -0.3493    0.0616 C   0  0  0

+   -2.2020    0.6148    0.0329 C   0  0  0

+    0.2787    0.0697    0.1228 C   0  0  0

+   -1.4856   -1.6822    0.0351 C   0  0  0

+   -3.4591    0.1329   -0.0227 C   0  0  0

+    1.2567   -0.8573    0.1484 N   0  0  0

+    0.5610    1.2526    0.1502 O   0  0  0

+   -3.2154   -1.6314   -0.0268 S   0  0  0

+   -4.7328    0.8863   -0.0622 N   0  3  0

+    2.5975   -0.4623    0.0734 C   0  0  0

+   -5.7928    0.2884   -0.1117 O   0  0  0

+   -4.7207    2.1042   -0.0453 O   0  5  0

+    3.5990   -1.4183   -0.0359 C   0  0  0

+    2.9277    0.8860    0.1024 C   0  0  0

+    4.9211   -1.0265   -0.1098 C   0  0  0

+    4.2514    1.2736    0.0282 C   0  0  0

+    5.2487    0.3188   -0.0749 C   0  0  0

+    6.5427    0.7000   -0.1473 F   0  0  0

+   -2.0132    1.6329    0.0000 H   0  0  0

+   -0.8667   -2.5124    0.0000 H   0  0  0

+    1.0145   -1.8641    0.0000 H   0  0  0

+    3.3558   -2.4249    0.0000 H   0  0  0

+    2.1793    1.6017    0.0000 H   0  0  0

+    5.6711   -1.7405    0.0000 H   0  0  0

+    4.4969    2.2796    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 17 18  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 19  1  0

+  4 20  1  0

+  6 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+530-62-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.0211   -0.9107    0.0769 C   0  0  0

+   -0.0462   -2.1197    0.1841 O   0  0  0

+    1.1598   -0.2627    0.0305 N   0  0  0

+   -1.1740   -0.2170   -0.0013 N   0  0  0

+    2.1756   -0.4754   -0.8716 C   0  0  0

+    1.5727    0.7329    0.8654 C   0  0  0

+   -2.4421   -0.7119    0.1933 C   0  0  0

+   -1.3051    1.1105   -0.2827 C   0  0  0

+    3.1614    0.3830   -0.5563 C   0  0  0

+    2.7681    1.1062    0.5043 N   0  0  0

+   -3.2913    0.3162    0.0203 C   0  0  0

+   -2.5727    1.4131   -0.2683 N   0  0  0

+    2.4229   -1.4241    0.0000 H   0  0  0

+    0.9115    1.4568    0.0000 H   0  0  0

+   -2.6886   -1.6608    0.0000 H   0  0  0

+   -0.5664    1.7551    0.0000 H   0  0  0

+    4.1263    0.2093    0.0000 H   0  0  0

+   -4.2702    0.2621    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  1  0

+  8  4  1  0

+  9  5  2  0

+ 10  6  2  0

+ 11  7  2  0

+ 12  8  2  0

+  9 10  1  0

+ 11 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119-34-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.3129    0.1533    0.0112 C   0  0  0

+   -0.0988   -1.2126   -0.0971 C   0  0  0

+    0.7620    1.0169    0.0939 C   0  0  0

+   -1.6935    0.6863    0.0321 N   0  3  0

+    1.1949   -1.7128   -0.1225 C   0  0  0

+   -1.1576   -2.0622   -0.1780 O   0  0  0

+    2.0571    0.5171    0.0686 C   0  0  0

+   -1.9730    1.6788   -0.6163 O   0  0  0

+   -2.5501    0.1325    0.6977 O   0  5  0

+    2.2706   -0.8509   -0.0399 C   0  0  0

+    3.1466    1.3913    0.1518 N   0  0  0

+    0.6027    2.0415    0.0000 H   0  0  0

+    1.3532   -2.7376    0.0000 H   0  0  0

+   -1.9664   -2.7112    0.0000 H   0  0  0

+    3.2373   -1.2261    0.0000 H   0  0  0

+    4.1130    1.0154    0.0000 H   0  0  0

+    2.9890    2.4162    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  7 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+102-01-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+    1.4529    0.5013   -0.2200 C   0  0  0

+    0.1874    1.0673   -0.4105 N   0  0  0

+    1.7616   -0.7230   -0.7977 C   0  0  0

+    2.4048    1.1658    0.5425 C   0  0  0

+   -0.9191    0.3648   -0.0965 C   0  0  0

+    3.0117   -1.2790   -0.6077 C   0  0  0

+    3.6527    0.6046    0.7287 C   0  0  0

+   -2.2818    0.9213   -0.4195 C   0  0  0

+   -0.8182   -0.7152    0.4461 O   0  0  0

+    3.9551   -0.6178    0.1567 C   0  0  0

+   -3.3413   -0.0512    0.0309 C   0  0  0

+   -4.7983    0.2715   -0.1785 C   0  0  0

+   -3.0226   -1.0890    0.5597 O   0  0  0

+    0.1161    2.0477    0.0000 H   0  0  0

+    1.0095   -1.3560    0.0000 H   0  0  0

+    2.3131    2.1445    0.0000 H   0  0  0

+    3.1063   -2.2574    0.0000 H   0  0  0

+    4.4075    1.2344    0.0000 H   0  0  0

+   -1.7810    1.7672    0.0000 H   0  0  0

+   -3.0453    1.5404    0.0000 H   0  0  0

+    4.8756   -0.9627    0.0000 H   0  0  0

+   -4.5857    1.2312    0.0000 H   0  0  0

+   -5.7580    0.4841    0.0000 H   0  0  0

+   -5.0109   -0.6882    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  2  0

+  6 10  2  0

+  8 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+  7 10  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146-68-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 43                          1 V2000

+   -0.2163    5.6131   -0.0861 N   0  3  0

+   -0.0059    6.3994    0.8201 O   0  5  0

+   -0.9445    5.9292   -1.0099 O   0  0  0

+    0.4180    4.2758   -0.0678 C   0  0  0

+    0.1779    3.3845   -1.0977 C   0  0  0

+    1.2538    3.9230    0.9767 C   0  0  0

+    0.7675    2.1361   -1.0844 C   0  0  0

+    1.8472    2.6769    0.9975 C   0  0  0

+    1.6038    1.7754   -0.0336 C   0  0  0

+    2.2002    0.5170   -0.0161 N   0  0  0

+    1.5374   -0.7195    0.0057 N   0  3  0

+    3.4668    0.2683   -0.0227 N   0  0  0

+    2.4459   -1.6364    0.0159 N   0  0  0

+    0.1594   -0.9198    0.0155 C   0  0  0

+    3.6341   -1.0469   -0.0013 C   0  0  0

+   -0.4424   -1.6752   -0.9852 C   0  0  0

+   -0.6181   -0.3695    1.0293 C   0  0  0

+    4.9420   -1.7476   -0.0003 C   0  0  0

+   -1.8088   -1.8720   -0.9719 C   0  0  0

+   -1.9835   -0.5706    1.0358 C   0  0  0

+    4.9893   -3.1398    0.0235 C   0  0  0

+    6.1276   -1.0156   -0.0289 C   0  0  0

+   -2.5795   -1.3186    0.0353 C   0  0  0

+    6.2088   -3.7865    0.0244 C   0  0  0

+    7.3412   -1.6725   -0.0277 C   0  0  0

+   -4.6525   -1.6205    0.0504 I   0  0  0

+    7.3823   -3.0550    0.0017 C   0  0  0

+   -0.8530    3.2925    0.0000 H   0  0  0

+    1.9690    4.6712    0.0000 H   0  0  0

+    0.0482    1.3919    0.0000 H   0  0  0

+    2.8780    2.7703    0.0000 H   0  0  0

+    0.0724   -2.5731    0.0000 H   0  0  0

+   -0.3773    0.6371    0.0000 H   0  0  0

+   -2.0547   -2.8774    0.0000 H   0  0  0

+   -2.4997    0.3265    0.0000 H   0  0  0

+    4.1116   -3.6884    0.0000 H   0  0  0

+    6.0981    0.0190    0.0000 H   0  0  0

+    6.2449   -4.8209    0.0000 H   0  0  0

+    8.2224   -1.1296    0.0000 H   0  0  0

+    8.2947   -3.5438    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

+  7  5  1  0

+  8  6  2  0

+  9  7  2  0

+ 10  9  1  0

+ 11 10  1  0

+ 12 10  1  0

+ 13 11  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 14  2  0

+ 17 14  1  0

+ 18 15  1  0

+ 19 16  1  0

+ 20 17  2  0

+ 21 18  2  0

+ 22 18  1  0

+ 23 19  2  0

+ 24 21  1  0

+ 25 22  2  0

+ 26 23  1  0

+ 27 24  2  0

+  8  9  1  0

+ 13 15  1  0

+ 20 23  1  0

+ 25 27  1  0

+  5 28  1  0

+  6 29  1  0

+  7 30  1  0

+  8 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 24 38  1  0

+ 25 39  1  0

+ 27 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89-72-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    0.0596    0.1005   -0.1019 C   0  0  0

+    0.9796   -0.9311    0.0144 C   0  0  0

+    0.4872    1.4137   -0.0621 C   0  0  0

+   -1.4043   -0.2109   -0.2778 C   0  0  0

+    2.3275   -0.6411    0.1705 C   0  0  0

+    0.5615   -2.2236   -0.0241 O   0  0  0

+    1.8307    1.7000    0.0935 C   0  0  0

+   -2.1975    0.3952    0.8816 C   0  0  0

+   -1.8971    0.3836   -1.5987 C   0  0  0

+    2.7499    0.6734    0.2097 C   0  0  0

+   -3.6838    0.0790    0.7030 C   0  0  0

+   -0.2047    2.1822    0.0000 H   0  0  0

+   -1.6314   -1.2197    0.0000 H   0  0  0

+    3.0216   -1.4076    0.0000 H   0  0  0

+    0.2432   -3.2075    0.0000 H   0  0  0

+    2.1514    2.6831    0.0000 H   0  0  0

+   -1.3948    1.0471    0.0000 H   0  0  0

+   -2.6434    1.3282    0.0000 H   0  0  0

+   -1.1010    1.0435    0.0000 H   0  0  0

+   -2.5570    1.1797    0.0000 H   0  0  0

+   -2.6932   -0.2763    0.0000 H   0  0  0

+    3.7613    0.8886    0.0000 H   0  0  0

+   -3.8990    1.0904    0.0000 H   0  0  0

+   -4.6952   -0.1362    0.0000 H   0  0  0

+   -3.4686   -0.9324    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  4  9  1  0

+  5 10  2  0

+  8 11  1  0

+  7 10  1  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+ 11 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+280-57-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    1.2805    0.0000    0.0008 N   0  0  0

+    0.7627   -0.0002   -1.3669 C   0  0  0

+    0.7630    1.1846    0.6828 C   0  0  0

+    0.7630   -1.1844    0.6832 C   0  0  0

+   -0.7628   -0.0002   -1.3669 C   0  0  0

+   -0.7630    1.1846    0.6829 C   0  0  0

+   -0.7629   -1.1844    0.6831 C   0  0  0

+   -1.2805    0.0000    0.0008 N   0  0  0

+    0.2780   -0.8399    0.0000 H   0  0  0

+    1.2477   -0.8397    0.0000 H   0  0  0

+    1.6962    1.4475    0.0000 H   0  0  0

+    0.6303    2.1450    0.0000 H   0  0  0

+    0.6303   -2.1448    0.0000 H   0  0  0

+    1.6962   -1.4473    0.0000 H   0  0  0

+   -1.2478   -0.8397    0.0000 H   0  0  0

+   -0.2781   -0.8399    0.0000 H   0  0  0

+   -0.6303    2.1450    0.0000 H   0  0  0

+   -1.6962    1.4475    0.0000 H   0  0  0

+   -1.6961   -1.4474    0.0000 H   0  0  0

+   -0.6302   -2.1448    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  6  8  1  0

+  7  8  1  0

+  2  9  1  0

+  2 10  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+111712-45-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+    0.0056    0.0175    0.7792 P   0  0  0

+   -1.0954    1.0696    1.3016 O   0  0  0

+    1.4629    0.4637    1.2981 O   0  0  0

+   -0.3408   -1.4485    1.3475 O   0  0  0

+   -0.0034   -0.0122   -0.7005 O   0  0  0

+   -0.8121    2.3157    0.6620 C   0  0  0

+    2.4059   -0.4249    0.6955 C   0  0  0

+   -1.5787   -1.8408    0.7511 C   0  0  0

+   -2.0992    2.8852    0.0621 C   0  0  0

+   -0.2493    3.2998    1.6894 C   0  0  0

+    3.5540    0.3846    0.0892 C   0  0  0

+    2.9589   -1.3781    1.7568 C   0  0  0

+   -1.4333   -3.2389    0.1469 C   0  0  0

+   -2.6758   -1.8577    1.8175 C   0  0  0

+   -2.5134    2.0449   -1.1475 C   0  0  0

+   -3.5277    2.8394    1.4120 Br  0  0  0

+    3.0443    1.1604   -1.1270 C   0  0  0

+    4.2451    1.6465    1.4290 Br  0  0  0

+   -0.5455   -3.1670   -1.0971 C   0  0  0

+   -0.6136   -4.4418    1.4683 Br  0  0  0

+   -4.1673    2.7767   -1.9184 Br  0  0  0

+    4.5540    2.0555   -2.0130 Br  0  0  0

+   -0.5057   -4.9250   -1.9762 Br  0  0  0

+    0.1699    1.9331    0.0000 H   0  0  0

+    1.5801   -1.0797    0.0000 H   0  0  0

+   -1.7478   -0.8005    0.0000 H   0  0  0

+   -1.8978    3.9197    0.0000 H   0  0  0

+    0.6656    2.7766    0.0000 H   0  0  0

+    0.2739    4.2147    0.0000 H   0  0  0

+   -1.1642    3.8230    0.0000 H   0  0  0

+    4.3401   -0.3173    0.0000 H   0  0  0

+    2.0473   -1.9070    0.0000 H   0  0  0

+    3.4878   -2.2897    0.0000 H   0  0  0

+    3.8705   -0.8492    0.0000 H   0  0  0

+   -2.4230   -3.6012    0.0000 H   0  0  0

+   -2.6920   -0.8039    0.0000 H   0  0  0

+   -3.7296   -1.8739    0.0000 H   0  0  0

+   -2.6596   -2.9115    0.0000 H   0  0  0

+   -2.9531    1.0871    0.0000 H   0  0  0

+   -1.5618    1.5920    0.0000 H   0  0  0

+    2.4929    2.0586    0.0000 H   0  0  0

+    2.1547    0.5953    0.0000 H   0  0  0

+    0.5075   -3.1227    0.0000 H   0  0  0

+   -0.6102   -2.1151    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  1  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  8 13  1  0

+  8 14  1  0

+  9 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 13 19  1  0

+ 13 20  1  0

+ 15 21  1  0

+ 17 22  1  0

+ 19 23  1  0

+  6 24  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+ 11 31  1  0

+ 12 32  1  0

+ 12 33  1  0

+ 12 34  1  0

+ 13 35  1  0

+ 14 36  1  0

+ 14 37  1  0

+ 14 38  1  0

+ 15 39  1  0

+ 15 40  1  0

+ 17 41  1  0

+ 17 42  1  0

+ 19 43  1  0

+ 19 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2381-21-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.9457    0.1246   -0.0020 C   0  0  0

+   -0.4938   -0.1847   -0.0016 C   0  0  0

+    1.3550    1.3711   -0.0013 C   0  0  0

+    1.9049   -0.9946    0.0029 C   0  0  0

+   -1.3789    0.7836    0.0000 C   0  0  0

+   -0.9086   -1.5991   -0.0024 C   0  0  0

+    0.3652    2.4617    0.0002 C   0  0  0

+    2.7996    1.6574   -0.0016 C   0  0  0

+    1.4011   -2.3761    0.0074 C   0  0  0

+    3.1943   -0.7359    0.0027 C   0  0  0

+   -0.9245    2.1846    0.0016 C   0  0  0

+   -2.8137    0.4513    0.0006 C   0  0  0

+    0.1183   -2.6518   -0.0044 C   0  0  0

+   -2.1905   -1.8929   -0.0019 C   0  0  0

+    3.6625    0.6618   -0.0026 C   0  0  0

+   -3.1914   -0.8108   -0.0005 C   0  0  0

+   -3.8451    1.5500    0.0030 C   0  0  0

+    0.7030    3.5123    0.0000 H   0  0  0

+    3.1578    2.7013    0.0000 H   0  0  0

+    2.1258   -3.2084    0.0000 H   0  0  0

+    3.9243   -1.5636    0.0000 H   0  0  0

+   -1.6641    3.0037    0.0000 H   0  0  0

+   -0.2005   -3.7084    0.0000 H   0  0  0

+   -2.5161   -2.9474    0.0000 H   0  0  0

+    4.7451    0.8761    0.0000 H   0  0  0

+   -4.2665   -1.0601    0.0000 H   0  0  0

+   -3.0405    2.3053    0.0000 H   0  0  0

+   -4.6004    2.3546    0.0000 H   0  0  0

+   -4.6497    0.7947    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  8 15  2  0

+ 12 16  2  0

+ 12 17  1  0

+  7 11  2  0

+  9 13  2  0

+ 10 15  1  0

+ 14 16  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+623-10-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.8201   -0.3066    0.0023 C   0  0  0

+    0.0585   -1.3823    0.0013 C   0  0  0

+   -0.3243    0.9912    0.0019 C   0  0  0

+   -2.1990   -0.5292   -0.0020 N   0  0  0

+    1.4216   -1.1587   -0.0002 C   0  0  0

+    1.0395    1.2076    0.0005 C   0  0  0

+   -3.0933    0.5687   -0.0010 O   0  0  0

+    1.9116    0.1342   -0.0006 C   0  0  0

+    3.3993    0.3743   -0.0016 C   0  0  0

+   -0.3101   -2.3566    0.0000 H   0  0  0

+   -0.9806    1.8001    0.0000 H   0  0  0

+   -2.5695   -1.5028    0.0000 H   0  0  0

+    2.0811   -1.9650    0.0000 H   0  0  0

+    1.4119    2.1804    0.0000 H   0  0  0

+   -3.7512    1.3764    0.0000 H   0  0  0

+    3.5653   -0.6541    0.0000 H   0  0  0

+    4.4277    0.5403    0.0000 H   0  0  0

+    3.2333    1.4027    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  8  9  1  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+613-13-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.8811    0.5600   -0.0047 C   0  0  0

+   -0.7643   -0.9023   -0.0021 C   0  0  0

+    0.2644    1.3553   -0.0044 C   0  0  0

+   -2.1668    1.1384   -0.0015 C   0  0  0

+    0.4921   -1.5048    0.0006 C   0  0  0

+   -1.9433   -1.6794   -0.0019 C   0  0  0

+    1.5205    0.7521   -0.0017 C   0  0  0

+   -3.2672    0.3316    0.0039 C   0  0  0

+    1.6369   -0.7099    0.0008 C   0  0  0

+   -3.1522   -1.0651   -0.0041 C   0  0  0

+    2.7008    1.5265   -0.0010 C   0  0  0

+   -4.5369    0.9108    0.0070 N   0  0  0

+    2.9248   -1.2875    0.0031 C   0  0  0

+    3.9084    0.9067    0.0021 C   0  0  0

+    4.0192   -0.4843    0.0029 C   0  0  0

+    0.1812    2.3985    0.0000 H   0  0  0

+   -2.2764    2.1792    0.0000 H   0  0  0

+    0.5756   -2.5480    0.0000 H   0  0  0

+   -1.8844   -2.7243    0.0000 H   0  0  0

+   -4.0210   -1.6486    0.0000 H   0  0  0

+    2.6451    2.5716    0.0000 H   0  0  0

+   -4.6368    1.9526    0.0000 H   0  0  0

+   -5.3891    0.3034    0.0000 H   0  0  0

+    3.0353   -2.3282    0.0000 H   0  0  0

+    4.7792    1.4873    0.0000 H   0  0  0

+    4.9709   -0.9197    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 11 14  2  0

+ 13 15  2  0

+  7  9  1  0

+  8 10  2  0

+ 14 15  1  0

+  3 16  1  0

+  4 17  1  0

+  5 18  1  0

+  6 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13104-21-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+    0.9200   -0.3713   -0.2729 C   0  0  0

+   -0.5482   -0.2089   -0.1826 C   0  0  0

+    1.6425   -0.8374    0.8272 C   0  0  0

+    1.5866   -0.0648   -1.4590 C   0  0  0

+   -1.3580   -1.2983   -0.2519 O   0  0  0

+   -1.0760    1.0050   -0.0334 C   0  0  0

+    3.0121   -0.9867    0.7366 C   0  0  0

+    0.8208   -1.2278    2.3057 Cl  0  0  0

+    2.9556   -0.2181   -1.5376 C   0  0  0

+   -2.8711   -0.7507   -0.3050 P   0  0  0

+    0.0489    2.5235    0.0340 Br  0  0  0

+    3.6682   -0.6751   -0.4421 C   0  0  0

+   -3.8814   -1.9855   -0.5209 O   0  0  0

+   -3.2213   -0.0064    1.0790 O   0  0  0

+   -3.0113    0.2035   -1.4276 O   0  0  0

+    5.3905   -0.8647   -0.5490 Cl  0  0  0

+   -3.5382   -2.5862   -1.7713 C   0  0  0

+   -4.5952    0.3794    1.0043 C   0  0  0

+    1.4267    0.9278    0.0000 H   0  0  0

+   -2.0749    1.1191    0.0000 H   0  0  0

+    3.1796   -1.9781    0.0000 H   0  0  0

+    3.2917    0.7295    0.0000 H   0  0  0

+   -4.4112   -3.0850    0.0000 H   0  0  0

+   -3.0394   -3.4592    0.0000 H   0  0  0

+   -2.6652   -2.0874    0.0000 H   0  0  0

+   -4.3234    1.3474    0.0000 H   0  0  0

+   -5.5632    0.6512    0.0000 H   0  0  0

+   -4.8670   -0.5886    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+ 10 13  1  0

+ 10 14  1  0

+ 10 15  2  0

+ 12 16  1  0

+ 13 17  1  0

+ 14 18  1  0

+  9 12  2  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 17 23  1  0

+ 17 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25265-71-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+    2.3934   -0.1338   -0.3349 C   0  0  0

+    1.1362    0.7202   -0.1590 C   0  0  0

+    3.6098    0.7784   -0.5051 C   0  0  0

+    2.5741   -0.9585    0.8181 O   0  0  0

+    0.0000   -0.1318    0.0000 O   0  0  0

+   -1.1362    0.7202    0.1589 C   0  0  0

+   -2.3934   -0.1338    0.3349 C   0  0  0

+   -3.6098    0.7784    0.5050 C   0  0  0

+   -2.5741   -0.9586   -0.8180 O   0  0  0

+    1.4803   -0.7517    0.0000 H   0  0  0

+    1.8523    1.5585    0.0000 H   0  0  0

+    0.3818    1.5241    0.0000 H   0  0  0

+    4.2713   -0.1036    0.0000 H   0  0  0

+    4.4918    1.4399    0.0000 H   0  0  0

+    2.9483    1.6604    0.0000 H   0  0  0

+    2.8101   -2.0354    0.0000 H   0  0  0

+   -0.3818    1.5241    0.0000 H   0  0  0

+   -1.8523    1.5585    0.0000 H   0  0  0

+   -1.4803   -0.7517    0.0000 H   0  0  0

+   -2.9483    1.6604    0.0000 H   0  0  0

+   -4.4918    1.4399    0.0000 H   0  0  0

+   -4.2713   -0.1036    0.0000 H   0  0  0

+   -2.8100   -2.0356    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  7  9  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+  8 21  1  0

+  8 22  1  0

+  9 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+151258-40-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    1.0133   -0.0442    0.0069 C   0  0  0

+   -0.0667   -1.0452    0.0930 C   0  0  0

+    0.4509    1.2427   -0.0865 C   0  0  0

+    2.4226   -0.1789    0.0100 C   0  0  0

+   -1.2694   -0.3624   -0.0062 C   0  0  0

+   -0.1458   -2.4317    0.2425 C   0  0  0

+   -1.0057    1.1038   -0.0161 C   0  0  0

+    1.2889    2.3620   -0.2180 C   0  0  0

+    3.2383    0.9714   -0.1097 C   0  0  0

+    3.0250   -1.4408    0.1314 C   0  0  0

+   -2.5183   -0.9720   -0.0746 C   0  0  0

+   -1.3855   -3.0457    0.2311 C   0  0  0

+   -2.0633    1.9216    0.0076 C   0  0  0

+    2.6397    2.2396   -0.2313 C   0  0  0

+    4.6362    0.8286   -0.1022 C   0  0  0

+    4.3833   -1.5428    0.1348 C   0  0  0

+   -3.6769   -0.0463   -0.3071 C   0  0  0

+   -2.5714   -2.3353    0.0634 C   0  0  0

+   -3.4313    1.3420    0.2646 C   0  0  0

+    5.1869   -0.4110    0.0186 C   0  0  0

+   -3.9322    0.0544   -1.7096 O   0  0  0

+   -3.6873    1.3303    1.6704 O   0  0  0

+    0.7264   -3.0081    0.0000 H   0  0  0

+    0.8637    3.3171    0.0000 H   0  0  0

+    2.4345   -2.3036    0.0000 H   0  0  0

+   -1.4272   -4.0904    0.0000 H   0  0  0

+   -1.9291    2.9584    0.0000 H   0  0  0

+    3.2387    3.0965    0.0000 H   0  0  0

+    5.2498    1.6751    0.0000 H   0  0  0

+    4.8279   -2.4891    0.0000 H   0  0  0

+   -4.2008   -0.9510    0.0000 H   0  0  0

+   -3.4909   -2.8329    0.0000 H   0  0  0

+   -3.6627    2.3616    0.0000 H   0  0  0

+    6.2272   -0.5150    0.0000 H   0  0  0

+   -4.9048    0.4380    0.0000 H   0  0  0

+   -4.7317    1.2826    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  2  0

+ 11 17  1  0

+ 11 18  2  0

+ 13 19  1  0

+ 15 20  2  0

+ 17 21  1  0

+ 19 22  1  0

+  5  7  1  0

+  9 14  1  0

+ 12 18  1  0

+ 16 20  1  0

+ 17 19  1  0

+  6 23  1  0

+  8 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122-14-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -0.0636    0.2413    0.9483 C   0  0  0

+   -1.3628    0.4354    1.2967 O   0  0  0

+    0.6459    1.2543    0.3202 C   0  0  0

+    0.5570   -0.9683    1.2254 C   0  0  0

+   -2.2595   -0.1523    0.0955 P   0  0  0

+    1.9666    1.0545   -0.0331 C   0  0  0

+    1.8775   -1.1631    0.8702 C   0  0  0

+   -1.9226   -1.7129   -0.1117 O   0  0  0

+   -3.8191    0.0167    0.4578 O   0  0  0

+   -1.8820    0.7785   -1.4742 S   0  0  0

+    2.5809   -0.1538    0.2386 C   0  0  0

+    2.7381    2.1546   -0.7155 C   0  0  0

+   -2.8118   -2.1970   -1.1202 C   0  0  0

+   -4.0327    1.4038    0.7267 C   0  0  0

+    3.9954   -0.3654   -0.1418 N   0  3  0

+    4.2780   -1.1657   -1.0154 O   0  0  0

+    4.8770    0.2607    0.4188 O   0  5  0

+    0.2516    2.1745    0.0000 H   0  0  0

+   -0.0260   -1.7821    0.0000 H   0  0  0

+    2.2746   -2.0821    0.0000 H   0  0  0

+    3.5577    1.5798    0.0000 H   0  0  0

+    3.3129    2.9742    0.0000 H   0  0  0

+    1.9185    2.7294    0.0000 H   0  0  0

+   -3.2905   -1.3178    0.0000 H   0  0  0

+   -3.6910   -2.6757    0.0000 H   0  0  0

+   -2.3331   -3.0762    0.0000 H   0  0  0

+   -3.0433    1.5562    0.0000 H   0  0  0

+   -4.1851    2.3932    0.0000 H   0  0  0

+   -5.0221    1.2514    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 15 16  2  0

+ 15 17  1  0

+  7 11  1  0

+  3 18  1  0

+  4 19  1  0

+  7 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+143-07-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+    1.7538   -0.6487    0.0000 C   0  0  0

+    0.5415    0.2847    0.0000 C   0  0  0

+    3.0379    0.1832    0.0000 C   0  0  0

+   -0.7426   -0.5472    0.0000 C   0  0  0

+    4.2502   -0.7501    0.0000 C   0  0  0

+   -1.9549    0.3862    0.0000 C   0  0  0

+    5.5150    0.0693    0.0000 C   0  0  0

+   -3.2390   -0.4457    0.0000 C   0  0  0

+    6.7103   -0.5414    0.0000 O   0  0  0

+    5.4531    1.2759    0.0000 O   0  0  0

+   -4.4513    0.4877    0.0000 C   0  0  0

+   -5.7354   -0.3442    0.0000 C   0  0  0

+   -6.9477    0.5891    0.0000 C   0  0  0

+   -8.2318   -0.2428    0.0000 C   0  0  0

+    0.9555   -1.4730    0.0000 H   0  0  0

+    2.4826   -1.5351    0.0000 H   0  0  0

+    1.3398    1.1090    0.0000 H   0  0  0

+   -0.1873    1.1711    0.0000 H   0  0  0

+    3.8362    1.0075    0.0000 H   0  0  0

+    2.3091    1.0696    0.0000 H   0  0  0

+   -1.5409   -1.3715    0.0000 H   0  0  0

+   -0.0138   -1.4336    0.0000 H   0  0  0

+    3.4519   -1.5744    0.0000 H   0  0  0

+    4.9790   -1.6365    0.0000 H   0  0  0

+   -1.1566    1.2105    0.0000 H   0  0  0

+   -2.6837    1.2726    0.0000 H   0  0  0

+   -4.0373   -1.2700    0.0000 H   0  0  0

+   -2.5102   -1.3321    0.0000 H   0  0  0

+    7.7322   -1.0635    0.0000 H   0  0  0

+   -3.6530    1.3120    0.0000 H   0  0  0

+   -5.1801    1.3741    0.0000 H   0  0  0

+   -6.5337   -1.1685    0.0000 H   0  0  0

+   -5.0066   -1.2306    0.0000 H   0  0  0

+   -6.1494    1.4134    0.0000 H   0  0  0

+   -7.6765    1.4755    0.0000 H   0  0  0

+   -8.8557    0.7203    0.0000 H   0  0  0

+   -9.1949   -0.8667    0.0000 H   0  0  0

+   -7.6079   -1.2059    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  7 10  2  0

+  8 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+  1 15  1  0

+  1 16  1  0

+  2 17  1  0

+  2 18  1  0

+  3 19  1  0

+  3 20  1  0

+  4 21  1  0

+  4 22  1  0

+  5 23  1  0

+  5 24  1  0

+  6 25  1  0

+  6 26  1  0

+  8 27  1  0

+  8 28  1  0

+  9 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+ 12 32  1  0

+ 12 33  1  0

+ 13 34  1  0

+ 13 35  1  0

+ 14 36  1  0

+ 14 37  1  0

+ 14 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+55-21-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.1646    0.0044    0.0033 C   0  0  0

+    0.5364   -1.2028    0.0029 C   0  0  0

+    0.5363    1.2112    0.0009 C   0  0  0

+   -1.6430    0.0045    0.0001 C   0  0  0

+    1.9157   -1.1959    0.0002 C   0  0  0

+    1.9160    1.2041   -0.0018 C   0  0  0

+   -2.3169    1.1717    0.0004 N   0  0  0

+   -2.2509   -1.0482   -0.0029 O   0  0  0

+    2.6046    0.0043   -0.0022 C   0  0  0

+    0.0210   -2.1033    0.0000 H   0  0  0

+    0.0210    2.1117    0.0000 H   0  0  0

+    2.4378   -2.0925    0.0000 H   0  0  0

+    2.4382    2.1006    0.0000 H   0  0  0

+   -1.7981    2.0702    0.0000 H   0  0  0

+   -3.3544    1.1717    0.0000 H   0  0  0

+    3.6421    0.0043    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6  9  2  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78-95-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    1.0993    0.0272   -0.0013 C   0  0  0

+   -0.0853    0.9588    0.0015 C   0  0  0

+    2.4983    0.5873   -0.0004 C   0  0  0

+    0.9274   -1.1681    0.0008 O   0  0  0

+   -1.6085   -0.0058   -0.0003 Cl  0  0  0

+    0.7093    1.7625    0.0000 H   0  0  0

+   -0.7941    1.8392    0.0000 H   0  0  0

+    2.9184   -0.4620    0.0000 H   0  0  0

+    3.5476    1.0074    0.0000 H   0  0  0

+    2.0782    1.6366    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51-65-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -1.7932   -0.1092   -0.4036 C   0  0  0

+   -3.2276    0.2270   -0.0865 C   0  0  0

+   -0.9655   -0.0769    0.8828 C   0  0  0

+   -1.7245   -1.4515   -0.9965 N   0  0  0

+   -3.6406    1.5038   -0.1189 O   0  0  0

+   -4.0059   -0.6527    0.1969 O   0  0  0

+    0.4997   -0.0137    0.5359 C   0  0  0

+    1.0638    1.1833    0.1365 C   0  0  0

+    1.2799   -1.1519    0.6228 C   0  0  0

+    2.4075    1.2424   -0.1820 C   0  0  0

+    2.6234   -1.0952    0.3049 C   0  0  0

+    3.1884    0.1022   -0.1008 C   0  0  0

+    4.5019    0.1589   -0.4117 F   0  0  0

+   -1.6970    0.8942    0.0000 H   0  0  0

+   -1.4339   -0.9695    0.0000 H   0  0  0

+   -0.4255   -0.9281    0.0000 H   0  0  0

+   -2.5706   -1.9995    0.0000 H   0  0  0

+   -0.8269   -1.9102    0.0000 H   0  0  0

+   -3.9508    2.4629    0.0000 H   0  0  0

+    0.5053    2.0225    0.0000 H   0  0  0

+    0.8289   -2.0534    0.0000 H   0  0  0

+    2.8579    2.1442    0.0000 H   0  0  0

+    3.1809   -1.9350    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  7  8  2  0

+  7  9  1  0

+  8 10  1  0

+  9 11  2  0

+ 10 12  2  0

+ 12 13  1  0

+ 11 12  1  0

+  1 14  1  0

+  3 15  1  0

+  3 16  1  0

+  4 17  1  0

+  4 18  1  0

+  5 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+959-33-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    2.0261    1.0205   -0.0038 C   0  0  0

+    0.7064    0.5032   -0.0034 C   0  0  0

+    2.2082    2.2243   -0.0004 O   0  0  0

+    3.1822    0.0975   -0.0021 C   0  0  0

+   -0.3508    1.3471    0.0007 C   0  0  0

+    4.4831    0.6035   -0.0025 C   0  0  0

+    2.9769   -1.2835    0.0056 C   0  0  0

+   -1.7183    0.8112    0.0011 C   0  0  0

+    5.5569   -0.2627   -0.0010 C   0  0  0

+    4.0592   -2.1384    0.0070 C   0  0  0

+   -2.8144    1.6826    0.0053 C   0  0  0

+   -1.9306   -0.5732   -0.0086 C   0  0  0

+    5.3465   -1.6302    0.0009 C   0  0  0

+   -4.0939    1.1750    0.0057 C   0  0  0

+   -3.2138   -1.0700   -0.0081 C   0  0  0

+   -4.2989   -0.2001    0.0019 C   0  0  0

+   -5.5626   -0.6953    0.0028 O   0  0  0

+   -5.4480   -2.1197   -0.0018 C   0  0  0

+    0.5505   -0.5278    0.0000 H   0  0  0

+   -0.1949    2.3781    0.0000 H   0  0  0

+    4.6430    1.6339    0.0000 H   0  0  0

+    2.0075   -1.6677    0.0000 H   0  0  0

+    6.5292    0.1140    0.0000 H   0  0  0

+    3.9072   -3.1700    0.0000 H   0  0  0

+   -2.6617    2.7141    0.0000 H   0  0  0

+   -1.1177   -1.2262    0.0000 H   0  0  0

+    6.1614   -2.2808    0.0000 H   0  0  0

+   -4.9108    1.8230    0.0000 H   0  0  0

+   -3.3729   -2.1005    0.0000 H   0  0  0

+   -6.4874   -2.2033    0.0000 H   0  0  0

+   -5.3644   -3.1591    0.0000 H   0  0  0

+   -4.4086   -2.0361    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  2  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 14  2  0

+ 17 16  1  0

+ 18 17  1  0

+ 10 13  1  0

+ 15 16  1  0

+  2 19  1  0

+  5 20  1  0

+  6 21  1  0

+  7 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5784-45-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -2.3607    1.0931   -0.0004 Cl  0  0  0

+   -1.1143   -0.1153   -0.0015 C   0  0  0

+    0.2423    0.2565   -0.0005 C   0  0  0

+   -1.4227   -1.3945    0.0021 N   0  0  0

+    1.2115   -0.7823   -0.0010 C   0  0  0

+    0.6626    1.5929    0.0006 C   0  0  0

+   -0.5478   -2.3299    0.0020 N   0  0  0

+    0.7477   -2.1091   -0.0025 C   0  0  0

+    2.5741   -0.4550   -0.0004 C   0  0  0

+    1.9960    1.8746    0.0011 C   0  0  0

+    2.9469    0.8557    0.0006 C   0  0  0

+   -0.0418    2.3688    0.0000 H   0  0  0

+    1.4242   -2.9095    0.0000 H   0  0  0

+    3.2996   -1.2112    0.0000 H   0  0  0

+    2.3116    2.8739    0.0000 H   0  0  0

+    3.9656    1.1016    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  2  0

+  8  5  2  0

+  9  5  1  0

+ 10  6  2  0

+ 11  9  2  0

+  7  8  1  0

+ 10 11  1  0

+  6 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1193-54-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+    0.6734   -0.1452   -0.0020 C   0  0  0

+   -0.6734   -0.1452   -0.0006 C   0  0  0

+    1.0995    1.2713   -0.0011 C   0  0  0

+    1.7092   -1.5384    0.0019 Cl  0  0  0

+   -1.0995    1.2713    0.0012 C   0  0  0

+   -1.7092   -1.5384   -0.0014 Cl  0  0  0

+    0.0000    2.0461    0.0008 N   0  0  0

+    2.2472    1.6674   -0.0023 O   0  0  0

+   -2.2472    1.6675    0.0022 O   0  0  0

+    0.0000    3.0562    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  5  9  2  0

+  5  7  1  0

+  7 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-41-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.5516    0.0010   -0.2868 C   0  0  0

+    0.1268   -1.1968   -0.1580 C   0  0  0

+    0.1280    1.1975   -0.1567 C   0  0  0

+   -2.0307    0.0020   -0.5751 C   0  0  0

+    1.4845   -1.1977    0.1007 C   0  0  0

+    1.4861    1.1966    0.1020 C   0  0  0

+   -2.8073   -0.0017    0.7432 C   0  0  0

+    2.1643   -0.0009    0.2307 C   0  0  0

+   -0.3932   -2.0883    0.0000 H   0  0  0

+   -0.3909    2.0897    0.0000 H   0  0  0

+   -1.5157    0.8964    0.0000 H   0  0  0

+   -2.5494    0.8943    0.0000 H   0  0  0

+    2.0034   -2.0899    0.0000 H   0  0  0

+    2.0061    2.0881    0.0000 H   0  0  0

+   -2.8122    1.0304    0.0000 H   0  0  0

+   -3.8394   -0.0066    0.0000 H   0  0  0

+   -2.8024   -1.0338    0.0000 H   0  0  0

+    3.1964   -0.0016    0.0000 H   0  0  0

+  1  2  1  0

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+  4 11  1  0

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+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+458-37-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 48                          1 V2000

+   -4.9491    0.0480   -0.0043 C   0  0  0

+   -6.0943   -0.7587   -0.0054 C   0  0  0

+   -5.0801    1.4425    0.0024 C   0  0  0

+   -3.6160   -0.5662   -0.0040 C   0  0  0

+   -7.3451   -0.1750    0.0001 C   0  0  0

+   -6.3321    2.0157    0.0079 C   0  0  0

+   -2.5091    0.2165   -0.0030 C   0  0  0

+   -7.4669    1.2146    0.0068 C   0  0  0

+   -8.4592   -0.9549   -0.0014 O   0  0  0

+   -1.2305   -0.3726   -0.0027 C   0  0  0

+   -8.6987    1.7860    0.0122 O   0  0  0

+   -8.0130   -2.3124   -0.0090 C   0  0  0

+    0.0000    0.4975   -0.0015 C   0  0  0

+   -1.1190   -1.5822   -0.0034 O   0  0  0

+    1.2304   -0.3726   -0.0015 C   0  0  0

+    2.5091    0.2164   -0.0005 C   0  0  0

+    1.1190   -1.5822   -0.0023 O   0  0  0

+    3.6159   -0.5663   -0.0004 C   0  0  0

+    4.9491    0.0479    0.0007 C   0  0  0

+    6.0943   -0.7588    0.0007 C   0  0  0

+    5.0802    1.4425   -0.0042 C   0  0  0

+    7.3451   -0.1750    0.0018 C   0  0  0

+    6.3321    2.0156   -0.0031 C   0  0  0

+    7.4669    1.2145    0.0028 C   0  0  0

+    8.4592   -0.9550    0.0023 O   0  0  0

+    8.6988    1.7860    0.0038 O   0  0  0

+    8.0130   -2.3125    0.0015 C   0  0  0

+   -6.0020   -1.7986    0.0000 H   0  0  0

+   -4.2290    2.0470    0.0000 H   0  0  0

+   -3.5202   -1.6058    0.0000 H   0  0  0

+   -6.4287    3.0552    0.0000 H   0  0  0

+   -2.6049    1.2561    0.0000 H   0  0  0

+   -9.6457    2.2253    0.0000 H   0  0  0

+   -9.0048   -2.6384    0.0000 H   0  0  0

+   -7.6870   -3.3042    0.0000 H   0  0  0

+   -7.0212   -1.9864    0.0000 H   0  0  0

+    0.6952    1.2763    0.0000 H   0  0  0

+   -0.6952    1.2763    0.0000 H   0  0  0

+    2.6049    1.2560    0.0000 H   0  0  0

+    3.5201   -1.6059    0.0000 H   0  0  0

+    6.0020   -1.7987    0.0000 H   0  0  0

+    4.2291    2.0470    0.0000 H   0  0  0

+    6.4287    3.0551    0.0000 H   0  0  0

+    9.6458    2.2253    0.0000 H   0  0  0

+    7.0212   -1.9865    0.0000 H   0  0  0

+    7.6870   -3.3043    0.0000 H   0  0  0

+    9.0048   -2.6385    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  3

+  5  8  2  0

+  5  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

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+ 13 15  1  0

+ 15 16  1  0

+ 15 17  2  0

+ 16 18  2  3

+ 18 19  1  0

+ 19 20  2  0

+ 19 21  1  0

+ 20 22  1  0

+ 21 23  2  0

+ 22 24  2  0

+ 22 25  1  0

+ 24 26  1  0

+ 25 27  1  0

+  6  8  1  0

+ 23 24  1  0

+  2 28  1  0

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+  4 30  1  0

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+ 21 42  1  0

+ 23 43  1  0

+ 26 44  1  0

+ 27 45  1  0

+ 27 46  1  0

+ 27 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+17433-31-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.3795    0.2099    0.0562 C   0  0  0

+   -0.0224    0.6775    0.1624 C   0  0  0

+    2.3755    1.0984   -0.3416 C   0  0  0

+    1.6766   -1.0510    0.3462 N   0  0  0

+   -0.9907   -0.1776    0.5468 N   0  0  0

+   -0.2992    1.8319   -0.0971 O   0  0  0

+    3.6827    0.6464   -0.4359 C   0  0  0

+    2.9077   -1.5059    0.2653 C   0  0  0

+   -2.3163    0.2645    0.6472 N   0  0  0

+    3.9477   -0.6787   -0.1290 C   0  0  0

+   -3.2774   -0.3116   -0.1017 C   0  0  0

+   -4.7033    0.1639    0.0063 C   0  0  0

+   -2.9947   -1.2127   -0.8626 O   0  0  0

+    2.1797    2.0756    0.0000 H   0  0  0

+   -0.7920   -1.1542    0.0000 H   0  0  0

+    4.4335    1.3018    0.0000 H   0  0  0

+    3.0655   -2.4900    0.0000 H   0  0  0

+   -2.4248    1.2552    0.0000 H   0  0  0

+    4.8837   -1.0211    0.0000 H   0  0  0

+   -4.3880    1.1094    0.0000 H   0  0  0

+   -5.6488    0.4792    0.0000 H   0  0  0

+   -5.0186   -0.7816    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  7 10  2  0

+  9 11  1  0

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+  8 10  1  0

+  3 14  1  0

+  5 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2208-41-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -0.8630   -0.6343    0.3289 C   0  0  0

+   -1.7843   -1.5801   -0.1533 C   0  0  0

+    0.3683   -1.3760    0.6146 C   0  0  0

+   -1.2316    0.7094    0.4385 C   0  0  0

+   -3.0637   -1.1696   -0.5150 C   0  0  0

+   -1.1476   -2.8031   -0.1557 N   0  0  0

+    0.1339   -2.6607    0.3052 C   0  0  0

+    1.6542   -0.8043    1.1537 C   0  0  0

+   -2.5017    1.1010    0.0716 C   0  0  0

+   -3.4198    0.1591   -0.3988 C   0  0  0

+    2.5469   -0.3700   -0.0105 C   0  0  0

+   -2.8650    2.4080    0.1767 O   0  0  0

+   -4.6715    0.5557   -0.7536 O   0  0  0

+    3.7969    0.1857    0.5136 N   0  0  0

+   -1.7317    3.1118    0.6890 C   0  0  0

+    4.7422    0.6362   -0.3350 C   0  0  0

+    6.0281    1.2079    0.2041 C   0  0  0

+    4.5579    0.5815   -1.5325 O   0  0  0

+   -0.5131    1.4057    0.0000 H   0  0  0

+   -3.7882   -1.8597    0.0000 H   0  0  0

+   -1.6185   -3.6859    0.0000 H   0  0  0

+    0.8163   -3.3924    0.0000 H   0  0  0

+    1.5605   -1.8004    0.0000 H   0  0  0

+    2.4766   -1.3741    0.0000 H   0  0  0

+    2.6406    0.6261    0.0000 H   0  0  0

+    1.7245    0.1998    0.0000 H   0  0  0

+   -5.6253    0.8579    0.0000 H   0  0  0

+    4.2154   -0.7231    0.0000 H   0  0  0

+   -1.2039    2.2618    0.0000 H   0  0  0

+   -0.8817    3.6396    0.0000 H   0  0  0

+   -2.2595    3.9618    0.0000 H   0  0  0

+    6.4346    0.2936    0.0000 H   0  0  0

+    6.9424    1.6144    0.0000 H   0  0  0

+    5.6216    2.1222    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

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+ 14 16  1  0

+ 16 17  1  0

+ 16 18  2  0

+  6  7  1  0

+  9 10  1  0

+  4 19  1  0

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+ 11 25  1  0

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+ 13 27  1  0

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+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4719-04-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+    1.3814   -0.1636   -0.1830 N   0  0  0

+    0.5455   -1.2555   -0.6959 C   0  0  0

+    0.8158    1.0878   -0.7012 C   0  0  0

+    2.7042   -0.3176   -0.8031 C   0  0  0

+   -0.8214   -1.1177   -0.1795 N   0  0  0

+   -0.5463    1.2671   -0.1849 N   0  0  0

+    3.7807   -0.3123    0.2841 C   0  0  0

+   -1.3487    0.1502   -0.6977 C   0  0  0

+   -1.6156   -2.1886   -0.7962 C   0  0  0

+   -1.0761    2.4880   -0.8068 C   0  0  0

+    3.6596   -1.4928    1.0801 O   0  0  0

+   -2.1787   -3.0998    0.2964 C   0  0  0

+   -1.6159    3.4206    0.2794 C   0  0  0

+   -3.1493   -2.3824    1.0614 O   0  0  0

+   -0.5306    3.9081    1.0710 O   0  0  0

+    0.2649   -2.2141    0.0000 H   0  0  0

+    1.4364   -1.7070    0.0000 H   0  0  0

+    1.7861    1.3246    0.0000 H   0  0  0

+    0.7616    2.0851    0.0000 H   0  0  0

+    2.1409   -1.1424    0.0000 H   0  0  0

+    3.1727   -1.1997    0.0000 H   0  0  0

+    4.7773   -0.3787    0.0000 H   0  0  0

+    3.8115    0.6860    0.0000 H   0  0  0

+   -2.0391    0.8719    0.0000 H   0  0  0

+   -2.1849   -0.3961    0.0000 H   0  0  0

+   -2.0386   -1.2838    0.0000 H   0  0  0

+   -2.6127   -2.1306    0.0000 H   0  0  0

+   -0.0802    2.4124    0.0000 H   0  0  0

+   -0.5448    3.3337    0.0000 H   0  0  0

+    3.5577   -2.4864    0.0000 H   0  0  0

+   -2.7499   -3.9191    0.0000 H   0  0  0

+   -1.3439   -3.6482    0.0000 H   0  0  0

+   -2.0560    4.3172    0.0000 H   0  0  0

+   -2.4969    2.9501    0.0000 H   0  0  0

+   -3.9525   -1.7887    0.0000 H   0  0  0

+    0.3805    4.3174    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  3  6  1  0

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+  5  8  1  0

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+ 12 31  1  0

+ 12 32  1  0

+ 13 33  1  0

+ 13 34  1  0

+ 14 35  1  0

+ 15 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3322-93-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.3261   -0.3721   -0.0244 C   0  0  0

+    0.4418    0.0847   -1.2664 C   0  0  0

+   -0.0008    0.5572    1.1467 C   0  0  0

+   -1.8288   -0.3275   -0.3087 C   0  0  0

+    1.9444    0.0401   -0.9821 C   0  0  0

+    1.5018    0.5126    1.4311 C   0  0  0

+   -2.5966   -0.7844    0.9333 C   0  0  0

+   -2.3550    1.5110   -0.7650 Br  0  0  0

+    2.2697    0.9695    0.1890 C   0  0  0

+    2.4707   -1.7983   -0.5255 Br  0  0  0

+   -4.5275   -0.7270    0.5680 Br  0  0  0

+    4.2006    0.9121    0.5544 Br  0  0  0

+   -0.0434   -1.4635    0.0000 H   0  0  0

+    0.8437    1.1381    0.0000 H   0  0  0

+   -0.4210    0.8104    0.0000 H   0  0  0

+    0.1476    1.6748    0.0000 H   0  0  0

+   -1.0974    0.8190    0.0000 H   0  0  0

+   -1.5460   -1.4189    0.0000 H   0  0  0

+    3.0714    0.0075    0.0000 H   0  0  0

+    1.0999   -0.5408    0.0000 H   0  0  0

+    2.3647   -0.2131    0.0000 H   0  0  0

+   -2.9985   -1.8378    0.0000 H   0  0  0

+   -1.7337   -1.5101    0.0000 H   0  0  0

+    1.9869    2.0609    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

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+  1 13  1  0

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+  2 15  1  0

+  3 16  1  0

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+  4 18  1  0

+  5 19  1  0

+  6 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  9 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+151-18-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+   -0.0937    0.6601    0.0000 C   0  0  0

+   -1.0747   -0.5140    0.0000 C   0  0  0

+    1.2859    0.1468    0.0000 C   0  0  0

+   -2.4514   -0.0017    0.0000 N   0  0  0

+    2.3506   -0.2494    0.0000 N   0  0  0

+    0.4052    1.6436    0.0000 H   0  0  0

+   -1.0145    1.2670    0.0000 H   0  0  0

+   -1.5737   -1.4975    0.0000 H   0  0  0

+   -0.1539   -1.1209    0.0000 H   0  0  0

+   -2.6351    1.0857    0.0000 H   0  0  0

+   -3.3013   -0.7045    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  3  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  4 10  1  0

+  4 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60-82-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    0.8553    0.0096    1.1019 C   0  0  0

+   -0.4473    0.0056    0.3441 C   0  0  0

+    0.8513    0.0126    2.3157 O   0  0  0

+    2.1232    0.0038    0.3754 C   0  0  0

+   -1.6135    0.0062    1.3345 C   0  0  0

+    2.7403    1.2172    0.0180 C   0  0  0

+    2.7383   -1.2155    0.0337 C   0  0  0

+   -2.9161    0.0022    0.5767 C   0  0  0

+    2.1602    2.3981    0.3467 O   0  0  0

+    3.9398    1.2012   -0.6686 C   0  0  0

+    2.1557   -2.3911    0.3767 O   0  0  0

+    3.9374   -1.2106   -0.6529 C   0  0  0

+   -3.5106   -1.1975    0.2327 C   0  0  0

+   -3.5176    1.1987    0.2317 C   0  0  0

+    4.5362   -0.0073   -1.0060 C   0  0  0

+   -4.7051   -1.2038   -0.4617 C   0  0  0

+   -4.7117    1.1977   -0.4624 C   0  0  0

+    5.7136   -0.0127   -1.6800 O   0  0  0

+   -5.3078   -0.0051   -0.8136 C   0  0  0

+   -6.4825   -0.0087   -1.4969 O   0  0  0

+   -0.9352   -0.8408    0.0000 H   0  0  0

+    0.0428   -0.8395    0.0000 H   0  0  0

+   -1.1256    0.8526    0.0000 H   0  0  0

+   -2.1036    0.8513    0.0000 H   0  0  0

+    1.7295    3.2750    0.0000 H   0  0  0

+    4.4611    2.0274    0.0000 H   0  0  0

+    1.7219   -3.2665    0.0000 H   0  0  0

+    4.4535   -2.0401    0.0000 H   0  0  0

+   -2.9933   -2.0263    0.0000 H   0  0  0

+   -3.0052    2.0305    0.0000 H   0  0  0

+   -5.2156   -2.0368    0.0000 H   0  0  0

+   -5.2271    2.0276    0.0000 H   0  0  0

+    6.6905   -0.0172    0.0000 H   0  0  0

+   -7.4595   -0.0117    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  1  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  6  1  0

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+ 12  7  2  0

+ 13  8  2  0

+ 14  8  1  0

+ 15 10  2  0

+ 16 13  1  0

+ 17 14  2  0

+ 18 15  1  0

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+ 20 19  1  0

+ 12 15  1  0

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+  2 21  1  0

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+  5 23  1  0

+  5 24  1  0

+  9 25  1  0

+ 10 26  1  0

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+ 13 29  1  0

+ 14 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75-34-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.0000   -0.5010    0.4661 C   0  0  0

+   -0.0001   -1.8858   -0.1843 C   0  0  0

+    1.4721    0.4043   -0.0477 Cl  0  0  0

+   -1.4721    0.4044   -0.0477 Cl  0  0  0

+    1.1314   -1.1335    0.0000 H   0  0  0

+   -1.2962   -1.8857    0.0000 H   0  0  0

+   -0.0002   -3.1819    0.0000 H   0  0  0

+    1.2960   -1.8859    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+578-95-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -1.2053    0.8905    0.1156 C   0  0  0

+   -1.2573   -0.5115    0.0229 C   0  0  0

+    0.0000    1.5347    0.3055 N   0  0  0

+   -2.3862    1.6216    0.0191 C   0  0  0

+    0.0000   -1.2776    0.1203 C   0  0  0

+   -2.4800   -1.1576   -0.1611 C   0  0  0

+    1.2053    0.8903    0.1172 C   0  0  0

+   -3.5867    0.9699   -0.1618 C   0  0  0

+    1.2571   -0.5113    0.0226 C   0  0  0

+    0.0001   -2.4855    0.2737 O   0  0  0

+   -3.6353   -0.4137   -0.2557 C   0  0  0

+    2.3864    1.6217    0.0191 C   0  0  0

+    2.4802   -1.1576   -0.1614 C   0  0  0

+    3.5862    0.9703   -0.1645 C   0  0  0

+    3.6355   -0.4140   -0.2533 C   0  0  0

+    0.0001    2.5722    0.0000 H   0  0  0

+   -2.3566    2.6587    0.0000 H   0  0  0

+   -2.5246   -2.1942    0.0000 H   0  0  0

+   -4.4689    1.5160    0.0000 H   0  0  0

+   -4.5547   -0.8945    0.0000 H   0  0  0

+    2.3568    2.6588    0.0000 H   0  0  0

+    2.5247   -2.1942    0.0000 H   0  0  0

+    4.4683    1.5166    0.0000 H   0  0  0

+    4.5550   -0.8946    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  1  0

+  7 12  1  0

+  9 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+  7  9  2  0

+  8 11  2  0

+ 14 15  1  0

+  3 16  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+117066-35-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 43                          1 V2000

+   -0.8559   -0.1224   -0.1052 C   0  0  0

+   -2.1075   -0.9151   -0.1060 C   0  0  0

+   -0.9335    1.2771   -0.1675 C   0  0  0

+    0.3822   -0.7453   -0.0381 C   0  0  0

+   -3.3060   -0.2835    0.2271 C   0  0  0

+   -2.0994   -2.2670   -0.4328 C   0  0  0

+    0.1545    2.0113   -0.1606 N   0  0  0

+   -2.2851    1.9394   -0.2509 C   0  0  2

+    1.5208    0.0646   -0.0359 C   0  0  0

+   -3.3082    1.1775    0.5858 C   0  0  2

+   -4.4819   -1.0054    0.2267 C   0  0  0

+   -3.2825   -2.9792   -0.4282 C   0  0  0

+    1.3728    1.4690   -0.0992 C   0  0  0

+   -2.7151    1.9743   -1.6132 O   0  0  0

+    2.8687   -0.5059    0.0311 C   0  0  0

+   -2.9962    1.3280    1.9722 O   0  0  0

+   -4.4699   -2.3495   -0.0997 C   0  0  0

+    2.5241    2.2915   -0.0925 C   0  0  0

+    3.9768    0.3721    0.0339 C   0  0  0

+    3.0786   -1.8841    0.0913 C   0  0  0

+    3.7655    1.7683   -0.0353 C   0  0  0

+    5.2713   -0.1612    0.0972 C   0  0  0

+    4.3529   -2.3730    0.1520 C   0  0  0

+    5.4446   -1.5134    0.1551 C   0  0  0

+    0.4611   -1.7799    0.0000 H   0  0  0

+   -1.1946   -2.7749    0.0000 H   0  0  0

+   -2.0100    2.9399    0.0000 H   0  0  0

+   -4.2358    1.6424    0.0000 H   0  0  0

+   -5.3896   -0.5028    0.0000 H   0  0  0

+   -3.2544   -4.0164    0.0000 H   0  0  0

+   -3.7493    2.0582    0.0000 H   0  0  0

+   -2.0617    1.7788    0.0000 H   0  0  0

+   -5.3566   -2.8883    0.0000 H   0  0  0

+    2.4094    3.3227    0.0000 H   0  0  0

+    2.2704   -2.5347    0.0000 H   0  0  0

+    4.5845    2.4053    0.0000 H   0  0  0

+    6.0949    0.4698    0.0000 H   0  0  0

+    4.5083   -3.3989    0.0000 H   0  0  0

+    6.4050   -1.9061    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  2  0

+ 13 18  1  0

+ 15 19  1  0

+ 15 20  2  0

+ 18 21  2  0

+ 19 22  2  0

+ 20 23  1  0

+ 22 24  1  0

+  8 10  1  0

+  9 13  2  0

+ 12 17  1  0

+ 19 21  1  0

+ 23 24  2  0

+  4 25  1  0

+  6 26  1  0

+  8 27  1  0

+ 10 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 14 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+ 24 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2363-23-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.4532    0.6215    0.0030 C   0  0  0

+   -0.9879   -0.6614    0.0011 C   0  0  0

+    0.9163    0.7967    0.0027 C   0  0  0

+   -1.3508    1.7985   -0.0008 N   0  3  0

+   -0.1414   -1.7633   -0.0011 C   0  0  0

+   -2.7351   -0.8899    0.0020 S   0  0  0

+    1.7559   -0.3026    0.0005 C   0  0  0

+   -0.8814    2.9224    0.0009 O   0  0  0

+   -2.5588    1.6431   -0.0056 O   0  5  0

+    1.2274   -1.5804   -0.0014 C   0  0  0

+   -2.8157   -2.7021   -0.0013 C   0  0  0

+    3.2236   -0.1106   -0.0002 N   0  3  0

+    3.9643   -1.0775   -0.0022 O   0  0  0

+    3.6907    1.0143    0.0011 O   0  5  0

+    1.3161    1.7538    0.0000 H   0  0  0

+   -0.5371   -2.7221    0.0000 H   0  0  0

+    1.8599   -2.4025    0.0000 H   0  0  0

+   -3.8519   -2.6560    0.0000 H   0  0  0

+   -2.8618   -3.7383    0.0000 H   0  0  0

+   -1.7795   -2.7482    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+  7 10  2  0

+  3 15  1  0

+  5 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58658-11-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+    0.5314    0.0018   -0.7200 C   0  0  0

+    1.1596   -1.2070   -0.3582 C   0  0  0

+    1.1668    1.2059   -0.3566 C   0  0  0

+   -0.6610    0.0059   -1.4107 N   0  0  0

+    2.3905   -1.1693    0.3480 C   0  0  0

+    0.5841   -2.4461   -0.6866 C   0  0  0

+    2.3977    1.1598    0.3497 C   0  0  0

+    0.5989    2.4491   -0.6832 C   0  0  0

+   -1.8740    0.0061   -0.7127 C   0  0  0

+    2.9549   -0.0066    0.6711 N   0  0  0

+    3.0081   -2.3858    0.7037 C   0  0  0

+    1.2119   -3.5978   -0.3247 C   0  0  0

+    3.0227    2.3720    0.7071 C   0  0  0

+    1.2338    3.5964   -0.3196 C   0  0  0

+   -3.0762    0.0103   -1.4090 C   0  0  0

+   -1.8760   -0.0036    0.6761 C   0  0  0

+    2.4218   -3.5654    0.3685 C   0  0  0

+    2.4435    3.5556    0.3735 C   0  0  0

+   -4.2725    0.0100   -0.7205 C   0  0  0

+   -3.0728   -0.0039    1.3647 C   0  0  0

+   -4.2745    0.0056    0.6686 C   0  0  0

+   -5.4871    0.0058    1.3664 N   0  0  0

+   -0.6593    0.9297    0.0000 H   0  0  0

+   -0.3392   -2.4758    0.0000 H   0  0  0

+   -0.3242    2.4846    0.0000 H   0  0  0

+    3.9319   -2.3819    0.0000 H   0  0  0

+    0.7509   -4.3984    0.0000 H   0  0  0

+    3.9465    2.3623    0.0000 H   0  0  0

+    0.7781    4.4000    0.0000 H   0  0  0

+   -3.0747    0.9341    0.0000 H   0  0  0

+   -1.2923   -0.7197    0.0000 H   0  0  0

+    2.9189   -4.3441    0.0000 H   0  0  0

+    2.9457    4.3310    0.0000 H   0  0  0

+   -4.7728    0.7867    0.0000 H   0  0  0

+   -3.0763   -0.9277    0.0000 H   0  0  0

+   -5.9489    0.8059    0.0000 H   0  0  0

+   -5.9491   -0.7942    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+  9 16  2  0

+ 11 17  2  0

+ 13 18  2  0

+ 15 19  2  0

+ 16 20  1  0

+ 19 21  1  0

+ 21 22  1  0

+  7 10  2  0

+ 12 17  1  0

+ 14 18  1  0

+ 20 21  2  0

+  4 23  1  0

+  6 24  1  0

+  8 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 22 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+536-33-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.4759    0.5330    0.0118 C   0  0  0

+    0.4589   -0.4883    0.2130 C   0  0  0

+   -0.0038    1.8444   -0.1147 C   0  0  0

+   -1.9217    0.2345   -0.0711 C   0  0  0

+    1.8000   -0.1648    0.2783 C   0  0  0

+    1.3549    2.0769   -0.0366 C   0  0  0

+   -2.8059    1.2329   -0.2653 N   0  0  0

+   -2.4725   -1.3795    0.0797 S   0  0  0

+    2.2019    1.0846    0.1545 N   0  0  0

+    2.8177   -1.2549    0.4947 C   0  0  0

+    3.2747   -1.8020   -0.8592 C   0  0  0

+    0.1566   -1.4778    0.0000 H   0  0  0

+   -0.6683    2.6375    0.0000 H   0  0  0

+    1.7071    3.0498    0.0000 H   0  0  0

+   -2.4781    2.2143    0.0000 H   0  0  0

+   -3.8197    1.0261    0.0000 H   0  0  0

+    3.8336   -1.0588    0.0000 H   0  0  0

+    3.1378   -0.2710    0.0000 H   0  0  0

+    2.4806   -2.4653    0.0000 H   0  0  0

+    3.9380   -2.5961    0.0000 H   0  0  0

+    4.0688   -1.1387    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+ 10 11  1  0

+  6  9  1  0

+  2 12  1  0

+  3 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97931-39-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.6865    0.1703   -0.0379 C   0  0  0

+   -2.1420    0.0374    0.0114 C   0  0  0

+   -0.1258    1.4574   -0.0438 C   0  0  0

+    0.1173   -0.9820   -0.1178 C   0  0  0

+   -2.9384    1.1973   -0.0970 C   0  0  0

+   -2.7256   -1.2167    0.2091 C   0  0  0

+    1.3318    1.5685    0.0212 C   0  0  0

+   -0.9644    2.5830   -0.1242 C   0  0  0

+    1.4661   -0.8788   -0.0569 C   0  0  0

+   -0.5397   -2.3236   -0.3167 C   0  0  0

+   -2.3141    2.4611   -0.1630 C   0  0  0

+   -4.3337    1.0508   -0.1272 C   0  0  0

+   -1.8555   -2.4199    0.4463 C   0  0  0

+   -4.0860   -1.3204    0.1922 C   0  0  0

+    2.1004    0.3799    0.0324 C   0  0  0

+    1.9718    2.8093    0.0713 C   0  0  0

+    2.2908   -2.1078   -0.0839 N   0  3  0

+   -4.8806   -0.1912    0.0137 C   0  0  0

+    3.4985    0.4745    0.1214 C   0  0  0

+    3.3335    2.8653    0.1440 C   0  0  0

+    2.6737   -2.5610   -1.1477 O   0  0  0

+    2.5866   -2.6658    0.9576 O   0  5  0

+    4.0925    1.6998    0.1728 C   0  0  0

+   -0.5357    3.5425    0.0000 H   0  0  0

+   -0.6479   -3.3690    0.0000 H   0  0  0

+    0.4706   -2.6133    0.0000 H   0  0  0

+   -2.9084    3.3279    0.0000 H   0  0  0

+   -4.9531    1.8998    0.0000 H   0  0  0

+   -2.8056   -2.8692    0.0000 H   0  0  0

+   -1.5880   -3.4362    0.0000 H   0  0  0

+   -4.5344   -2.2709    0.0000 H   0  0  0

+    1.4066    3.6953    0.0000 H   0  0  0

+   -5.9264   -0.2953    0.0000 H   0  0  0

+    4.0863   -0.3968    0.0000 H   0  0  0

+    3.8153    3.7993    0.0000 H   0  0  0

+    5.1414    1.7659    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

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+  9 17  1  0

+ 12 18  2  0

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+  8 11  2  0

+  9 15  1  0

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+ 12 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 16 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-97-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.5504   -0.5313    0.0000 C   0  0  0

+   -0.5504    0.5313    0.0000 C   0  0  0

+    1.9192    0.1524    0.0000 C   0  0  0

+   -1.9192   -0.1524    0.0000 C   0  0  0

+   -0.3348   -1.2616    0.0000 H   0  0  0

+    1.1759   -1.4934    0.0000 H   0  0  0

+    0.3348    1.2616    0.0000 H   0  0  0

+   -1.1759    1.4934    0.0000 H   0  0  0

+    2.4320   -0.8742    0.0000 H   0  0  0

+    2.9458    0.6652    0.0000 H   0  0  0

+    1.4064    1.1790    0.0000 H   0  0  0

+   -2.4320    0.8742    0.0000 H   0  0  0

+   -2.9458   -0.6652    0.0000 H   0  0  0

+   -1.4064   -1.1790    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33389-36-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -2.8838   -0.7553   -0.0702 C   0  0  0

+   -2.1481   -1.9623    0.0238 C   0  0  0

+   -2.1673    0.4670   -0.1367 C   0  0  0

+   -4.2815   -0.7963   -0.0892 C   0  0  0

+   -0.8098   -1.9033    0.0462 N   0  0  0

+   -2.8367   -3.1821    0.0912 C   0  0  0

+   -0.8448    0.4228   -0.1078 N   0  0  0

+   -2.8320    1.6713   -0.2296 N   0  0  0

+   -4.9203   -1.9998   -0.0168 C   0  0  0

+   -0.1900   -0.7364   -0.0185 C   0  0  0

+   -4.1997   -3.1878    0.0652 C   0  0  0

+   -2.0739    2.9231   -0.2972 C   0  0  0

+    1.2843   -0.7158    0.0096 C   0  0  0

+   -3.0441    4.1022   -0.3946 C   0  0  0

+    2.3916    0.6831   -0.0608 S   0  0  0

+    2.1615   -1.7657    0.1026 C   0  0  0

+   -3.8901    4.1193    0.7570 O   0  0  0

+    3.9339   -0.2114    0.0303 C   0  0  0

+    3.5110   -1.5010    0.1114 C   0  0  0

+    5.3173    0.3158    0.0235 N   0  3  0

+    6.2614   -0.4506    0.0938 O   0  0  0

+    5.5114    1.5158   -0.0523 O   0  5  0

+   -4.8260    0.0798    0.0000 H   0  0  0

+   -2.3148   -4.0718    0.0000 H   0  0  0

+   -3.8633    1.6920    0.0000 H   0  0  0

+   -5.9514   -2.0293    0.0000 H   0  0  0

+   -4.7039   -4.0877    0.0000 H   0  0  0

+   -1.2572    2.2930    0.0000 H   0  0  0

+   -1.3560    3.6639    0.0000 H   0  0  0

+   -2.1163    4.5530    0.0000 H   0  0  0

+   -3.2652    5.1098    0.0000 H   0  0  0

+    1.8170   -2.7380    0.0000 H   0  0  0

+   -4.9214    4.1401    0.0000 H   0  0  0

+    4.1941   -2.2739    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  2  0

+  8 12  1  0

+ 10 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 13 16  2  0

+ 14 17  1  0

+ 15 18  1  0

+ 16 19  1  0

+ 18 20  1  0

+ 20 21  2  0

+ 20 22  1  0

+  7 10  1  0

+  9 11  1  0

+ 18 19  2  0

+  4 23  1  0

+  6 24  1  0

+  8 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110-57-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.5607    0.8775   -0.3386 C   0  0  0

+   -0.5607    0.8776    0.3386 C   0  0  0

+    1.8804    0.8776    0.3890 C   0  0  0

+   -1.8804    0.8775   -0.3890 C   0  0  0

+    2.8170   -0.5946   -0.0651 Cl  0  0  0

+   -2.8170   -0.5946    0.0651 Cl  0  0  0

+    0.5607   -0.1123    0.0000 H   0  0  0

+   -0.5607    1.8674    0.0000 H   0  0  0

+    2.8004    1.2427    0.0000 H   0  0  0

+    1.6945    1.8498    0.0000 H   0  0  0

+   -1.6946    1.8497    0.0000 H   0  0  0

+   -2.8004    1.2425    0.0000 H   0  0  0

+  1  2  2  3

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  1  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1615-02-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.1472   -0.4125    0.0046 C   0  0  0

+    0.7410   -1.4934    0.0034 C   0  0  0

+    0.3519    0.8942    0.0034 C   0  0  0

+   -1.5993   -0.6490    0.0011 C   0  0  0

+    2.0999   -1.2642    0.0010 C   0  0  0

+    1.7136    1.1082    0.0010 C   0  0  0

+   -2.4532    0.3960    0.0022 C   0  0  0

+    2.5872    0.0330   -0.0002 C   0  0  0

+   -3.8961    0.1610   -0.0013 C   0  0  0

+    4.3006    0.3122   -0.0027 Cl  0  0  0

+   -4.7497    1.2057   -0.0001 O   0  0  0

+   -4.3269   -0.9765   -0.0053 O   0  0  0

+    0.3769   -2.4667    0.0000 H   0  0  0

+   -0.3022    1.7016    0.0000 H   0  0  0

+   -1.9674   -1.6208    0.0000 H   0  0  0

+    2.7608   -2.0661    0.0000 H   0  0  0

+    2.0858    2.0784    0.0000 H   0  0  0

+   -2.0851    1.3678    0.0000 H   0  0  0

+   -5.4072    2.0104    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  9 12  2  0

+  6  8  2  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  7 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103393-70-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.3136    0.7929   -0.1223 C   0  0  0

+    0.2406   -0.4897   -0.2701 C   0  0  0

+    1.6895    1.2163    0.1338 C   0  0  0

+   -0.7978    1.7334   -0.1982 C   0  0  0

+    1.6005   -1.0307   -0.1191 C   0  0  0

+   -1.1023   -1.0403   -0.5348 C   0  0  0

+    2.4533   -0.0406    0.1174 C   0  0  0

+    1.8988    2.4982    0.3018 C   0  0  0

+   -1.9912    1.2456   -0.4384 C   0  0  0

+   -0.4630    3.1532    0.0047 C   0  0  0

+    2.1058   -2.4145   -0.1896 C   0  0  0

+   -2.1337   -0.2177   -0.6053 C   0  0  0

+    3.8831   -0.3299    0.3069 C   0  0  0

+    0.7976    3.4728    0.2362 C   0  0  0

+    3.3838   -2.6682   -0.0204 C   0  0  0

+   -3.5019   -0.7887   -0.8757 C   0  0  0

+    4.3258   -1.5668    0.2433 C   0  0  0

+   -4.3035   -1.1943    0.6876 Cl  0  0  0

+   -1.2562   -2.1163    0.0000 H   0  0  0

+    2.9227    2.8630    0.0000 H   0  0  0

+   -2.8631    1.8947    0.0000 H   0  0  0

+   -1.2380    3.9154    0.0000 H   0  0  0

+    1.3987   -3.2400    0.0000 H   0  0  0

+    4.5944    0.4920    0.0000 H   0  0  0

+    1.0540    4.5291    0.0000 H   0  0  0

+    3.7398   -3.6952    0.0000 H   0  0  0

+   -3.3892    0.2924    0.0000 H   0  0  0

+   -4.3971   -0.1722    0.0000 H   0  0  0

+    5.3948   -1.7635    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+ 16 18  1  0

+  5  7  2  0

+  9 12  1  0

+ 10 14  2  0

+ 15 17  1  0

+  6 19  1  0

+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7269-60-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -2.3125   -0.9763    0.0001 N   0  0  0

+   -3.6488   -0.5081    0.0010 O   0  0  0

+   -1.2631   -0.0740    0.0012 C   0  0  0

+    0.0691   -0.5207    0.0004 C   0  0  0

+   -1.4921    1.2352   -0.0025 N   0  0  0

+    1.0919    0.4429    0.0011 C   0  0  0

+    0.6663   -1.7367   -0.0010 N   0  0  0

+   -0.4972    2.1034   -0.0019 C   0  0  0

+    2.2715   -0.2577    0.0001 N   0  0  0

+    0.7655    1.7311    0.0021 N   0  0  0

+    1.9587   -1.5845   -0.0012 C   0  0  0

+    3.6199    0.3151    0.0003 C   0  0  0

+   -2.1228   -1.9809    0.0000 H   0  0  0

+   -4.6137   -0.1700    0.0000 H   0  0  0

+   -0.7157    3.1022    0.0000 H   0  0  0

+    2.6392   -2.3475    0.0000 H   0  0  0

+    4.0196   -0.6259    0.0000 H   0  0  0

+    4.5609    0.7148    0.0000 H   0  0  0

+    3.2202    1.2561    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  4  1  0

+  8  5  2  0

+  9  6  1  0

+ 10  6  2  0

+ 11  7  2  0

+ 12  9  1  0

+  8 10  1  0

+  9 11  1  0

+  1 13  1  0

+  2 14  1  0

+  8 15  1  0

+ 11 16  1  0

+ 12 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1074-12-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.2724    0.1103   -0.0010 C   0  0  0

+   -1.1846    0.3358   -0.0002 C   0  0  0

+    1.1525    1.1982    0.0003 C   0  0  0

+    0.7823   -1.1925    0.0027 C   0  0  0

+   -2.1176   -0.8248   -0.0015 C   0  0  0

+   -1.6236    1.4674    0.0017 O   0  0  0

+    2.5132    0.9792   -0.0006 C   0  0  0

+    2.1460   -1.3950    0.0019 C   0  0  0

+   -3.3113   -0.6400   -0.0008 O   0  0  0

+    3.0101   -0.3134   -0.0027 C   0  0  0

+    0.7813    2.1681    0.0000 H   0  0  0

+    0.1353   -2.0048    0.0000 H   0  0  0

+   -1.7420   -1.7930    0.0000 H   0  0  0

+    3.1675    1.7856    0.0000 H   0  0  0

+    2.5260   -2.3614    0.0000 H   0  0  0

+    4.0363   -0.4722    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+  8 10  2  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5047-01-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.7329   -0.2807    0.0008 C   0  0  0

+   -0.7329   -0.2807    0.0006 C   0  0  0

+    1.4115    0.9588    0.0003 C   0  0  0

+    1.4642   -1.4700   -0.0042 C   0  0  0

+   -1.4115    0.9588   -0.0002 C   0  0  0

+   -1.4642   -1.4700    0.0017 C   0  0  0

+    2.8136    0.9704    0.0005 C   0  0  0

+    0.6741    2.1657   -0.0009 C   0  0  0

+    2.8292   -1.4252   -0.0043 C   0  0  0

+   -2.8136    0.9704   -0.0004 C   0  0  0

+   -0.6741    2.1657   -0.0002 C   0  0  0

+   -2.8292   -1.4252    0.0019 C   0  0  0

+    3.5004   -0.2081    0.0012 C   0  0  0

+   -3.5004   -0.2081    0.0002 C   0  0  0

+    4.9805   -0.1906    0.0009 N   0  3  0

+   -4.9805   -0.1906    0.0000 N   0  3  0

+    5.6019   -1.2381    0.0016 O   0  0  0

+    5.5769    0.8714    0.0001 O   0  5  0

+   -5.6019   -1.2381    0.0005 O   0  0  0

+   -5.5769    0.8714   -0.0007 O   0  5  0

+    0.9694   -2.3902    0.0000 H   0  0  0

+   -0.9694   -2.3902    0.0000 H   0  0  0

+    3.3304    1.8784    0.0000 H   0  0  0

+    1.1852    3.0769    0.0000 H   0  0  0

+    3.3751   -2.3160    0.0000 H   0  0  0

+   -3.3304    1.8784    0.0000 H   0  0  0

+   -1.1852    3.0769    0.0000 H   0  0  0

+   -3.3751   -2.3160    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+ 10 14  2  0

+ 13 15  1  0

+ 14 16  1  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  8 11  2  0

+  9 13  1  0

+ 12 14  1  0

+  4 21  1  0

+  6 22  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-73-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -0.0687   -0.3500    0.0000 C   0  0  0

+   -1.3194    0.5313    0.0000 C   0  0  0

+    1.1791    0.5353    0.0000 C   0  0  0

+   -2.5672   -0.3540    0.0000 C   0  0  0

+    2.3799   -0.3109    0.0000 N   0  0  0

+   -0.8315   -1.2073    0.0000 H   0  0  0

+    0.6968   -1.2048    0.0000 H   0  0  0

+   -0.5566    1.3886    0.0000 H   0  0  0

+   -2.0849    1.3861    0.0000 H   0  0  0

+    1.9419    1.3925    0.0000 H   0  0  0

+    0.4136    1.3901    0.0000 H   0  0  0

+   -3.2312    0.5818    0.0000 H   0  0  0

+   -3.5030   -1.0180    0.0000 H   0  0  0

+   -1.9032   -1.2898    0.0000 H   0  0  0

+    2.2765   -1.4537    0.0000 H   0  0  0

+    3.4213    0.1709    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+79-09-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.3943   -0.0041   -0.0013 C   0  0  0

+   -0.8279    0.8775    0.0013 C   0  0  0

+    1.6187    0.5461   -0.0001 O   0  0  0

+    0.2722   -1.2061    0.0007 O   0  0  0

+   -2.0854    0.0059   -0.0007 C   0  0  0

+   -0.1089    1.6679    0.0000 H   0  0  0

+   -1.5319    1.6812    0.0000 H   0  0  0

+    2.5933    0.9841    0.0000 H   0  0  0

+   -2.6941    0.8841    0.0000 H   0  0  0

+   -2.9636   -0.6028    0.0000 H   0  0  0

+   -1.4767   -0.8723    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25973-55-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 59                          1 V2000

+    1.5132   -0.0865   -0.0151 N   0  0  0

+    0.1138   -0.1064   -0.0334 C   0  0  0

+    2.3213    0.0872    1.1165 N   0  0  0

+    2.3553   -0.2429   -1.1242 N   0  0  0

+   -0.6009    1.0873   -0.1133 C   0  0  0

+   -0.5652   -1.3144    0.0222 C   0  0  0

+    3.6580    0.0432    0.7031 C   0  0  0

+    3.6789   -0.1600   -0.6762 C   0  0  0

+   -1.9851    1.0617   -0.1310 C   0  0  0

+    0.0598    2.2747   -0.1733 O   0  0  0

+   -1.9476   -1.3313    0.0040 C   0  0  0

+    4.8504    0.1588    1.4013 C   0  0  0

+    4.8920   -0.2459   -1.3423 C   0  0  0

+   -2.6557   -0.1466   -0.0699 C   0  0  0

+   -2.7614    2.3505   -0.2173 C   0  0  0

+   -2.6841   -2.6447    0.0645 C   0  0  0

+    6.0557    0.0757    0.7287 C   0  0  0

+    6.0764   -0.1267   -0.6388 C   0  0  0

+   -2.3421    3.2760    0.9266 C   0  0  0

+   -2.4719    3.0314   -1.5565 C   0  0  0

+   -4.2582    2.0525   -0.1097 C   0  0  0

+   -1.6750   -3.7922    0.1402 C   0  0  0

+   -3.5797   -2.6705    1.3047 C   0  0  0

+   -3.5453   -2.8047   -1.1899 C   0  0  0

+   -3.1302    4.5844    0.8389 C   0  0  0

+   -2.4227   -5.1257    0.2016 C   0  0  0

+    2.2310    1.0943    0.0000 H   0  0  0

+    2.2941   -1.2521    0.0000 H   0  0  0

+   -0.0493   -2.1840    0.0000 H   0  0  0

+    0.5514    3.1582    0.0000 H   0  0  0

+    4.8363    1.1698    0.0000 H   0  0  0

+    4.9070   -1.2569    0.0000 H   0  0  0

+   -3.6667   -0.1628    0.0000 H   0  0  0

+    6.7587    0.8024    0.0000 H   0  0  0

+    6.8599   -0.7658    0.0000 H   0  0  0

+   -1.5230    2.6832    0.0000 H   0  0  0

+   -1.5976    3.9602    0.0000 H   0  0  0

+   -1.5414    2.6358    0.0000 H   0  0  0

+   -2.0763    3.9619    0.0000 H   0  0  0

+   -3.4024    3.4270    0.0000 H   0  0  0

+   -4.4556    3.0441    0.0000 H   0  0  0

+   -5.2498    1.8551    0.0000 H   0  0  0

+   -4.0608    1.0609    0.0000 H   0  0  0

+   -0.8544   -4.3828    0.0000 H   0  0  0

+   -0.9957   -3.0433    0.0000 H   0  0  0

+   -3.6088   -1.6598    0.0000 H   0  0  0

+   -4.5904   -2.6996    0.0000 H   0  0  0

+   -3.5506   -3.6812    0.0000 H   0  0  0

+   -3.7300   -1.8106    0.0000 H   0  0  0

+   -4.5394   -2.9894    0.0000 H   0  0  0

+   -3.3606   -3.7988    0.0000 H   0  0  0

+   -2.2641    5.1061    0.0000 H   0  0  0

+   -3.6519    5.4505    0.0000 H   0  0  0

+   -3.9963    4.0627    0.0000 H   0  0  0

+   -3.3046   -4.6312    0.0000 H   0  0  0

+   -2.9172   -6.0076    0.0000 H   0  0  0

+   -1.5408   -5.6202    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

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+  9 14  1  0

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+ 11 16  1  0

+ 12 17  2  0

+ 13 18  2  0

+ 15 19  1  0

+ 15 20  1  0

+ 15 21  1  0

+ 16 22  1  0

+ 16 23  1  0

+ 16 24  1  0

+ 19 25  1  0

+ 22 26  1  0

+  7  8  2  0

+ 11 14  2  0

+ 17 18  1  0

+  3 27  1  0

+  4 28  1  0

+  6 29  1  0

+ 10 30  1  0

+ 12 31  1  0

+ 13 32  1  0

+ 14 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 20 40  1  0

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+ 25 52  1  0

+ 25 53  1  0

+ 25 54  1  0

+ 26 55  1  0

+ 26 56  1  0

+ 26 57  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-30-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.4329   -0.0001    0.0019 C   0  0  0

+   -0.7383   -1.2022    0.0013 C   0  0  0

+   -0.7381    1.2024    0.0014 C   0  0  0

+   -2.8323   -0.0001   -0.0027 N   0  0  0

+    0.6430   -1.2013    0.0002 C   0  0  0

+    0.6428    1.2015    0.0002 C   0  0  0

+    1.3360   -0.0001   -0.0004 C   0  0  0

+    2.6960   -0.0001   -0.0011 O   0  0  0

+   -1.2580   -2.1033    0.0000 H   0  0  0

+   -1.2578    2.1035    0.0000 H   0  0  0

+   -3.3524    0.9008    0.0000 H   0  0  0

+   -3.3524   -0.9010    0.0000 H   0  0  0

+    1.1636   -2.1019    0.0000 H   0  0  0

+    1.1634    2.1021    0.0000 H   0  0  0

+    3.7362   -0.0001    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  7  8  1  0

+  6  7  1  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6270-13-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+   -2.0566    0.0964    0.0838 N   0  0  0

+   -2.8228    1.1303   -0.6163 C   0  0  0

+   -2.7229   -0.7819    1.0486 C   0  0  0

+   -0.6927   -0.0558   -0.1728 C   0  0  0

+   -2.6458    2.4700    0.1014 C   0  0  0

+   -3.0617   -2.1140    0.3765 C   0  0  0

+    0.2271    0.3385    0.7737 C   0  0  0

+   -0.2739   -0.6129   -1.3874 C   0  0  0

+   -1.4093    3.0646   -0.2982 O   0  0  0

+   -1.8964   -2.9404    0.3428 O   0  0  0

+    1.5982    0.1835    0.5123 C   0  0  0

+    1.0471   -0.7732   -1.6634 C   0  0  0

+    2.0132   -0.3765   -0.7220 C   0  0  0

+    2.5675    0.5742    1.4528 C   0  0  0

+    3.3859   -0.5299   -0.9809 C   0  0  0

+    3.8879    0.4102    1.1669 C   0  0  0

+    4.2958   -0.1404   -0.0467 C   0  0  0

+   -3.7274    1.5112    0.0000 H   0  0  0

+   -3.4291    0.3584    0.0000 H   0  0  0

+   -3.2204    0.0642    0.0000 H   0  0  0

+   -3.6947   -0.9201    0.0000 H   0  0  0

+   -2.8934    3.4198    0.0000 H   0  0  0

+   -3.6255    2.4093    0.0000 H   0  0  0

+   -3.9762   -1.7576    0.0000 H   0  0  0

+   -3.5273   -2.9781    0.0000 H   0  0  0

+    0.0841    1.3096    0.0000 H   0  0  0

+   -0.7646   -1.4630    0.0000 H   0  0  0

+   -0.5247    3.4900    0.0000 H   0  0  0

+   -1.0958   -3.5082    0.0000 H   0  0  0

+    1.1787   -1.7459    0.0000 H   0  0  0

+    2.4405    1.5475    0.0000 H   0  0  0

+    3.5293   -1.5009    0.0000 H   0  0  0

+    4.3827    1.2579    0.0000 H   0  0  0

+    5.2432   -0.3969    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  3  1  0

+  7  4  2  0

+  8  4  1  0

+  9  5  1  0

+ 10  6  1  0

+ 11  7  1  0

+ 12  8  2  0

+ 13 11  2  0

+ 14 11  1  0

+ 15 13  1  0

+ 16 14  2  0

+ 17 15  2  0

+ 12 13  1  0

+ 16 17  1  0

+  2 18  1  0

+  2 19  1  0

+  3 20  1  0

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+  5 22  1  0

+  5 23  1  0

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+  6 25  1  0

+  7 26  1  0

+  8 27  1  0

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+ 10 29  1  0

+ 12 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-93-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.9207    0.0000    0.3389 C   0  0  0

+   -0.2242   -1.2492   -0.2045 C   0  0  0

+   -0.2242    1.2492   -0.2045 C   0  0  0

+   -2.2889    0.0000   -0.0737 O   0  0  0

+    1.2406   -1.2492    0.2372 C   0  0  0

+    1.2406    1.2492    0.2372 C   0  0  0

+    1.9371    0.0000   -0.3061 C   0  0  0

+    0.1520    0.0000    0.0000 H   0  0  0

+   -1.2358   -1.6060    0.0000 H   0  0  0

+   -0.0432   -2.3065    0.0000 H   0  0  0

+   -0.0432    2.3065    0.0000 H   0  0  0

+   -1.2358    1.6060    0.0000 H   0  0  0

+   -3.3616    0.0000    0.0000 H   0  0  0

+    1.0596   -2.3065    0.0000 H   0  0  0

+    2.2522   -1.6060    0.0000 H   0  0  0

+    2.2522    1.6060    0.0000 H   0  0  0

+    1.0596    2.3065    0.0000 H   0  0  0

+    2.7623   -0.6854    0.0000 H   0  0  0

+    2.7623    0.6854    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

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+  4 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-00-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  4  3                          1 V2000

+   -0.6898    0.0000    0.0000 C   0  0  0

+    0.5178    0.0000    0.0000 O   0  0  0

+   -1.1427    0.7844    0.0000 H   0  0  0

+   -1.1427   -0.7844    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-98-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    2.1040    0.0000    0.0022 N   0  0  0

+    2.8365   -1.2687    0.0032 C   0  0  0

+    2.8365    1.2687   -0.0046 C   0  0  0

+    0.7040    0.0001    0.0018 C   0  0  0

+    0.0098    1.2024    0.0009 C   0  0  0

+    0.0096   -1.2027   -0.0032 C   0  0  0

+   -1.3713    1.2025    0.0006 C   0  0  0

+   -1.3711   -1.2026   -0.0036 C   0  0  0

+   -2.0655    0.0001    0.0013 C   0  0  0

+   -3.4655    0.0001    0.0010 N   0  0  0

+    1.9344   -1.7895    0.0000 H   0  0  0

+    3.3573   -2.1708    0.0000 H   0  0  0

+    3.7386   -0.7479    0.0000 H   0  0  0

+    3.7386    0.7479    0.0000 H   0  0  0

+    3.3573    2.1708    0.0000 H   0  0  0

+    1.9344    1.7895    0.0000 H   0  0  0

+    0.5306    2.1044    0.0000 H   0  0  0

+    0.5304   -2.1048    0.0000 H   0  0  0

+   -1.8921    2.1046    0.0000 H   0  0  0

+   -1.8919   -2.1046    0.0000 H   0  0  0

+   -3.9863    0.9022    0.0000 H   0  0  0

+   -3.9863   -0.9020    0.0000 H   0  0  0

+  2  1  1  0

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+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-62-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -1.1968    0.9603   -0.0024 C   0  0  0

+   -1.1602   -0.5058   -0.0015 C   0  0  0

+   -0.0002    1.6803   -0.0023 C   0  0  0

+   -2.4440    1.6189    0.0025 C   0  0  0

+   -0.0001   -1.1565   -0.0006 N   0  0  0

+   -2.3806   -1.2086   -0.0011 C   0  0  0

+    1.1970    0.9603   -0.0014 C   0  0  0

+   -3.5887    0.8919    0.0080 C   0  0  0

+    1.1604   -0.5058   -0.0005 C   0  0  0

+   -3.5654   -0.5099   -0.0016 C   0  0  0

+    2.4438    1.6188   -0.0017 C   0  0  0

+    2.3803   -1.2085    0.0009 C   0  0  0

+   -4.7690   -1.2108   -0.0016 N   0  0  0

+    3.5889    0.8916   -0.0012 C   0  0  0

+    3.5656   -0.5098    0.0014 C   0  0  0

+    4.7691   -1.2107    0.0029 N   0  0  0

+   -0.0003    2.7279    0.0000 H   0  0  0

+   -2.4859    2.6656    0.0000 H   0  0  0

+   -2.3860   -2.2562    0.0000 H   0  0  0

+   -4.5109    1.3888    0.0000 H   0  0  0

+    2.4856    2.6655    0.0000 H   0  0  0

+    2.3856   -2.2561    0.0000 H   0  0  0

+   -5.6782   -0.6904    0.0000 H   0  0  0

+   -4.7651   -2.2584    0.0000 H   0  0  0

+    4.5111    1.3885    0.0000 H   0  0  0

+    4.7652   -2.2583    0.0000 H   0  0  0

+    5.6783   -0.6903    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+147293-15-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.3809   -0.4186    0.0018 C   0  0  0

+   -1.0758   -0.4056    0.0012 C   0  0  0

+    1.0594    0.8048    0.0007 C   0  0  0

+    1.3137   -1.3987   -0.0022 N   0  0  0

+   -1.7514    0.8416   -0.0003 C   0  0  0

+   -1.8404   -1.5797    0.0017 C   0  0  0

+    2.4081    0.4946    0.0016 N   0  0  0

+    0.3497    2.0080   -0.0004 C   0  0  0

+    2.5114   -0.8653    0.0007 C   0  0  0

+   -1.0077    2.0351   -0.0013 C   0  0  0

+   -3.1545    0.8408   -0.0013 C   0  0  0

+   -3.2005   -1.4750    0.0006 C   0  0  0

+    3.5188    1.4499    0.0006 C   0  0  0

+    3.6963   -1.5724   -0.0020 N   0  0  0

+   -3.8091   -0.2977   -0.0008 N   0  0  0

+   -1.3811   -2.5105    0.0000 H   0  0  0

+    0.8734    2.9041    0.0000 H   0  0  0

+   -1.5024    2.9476    0.0000 H   0  0  0

+   -3.6745    1.7391    0.0000 H   0  0  0

+   -3.7739   -2.3402    0.0000 H   0  0  0

+    4.1956    0.6630    0.0000 H   0  0  0

+    4.3057    2.1267    0.0000 H   0  0  0

+    2.8420    2.2368    0.0000 H   0  0  0

+    3.6813   -2.6102    0.0000 H   0  0  0

+    4.6026   -1.0665    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  5 10  2  0

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+  7  9  1  0

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+ 10 18  1  0

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+ 12 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+614-48-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    3.6525    0.2884   -0.0008 C   0  0  0

+    2.3277    0.9463   -0.0008 C   0  0  0

+    4.8173    1.0577   -0.0013 C   0  0  0

+    3.7435   -1.1050    0.0053 C   0  0  0

+    1.1098    0.1373   -0.0004 C   0  0  0

+    2.2515    2.1611   -0.0011 O   0  0  0

+    6.0497    0.4378   -0.0014 C   0  0  0

+    4.9819   -1.7120    0.0052 C   0  0  0

+   -0.1001    0.7381   -0.0003 C   0  0  0

+    6.1328   -0.9433   -0.0011 C   0  0  0

+   -1.3255   -0.0757    0.0001 C   0  0  0

+   -2.5805    0.5428    0.0002 C   0  0  0

+   -1.2421   -1.4721   -0.0053 C   0  0  0

+   -3.7241   -0.2270    0.0006 C   0  0  0

+   -2.3955   -2.2278   -0.0048 C   0  0  0

+   -3.6331   -1.6084    0.0010 C   0  0  0

+   -5.0528    0.4252    0.0012 N   0  3  0

+   -6.0643   -0.2534    0.0016 O   0  0  0

+   -5.1348    1.6404    0.0012 O   0  5  0

+    4.7563    2.0939    0.0000 H   0  0  0

+    2.8811   -1.6826    0.0000 H   0  0  0

+    1.1749   -0.8986    0.0000 H   0  0  0

+    6.9166    1.0087    0.0000 H   0  0  0

+    5.0509   -2.7477    0.0000 H   0  0  0

+   -0.1651    1.7740    0.0000 H   0  0  0

+    7.0625   -1.4050    0.0000 H   0  0  0

+   -2.6503    1.5784    0.0000 H   0  0  0

+   -0.3146   -1.9381    0.0000 H   0  0  0

+   -2.3353   -3.2640    0.0000 H   0  0  0

+   -4.4977   -2.1827    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

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+ 11 12  1  0

+ 11 13  2  0

+ 12 14  2  0

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+ 17 18  2  0

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+  8 10  1  0

+ 15 16  2  0

+  3 20  1  0

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+  5 22  1  0

+  7 23  1  0

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+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+94500-46-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    0.4191    0.3111    0.1247 C   0  0  0

+   -0.7507    1.0913    0.1360 C   0  0  0

+    1.6667    0.9241   -0.0884 C   0  0  0

+    0.3299   -1.1338    0.3409 C   0  0  0

+   -2.0075    0.4824    0.3505 C   0  0  0

+   -0.6570    2.4871   -0.0681 C   0  0  0

+    2.8626    0.0837   -0.0942 C   0  0  0

+    1.7347    2.3156   -0.2884 C   0  0  0

+    1.4817   -1.9024    0.3293 C   0  0  0

+   -0.9862   -1.7330    0.5651 C   0  0  0

+   -2.0942   -0.9606    0.5604 C   0  0  0

+   -3.1517    1.2823    0.3565 C   0  0  0

+    0.6101    3.0746   -0.2806 C   0  0  0

+   -1.8286    3.2540   -0.0546 C   0  0  0

+    2.7381   -1.3132    0.1129 C   0  0  0

+    4.1304    0.6409   -0.3012 C   0  0  0

+   -3.4414   -1.5964    0.7884 C   0  0  0

+   -3.0489    2.6473    0.1553 C   0  0  0

+    3.9002   -2.1102    0.1051 C   0  0  0

+    5.2324   -0.1613   -0.3021 C   0  0  0

+   -4.1519   -2.0833   -0.7956 Cl  0  0  0

+    5.1156   -1.5342   -0.0991 C   0  0  0

+    2.6700    2.7838    0.0000 H   0  0  0

+    1.4034   -2.9454    0.0000 H   0  0  0

+   -1.0810   -2.7747    0.0000 H   0  0  0

+   -4.0968    0.8342    0.0000 H   0  0  0

+    0.6934    4.1172    0.0000 H   0  0  0

+   -1.7668    4.2981    0.0000 H   0  0  0

+    4.2427    1.6808    0.0000 H   0  0  0

+   -3.4107   -0.5509    0.0000 H   0  0  0

+   -4.3595   -1.0952    0.0000 H   0  0  0

+   -3.9167    3.2312    0.0000 H   0  0  0

+    3.8173   -3.1529    0.0000 H   0  0  0

+    6.1839    0.2732    0.0000 H   0  0  0

+    5.9750   -2.1304    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  2  0

+  7 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 17 21  1  0

+ 19 22  2  0

+  8 13  2  0

+  9 15  1  0

+ 10 11  2  0

+ 14 18  2  0

+ 20 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+620-89-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.2282   -1.0695   -0.0322 C   0  0  0

+   -1.0614   -1.6064   -0.0527 N   0  0  0

+    0.8477   -0.7917    1.1802 C   0  0  0

+    0.8963   -0.8173   -1.2236 C   0  0  0

+   -2.1716   -0.7585   -0.0310 C   0  0  0

+    2.1224   -0.2615    1.1968 C   0  0  0

+    2.1713   -0.2869   -1.1997 C   0  0  0

+   -3.4489   -1.2871    0.1098 C   0  0  0

+   -2.0006    0.6153   -0.1446 C   0  0  0

+    2.7827   -0.0068    0.0084 C   0  0  0

+   -4.5438   -0.4462    0.1313 C   0  0  0

+   -3.1003    1.4507   -0.1224 C   0  0  0

+    4.1491    0.5621    0.0301 N   0  3  0

+   -4.3703    0.9209    0.0127 C   0  0  0

+    4.7319    0.7870   -1.0155 O   0  0  0

+    4.6907    0.8054    1.0936 O   0  5  0

+   -5.5678    1.8355    0.0365 C   0  0  0

+   -1.1945   -2.6332    0.0000 H   0  0  0

+    0.4370    0.1588    0.0000 H   0  0  0

+    1.2780   -1.7798    0.0000 H   0  0  0

+    1.7372    0.6996    0.0000 H   0  0  0

+    2.5858   -1.2357    0.0000 H   0  0  0

+   -3.5844   -2.3136    0.0000 H   0  0  0

+   -1.0464    1.0172    0.0000 H   0  0  0

+   -5.4996   -0.8445    0.0000 H   0  0  0

+   -2.9689    2.4778    0.0000 H   0  0  0

+   -4.9393    2.6584    0.0000 H   0  0  0

+   -6.3907    2.4640    0.0000 H   0  0  0

+   -6.1963    1.0126    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  2  0

+  6 10  1  0

+  8 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 11 14  1  0

+ 13 15  2  0

+ 13 16  1  0

+ 14 17  1  0

+  7 10  2  0

+ 12 14  2  0

+  2 18  1  0

+  3 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+756-79-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -0.0092   -0.3184   -0.0026 P   0  0  0

+   -0.8418    0.8543    0.7210 O   0  0  0

+    1.5460   -0.1967    0.3956 O   0  0  0

+   -0.6491   -1.9386    0.5348 C   0  0  0

+   -0.1539   -0.1929   -1.4702 O   0  0  0

+   -2.0385    1.0398   -0.0378 C   0  0  0

+    1.9782    1.1007   -0.0190 C   0  0  0

+   -1.6277   -1.5521    0.0000 H   0  0  0

+   -1.0356   -2.9172    0.0000 H   0  0  0

+    0.3295   -2.3251    0.0000 H   0  0  0

+   -1.8773    2.0795    0.0000 H   0  0  0

+   -3.0782    1.2010    0.0000 H   0  0  0

+   -2.1997    0.0001    0.0000 H   0  0  0

+    2.9764    0.7682    0.0000 H   0  0  0

+    2.3107    2.0989    0.0000 H   0  0  0

+    0.9800    1.4332    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  4 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+555-66-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 44                          1 V2000

+    2.5315    0.2656   -0.6897 C   0  0  0

+    3.3724   -0.6561   -0.0934 C   0  0  0

+    2.9100    1.5916   -0.7837 C   0  0  0

+    1.2021   -0.1778   -1.2439 C   0  0  0

+    4.5972   -0.2512    0.4114 C   0  0  0

+    4.1314    2.0024   -0.2818 C   0  0  0

+    0.1331   -0.0668   -0.1549 C   0  0  0

+    4.9785    1.0842    0.3167 C   0  0  0

+    5.4252   -1.1563    0.9985 O   0  0  0

+   -1.1963   -0.5103   -0.7091 C   0  0  0

+    6.1799    1.4865    0.8107 O   0  0  0

+    4.7612   -2.4204    0.9428 C   0  0  0

+   -2.3851   -0.4963    0.1429 C   0  0  0

+   -1.2805   -0.8789   -1.8619 O   0  0  0

+   -3.5624   -0.8890   -0.3479 C   0  0  0

+   -4.7873   -0.8745    0.5299 C   0  0  0

+   -5.8402    0.0537   -0.0790 C   0  0  0

+   -7.0838    0.0683    0.8122 C   0  0  0

+   -8.1366    0.9965    0.2033 C   0  0  0

+   -9.3802    1.0111    1.0945 C   0  0  0

+    3.1335   -1.5689    0.0000 H   0  0  0

+    2.2275    2.2432    0.0000 H   0  0  0

+    0.7620   -1.0125    0.0000 H   0  0  0

+    1.8127   -0.8972    0.0000 H   0  0  0

+    4.3654    2.9165    0.0000 H   0  0  0

+    0.5732    0.7679    0.0000 H   0  0  0

+   -0.4775    0.6526    0.0000 H   0  0  0

+    7.0747    1.7861    0.0000 H   0  0  0

+    3.9258   -1.9816    0.0000 H   0  0  0

+    4.3224   -3.2558    0.0000 H   0  0  0

+    5.5966   -2.8592    0.0000 H   0  0  0

+   -2.5309    0.4360    0.0000 H   0  0  0

+   -3.4167   -1.8213    0.0000 H   0  0  0

+   -5.5860   -1.3770    0.0000 H   0  0  0

+   -4.5312   -1.7827    0.0000 H   0  0  0

+   -5.0415    0.5562    0.0000 H   0  0  0

+   -6.0964    0.9619    0.0000 H   0  0  0

+   -7.8825   -0.4342    0.0000 H   0  0  0

+   -6.8277   -0.8399    0.0000 H   0  0  0

+   -7.3379    1.4990    0.0000 H   0  0  0

+   -8.3927    1.9047    0.0000 H   0  0  0

+   -9.3691    1.9546    0.0000 H   0  0  0

+  -10.3237    1.0222    0.0000 H   0  0  0

+   -9.3913    0.0676    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  7 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 15 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+  6  8  2  0

+  2 21  1  0

+  3 22  1  0

+  4 23  1  0

+  4 24  1  0

+  6 25  1  0

+  7 26  1  0

+  7 27  1  0

+ 11 28  1  0

+ 12 29  1  0

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+ 15 33  1  0

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+ 16 35  1  0

+ 17 36  1  0

+ 17 37  1  0

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+ 18 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 20 42  1  0

+ 20 43  1  0

+ 20 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64371-62-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    3.5436   -0.1439   -0.1226 C   0  0  0

+    2.0374   -0.1059   -0.0907 C   0  0  0

+    4.2902    1.1915   -0.1401 C   0  0  0

+    4.2465    0.3546    1.0174 O   0  0  0

+    4.1621   -1.3165   -0.8863 C   0  0  0

+    1.3354   -1.1260    0.5251 C   0  0  0

+    1.3622    0.9521   -0.6727 C   0  0  0

+   -0.0443   -1.0963    0.5573 C   0  0  0

+   -0.0169    0.9919   -0.6464 C   0  0  0

+   -0.7295   -0.0362   -0.0322 C   0  0  0

+   -2.2127    0.0009   -0.0012 C   0  0  0

+   -2.8777    1.2064    0.2150 C   0  0  0

+   -2.9454   -1.1682   -0.1940 C   0  0  0

+   -4.2571    1.2352    0.2424 C   0  0  0

+   -4.3249   -1.1278   -0.1646 C   0  0  0

+   -4.9797    0.0704    0.0556 C   0  0  0

+    5.2686    1.5145    0.0000 H   0  0  0

+    3.6344    1.9862    0.0000 H   0  0  0

+    3.2508   -1.7972    0.0000 H   0  0  0

+    4.6428   -2.2278    0.0000 H   0  0  0

+    5.0734   -0.8358    0.0000 H   0  0  0

+    1.8050   -2.0431    0.0000 H   0  0  0

+    1.8704    1.8484    0.0000 H   0  0  0

+   -0.5466   -1.9959    0.0000 H   0  0  0

+   -0.4816    1.9115    0.0000 H   0  0  0

+   -2.3446    2.0881    0.0000 H   0  0  0

+   -2.4597   -2.0769    0.0000 H   0  0  0

+   -4.7486    2.1407    0.0000 H   0  0  0

+   -4.8634   -2.0062    0.0000 H   0  0  0

+   -6.0096    0.0988    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  6  8  1  0

+  7  9  2  0

+  8 10  2  0

+ 10 11  1  0

+ 11 12  1  0

+ 11 13  2  0

+ 12 14  2  0

+ 13 15  1  0

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+  3  4  1  0

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+ 15 16  2  0

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+  5 19  1  0

+  5 20  1  0

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+  6 22  1  0

+  7 23  1  0

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+  9 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112-53-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 38                          1 V2000

+   -0.1780   -0.4036   -0.0044 C   0  0  0

+   -1.4284    0.4781    0.0052 C   0  0  0

+    1.0701    0.4813    0.0053 C   0  0  0

+   -2.6765   -0.4068   -0.0044 C   0  0  0

+    2.3204   -0.4004   -0.0044 C   0  0  0

+   -3.9268    0.4749    0.0052 C   0  0  0

+    3.5685    0.4846    0.0053 C   0  0  0

+   -5.1749   -0.4100   -0.0045 C   0  0  0

+    4.8189   -0.3971   -0.0043 C   0  0  0

+   -6.4253    0.4717    0.0051 C   0  0  0

+    6.0670    0.4878    0.0053 C   0  0  0

+   -7.6734   -0.4132   -0.0045 C   0  0  0

+    7.2348   -0.3357   -0.0037 O   0  0  0

+   -0.9410   -1.2606    0.0000 H   0  0  0

+    0.5872   -1.2586    0.0000 H   0  0  0

+   -0.6654    1.3351    0.0000 H   0  0  0

+   -2.1936    1.3331    0.0000 H   0  0  0

+    1.8332    1.3383    0.0000 H   0  0  0

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+   -3.4396   -1.2638    0.0000 H   0  0  0

+   -1.9113   -1.2619    0.0000 H   0  0  0

+    1.5574   -1.2574    0.0000 H   0  0  0

+    3.0857   -1.2554    0.0000 H   0  0  0

+   -3.1637    1.3319    0.0000 H   0  0  0

+   -4.6920    1.3300    0.0000 H   0  0  0

+    4.3315    1.3416    0.0000 H   0  0  0

+    2.8032    1.3396    0.0000 H   0  0  0

+   -5.9379   -1.2670    0.0000 H   0  0  0

+   -4.4097   -1.2650    0.0000 H   0  0  0

+    4.0559   -1.2541    0.0000 H   0  0  0

+    5.5841   -1.2521    0.0000 H   0  0  0

+   -5.6623    1.3287    0.0000 H   0  0  0

+   -7.1905    1.3267    0.0000 H   0  0  0

+    6.8301    1.3448    0.0000 H   0  0  0

+    5.3018    1.3428    0.0000 H   0  0  0

+   -8.3371    0.5229    0.0000 H   0  0  0

+   -8.6095   -1.0769    0.0000 H   0  0  0

+   -7.0097   -1.3493    0.0000 H   0  0  0

+    8.1726   -0.9970    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  3  5  1  0

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+  5  7  1  0

+  6  8  1  0

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+  1 14  1  0

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+  8 28  1  0

+  8 29  1  0

+  9 30  1  0

+  9 31  1  0

+ 10 32  1  0

+ 10 33  1  0

+ 11 34  1  0

+ 11 35  1  0

+ 12 36  1  0

+ 12 37  1  0

+ 12 38  1  0

+ 13 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13306-69-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+    1.6741   -0.2430    0.1819 P   0  0  0

+    0.6262   -0.4931    1.3783 O   0  0  0

+    3.1678   -0.5351    0.7070 O   0  0  0

+    1.3339   -1.2290   -1.0445 O   0  0  0

+    1.5520    1.5261   -0.3911 S   0  0  0

+   -0.6025   -0.1583    0.9010 C   0  0  0

+    4.0548   -0.1950   -0.3605 C   0  0  0

+    0.6114   -0.4578   -2.0063 C   0  0  0

+   -1.5081   -1.1523    0.5599 C   0  0  0

+   -0.9515    1.1765    0.7610 C   0  0  0

+   -2.7561   -0.8132    0.0757 C   0  0  0

+   -2.1994    1.5175    0.2768 C   0  0  0

+   -3.1045    0.5233   -0.0698 C   0  0  0

+   -3.7395   -1.8932   -0.2953 C   0  0  0

+   -4.3687    0.8677   -0.5610 N   0  0  0

+    4.4066   -1.1126    0.0000 H   0  0  0

+    4.9724    0.1568    0.0000 H   0  0  0

+    3.7030    0.7226    0.0000 H   0  0  0

+    1.3286    0.2141    0.0000 H   0  0  0

+   -0.0605    0.2594    0.0000 H   0  0  0

+   -0.1058   -1.1297    0.0000 H   0  0  0

+   -1.2334   -2.0958    0.0000 H   0  0  0

+   -0.2528    1.8675    0.0000 H   0  0  0

+   -2.4736    2.4612    0.0000 H   0  0  0

+   -4.4661   -1.2316    0.0000 H   0  0  0

+   -4.4011   -2.6198    0.0000 H   0  0  0

+   -3.0129   -2.5548    0.0000 H   0  0  0

+   -4.6191    1.8180    0.0000 H   0  0  0

+   -5.0665    0.1757    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

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+ 12 13  2  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117-08-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+   -1.1269    0.7057   -0.0023 C   0  0  0

+   -1.1269   -0.7058   -0.0020 C   0  0  0

+    0.0768    1.3958   -0.0013 C   0  0  0

+   -2.5453    1.1107    0.0024 C   0  0  0

+    0.0769   -1.3958   -0.0009 C   0  0  0

+   -2.5452   -1.1108   -0.0032 C   0  0  0

+    1.2742    0.6919   -0.0002 C   0  0  0

+    0.0862    3.1317   -0.0022 Cl  0  0  0

+   -3.3088   -0.0001    0.0051 O   0  0  0

+   -2.9562    2.2533    0.0039 O   0  0  0

+    1.2742   -0.6919    0.0000 C   0  0  0

+    0.0864   -3.1317   -0.0001 Cl  0  0  0

+   -2.9561   -2.2534   -0.0033 O   0  0  0

+    2.7809    1.5541    0.0003 Cl  0  0  0

+    2.7810   -1.5539    0.0020 Cl  0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  7 14  1  0

+ 11 15  1  0

+  6  9  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2314-61-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.4244   -0.3118    0.0574 C   0  0  0

+   -1.8827   -0.0685    0.0183 C   0  0  0

+    0.7682    0.9624   -0.1820 S   0  0  0

+    0.1024   -1.5065    0.2813 C   0  0  0

+   -2.7313   -0.9930   -0.5925 C   0  0  0

+   -2.4166    1.0836    0.5968 C   0  0  0

+    2.3477    0.1579   -0.0393 C   0  0  0

+    1.8639   -1.5239    0.2768 S   0  0  0

+   -4.0905   -0.7602   -0.6256 C   0  0  0

+   -3.7780    1.3047    0.5568 C   0  0  0

+    3.9185    0.8262   -0.1690 S   0  0  0

+   -4.6131    0.3871   -0.0551 C   0  0  0

+   -0.4668   -2.3702    0.0000 H   0  0  0

+   -2.3968   -1.9719    0.0000 H   0  0  0

+   -1.7915    1.9078    0.0000 H   0  0  0

+   -4.7219   -1.5796    0.0000 H   0  0  0

+   -4.1188    2.2814    0.0000 H   0  0  0

+   -5.6351    0.5473    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  2  0

+  9 12  1  0

+  7  8  1  0

+ 10 12  2  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6755-16-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -0.6069    0.0218   -0.0035 C   0  0  0

+   -1.7772   -0.6501   -0.0028 O   0  0  0

+   -0.8954    1.3708   -0.0010 C   0  0  0

+    0.6864   -0.5549   -0.0011 C   0  0  0

+   -2.7932    0.2238    0.0001 C   0  0  0

+   -2.2943    1.4799    0.0012 C   0  0  0

+    1.7841    0.2416   -0.0022 C   0  0  0

+   -4.2308   -0.1298    0.0010 N   0  3  0

+    3.0769   -0.3349    0.0003 C   0  0  0

+   -5.0741    0.7490    0.0037 O   0  0  0

+   -4.5702   -1.2996   -0.0010 O   0  5  0

+    4.1677    0.4567   -0.0008 N   0  0  0

+    3.2034   -1.5461    0.0034 O   0  0  0

+    5.5057   -0.1400    0.0017 C   0  0  0

+    6.5589    0.9698   -0.0002 C   0  0  0

+   -0.2255    2.1362    0.0000 H   0  0  0

+    0.7921   -1.5666    0.0000 H   0  0  0

+   -2.8324    2.3431    0.0000 H   0  0  0

+    1.6784    1.2533    0.0000 H   0  0  0

+    4.0620    1.4684    0.0000 H   0  0  0

+    4.9891   -1.0162    0.0000 H   0  0  0

+    6.3179   -0.7523    0.0000 H   0  0  0

+    7.2967    0.2696    0.0000 H   0  0  0

+    7.2591    1.7076    0.0000 H   0  0  0

+    5.8211    1.6700    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+  4  7  2  0

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+  5  6  2  0

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+  4 17  1  0

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+ 12 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100333-37-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.1007    0.0301   -0.0032 C   0  0  0

+   -1.2340   -0.9102   -0.0528 C   0  0  0

+   -0.6277    1.3414    0.0811 C   0  0  0

+    1.2893   -0.1465   -0.0292 C   0  0  0

+   -2.3942   -0.1292    0.0007 C   0  0  0

+   -1.4080   -2.2827   -0.1340 C   0  0  0

+   -2.1001    1.2360    0.0815 C   0  0  0

+    0.2420    2.4259    0.1443 C   0  0  0

+    2.1369    0.9599    0.0365 C   0  0  0

+    1.8779   -1.4971   -0.1249 C   0  0  0

+   -3.6905   -0.6507   -0.0240 C   0  0  0

+   -2.6943   -2.8180   -0.1588 C   0  0  0

+   -3.1766    2.1045    0.1387 C   0  0  0

+    1.6098    2.2332    0.1237 C   0  0  0

+    3.6284    0.7493    0.0076 C   0  0  0

+    3.1425   -1.6856    0.2287 C   0  0  0

+   -3.8237   -2.0470   -0.1067 C   0  0  0

+   -4.7560    0.2640    0.0355 C   0  0  0

+   -4.4765    1.6007    0.1145 C   0  0  0

+    3.9830   -0.5463    0.7345 C   0  0  0

+    4.0722    0.6715   -1.3485 O   0  0  0

+    5.3649   -0.8455    0.5276 O   0  0  0

+   -0.5757   -2.9171    0.0000 H   0  0  0

+   -0.1437    3.3987    0.0000 H   0  0  0

+    1.2413   -2.3277    0.0000 H   0  0  0

+   -2.8012   -3.8590    0.0000 H   0  0  0

+   -3.0155    3.1385    0.0000 H   0  0  0

+    2.2507    3.0605    0.0000 H   0  0  0

+    3.7919    1.7829    0.0000 H   0  0  0

+    3.5439   -2.6521    0.0000 H   0  0  0

+   -4.7712   -2.4912    0.0000 H   0  0  0

+   -5.7468   -0.0728    0.0000 H   0  0  0

+   -5.2745    2.2777    0.0000 H   0  0  0

+    2.9542   -0.3546    0.0000 H   0  0  0

+    5.1030    0.4908    0.0000 H   0  0  0

+    6.3877   -1.0669    0.0000 H   0  0  0

+  1  2  1  0

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+  5  7  1  0

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+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4394-00-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -2.2666    0.6139    0.6331 C   0  0  0

+   -2.9997   -0.4515    0.0810 C   0  0  0

+   -0.9772    0.4001    1.0861 N   0  0  0

+   -2.8022    1.8220    0.7164 N   0  0  0

+   -4.3027   -0.2102   -0.3706 C   0  0  0

+   -2.4078   -1.7965   -0.0198 C   0  0  0

+    0.1000    0.4975    0.2006 C   0  0  0

+   -4.0255    2.0701    0.2916 C   0  0  0

+   -4.8124    1.0706   -0.2529 C   0  0  0

+   -3.0622   -2.7730   -0.6790 O   0  0  0

+   -1.3295   -2.0258    0.4915 O   0  0  0

+    1.3811    0.1682    0.6240 C   0  0  0

+   -0.1094    0.9184   -1.1067 C   0  0  0

+    2.4432    0.2656   -0.2536 C   0  0  0

+    0.9568    1.0135   -1.9789 C   0  0  0

+    2.2322    0.6908   -1.5522 C   0  0  0

+    3.8336   -0.0914    0.2050 C   0  0  0

+    4.7331    0.0856   -0.8518 F   0  0  0

+    4.1995    0.7358    1.2723 F   0  0  0

+    3.8591   -1.4271    0.6203 F   0  0  0

+   -1.0126   -0.5533    0.0000 H   0  0  0

+   -4.9082   -0.9475    0.0000 H   0  0  0

+   -4.3543    2.9657    0.0000 H   0  0  0

+   -5.7566    1.2076    0.0000 H   0  0  0

+   -3.5933   -3.5656    0.0000 H   0  0  0

+    1.3048   -0.7828    0.0000 H   0  0  0

+   -0.9420    1.3842    0.0000 H   0  0  0

+    1.0325    1.9646    0.0000 H   0  0  0

+    2.8314    1.4333    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  2  0

+  2  5  2  0

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+  8  9  2  0

+ 15 16  1  0

+  3 21  1  0

+  5 22  1  0

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+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19408-84-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 51                          1 V2000

+    3.5394    0.7438   -0.2882 C   0  0  0

+    4.1828   -0.4313   -0.6293 C   0  0  0

+    4.0943    1.5913    0.6527 C   0  0  0

+    2.2335    1.1048   -0.9479 C   0  0  0

+    5.3865   -0.7619   -0.0278 C   0  0  0

+    5.2949    1.2674    1.2566 C   0  0  0

+    1.1231    0.5563   -0.1654 N   0  0  0

+    5.9450    0.0911    0.9192 C   0  0  0

+    6.0204   -1.9178   -0.3618 O   0  0  0

+   -0.1478    0.7551   -0.5679 C   0  0  0

+    7.1261   -0.2290    1.5124 O   0  0  0

+    5.2090   -2.5648   -1.3441 C   0  0  0

+   -1.2900    0.1909    0.2371 C   0  0  0

+   -0.3721    1.3880   -1.5778 O   0  0  0

+   -2.6159    0.5574   -0.4327 C   0  0  0

+   -3.7756   -0.0155    0.3845 C   0  0  0

+   -5.1014    0.3511   -0.2853 C   0  0  0

+   -6.2611   -0.2218    0.5319 C   0  0  0

+   -7.5870    0.1447   -0.1379 C   0  0  0

+   -8.7467   -0.4281    0.6794 C   0  0  0

+  -10.0726   -0.0616    0.0095 C   0  0  0

+   -8.6160   -1.9507    0.7523 C   0  0  0

+    3.5812   -1.1923    0.0000 H   0  0  0

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+   -5.7552    1.0678    0.0000 H   0  0  0

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+   -8.8383    0.5377    0.0000 H   0  0  0

+   -9.8141    0.8734    0.0000 H   0  0  0

+  -11.0076    0.1969    0.0000 H   0  0  0

+  -10.3311   -0.9966    0.0000 H   0  0  0

+   -9.5825   -2.0337    0.0000 H   0  0  0

+   -8.5330   -2.9172    0.0000 H   0  0  0

+   -7.6495   -1.8677    0.0000 H   0  0  0

+  1  2  2  0

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+ 21 47  1  0

+ 21 48  1  0

+ 22 49  1  0

+ 22 50  1  0

+ 22 51  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-37-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.8172    0.0713    0.4619 C   0  0  0

+    0.0014   -1.2153    0.2560 C   0  0  0

+    0.0597    1.2367   -0.0409 C   0  0  0

+   -2.0978    0.0000   -0.3721 C   0  0  0

+    1.3471   -0.7868   -0.3648 C   0  0  0

+    1.5069    0.6941    0.0599 C   0  0  0

+   -1.3381    1.0464    0.0000 H   0  0  0

+   -0.9789   -1.7263    0.0000 H   0  0  0

+    0.4262   -2.2359    0.0000 H   0  0  0

+    0.5447    2.2301    0.0000 H   0  0  0

+   -0.8830    1.8142    0.0000 H   0  0  0

+   -2.1593    1.1038    0.0000 H   0  0  0

+   -3.2016   -0.0615    0.0000 H   0  0  0

+   -2.0363   -1.1038    0.0000 H   0  0  0

+    1.5338   -1.8764    0.0000 H   0  0  0

+    2.4521   -0.7524    0.0000 H   0  0  0

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+    1.8071    1.7581    0.0000 H   0  0  0

+  1  2  1  0

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+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20562-03-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+133141                          1 V2000

+   -7.3643   -0.6506    0.8937 C   0  0  2

+   -8.8406   -0.9007    1.1653 C   0  0  0

+   -7.3839    0.3276   -0.3071 C   0  0  0

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+   -8.5065    1.2983    0.0477 C   0  0  0

+   -5.1456   -1.3632    0.1204 C   0  0  0

+  -10.6450    0.1575   -0.0323 N   0  0  0

+  -10.8637   -1.3081    0.0187 C   0  0  0

+   -8.7256   -1.6122   -1.2478 C   0  0  0

+   -5.0374    0.1269    0.4482 C   0  0  0

+   -6.0092    2.3808    0.1047 C   0  0  0

+  -11.9169    0.7537    0.3241 C   0  0  0

+  -11.6432   -1.6830   -1.2307 C   0  0  0

+   -3.6178    0.6208    0.2120 C   0  0  2

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+  -14.2701    1.0532   -0.4813 C   0  0  0

+   -2.1642    2.7420    0.1874 C   0  0  0

+   -2.0112    1.0572   -1.6557 C   0  0  0

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+ 60133  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-69-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+    4.4619   -0.0303   -0.0009 C   0  0  0

+    3.3059    0.8805   -0.0005 C   0  0  0

+    5.7621    0.4844   -0.0006 C   0  0  0

+    4.2658   -1.4152    0.0042 C   0  0  0

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+    0.9042    1.2851   -0.0005 C   0  0  0

+    6.6378   -1.7446   -0.0018 C   0  0  0

+   -0.3486    0.7849   -0.0008 O   0  0  0

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+   -1.2395    1.9022   -0.0003 C   0  0  0

+   -2.6636    1.4091   -0.0006 C   0  0  0

+   -2.9143    0.1074   -0.0013 C   0  0  0

+   -4.3111   -0.3762   -0.0017 C   0  0  0

+   -4.5783   -1.7455   -0.0024 C   0  0  0

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+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+76180-96-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.3737   -0.4269   -0.0014 C   0  0  0

+   -1.0861   -0.4336   -0.0006 C   0  0  0

+    1.0370    0.8038   -0.0007 C   0  0  0

+    1.3123   -1.3927    0.0026 N   0  0  0

+   -1.7785    0.8016    0.0008 C   0  0  0

+   -1.8172   -1.6284   -0.0016 C   0  0  0

+    2.3905    0.5094   -0.0017 N   0  0  0

+    0.3112    1.9962    0.0007 C   0  0  0

+    2.5061   -0.8494   -0.0006 C   0  0  0

+   -1.0462    2.0040    0.0014 C   0  0  0

+   -3.1152    0.8105    0.0011 N   0  0  0

+   -3.1838   -1.5498   -0.0013 C   0  0  0

+    3.4912    1.4762   -0.0016 C   0  0  0

+    3.6967   -1.5460    0.0021 N   0  0  0

+   -3.8052   -0.3052    0.0001 C   0  0  0

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+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+70897-83-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 23                          1 V2000

+   -3.0959    0.0000    0.8464 O   0  0  0

+   -2.0889    0.0000   -0.1675 C   0  0  0

+   -1.1686    1.2209    0.0228 C   0  0  0

+   -1.1686   -1.2209    0.0228 C   0  0  0

+    0.2265    0.7724   -0.4206 C   0  0  0

+    0.2265   -0.7724   -0.4206 C   0  0  0

+    0.4023    0.0000   -1.6025 O   0  0  0

+    1.4042    1.4562    0.2257 C   0  0  0

+    1.4042   -1.4562    0.2258 C   0  0  0

+    2.3767    0.7311    0.7594 C   0  0  0

+    2.3767   -0.7311    0.7595 C   0  0  0

+   -4.1173    0.0000    0.0000 H   0  0  0

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+   -2.0476    1.7410    0.0000 H   0  0  0

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+ 10 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106671-91-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -0.3785    0.2559    0.0271 C   0  0  0

+   -1.2717   -0.9015   -0.0826 C   0  0  0

+    1.0985    0.2347    0.0236 C   0  0  0

+   -1.1547    1.3253    0.1241 N   0  0  0

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+   -2.4250    0.9724    0.0880 C   0  0  0

+   -3.8681   -0.8583   -0.0767 C   0  0  0

+   -1.7844   -3.0213   -0.2841 O   0  0  0

+    3.1913    1.1977   -0.6573 C   0  0  0

+    3.1657   -0.7848    0.7006 C   0  0  0

+   -4.0506    1.5637    0.1385 S   0  0  0

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+    5.6039    0.1706    0.0143 Cl  0  0  0

+    1.3577    2.1334    0.0000 H   0  0  0

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+   -4.0386   -1.8618    0.0000 H   0  0  0

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+ 15 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+62826-28-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.0984   -0.4108    0.3923 C   0  0  0

+   -1.0948    0.5072    0.0928 C   0  0  0

+    1.2714    0.0687    0.7982 C   0  0  0

+   -0.3647   -1.7643    0.3235 C   0  0  0

+   -2.3548    0.0627   -0.2801 C   0  0  0

+   -0.8370    1.8395    0.1652 O   0  0  0

+    2.1463    0.2264   -0.4470 C   0  0  0

+   -1.6231   -2.2049   -0.0434 C   0  0  0

+   -2.6146   -1.2924   -0.3524 C   0  0  0

+   -2.0438    2.5140   -0.1961 C   0  0  0

+    3.5370    0.7132   -0.0348 C   0  0  0

+    3.2686   -0.6534   -0.3551 O   0  0  0

+    1.5697    1.0594    0.0000 H   0  0  0

+    0.5238    0.7839    0.0000 H   0  0  0

+    0.4171   -2.4419    0.0000 H   0  0  0

+   -3.1390    0.7375    0.0000 H   0  0  0

+    1.8828    1.2269    0.0000 H   0  0  0

+   -1.8323   -3.2181    0.0000 H   0  0  0

+   -3.5971   -1.6166    0.0000 H   0  0  0

+   -1.5390    3.4171    0.0000 H   0  0  0

+   -2.9469    3.0188    0.0000 H   0  0  0

+   -2.5486    1.6109    0.0000 H   0  0  0

+    4.5714    0.6956    0.0000 H   0  0  0

+    3.3723    1.7346    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  8  9  2  0

+ 11 12  1  0

+  3 13  1  0

+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1663-39-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -0.2303   -0.7669    0.0903 O   0  0  0

+   -1.5041   -0.0772   -0.0099 C   0  0  0

+    0.9208   -0.0675    0.0378 C   0  0  0

+   -1.5594    0.7032   -1.3248 C   0  0  0

+   -2.6418   -1.0996    0.0246 C   0  0  0

+   -1.6533    0.8917    1.1648 C   0  0  0

+    2.2091   -0.7739    0.0111 C   0  0  0

+    0.8932    1.1473    0.0126 O   0  0  0

+    3.3456   -0.0834   -0.0408 C   0  0  0

+   -0.5581    0.7742    0.0000 H   0  0  0

+   -1.6304    1.7045    0.0000 H   0  0  0

+   -2.5607    0.6322    0.0000 H   0  0  0

+   -3.3127   -0.3530    0.0000 H   0  0  0

+   -3.3884   -1.7705    0.0000 H   0  0  0

+   -1.9709   -1.8462    0.0000 H   0  0  0

+   -0.6612    1.0445    0.0000 H   0  0  0

+   -1.8061    1.8838    0.0000 H   0  0  0

+   -2.6454    0.7389    0.0000 H   0  0  0

+    2.2314   -1.7774    0.0000 H   0  0  0

+    4.2259   -0.5657    0.0000 H   0  0  0

+    3.3232    0.9201    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  2  1  0

+  6  2  1  0

+  7  3  1  0

+  8  3  2  0

+  9  7  2  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+  7 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+616-44-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -1.0809    0.0625    0.0021 C   0  0  0

+   -0.5127   -1.1976    0.0011 C   0  0  0

+   -0.2705    1.1490    0.0015 C   0  0  0

+   -2.5790    0.2258   -0.0024 C   0  0  0

+    0.8382   -1.3095   -0.0005 C   0  0  0

+    1.3504    0.4007   -0.0006 S   0  0  0

+   -1.1377   -2.0826    0.0000 H   0  0  0

+   -0.5372    2.1991    0.0000 H   0  0  0

+   -2.4616    1.3029    0.0000 H   0  0  0

+   -3.6561    0.3432    0.0000 H   0  0  0

+   -2.6964   -0.8513    0.0000 H   0  0  0

+    1.4487   -2.2046    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+74940-61-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+   -0.7434    1.4923   -0.0119 P   0  0  0

+   -0.2247   -0.2154   -0.3836 C   0  0  0

+    0.4676    2.5032   -0.3340 O   0  0  0

+   -2.0178    1.8754   -0.9181 O   0  0  0

+   -1.1061    1.5973    1.4192 O   0  0  0

+    0.9425   -0.5507    0.4124 O   0  0  0

+   -1.3647   -1.1791   -0.0482 C   0  0  0

+    1.2649    2.5830    0.8492 C   0  0  0

+   -2.4619    3.1621   -0.4833 C   0  0  0

+    2.1734   -0.3216   -0.0717 C   0  0  0

+   -0.8517   -2.8680   -0.4158 Cl  0  0  0

+   -1.7718   -1.0423    1.7029 Cl  0  0  0

+   -2.8141   -0.7626   -1.0364 Cl  0  0  0

+    3.3848   -0.7316    0.7254 C   0  0  0

+    2.3100    0.2134   -1.1464 O   0  0  0

+    4.8789   -0.2930   -0.1837 Cl  0  0  0

+   -0.0156   -1.1913    0.0000 H   0  0  0

+    1.3643    1.5899    0.0000 H   0  0  0

+    2.2580    2.6824    0.0000 H   0  0  0

+    1.1655    3.5761    0.0000 H   0  0  0

+   -1.5185    3.4877    0.0000 H   0  0  0

+   -2.7875    4.1055    0.0000 H   0  0  0

+   -3.4053    2.8365    0.0000 H   0  0  0

+    2.7840   -1.5286    0.0000 H   0  0  0

+    3.9526   -1.5524    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  4  9  1  0

+  6 10  1  0

+  7 11  1  0

+  7 12  1  0

+  7 13  1  0

+ 10 14  1  0

+ 10 15  2  0

+ 14 16  1  0

+  2 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 14 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+63041-90-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.7398    0.1503   -0.0026 C   0  0  0

+   -2.1406    0.0226    0.0013 C   0  0  0

+   -0.1558    1.4402    0.0054 C   0  0  0

+    0.0695   -1.0088   -0.0203 C   0  0  0

+   -2.9554    1.1764    0.0126 C   0  0  0

+   -2.7311   -1.2634   -0.0067 C   0  0  0

+    1.3148    1.5637    0.0012 C   0  0  0

+   -0.9704    2.5675    0.0175 C   0  0  0

+    1.5263   -0.8750   -0.0238 C   0  0  0

+   -0.5322   -2.2722   -0.0339 C   0  0  0

+   -2.3521    2.4453    0.0199 C   0  0  0

+   -4.3583    1.0364    0.0160 C   0  0  0

+   -1.9174   -2.3985   -0.0180 C   0  0  0

+   -4.1905   -1.3664   -0.0024 C   0  0  0

+    2.1186    0.3960   -0.0106 C   0  0  0

+    1.9175    2.8135    0.0083 C   0  0  0

+    2.3791   -2.0870   -0.0419 N   0  3  0

+   -4.9494   -0.2170    0.0083 C   0  0  0

+    3.5225    0.5250   -0.0150 C   0  0  0

+    3.3039    2.9165    0.0039 C   0  0  0

+    2.7258   -2.5720   -1.1040 O   0  0  0

+    2.7908   -2.6812    1.1757 O   0  5  0

+    4.0956    1.7809   -0.0077 C   0  0  0

+   -0.5335    3.5241    0.0000 H   0  0  0

+    0.0691   -3.1350    0.0000 H   0  0  0

+   -2.9525    3.3087    0.0000 H   0  0  0

+   -4.9649    1.8955    0.0000 H   0  0  0

+   -2.3548   -3.3549    0.0000 H   0  0  0

+   -4.6559   -2.3095    0.0000 H   0  0  0

+    1.3256    3.6828    0.0000 H   0  0  0

+   -5.9984   -0.2921    0.0000 H   0  0  0

+    4.1311   -0.3327    0.0000 H   0  0  0

+    3.7556    3.8662    0.0000 H   0  0  0

+    5.1430    1.8758    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+ 12 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 17 21  2  0

+ 17 22  1  0

+ 19 23  2  0

+  8 11  2  0

+  9 15  2  0

+ 10 13  2  0

+ 14 18  2  0

+ 20 23  1  0

+  8 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6098-45-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+   -2.6830   -0.0593   -0.4168 C   0  0  0

+   -4.0728   -0.5755   -0.3614 C   0  0  0

+   -2.2609    0.2741    0.8681 C   0  0  0

+   -1.8118    0.1171   -1.4948 C   0  0  0

+   -4.5196   -0.5649    0.9576 C   0  0  0

+   -4.9239   -1.0326   -1.3693 C   0  0  0

+   -3.3989   -0.0265    1.8128 C   0  0  0

+   -0.9963    0.7785    1.0761 C   0  0  0

+   -0.5482    0.6232   -1.2850 C   0  0  0

+   -5.7906   -1.0019    1.2641 C   0  0  0

+   -6.1942   -1.4680   -1.0531 C   0  0  0

+   -0.1336    0.9571   -0.0001 C   0  0  0

+   -6.6289   -1.4537    0.2598 C   0  0  0

+    1.1478    1.4680    0.2095 N   0  0  0

+    2.0618    0.7184    0.5032 O   0  0  0

+    1.3742    2.7909    0.0870 C   0  0  0

+    2.7101    0.0398   -0.4591 C   0  0  0

+    1.8435    3.5884    1.2765 C   0  0  0

+    1.2002    3.3399   -0.9812 O   0  0  0

+    3.8189   -0.8696   -0.1028 C   0  0  0

+    2.3844    0.1743   -1.6221 O   0  0  0

+    4.4945   -1.5760   -1.0999 C   0  0  0

+    4.1994   -1.0220    1.2316 C   0  0  0

+    5.5285   -2.4233   -0.7604 C   0  0  0

+    5.2355   -1.8728    1.5574 C   0  0  0

+    5.8969   -2.5741    0.5650 C   0  0  0

+   -1.6044   -0.5771    0.0000 H   0  0  0

+   -4.6341   -1.6967    0.0000 H   0  0  0

+   -3.2534    0.6833    0.0000 H   0  0  0

+   -3.9702    0.4192    0.0000 H   0  0  0

+   -1.2048    1.4724    0.0000 H   0  0  0

+   -0.1822   -0.0021    0.0000 H   0  0  0

+   -6.0812   -0.3382    0.0000 H   0  0  0

+   -6.0869   -2.1846    0.0000 H   0  0  0

+   -7.3343   -1.6194    0.0000 H   0  0  0

+    2.4680    3.2209    0.0000 H   0  0  0

+    2.2110    4.2129    0.0000 H   0  0  0

+    1.2190    3.9559    0.0000 H   0  0  0

+    4.0022   -2.1076    0.0000 H   0  0  0

+    4.5683   -0.3984    0.0000 H   0  0  0

+    5.1575   -3.0457    0.0000 H   0  0  0

+    5.7300   -1.3432    0.0000 H   0  0  0

+    6.4943   -2.9842    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  6 11  1  0

+  8 12  2  0

+ 10 13  1  0

+ 12 14  1  0

+ 14 15  1  0

+ 14 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 16 19  2  0

+ 17 20  1  0

+ 17 21  2  0

+ 20 22  1  0

+ 20 23  2  0

+ 22 24  2  0

+ 23 25  1  0

+ 24 26  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  2  0

+ 25 26  2  0

+  4 27  1  0

+  6 28  1  0

+  7 29  1  0

+  7 30  1  0

+  8 31  1  0

+  9 32  1  0

+ 10 33  1  0

+ 11 34  1  0

+ 13 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+ 24 41  1  0

+ 25 42  1  0

+ 26 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-89-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+    1.3104    0.1896   -0.0033 C   0  0  0

+    0.0865   -0.4875   -0.0027 C   0  0  0

+    1.3276    1.5879   -0.0014 C   0  0  0

+    2.5735   -0.5656    0.0002 C   0  0  0

+   -1.0925    0.2271   -0.0002 C   0  0  0

+    0.1397    2.2884    0.0011 C   0  0  0

+    3.8900    0.1679   -0.0005 C   0  0  0

+    2.5550   -1.7780    0.0036 O   0  0  0

+   -1.0671    1.6112    0.0017 C   0  0  0

+   -2.3886   -0.4874    0.0000 N   0  3  0

+   -3.4312    0.1424    0.0022 O   0  0  0

+   -2.4128   -1.7051   -0.0020 O   0  5  0

+    0.0660   -1.5254    0.0000 H   0  0  0

+    2.2321    2.0972    0.0000 H   0  0  0

+    0.1508    3.3264    0.0000 H   0  0  0

+    4.3952   -0.7389    0.0000 H   0  0  0

+    4.7968    0.6731    0.0000 H   0  0  0

+    3.3848    1.0747    0.0000 H   0  0  0

+   -1.9580    2.1439    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+ 10 11  2  0

+ 10 12  1  0

+  6  9  2  0

+  2 13  1  0

+  3 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+873-76-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -1.5159   -0.2060   -0.2620 C   0  0  0

+   -0.7555   -1.3423   -0.0590 C   0  0  0

+   -0.9035    1.0310   -0.3429 C   0  0  0

+   -3.0124   -0.3161   -0.4014 C   0  0  0

+    0.6178   -1.2425    0.0632 C   0  0  0

+    0.4693    1.1320   -0.2208 C   0  0  0

+   -3.6441    0.4447    0.6302 O   0  0  0

+    1.2310   -0.0052   -0.0176 C   0  0  0

+    2.9556    0.1209    0.1358 Cl  0  0  0

+   -1.2086   -2.2703    0.0000 H   0  0  0

+   -1.4800    1.8878    0.0000 H   0  0  0

+   -3.9253   -0.7989    0.0000 H   0  0  0

+   -2.7271   -1.3086    0.0000 H   0  0  0

+    1.1937   -2.0997    0.0000 H   0  0  0

+    0.9218    2.0603    0.0000 H   0  0  0

+   -4.3038    1.2392    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  8  9  1  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15743-13-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -1.2310    0.0000   -0.0001 C   0  0  0

+   -0.3053   -1.1977    0.0000 C   0  0  0

+   -0.3053    1.1977    0.0003 C   0  0  0

+   -2.2589    0.0002   -1.4813 Cl  0  0  0

+   -2.2595   -0.0002    1.4808 Cl  0  0  0

+    1.0652   -0.6721    0.0003 C   0  0  0

+   -0.6325   -2.3652    0.0001 O   0  0  0

+    1.0652    0.6721    0.0005 C   0  0  0

+   -0.6325    2.3652    0.0004 O   0  0  0

+    2.4957   -1.6556   -0.0001 Cl  0  0  0

+    2.4957    1.6556    0.0000 Cl  0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

+  3  9  2  0

+  6 10  1  0

+  8 11  1  0

+  6  8  2  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+396-30-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.3529    0.6344   -0.0030 C   0  0  0

+   -0.6477   -0.7518   -0.0009 C   0  0  0

+    0.9852    1.0597   -0.0023 C   0  0  0

+   -1.4149    1.5580    0.0002 C   0  0  0

+    0.4116   -1.6766    0.0013 C   0  0  0

+   -1.9201   -1.1609   -0.0007 N   0  0  0

+    1.9861    0.1339    0.0003 C   0  0  0

+   -2.6916    1.0720    0.0051 C   0  0  0

+    1.6971   -1.2316    0.0015 C   0  0  0

+   -2.9118   -0.3034   -0.0023 C   0  0  0

+    3.2736    0.5433    0.0005 F   0  0  0

+    1.2103    2.0695    0.0000 H   0  0  0

+   -1.2337    2.5766    0.0000 H   0  0  0

+    0.2139   -2.6922    0.0000 H   0  0  0

+   -3.4942    1.7249    0.0000 H   0  0  0

+    2.4728   -1.9162    0.0000 H   0  0  0

+   -3.8839   -0.6577    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

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+  6 10  1  0

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+  7  9  1  0

+  8 10  2  0

+  3 12  1  0

+  4 13  1  0

+  5 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86674-49-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -0.3545   -0.2145   -0.0008 C   0  0  0

+   -1.5754    0.2458   -0.0171 C   0  0  0

+    0.7901    0.7158   -0.0094 C   0  0  0

+   -0.1008   -1.6661    0.0326 C   0  0  0

+   -1.8207    1.7000   -0.0443 C   0  0  0

+   -2.7249   -0.6769   -0.0081 C   0  0  0

+    2.1435    0.1335    0.0106 C   0  0  0

+    0.5772    2.0099   -0.0338 C   0  0  0

+    1.1391   -2.0961    0.0489 C   0  0  0

+   -1.2443   -2.5938    0.0462 C   0  0  0

+   -0.8060    2.5314   -0.0522 C   0  0  0

+   -3.2216    2.1562   -0.0611 C   0  0  0

+   -2.4789   -2.1285    0.0184 C   0  0  0

+   -3.9400   -0.1814   -0.0244 C   0  0  0

+    2.2825   -1.1748    0.0350 C   0  0  0

+    3.2343    0.9374    0.0034 N   0  3  0

+    1.3723   -3.4376    0.0798 O   0  0  0

+   -4.1901    1.2653   -0.0514 C   0  0  0

+    4.1356    0.7339   -0.7901 O   0  0  0

+    3.3134    1.8635    0.7905 O   0  5  0

+    1.3670    2.6573    0.0000 H   0  0  0

+   -1.0810   -3.6019    0.0000 H   0  0  0

+   -0.9717    3.5391    0.0000 H   0  0  0

+   -3.4389    3.1540    0.0000 H   0  0  0

+   -3.2671   -2.7779    0.0000 H   0  0  0

+   -4.7357   -0.8215    0.0000 H   0  0  0

+    3.2257   -1.5662    0.0000 H   0  0  0

+    1.5472   -4.4437    0.0000 H   0  0  0

+   -5.1569    1.5942    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1806-54-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 80 79                          1 V2000

+   -0.0188    1.3754    0.1820 P   0  0  0

+   -1.3339    1.4215   -0.7457 O   0  0  0

+   -0.0091    0.0080    1.0318 O   0  0  0

+    1.2952    1.4399   -0.7460 O   0  0  0

+   -0.0268    2.5309    1.1068 O   0  0  0

+   -2.4489    1.6113    0.1276 C   0  0  0

+    0.0109   -1.0647    0.0879 C   0  0  0

+    2.4087    1.6367    0.1277 C   0  0  0

+   -3.7378    1.6643   -0.6952 C   0  0  0

+    0.0210   -2.4004    0.8341 C   0  0  0

+    3.6965    1.7073   -0.6954 C   0  0  0

+   -4.9317    1.8676    0.2398 C   0  0  0

+    0.0425   -3.5490   -0.1765 C   0  0  0

+    4.8887    1.9181    0.2401 C   0  0  0

+   -6.2205    1.9206   -0.5830 C   0  0  0

+    0.0526   -4.8847    0.5696 C   0  0  0

+    6.1765    1.9886   -0.5830 C   0  0  0

+   -7.4144    2.1239    0.3520 C   0  0  0

+    0.0741   -6.0332   -0.4410 C   0  0  0

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+   -1.8637    2.3815    0.0000 H   0  0  0

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+  -11.2257    1.4667    0.0000 H   0  0  0

+   -0.8515   -9.8604    0.0000 H   0  0  0

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+ 28 77  1  0

+ 29 78  1  0

+ 29 79  1  0

+ 29 80  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3208-16-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.2903   -0.0503   -0.2668 C   0  0  0

+    0.4518   -1.1601   -0.1023 C   0  0  0

+    0.4995    1.0198   -0.0804 O   0  0  0

+   -1.7576   -0.0140   -0.6085 C   0  0  0

+    1.7652   -0.7334    0.2008 C   0  0  0

+    1.7471    0.6116    0.2034 C   0  0  0

+   -2.5816   -0.0125    0.6806 C   0  0  0

+    0.1239   -2.1062    0.0000 H   0  0  0

+   -1.2422    0.8445    0.0000 H   0  0  0

+   -2.2500    0.8578    0.0000 H   0  0  0

+    2.5792   -1.3165    0.0000 H   0  0  0

+    2.5538    1.2048    0.0000 H   0  0  0

+   -2.5798    0.9888    0.0000 H   0  0  0

+   -3.5829   -0.0107    0.0000 H   0  0  0

+   -2.5834   -1.0138    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  4 10  1  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+106589-50-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+   -1.1790    0.1783    0.0185 C   0  0  0

+   -2.4767   -0.5113    0.0211 C   0  0  0

+   -1.1459    1.5962   -0.0443 C   0  0  0

+    0.0042   -0.5480    0.0825 C   0  0  0

+   -3.6632    0.2503   -0.0370 C   0  0  0

+   -2.5531   -1.9040    0.0796 C   0  0  0

+    0.0063    2.2571   -0.0531 N   0  0  0

+   -2.4026    2.3424   -0.1007 C   0  0  0

+    1.2135    0.1615    0.0734 C   0  0  0

+   -3.5898    1.7068   -0.0977 C   0  0  0

+   -4.9019   -0.4043   -0.0362 C   0  0  0

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+    2.5393   -1.9871    0.2237 C   0  0  0

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+    4.9207   -0.4324    0.1792 C   0  0  0

+    3.7639   -2.4841   -0.5425 C   0  0  0

+    4.9903   -1.7200   -0.1260 C   0  0  0

+   -0.0063   -1.5985    0.0000 H   0  0  0

+   -1.6750   -2.4807    0.0000 H   0  0  0

+   -2.3793    3.3927    0.0000 H   0  0  0

+   -4.4772    2.2691    0.0000 H   0  0  0

+   -5.7918    0.1539    0.0000 H   0  0  0

+   -3.8417   -3.5682    0.0000 H   0  0  0

+   -5.8820   -2.2532    0.0000 H   0  0  0

+    2.3854    3.3878    0.0000 H   0  0  0

+    1.4931   -1.8916    0.0000 H   0  0  0

+    2.2914   -3.0080    0.0000 H   0  0  0

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+    3.1752   -3.3542    0.0000 H   0  0  0

+    4.4926   -3.2408    0.0000 H   0  0  0

+    5.9222   -2.2049    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  2  0

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+ 15 29  1  0

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+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78281-06-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+   -0.9145    0.0310   -0.0095 C   0  0  0

+   -2.3970   -0.0212    0.0016 C   0  0  0

+   -0.2605    1.2310   -0.2833 C   0  0  0

+   -0.1734   -1.1188    0.2595 C   0  0  0

+   -3.0623   -1.1208   -0.5379 C   0  0  0

+   -3.1295    1.0262    0.5566 C   0  0  0

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+    1.2041   -1.0678    0.2491 C   0  0  0

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+   -4.5088    0.9720    0.5647 C   0  0  0

+    1.8542    0.1288   -0.0294 C   0  0  0

+   -5.1638   -0.1191    0.0232 C   0  0  0

+    3.2516    0.1781   -0.0394 N   0  0  0

+    3.9670   -0.9352    0.2158 C   0  0  0

+    3.9150    1.3978   -0.3177 O   0  0  0

+    5.1791   -0.8924    0.2071 O   0  0  0

+   -0.7986    2.1034    0.0000 H   0  0  0

+   -0.6473   -2.0277    0.0000 H   0  0  0

+   -2.5449   -2.0056    0.0000 H   0  0  0

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+   -6.1883   -0.1519    0.0000 H   0  0  0

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+  1  2  1  0

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+  8 22  1  0

+  9 23  1  0

+ 10 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+113698-22-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.7185    0.4716    0.0035 C   0  0  0

+   -1.4780   -0.7197    0.0026 C   0  0  0

+    0.6768    0.3537    0.0021 C   0  0  0

+   -1.5805    1.5368    0.0001 N   0  0  0

+   -2.8905   -0.3079    0.0043 C   0  0  0

+   -0.8234   -1.9470    0.0000 C   0  0  0

+    1.2532   -0.9252    0.0001 C   0  0  0

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+   -2.8936    1.0964   -0.0030 C   0  0  0

+   -4.0958   -1.0082    0.0043 C   0  0  0

+    0.4916   -2.0125   -0.0023 N   0  0  0

+   -1.6307   -3.2196   -0.0009 C   0  0  0

+    2.7306   -1.0467   -0.0013 C   0  0  0

+    3.0015    1.3987    0.0004 C   0  0  0

+    1.0455    2.6597    0.0037 O   0  0  0

+   -4.1082    1.7739   -0.0070 C   0  0  0

+   -5.2884   -0.3181    0.0061 C   0  0  0

+    3.5679    0.1747   -0.0006 C   0  0  0

+    3.2520   -2.1432   -0.0026 O   0  0  0

+   -5.2928    1.0685   -0.0095 C   0  0  0

+    4.9167    0.0615   -0.0015 O   0  0  0

+    5.4428    1.3902   -0.0005 C   0  0  0

+   -1.2888    2.5384    0.0000 H   0  0  0

+   -4.0949   -2.0514    0.0000 H   0  0  0

+   -2.5116   -2.6608    0.0000 H   0  0  0

+   -2.1895   -4.1005    0.0000 H   0  0  0

+   -0.7498   -3.7784    0.0000 H   0  0  0

+    3.6078    2.2476    0.0000 H   0  0  0

+   -4.1229    2.8170    0.0000 H   0  0  0

+   -6.1913   -0.8407    0.0000 H   0  0  0

+   -6.2006    1.5826    0.0000 H   0  0  0

+    6.4128    1.0061    0.0000 H   0  0  0

+    5.8269    2.3602    0.0000 H   0  0  0

+    4.4728    1.7743    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+  8 15  2  0

+  9 16  1  0

+ 10 17  2  0

+ 13 18  1  0

+ 13 19  2  0

+ 16 20  2  0

+ 18 21  1  0

+ 21 22  1  0

+  5  9  2  0

+  7 11  1  0

+ 14 18  2  0

+ 17 20  1  0

+  4 23  1  0

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+ 12 25  1  0

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+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 20 31  1  0

+ 22 32  1  0

+ 22 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85-86-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+    4.4606    0.7654    0.0216 C   0  0  0

+    3.5987   -0.3845    0.2960 C   0  0  0

+    5.8652    0.5883    0.0424 C   0  0  0

+    3.9262    2.0263   -0.2646 C   0  0  0

+    2.2472   -0.2570    0.2853 N   0  0  0

+    4.1984   -1.6181    0.5691 C   0  0  0

+    6.4007   -0.6815    0.3241 C   0  0  0

+    6.6989    1.6884   -0.2203 C   0  0  0

+    4.7642    3.0728   -0.5154 C   0  0  0

+    1.5254   -1.0965   -0.3767 N   0  0  0

+    5.5868   -1.7404    0.5776 C   0  0  0

+    3.4244   -2.7016    0.8275 O   0  0  0

+    6.1459    2.9037   -0.4899 C   0  0  0

+    0.1674   -0.9684   -0.3875 C   0  0  0

+   -0.6159   -1.8794   -1.1059 C   0  0  0

+   -0.4434    0.0708    0.3248 C   0  0  0

+   -1.9751   -1.7514   -1.1162 C   0  0  0

+   -1.8023    0.1987    0.3145 C   0  0  0

+   -2.5854   -0.7094   -0.4084 C   0  0  0

+   -3.9436   -0.5813   -0.4191 N   0  0  0

+   -4.5061    0.3791    0.2331 N   0  0  0

+   -5.8662    0.5073    0.2224 C   0  0  0

+   -6.4792    1.5466    0.9279 C   0  0  0

+   -6.6515   -0.3970   -0.4991 C   0  0  0

+   -7.8528    1.6696    0.9124 C   0  0  0

+   -8.0235   -0.2611   -0.5051 C   0  0  0

+   -8.6238    0.7673    0.2007 C   0  0  0

+    2.9152    2.1658    0.0000 H   0  0  0

+    7.4129   -0.8119    0.0000 H   0  0  0

+    7.7132    1.5756    0.0000 H   0  0  0

+    4.3791    4.0179    0.0000 H   0  0  0

+    5.9972   -2.6748    0.0000 H   0  0  0

+    2.8312   -3.5320    0.0000 H   0  0  0

+    6.7494    3.7267    0.0000 H   0  0  0

+   -0.2342   -2.8259    0.0000 H   0  0  0

+    0.1044    0.9319    0.0000 H   0  0  0

+   -2.5236   -2.6120    0.0000 H   0  0  0

+   -2.1834    1.1455    0.0000 H   0  0  0

+   -5.9340    2.4093    0.0000 H   0  0  0

+   -6.2744   -1.3453    0.0000 H   0  0  0

+   -8.2382    2.6146    0.0000 H   0  0  0

+   -8.5747   -1.1200    0.0000 H   0  0  0

+   -9.6403    0.8584    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

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+  5 10  2  0

+  6 11  2  0

+  6 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 14 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 16 18  2  0

+ 17 19  2  0

+ 19 20  1  0

+ 20 21  2  0

+ 21 22  1  0

+ 22 23  2  0

+ 22 24  1  0

+ 23 25  1  0

+ 24 26  2  0

+ 25 27  2  0

+  7 11  1  0

+  9 13  1  0

+ 18 19  1  0

+ 26 27  1  0

+  4 28  1  0

+  7 29  1  0

+  8 30  1  0

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+ 15 35  1  0

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+ 18 38  1  0

+ 23 39  1  0

+ 24 40  1  0

+ 25 41  1  0

+ 26 42  1  0

+ 27 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+84498-34-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 34                          1 V2000

+    0.4761    0.7604    0.0021 C   0  0  0

+   -0.3777   -0.3577    0.0011 C   0  0  0

+    1.9232    0.5361    0.0015 C   0  0  0

+   -0.0598    2.0603   -0.0022 C   0  0  0

+   -1.8236   -0.1332    0.0012 C   0  0  0

+    0.1602   -1.6614   -0.0004 C   0  0  0

+    2.4090   -0.7925    0.0002 C   0  0  0

+    2.8260    1.6031    0.0018 C   0  0  0

+   -1.3956    2.2736   -0.0076 C   0  0  0

+   -2.3068    1.1961    0.0025 C   0  0  0

+   -2.7283   -1.1990   -0.0003 C   0  0  0

+    1.5018   -1.8721   -0.0018 C   0  0  0

+   -0.6807   -2.7281   -0.0011 O   0  0  0

+    3.7954   -1.0137   -0.0006 C   0  0  0

+    4.1677    1.3535    0.0007 C   0  0  0

+   -3.6924    1.4199    0.0024 C   0  0  0

+   -4.0694   -0.9468   -0.0007 C   0  0  0

+    4.6494    0.0485    0.0001 C   0  0  0

+   -4.5484    0.3593    0.0013 C   0  0  0

+    0.5918    2.8844    0.0000 H   0  0  0

+    2.4733    2.5927    0.0000 H   0  0  0

+   -1.7610    3.2586    0.0000 H   0  0  0

+   -2.3774   -2.1893    0.0000 H   0  0  0

+    1.8700   -2.8560    0.0000 H   0  0  0

+   -1.3311   -3.5531    0.0000 H   0  0  0

+    4.1731   -1.9941    0.0000 H   0  0  0

+    4.8450    2.1567    0.0000 H   0  0  0

+   -4.0682    2.4010    0.0000 H   0  0  0

+   -4.7483   -1.7486    0.0000 H   0  0  0

+    5.6863   -0.1207    0.0000 H   0  0  0

+   -5.5849    0.5306    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

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+ 11 23  1  0

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+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98-33-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -1.9412    0.0658   -0.0749 S   0  0  0

+   -2.4518   -1.0729   -0.7546 O   0  0  0

+   -2.1608    1.4174   -0.4546 O   0  0  0

+   -2.4430   -0.0481    1.3574 O   0  0  0

+   -0.1920   -0.1430   -0.0384 C   0  0  0

+    0.6351    0.9650   -0.0361 C   0  0  0

+    0.3506   -1.4149   -0.0064 C   0  0  0

+    2.0067    0.8049   -0.0075 C   0  0  0

+    1.7209   -1.5821    0.0223 C   0  0  0

+    2.9073    2.0132   -0.0056 C   0  0  0

+    2.5549   -0.4710    0.0190 C   0  0  0

+    3.9415   -0.6365    0.0475 N   0  0  0

+   -3.4543   -0.2777    0.0000 H   0  0  0

+    0.2249    1.9175    0.0000 H   0  0  0

+   -0.2725   -2.2439    0.0000 H   0  0  0

+    2.1274   -2.5362    0.0000 H   0  0  0

+    3.7388    1.3935    0.0000 H   0  0  0

+    3.5270    2.8447    0.0000 H   0  0  0

+    2.0758    2.6329    0.0000 H   0  0  0

+    4.3499   -1.5897    0.0000 H   0  0  0

+    4.5628    0.1938    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  2  0

+  4  1  1  0

+  5  1  1  0

+  6  5  2  0

+  7  5  1  0

+  8  6  1  0

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+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+134-62-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    0.4481    0.2131    0.2783 C   0  0  0

+   -0.9167   -0.1423    0.7220 C   0  0  0

+    1.5073   -0.6696    0.4941 C   0  0  0

+    0.6818    1.4305   -0.3636 C   0  0  0

+   -1.9159   -0.2325   -0.1780 N   0  0  0

+   -1.1376   -0.3531    1.8985 O   0  0  0

+    2.7786   -0.3318    0.0775 C   0  0  0

+    1.9575    1.7560   -0.7750 C   0  0  0

+   -1.7203   -0.9911   -1.4160 C   0  0  0

+   -3.1975    0.4280    0.0817 C   0  0  0

+    3.0044    0.8788   -0.5528 C   0  0  0

+    3.9237   -1.2835    0.3101 C   0  0  0

+   -1.6825   -2.4869   -1.0969 C   0  0  0

+   -3.0339    1.9405   -0.0809 C   0  0  0

+    1.2902   -1.6518    0.0000 H   0  0  0

+   -0.0505    2.1201    0.0000 H   0  0  0

+    2.1807    2.7368    0.0000 H   0  0  0

+   -0.8029   -1.4037    0.0000 H   0  0  0

+   -0.9511   -0.3429    0.0000 H   0  0  0

+   -4.1768    0.6578    0.0000 H   0  0  0

+   -3.5454   -0.5158    0.0000 H   0  0  0

+    3.9512    1.2185    0.0000 H   0  0  0

+    3.2808   -2.0571    0.0000 H   0  0  0

+    4.6973   -1.9264    0.0000 H   0  0  0

+    4.5666   -0.5099    0.0000 H   0  0  0

+   -2.6881   -2.5123    0.0000 H   0  0  0

+   -1.6571   -3.4925    0.0000 H   0  0  0

+   -0.6769   -2.4615    0.0000 H   0  0  0

+   -2.0338    1.8323    0.0000 H   0  0  0

+   -2.9257    2.9406    0.0000 H   0  0  0

+   -4.0340    2.0487    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  7 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 10 14  1  0

+  8 11  1  0

+  3 15  1  0

+  4 16  1  0

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+  9 18  1  0

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+ 12 23  1  0

+ 12 24  1  0

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+ 13 26  1  0

+ 13 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108043-88-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.7413   -0.3966   -0.0012 C   0  0  0

+   -0.6734   -0.3670   -0.0003 C   0  0  0

+    1.4498    0.8118   -0.0009 C   0  0  0

+    1.6476   -1.3939    0.0029 N   0  0  0

+   -1.3407    0.8698    0.0010 C   0  0  0

+   -1.4254   -1.5644   -0.0016 C   0  0  0

+    0.7689    2.0239    0.0008 C   0  0  0

+    2.7939    0.4694   -0.0020 N   0  0  0

+    2.8598   -0.8927   -0.0005 C   0  0  0

+   -0.6077    2.0546    0.0028 C   0  0  0

+   -2.7211    0.9002    0.0010 N   0  0  0

+   -2.7818   -1.4962   -0.0016 C   0  0  0

+    3.9286    1.3961   -0.0029 C   0  0  0

+    4.0237   -1.6309    0.0026 N   0  0  0

+   -3.4288   -0.2447   -0.0003 C   0  0  0

+   -4.6473   -0.1982   -0.0003 O   0  0  0

+   -0.9462   -2.4851    0.0000 H   0  0  0

+    1.3031    2.9138    0.0000 H   0  0  0

+   -1.1028    2.9668    0.0000 H   0  0  0

+   -3.2165    1.8123    0.0000 H   0  0  0

+   -3.3436   -2.3689    0.0000 H   0  0  0

+    4.5851    0.5922    0.0000 H   0  0  0

+    4.7325    2.0526    0.0000 H   0  0  0

+    3.2721    2.2000    0.0000 H   0  0  0

+    3.9805   -2.6679    0.0000 H   0  0  0

+    4.9434   -1.1498    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 15 16  2  0

+  7 10  2  0

+  8  9  1  0

+ 12 15  1  0

+  6 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+534-07-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.0000    0.2511   -0.0002 C   0  0  0

+   -1.3051    1.0046    0.0012 C   0  0  0

+    1.3051    1.0046    0.0012 C   0  0  0

+    0.0000   -0.9565    0.0026 O   0  0  0

+   -2.6755   -0.1670   -0.0009 Cl  0  0  0

+    2.6755   -0.1670   -0.0010 Cl  0  0  0

+   -0.6330    1.9133    0.0000 H   0  0  0

+   -2.1320    1.7752    0.0000 H   0  0  0

+    2.1320    1.7752    0.0000 H   0  0  0

+    0.6330    1.9133    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+10159-53-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 21                          1 V2000

+   -0.0363   -0.0045    0.3440 N   0  0  0

+    0.0807   -1.6507    0.0141 P   0  0  0

+    1.1030    0.6413   -0.3214 C   0  0  0

+   -1.2483    0.4765   -0.3323 C   0  0  0

+   -1.1087   -2.4800    0.8687 N   0  0  0

+   -0.1217   -1.8975   -1.5639 O   0  0  0

+    1.4154   -2.1422    0.4231 O   0  0  0

+    2.2112    0.9000    0.7013 C   0  0  0

+   -2.2585    0.9565    0.7117 C   0  0  0

+    3.6096    1.6927   -0.1155 Cl  0  0  0

+   -3.7462    1.5469   -0.1185 Cl  0  0  0

+    1.3053    1.6456    0.0000 H   0  0  0

+    0.2734    1.2423    0.0000 H   0  0  0

+   -2.0788   -0.1234    0.0000 H   0  0  0

+   -1.1217   -0.5401    0.0000 H   0  0  0

+   -2.0363   -2.0452    0.0000 H   0  0  0

+   -1.0214   -3.5007    0.0000 H   0  0  0

+   -0.7713   -2.6897    0.0000 H   0  0  0

+    2.0089   -0.1043    0.0000 H   0  0  0

+    3.0408    0.2990    0.0000 H   0  0  0

+   -1.4280    1.5564    0.0000 H   0  0  0

+   -2.3851    1.9731    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  2  7  2  0

+  3  8  1  0

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+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+  9 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53716-49-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.1760   -0.0799   -0.2148 C   0  0  0

+   -1.6322    0.0973   -0.0664 C   0  0  0

+    0.3989    1.1880   -0.0424 C   0  0  0

+    0.6346   -1.1845   -0.4659 C   0  0  0

+   -1.8435    1.4607    0.1861 C   0  0  0

+   -2.7154   -0.7763   -0.1297 C   0  0  0

+   -0.6151    2.0980    0.1967 N   0  0  0

+    1.7809    1.3274   -0.1300 C   0  0  0

+    2.0009   -1.0262   -0.5507 C   0  0  0

+   -3.1417    1.9270    0.3711 C   0  0  0

+   -3.9947   -0.2960    0.0567 C   0  0  0

+    2.5706    0.2269   -0.3839 C   0  0  0

+   -4.2049    1.0527    0.3057 C   0  0  0

+   -5.3466   -1.3822   -0.0221 Cl  0  0  0

+    4.0662    0.3863   -0.4778 C   0  0  0

+    4.7291   -0.4652    0.5742 C   0  0  0

+    4.5400   -0.0551   -1.8641 C   0  0  0

+    6.0672   -0.4818    0.6789 O   0  0  0

+    4.0561   -1.1328    1.3233 O   0  0  0

+    0.2220   -2.1308    0.0000 H   0  0  0

+   -2.5512   -1.7955    0.0000 H   0  0  0

+   -0.4849    3.1221    0.0000 H   0  0  0

+    2.2056    2.2684    0.0000 H   0  0  0

+    2.6089   -1.8606    0.0000 H   0  0  0

+   -3.3181    2.9442    0.0000 H   0  0  0

+   -5.1696    1.4202    0.0000 H   0  0  0

+    4.3928    1.3657    0.0000 H   0  0  0

+    3.8363   -0.8105    0.0000 H   0  0  0

+    5.2954   -0.7588    0.0000 H   0  0  0

+    5.2437    0.7003    0.0000 H   0  0  0

+    7.0995   -0.4946    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+ 10 13  2  0

+ 11 14  1  0

+ 12 15  1  0

+ 15 16  1  0

+ 15 17  1  0

+ 16 18  1  0

+ 16 19  2  0

+  5  7  1  0

+  9 12  1  0

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+  8 23  1  0

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+ 13 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+602-06-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 63                          1 V2000

+    0.7054    0.2271   -1.8992 O   0  0  0

+    1.5824    0.0810   -1.0698 C   0  0  0

+    1.6767    0.9923    0.0867 C   0  0  0

+    2.5647   -1.0162   -1.2038 C   0  0  0

+    0.6141    1.8481    0.4085 C   0  0  0

+    2.8438    1.0019    0.8749 C   0  0  0

+    3.7318   -1.0046   -0.4159 C   0  0  0

+    2.3462   -2.0573   -2.0988 C   0  0  0

+    0.7256    2.7080    1.5189 C   0  0  0

+   -0.6126    1.8480   -0.4096 C   0  0  0

+    3.9605    0.1026    0.5360 C   0  0  0

+    2.9347    1.8644    1.9738 C   0  0  0

+    4.6608   -2.0403   -0.5417 C   0  0  0

+    3.2761   -3.0781   -2.2129 C   0  0  0

+   -0.2990    3.5376    1.8360 O   0  0  0

+    1.8750    2.7097    2.2859 C   0  0  0

+   -1.6743    0.9906   -0.0889 C   0  0  0

+   -0.7275    2.7136   -1.5151 C   0  0  0

+    5.0566    0.2672    1.0375 O   0  0  0

+    4.0561    1.8756    2.7346 O   0  0  0

+    5.7889   -2.0393    0.2108 O   0  0  0

+    4.4223   -3.0730   -1.4440 C   0  0  0

+    3.0337   -4.2041   -3.1847 C   0  0  0

+   -2.8417    1.0004   -0.8767 C   0  0  0

+   -1.5786    0.0776    1.0661 C   0  0  0

+    0.2942    3.5484   -1.8281 O   0  0  0

+   -1.8773    2.7157   -2.2816 C   0  0  0

+   -3.9572    0.0990   -0.5393 C   0  0  0

+   -2.9338    1.8650   -1.9738 C   0  0  0

+   -0.7017    0.2235    1.8955 O   0  0  0

+   -2.5635   -1.0171    1.2022 C   0  0  0

+   -5.0536    0.2632   -1.0404 O   0  0  0

+   -3.7303   -1.0047    0.4133 C   0  0  0

+   -4.0559    1.8771   -2.7337 O   0  0  0

+   -2.3479   -2.0562    2.0996 C   0  0  0

+   -4.6611   -2.0381    0.5405 C   0  0  0

+   -3.2803   -3.0751    2.2154 C   0  0  0

+   -5.7881   -2.0372   -0.2138 O   0  0  0

+   -4.4254   -3.0696    1.4456 C   0  0  0

+   -3.0411   -4.1992    3.1902 C   0  0  0

+    1.5146   -2.2839    0.0000 H   0  0  0

+   -0.9689    4.0800    0.0000 H   0  0  0

+    2.1591    3.5235    0.0000 H   0  0  0

+    4.9180    1.8842    0.0000 H   0  0  0

+    6.6509   -2.0385    0.0000 H   0  0  0

+    4.9604   -3.7464    0.0000 H   0  0  0

+    2.1911   -4.0227    0.0000 H   0  0  0

+    2.8523   -5.0467    0.0000 H   0  0  0

+    3.8763   -4.3855    0.0000 H   0  0  0

+    0.9617    4.0938    0.0000 H   0  0  0

+   -2.1632    3.5289    0.0000 H   0  0  0

+   -4.9178    1.8864    0.0000 H   0  0  0

+   -1.5168   -2.2847    0.0000 H   0  0  0

+   -6.6501   -2.0365    0.0000 H   0  0  0

+   -4.9644   -3.7423    0.0000 H   0  0  0

+   -3.8842   -4.3786    0.0000 H   0  0  0

+   -2.8617   -5.0423    0.0000 H   0  0  0

+   -2.1980   -4.0198    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

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+ 17 10  2  0

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+ 26 18  1  0

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+ 28 24  1  0

+ 29 24  2  0

+ 30 25  2  0

+ 31 25  1  0

+ 32 28  2  0

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+ 34 29  1  0

+ 35 31  2  0

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+ 40 37  1  0

+  7 11  1  0

+ 12 16  1  0

+ 14 22  1  0

+ 27 29  1  0

+ 31 33  1  0

+ 37 39  2  0

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+ 35 53  1  0

+ 38 54  1  0

+ 39 55  1  0

+ 40 56  1  0

+ 40 57  1  0

+ 40 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+585-86-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 47                          1 V2000

+   -0.7355   -0.7367    0.9346 C   0  0  1

+   -0.0915   -0.3532   -0.2821 O   0  0  0

+   -1.5715    0.3271    1.3858 O   0  0  0

+   -1.5780   -1.9911    0.6923 C   0  0  1

+    1.0356    0.4466    0.0815 C   0  0  1

+   -2.4258    0.6933    0.3039 C   0  0  1

+   -2.6160   -1.6931   -0.3956 C   0  0  2

+   -0.7305   -3.0584    0.2624 O   0  0  0

+    2.2786   -0.0603   -0.6524 C   0  0  1

+    0.7733    1.9034   -0.3057 C   0  0  1

+   -3.4066   -0.4441    0.0100 C   0  0  2

+   -3.2057    1.9562    0.6748 C   0  0  0

+   -3.5083   -2.8024   -0.5192 O   0  0  0

+    3.2618   -0.6530    0.3590 C   0  0  2

+    1.8990   -1.0665   -1.5935 O   0  0  0

+    1.8853    2.7894    0.2595 C   0  0  0

+    0.7483    2.0206   -1.7296 O   0  0  0

+   -4.2735   -0.0610   -1.0595 O   0  0  0

+   -2.3021    3.0572    0.7907 O   0  0  0

+    4.6387   -0.7970   -0.2924 C   0  0  0

+    2.7968   -1.9374    0.7789 O   0  0  0

+    1.5470    4.1634    0.0605 O   0  0  0

+    5.5570   -1.3506    0.6523 O   0  0  0

+   -0.0310   -1.4805    0.0000 H   0  0  0

+   -2.1477   -2.8426    0.0000 H   0  0  0

+    1.1531   -0.5711    0.0000 H   0  0  0

+   -1.7570    1.4694    0.0000 H   0  0  0

+   -2.0017   -0.8732    0.0000 H   0  0  0

+   -0.0934   -3.8607    0.0000 H   0  0  0

+    2.7379    0.8555    0.0000 H   0  0  0

+   -0.2319    1.7057    0.0000 H   0  0  0

+   -4.0754   -1.2202    0.0000 H   0  0  0

+   -3.9214    2.6892    0.0000 H   0  0  0

+   -4.0129    1.3254    0.0000 H   0  0  0

+   -4.1504   -3.6007    0.0000 H   0  0  0

+    3.5873    0.3184    0.0000 H   0  0  0

+    1.5374   -2.0250    0.0000 H   0  0  0

+    2.4023    1.9049    0.0000 H   0  0  0

+    2.8347    3.1743    0.0000 H   0  0  0

+    0.5346    3.0225    0.0000 H   0  0  0

+   -5.2106    0.3531    0.0000 H   0  0  0

+   -1.6522    3.8491    0.0000 H   0  0  0

+    5.4538   -0.1764    0.0000 H   0  0  0

+    4.3622    0.1895    0.0000 H   0  0  0

+    2.4480   -2.9007    0.0000 H   0  0  0

+    1.3021    5.1582    0.0000 H   0  0  0

+    6.4344   -1.8795    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  5  2  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

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+  6 12  1  0

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+  9 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 14 20  1  0

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+ 16 22  1  0

+ 20 23  1  0

+  7 11  1  0

+  1 24  1  0

+  4 25  1  0

+  5 26  1  0

+  6 27  1  0

+  7 28  1  0

+  8 29  1  0

+  9 30  1  0

+ 10 31  1  0

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+ 12 33  1  0

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+ 17 40  1  0

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+ 19 42  1  0

+ 20 43  1  0

+ 20 44  1  0

+ 21 45  1  0

+ 22 46  1  0

+ 23 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13436-58-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.2958    0.0248    0.0027 C   0  0  0

+   -1.2379   -1.1053    0.0020 C   0  0  0

+    1.0886   -0.2508    0.0002 C   0  0  0

+   -1.0232    1.1270    0.0004 N   0  0  0

+   -2.5067   -0.5563    0.0043 C   0  0  0

+   -0.7226   -2.4191   -0.0001 C   0  0  0

+    1.5153   -1.5382   -0.0026 C   0  0  0

+    2.0685    0.8585    0.0003 N   0  3  0

+   -2.3784    0.7774   -0.0017 N   0  0  0

+    0.6204   -2.6107   -0.0016 C   0  0  0

+    3.2623    0.6165   -0.0018 O   0  0  0

+    1.6812    2.0133    0.0024 O   0  5  0

+   -3.4922    1.7292   -0.0046 C   0  0  0

+   -3.4042   -1.0861    0.0000 H   0  0  0

+   -1.3693   -3.2364    0.0000 H   0  0  0

+    2.5392   -1.7326    0.0000 H   0  0  0

+    0.9942   -3.5836    0.0000 H   0  0  0

+   -2.8151    2.5215    0.0000 H   0  0  0

+   -4.2845    2.4063    0.0000 H   0  0  0

+   -4.1693    0.9369    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  6 10  2  0

+  8 11  2  0

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+  9 13  1  0

+  5  9  1  0

+  7 10  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+ 10 17  1  0

+ 13 18  1  0

+ 13 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+394-70-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.5576    0.9114   -0.0026 C   0  0  0

+   -0.0280   -0.4023   -0.0016 C   0  0  0

+    0.2691    1.9622   -0.0014 N   0  0  0

+   -1.9526    1.0858    0.0011 C   0  0  0

+    1.3714   -0.5745    0.0002 C   0  0  0

+   -0.9000   -1.5022   -0.0019 C   0  0  0

+    1.5717    1.8066    0.0007 C   0  0  0

+   -2.7692   -0.0029    0.0055 C   0  0  0

+    2.1591    0.5457    0.0008 C   0  0  0

+    1.9196   -1.8093    0.0016 F   0  0  0

+   -2.2457   -1.2941   -0.0031 C   0  0  0

+   -2.3571    2.0387    0.0000 H   0  0  0

+   -0.5223   -2.4660    0.0000 H   0  0  0

+    2.1789    2.6449    0.0000 H   0  0  0

+   -3.7957    0.1305    0.0000 H   0  0  0

+    3.1902    0.4543    0.0000 H   0  0  0

+   -2.8881   -2.1058    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7  9  2  0

+  8 11  1  0

+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+87-82-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -3.2746    0.0447   -0.0035 Br  0  0  0

+   -1.3837    0.0189   -0.0042 C   0  0  0

+   -0.6757    1.2077   -0.0016 C   0  0  0

+   -0.7081   -1.1890   -0.0014 C   0  0  0

+   -1.5988    2.8581    0.0024 Br  0  0  0

+    0.7083    1.1889   -0.0016 C   0  0  0

+   -1.6758   -2.8136    0.0018 Br  0  0  0

+    0.6755   -1.2078   -0.0014 C   0  0  0

+    1.6760    2.8135    0.0025 Br  0  0  0

+    1.3837   -0.0187   -0.0041 C   0  0  0

+    1.5986   -2.8582    0.0031 Br  0  0  0

+    3.2746   -0.0444   -0.0041 Br  0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  3  1  0

+  7  4  1  0

+  8  4  2  0

+  9  6  1  0

+ 10  6  2  0

+ 11  8  1  0

+ 12 10  1  0

+  8 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5737-13-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 27                          1 V2000

+    0.0000   -3.1892    0.0018 O   0  0  0

+    0.0000   -1.9741    0.0030 C   0  0  0

+    1.2003   -1.0999    0.0006 C   0  0  0

+   -1.2003   -1.0999    0.0007 C   0  0  0

+    0.7143    0.2069    0.0018 C   0  0  0

+    2.5806   -1.1963   -0.0022 C   0  0  0

+   -0.7143    0.2069    0.0019 C   0  0  0

+   -2.5806   -1.1963   -0.0021 C   0  0  0

+    1.4347    1.3962    0.0006 C   0  0  0

+    3.3483   -0.0282   -0.0040 C   0  0  0

+   -1.4347    1.3962    0.0005 C   0  0  0

+   -3.3483   -0.0282   -0.0039 C   0  0  0

+    0.6841    2.5910    0.0027 C   0  0  0

+    2.8313    1.2417   -0.0021 C   0  0  0

+   -0.6841    2.5910    0.0024 C   0  0  0

+   -2.8313    1.2417   -0.0023 C   0  0  0

+    3.0447   -2.1334    0.0000 H   0  0  0

+   -3.0447   -2.1334    0.0000 H   0  0  0

+    4.3890   -0.1299    0.0000 H   0  0  0

+   -4.3890   -0.1299    0.0000 H   0  0  0

+    1.1900    3.5062    0.0000 H   0  0  0

+    3.4618    2.0759    0.0000 H   0  0  0

+   -1.1900    3.5062    0.0000 H   0  0  0

+   -3.4618    2.0759    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

+  5  3  2  0

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+  7  4  2  0

+  8  4  1  0

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+ 10  6  2  0

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+ 15 11  1  0

+ 16 11  2  0

+  5  7  1  0

+ 10 14  1  0

+ 13 15  2  0

+ 12 16  1  0

+  6 17  1  0

+  8 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 15 23  1  0

+ 16 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+125974-01-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.0773    1.1044    0.0040 C   0  0  0

+    0.4587   -0.1711    0.0018 C   0  0  0

+    1.3360    1.9401    0.0019 C   0  0  0

+   -1.3398    1.6169    0.0022 C   0  0  0

+    1.9233   -0.2438   -0.0016 C   0  0  0

+   -0.6124   -1.5373    0.0029 Cl  0  0  0

+    2.4445    0.9973   -0.0016 O   0  0  0

+   -2.4831    0.2228   -0.0034 Cl  0  0  0

+    2.5708   -1.2723   -0.0035 O   0  0  0

+    2.1235    2.7078    0.0000 H   0  0  0

+    0.6450    2.7957    0.0000 H   0  0  0

+   -0.8512    2.6022    0.0000 H   0  0  0

+   -2.2636    2.2137    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  1  0

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+  5  9  2  0

+  5  7  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85-01-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    0.7328   -0.3823   -0.0015 C   0  0  0

+   -0.7328   -0.3823   -0.0010 C   0  0  0

+    1.4115    0.8574   -0.0006 C   0  0  0

+    1.4641   -1.5716    0.0030 C   0  0  0

+   -1.4115    0.8574    0.0003 C   0  0  0

+   -1.4642   -1.5716   -0.0014 C   0  0  0

+    0.6742    2.0640    0.0012 C   0  0  0

+    2.8136    0.8689   -0.0010 C   0  0  0

+    2.8292   -1.5267    0.0023 C   0  0  0

+   -0.6742    2.0640    0.0007 C   0  0  0

+   -2.8136    0.8689    0.0008 C   0  0  0

+   -2.8292   -1.5267   -0.0005 C   0  0  0

+    3.5003   -0.3096   -0.0023 C   0  0  0

+   -3.5003   -0.3096   -0.0001 C   0  0  0

+    0.9682   -2.4939    0.0000 H   0  0  0

+   -0.9684   -2.4939    0.0000 H   0  0  0

+    1.1864    2.9773    0.0000 H   0  0  0

+    3.3316    1.7789    0.0000 H   0  0  0

+    3.3764   -2.4195    0.0000 H   0  0  0

+   -1.1864    2.9773    0.0000 H   0  0  0

+   -3.3316    1.7789    0.0000 H   0  0  0

+   -3.3764   -2.4195    0.0000 H   0  0  0

+    4.5474   -0.2972    0.0000 H   0  0  0

+   -4.5474   -0.2972    0.0000 H   0  0  0

+  1  2  2  0

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+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-04-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+   -0.0462   -0.5915    0.0000 C   0  0  0

+   -1.2972    0.2893    0.0000 C   0  0  0

+    1.1516    0.2591    0.0000 N   0  0  0

+   -0.7935   -1.4320    0.0000 H   0  0  0

+    0.7044   -1.4290    0.0000 H   0  0  0

+   -0.6497    1.2089    0.0000 H   0  0  0

+   -2.2168    0.9368    0.0000 H   0  0  0

+   -1.9447   -0.6303    0.0000 H   0  0  0

+    2.1740   -0.2094    0.0000 H   0  0  0

+    1.0462    1.3788    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+35203-91-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    1.9567   -0.2426   -0.0603 S   0  0  0

+    2.0256   -1.1741    1.3071 N   0  0  0

+    2.9619    0.7494    0.0973 O   0  0  0

+    1.8651   -1.1556   -1.1452 O   0  0  0

+    0.4219    0.6224   -0.0315 C   0  0  0

+   -0.7893   -0.0904   -0.0091 C   0  0  0

+    0.4048    1.9834   -0.0254 C   0  0  0

+   -2.0109    0.6275    0.0137 C   0  0  0

+   -0.8033   -1.4272   -0.0085 N   0  0  0

+   -0.7974    2.6871   -0.0029 C   0  0  0

+   -1.9907    2.0313    0.0130 C   0  0  0

+   -3.2229   -0.0883    0.0362 C   0  0  0

+   -1.9299   -2.0968    0.0129 C   0  0  0

+   -3.1654   -1.4528    0.0350 C   0  0  0

+    1.1618   -1.7618    0.0000 H   0  0  0

+    2.9665   -1.6283    0.0000 H   0  0  0

+    1.3079    2.5088    0.0000 H   0  0  0

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+   -4.0471   -2.0132    0.0000 H   0  0  0

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+ 10 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50892-23-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -0.9573   -1.2972   -0.1102 C   0  0  0

+   -2.3355   -1.1580   -0.1712 N   0  0  0

+   -0.1710   -0.2254   -0.1042 N   0  0  0

+   -0.3759   -2.5648   -0.0483 C   0  0  0

+   -2.9141    0.1118   -0.0876 C   0  0  0

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+    2.1522    1.0923   -0.0404 S   0  0  0

+    1.7774   -4.2077    0.0906 Cl  0  0  0

+   -4.8621    1.4990    0.0904 C   0  0  0

+   -5.1693   -0.9833    0.0213 C   0  0  0

+   -2.6854    2.4978   -0.0116 C   0  0  0

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+   -6.3587    1.6426    0.1936 C   0  0  0

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+ 20 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+611-23-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.4538    0.0175    0.0020 C   0  0  0

+    0.5076   -1.0135    0.0004 C   0  0  0

+   -0.0289    1.3616    0.0019 C   0  0  0

+   -1.7582   -0.2771   -0.0019 N   0  0  0

+    1.8463   -0.6945   -0.0012 C   0  0  0

+    0.0720   -2.4562    0.0011 C   0  0  0

+    1.3054    1.6524    0.0002 C   0  0  0

+   -2.5846    0.6176   -0.0006 O   0  0  0

+    2.2457    0.6333   -0.0013 C   0  0  0

+   -0.7298    2.1298    0.0000 H   0  0  0

+    2.5599   -1.4509    0.0000 H   0  0  0

+   -0.9235   -2.1556    0.0000 H   0  0  0

+   -0.2286   -3.4517    0.0000 H   0  0  0

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+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+26741-53-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 91 94                          1 V2000

+    0.0015   -1.1269    0.1234 C   0  0  0

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+ 41 91  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+78448-09-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+    0.3825   -0.7345    0.0018 C   0  0  0

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+   -0.4333   -2.8309   -0.0067 N   0  0  0

+    2.0820   -2.4601   -0.0037 C   0  0  0

+   -3.4320    0.0880    0.0008 C   0  0  0

+   -1.6570    1.7521   -0.0004 C   0  0  0

+   -2.9115   -2.2610    0.0031 C   0  0  0

+    3.0750   -1.5377    0.0030 C   0  0  0

+    3.8170    0.8010    0.0009 C   0  0  0

+    2.1651    2.5507   -0.0026 C   0  0  0

+   -3.8283   -1.2633    0.0026 C   0  0  0

+   -4.3782    1.1253   -0.0002 C   0  0  0

+   -2.6023    2.7348   -0.0009 C   0  0  0

+    3.4940    2.1402   -0.0008 C   0  0  0

+    5.1178    0.4106    0.0022 O   0  0  0

+   -3.9586    2.4214   -0.0014 C   0  0  0

+    0.1527    1.9661    0.0000 H   0  0  0

+   -0.4750   -3.8790    0.0000 H   0  0  0

+    2.3314   -3.4790    0.0000 H   0  0  0

+   -0.6380    2.0010    0.0000 H   0  0  0

+   -3.2409   -3.2569    0.0000 H   0  0  0

+    4.0745   -1.8559    0.0000 H   0  0  0

+    1.9406    3.5753    0.0000 H   0  0  0

+   -4.8499   -1.5014    0.0000 H   0  0  0

+   -5.4034    0.9034    0.0000 H   0  0  0

+   -2.3035    3.7403    0.0000 H   0  0  0

+    4.2587    2.8582    0.0000 H   0  0  0

+    6.1225    0.1091    0.0000 H   0  0  0

+   -4.6677    3.1943    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  2  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  2  0

+ 15 20  2  0

+ 15 21  1  0

+ 18 22  2  0

+  6  9  1  0

+ 10 14  2  0

+ 13 17  2  0

+ 16 20  1  0

+ 19 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+431-03-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+    0.7430   -0.0183   -0.0148 C   0  0  0

+   -0.7430    0.0173   -0.0135 C   0  0  0

+    1.5228    1.0944   -0.6667 C   0  0  0

+    1.3256   -0.9365    0.5110 O   0  0  0

+   -1.5239   -1.0938   -0.6667 C   0  0  0

+   -1.3246    0.9368    0.5111 O   0  0  0

+    2.3569    0.5098    0.0000 H   0  0  0

+    2.1074    1.9285    0.0000 H   0  0  0

+    0.6887    1.6790    0.0000 H   0  0  0

+   -2.3572   -0.5081    0.0000 H   0  0  0

+   -2.1096   -1.9271    0.0000 H   0  0  0

+   -0.6906   -1.6795    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+43192-07-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    1.0204   -0.2466   -0.0024 C   0  0  0

+   -0.0150   -1.1729   -0.0016 C   0  0  0

+    0.7325    1.1121   -0.0016 C   0  0  0

+    2.3480   -0.6808    0.0018 N   0  0  0

+   -1.3263   -0.7403   -0.0001 C   0  0  0

+   -0.5815    1.5380   -0.0001 C   0  0  0

+    3.4021    0.2647    0.0010 O   0  0  0

+   -1.6095    0.6135    0.0002 C   0  0  0

+   -2.4501   -1.7443    0.0007 C   0  0  0

+   -3.0419    1.0819    0.0014 C   0  0  0

+    0.1977   -2.1928    0.0000 H   0  0  0

+    1.5067    1.8092    0.0000 H   0  0  0

+    2.5627   -1.7003    0.0000 H   0  0  0

+   -0.7982    2.5570    0.0000 H   0  0  0

+    4.1776    0.9603    0.0000 H   0  0  0

+   -3.1442   -0.9674    0.0000 H   0  0  0

+   -3.2270   -2.4384    0.0000 H   0  0  0

+   -1.7560   -2.5212    0.0000 H   0  0  0

+   -2.7181    2.0721    0.0000 H   0  0  0

+   -4.0321    1.4057    0.0000 H   0  0  0

+   -3.3657    0.0917    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

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+  6  8  2  0

+  2 11  1  0

+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+95-93-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -1.1972    0.6911    0.0015 C   0  0  0

+   -1.1972   -0.6911    0.0008 C   0  0  0

+    0.0002    1.3824    0.0014 C   0  0  0

+   -2.5023    1.4446   -0.0039 C   0  0  0

+    0.0001   -1.3823   -0.0001 C   0  0  0

+   -2.5023   -1.4446    0.0015 C   0  0  0

+    1.1971    0.6913    0.0005 C   0  0  0

+    1.1971   -0.6913   -0.0007 C   0  0  0

+    2.5022    1.4448    0.0009 C   0  0  0

+    2.5022   -1.4448   -0.0021 C   0  0  0

+    0.0002    2.4194    0.0000 H   0  0  0

+   -1.9838    2.3426    0.0000 H   0  0  0

+   -3.4003    1.9631    0.0000 H   0  0  0

+   -3.0208    0.5466    0.0000 H   0  0  0

+    0.0001   -2.4193    0.0000 H   0  0  0

+   -3.0208   -0.5466    0.0000 H   0  0  0

+   -3.4003   -1.9631    0.0000 H   0  0  0

+   -1.9838   -2.3426    0.0000 H   0  0  0

+    3.0207    0.5468    0.0000 H   0  0  0

+    3.4002    1.9633    0.0000 H   0  0  0

+    1.9837    2.3428    0.0000 H   0  0  0

+    1.9837   -2.3428    0.0000 H   0  0  0

+    3.4002   -1.9633    0.0000 H   0  0  0

+    3.0207   -0.5468    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

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+  7  8  1  0

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+  6 17  1  0

+  6 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146795-41-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -2.5291   -0.3883    0.0658 C   0  0  0

+   -3.5475    0.6313    0.0402 C   0  0  0

+   -1.1002   -0.0455    0.1465 C   0  0  0

+   -2.9535   -1.7001    0.0171 C   0  0  0

+   -4.8277    0.2175   -0.0348 C   0  0  0

+   -0.1728   -1.0231    0.1685 N   0  0  0

+   -0.7562    1.1204    0.1933 O   0  0  0

+   -4.6774   -1.5570   -0.0608 S   0  0  0

+   -6.0593    1.0378   -0.0754 N   0  3  0

+    1.1869   -0.6989    0.1121 C   0  0  0

+   -7.1488    0.4975   -0.1441 O   0  0  0

+   -5.9833    2.2529   -0.0402 O   0  5  0

+    2.1381   -1.7049   -0.0009 C   0  0  0

+    1.5879    0.6296    0.1630 C   0  0  0

+    3.4794   -1.3819   -0.0569 C   0  0  0

+    2.9311    0.9469    0.1066 C   0  0  0

+    3.8765   -0.0574   -0.0006 C   0  0  0

+    5.7144    0.3809   -0.0776 Br  0  0  0

+   -3.3043    1.6394    0.0000 H   0  0  0

+   -2.3786   -2.5633    0.0000 H   0  0  0

+   -0.4682   -2.0172    0.0000 H   0  0  0

+    1.8430   -2.6991    0.0000 H   0  0  0

+    0.8774    1.3850    0.0000 H   0  0  0

+    4.1923   -2.1351    0.0000 H   0  0  0

+    3.2294    1.9401    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 14 16  1  0

+ 15 17  1  0

+ 17 18  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 19  1  0

+  4 20  1  0

+  6 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96918-27-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 35                          1 V2000

+   -1.2125   -0.2596   -0.0015 C   0  0  0

+   -2.5638    0.1295   -0.0010 C   0  0  0

+   -0.1994    0.7252   -0.0006 C   0  0  0

+   -0.8741   -1.6332    0.0029 C   0  0  0

+   -2.9010    1.5018    0.0005 C   0  0  0

+   -3.5798   -0.8536   -0.0023 C   0  0  0

+    1.2106    0.2902   -0.0012 C   0  0  0

+   -0.5458    2.0711    0.0012 C   0  0  0

+    0.5378   -2.0307    0.0028 C   0  0  0

+   -1.8899   -2.5902    0.0078 C   0  0  0

+   -1.8805    2.4614    0.0009 C   0  0  0

+   -4.2658    1.8734    0.0010 C   0  0  0

+   -3.2265   -2.2081   -0.0038 C   0  0  0

+   -4.9346   -0.4413   -0.0017 C   0  0  0

+    1.5263   -1.0898   -0.0026 C   0  0  0

+    2.4249    0.9761   -0.0002 C   0  0  0

+   -5.2500    0.9024    0.0002 C   0  0  0

+    2.8768   -1.1941   -0.0024 O   0  0  0

+    3.4251    0.0237   -0.0010 C   0  0  0

+    4.8782    0.3083    0.0001 N   0  3  0

+    5.6786   -0.6098   -0.0008 O   0  0  0

+    5.3373    1.6478    0.0021 O   0  5  0

+    0.2088    2.8015    0.0000 H   0  0  0

+    0.7907   -3.0500    0.0000 H   0  0  0

+   -1.6417   -3.6107    0.0000 H   0  0  0

+   -2.1251    3.4827    0.0000 H   0  0  0

+   -4.5321    2.8893    0.0000 H   0  0  0

+   -3.9777   -2.9420    0.0000 H   0  0  0

+   -5.7009   -1.1595    0.0000 H   0  0  0

+    2.5541    2.0184    0.0000 H   0  0  0

+   -6.2591    1.1934    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

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+ 15 18  1  0

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+  8 11  2  0

+  9 15  2  0

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+  8 23  1  0

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+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+109-43-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 55                          1 V2000

+   -4.3523   -0.6078   -0.0066 C   0  0  0

+   -5.6150    0.2148    0.0024 C   0  0  0

+   -3.1376    0.3225    0.0035 C   0  0  0

+   -6.8119   -0.3928   -0.0043 O   0  0  0

+   -5.5500    1.4212    0.0155 O   0  0  0

+   -1.8557   -0.5127   -0.0056 C   0  0  0

+   -8.0285    0.3997    0.0044 C   0  0  0

+   -0.6410    0.4176    0.0046 C   0  0  0

+   -9.2432   -0.5305   -0.0058 C   0  0  0

+    0.6410   -0.4176   -0.0046 C   0  0  0

+  -10.5251    0.3046    0.0033 C   0  0  0

+    1.8557    0.5127    0.0056 C   0  0  0

+  -11.7398   -0.6256   -0.0068 C   0  0  0

+    3.1376   -0.3225   -0.0035 C   0  0  0

+    4.3523    0.6078    0.0066 C   0  0  0

+    5.6150   -0.2148   -0.0024 C   0  0  0

+    6.8119    0.3928    0.0043 O   0  0  0

+    5.5500   -1.4212   -0.0155 O   0  0  0

+    8.0285   -0.3997   -0.0044 C   0  0  0

+    9.2432    0.5305    0.0058 C   0  0  0

+   10.5251   -0.3046   -0.0033 C   0  0  0

+   11.7398    0.6256    0.0068 C   0  0  0

+   -5.0833   -1.4923    0.0000 H   0  0  0

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+   -3.9338    1.1488    0.0000 H   0  0  0

+   -2.5867   -1.3972    0.0000 H   0  0  0

+   -1.0595   -1.3390    0.0000 H   0  0  0

+   -7.2975    1.2842    0.0000 H   0  0  0

+   -8.8247    1.2260    0.0000 H   0  0  0

+    0.0900    1.3021    0.0000 H   0  0  0

+   -1.4372    1.2439    0.0000 H   0  0  0

+   -9.9742   -1.4150    0.0000 H   0  0  0

+   -8.4470   -1.3568    0.0000 H   0  0  0

+   -0.0900   -1.3021    0.0000 H   0  0  0

+    1.4372   -1.2439    0.0000 H   0  0  0

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+  -12.4375    0.2854    0.0000 H   0  0  0

+  -12.6508   -1.3232    0.0000 H   0  0  0

+  -11.0422   -1.5366    0.0000 H   0  0  0

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+    3.5561    1.4341    0.0000 H   0  0  0

+    7.2975   -1.2842    0.0000 H   0  0  0

+    8.8247   -1.2260    0.0000 H   0  0  0

+    9.9742    1.4150    0.0000 H   0  0  0

+    8.4470    1.3568    0.0000 H   0  0  0

+    9.7941   -1.1891    0.0000 H   0  0  0

+   11.3213   -1.1309    0.0000 H   0  0  0

+   12.4375   -0.2854    0.0000 H   0  0  0

+   12.6508    1.3232    0.0000 H   0  0  0

+   11.0422    1.5366    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 20 51  1  0

+ 21 52  1  0

+ 21 53  1  0

+ 22 54  1  0

+ 22 55  1  0

+ 22 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+330-54-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -1.4474    0.4730   -0.2141 C   0  0  0

+   -2.1232   -0.7005    0.0752 C   0  0  0

+   -0.0782    0.4542   -0.4040 C   0  0  0

+   -2.3211    1.9674   -0.3454 Cl  0  0  0

+   -1.4299   -1.8939    0.1753 C   0  0  0

+   -3.8426   -0.6744    0.3133 Cl  0  0  0

+    0.6185   -0.7423   -0.3044 C   0  0  0

+   -0.0621   -1.9175   -0.0136 C   0  0  0

+    2.0050   -0.7643   -0.4967 N   0  0  0

+    2.7997    0.0417    0.2349 C   0  0  0

+    4.1193    0.1086   -0.0309 N   0  0  0

+    2.3261    0.7085    1.1346 O   0  0  0

+    4.6899   -0.6948   -1.1149 C   0  0  0

+    4.9831    0.9847    0.7644 C   0  0  0

+    0.4374    1.3369    0.0000 H   0  0  0

+   -1.9475   -2.7755    0.0000 H   0  0  0

+    0.4408   -2.8075    0.0000 H   0  0  0

+    2.3920   -1.7105    0.0000 H   0  0  0

+    3.8564   -1.2867    0.0000 H   0  0  0

+    5.2818   -1.5283    0.0000 H   0  0  0

+    5.5234   -0.1029    0.0000 H   0  0  0

+    5.7110    0.2670    0.0000 H   0  0  0

+    5.7008    1.7126    0.0000 H   0  0  0

+    4.2552    1.7024    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  9 10  1  0

+ 10 11  1  0

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+ 11 13  1  0

+ 11 14  1  0

+  7  8  1  0

+  3 15  1  0

+  5 16  1  0

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+ 13 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 14 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+136-77-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+   -0.9011   -0.1215   -0.6238 C   0  0  0

+   -1.5453    0.9923   -0.1043 C   0  0  0

+   -1.5390   -1.3474   -0.6351 C   0  0  0

+    0.4928    0.0071   -1.1819 C   0  0  0

+   -2.8300    0.8745    0.4038 C   0  0  0

+   -0.9176    2.1976   -0.0938 O   0  0  0

+   -2.8191   -1.4673   -0.1294 C   0  0  0

+    1.5121   -0.1813   -0.0565 C   0  0  0

+   -3.4676   -0.3562    0.3914 C   0  0  0

+    2.9273   -0.0508   -0.6230 C   0  0  0

+   -4.7266   -0.4748    0.8891 O   0  0  0

+    3.9465   -0.2391    0.5024 C   0  0  0

+    5.3618   -0.1086   -0.0642 C   0  0  0

+    6.3810   -0.2970    1.0612 C   0  0  0

+   -0.9996   -2.1491    0.0000 H   0  0  0

+    1.0501    0.7965    0.0000 H   0  0  0

+    0.0093    0.8437    0.0000 H   0  0  0

+   -3.3693    1.6763    0.0000 H   0  0  0

+   -0.4713    3.0546    0.0000 H   0  0  0

+   -3.2606   -2.3268    0.0000 H   0  0  0

+    0.9548   -0.9707    0.0000 H   0  0  0

+    1.9956   -1.0179    0.0000 H   0  0  0

+    3.4846    0.7386    0.0000 H   0  0  0

+    2.4438    0.7858    0.0000 H   0  0  0

+   -5.6886   -0.5654    0.0000 H   0  0  0

+    3.3892   -1.0285    0.0000 H   0  0  0

+    4.4300   -1.0757    0.0000 H   0  0  0

+    5.9192    0.6807    0.0000 H   0  0  0

+    4.8783    0.7281    0.0000 H   0  0  0

+    6.2054   -1.2472    0.0000 H   0  0  0

+    7.3312   -0.4726    0.0000 H   0  0  0

+    6.5566    0.6532    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  7  9  1  0

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+ 12 27  1  0

+ 13 28  1  0

+ 13 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 14 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18028-55-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -0.7146   -2.9998    0.0017 C   0  0  0

+   -1.2739   -1.6005    0.0017 C   0  0  0

+   -0.4145   -0.5048    0.0008 C   0  0  0

+   -2.6379   -1.4011   -0.0031 C   0  0  0

+    1.0535   -0.3664    0.0001 C   0  0  0

+   -0.9368    0.7974    0.0008 C   0  0  0

+   -3.1557   -0.1153   -0.0031 C   0  0  0

+    1.3235    1.0101   -0.0002 C   0  0  0

+    2.1028   -1.2826    0.0002 C   0  0  0

+    0.1192    1.6911    0.0003 N   0  0  0

+   -2.3164    0.9783    0.0010 C   0  0  0

+    2.6453    1.4455   -0.0008 C   0  0  0

+    3.4052   -0.8321    0.0000 C   0  0  0

+   -2.8934    2.3704    0.0016 C   0  0  0

+    3.6738    0.5282   -0.0011 C   0  0  0

+   -1.6836   -3.3871    0.0000 H   0  0  0

+   -0.3273   -3.9688    0.0000 H   0  0  0

+    0.2544   -2.6125    0.0000 H   0  0  0

+   -3.2831   -2.2213    0.0000 H   0  0  0

+   -4.1896    0.0261    0.0000 H   0  0  0

+    1.9033   -2.3069    0.0000 H   0  0  0

+    0.0214    2.7301    0.0000 H   0  0  0

+    2.8578    2.4672    0.0000 H   0  0  0

+    4.1922   -1.5173    0.0000 H   0  0  0

+   -1.9294    2.7700    0.0000 H   0  0  0

+   -3.2930    3.3344    0.0000 H   0  0  0

+   -3.8574    1.9708    0.0000 H   0  0  0

+    4.6631    0.8602    0.0000 H   0  0  0

+  2  1  1  0

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+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+38178-41-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.1562    0.3340   -0.0061 C   0  0  0

+    0.0865   -1.0366   -0.0031 C   0  0  0

+    0.8849    1.2093   -0.0054 O   0  0  0

+   -1.4585    0.8039   -0.0042 C   0  0  0

+    1.3649   -1.5011    0.0006 O   0  0  0

+   -0.9753   -1.9252   -0.0034 C   0  0  0

+    2.1631    0.7445   -0.0016 C   0  0  0

+   -2.5155   -0.0890    0.0008 C   0  0  0

+    2.4058   -0.6256    0.0014 C   0  0  0

+   -2.2746   -1.4495   -0.0067 C   0  0  0

+    3.2253    1.6334   -0.0004 C   0  0  0

+   -3.9075    0.4145    0.0034 N   0  3  0

+    3.7085   -1.0957    0.0047 C   0  0  0

+    4.5242    1.1579    0.0039 C   0  0  0

+   -4.8390   -0.3703    0.0078 O   0  0  0

+   -4.1215    1.6135    0.0012 O   0  5  0

+    4.7652   -0.2030    0.0050 C   0  0  0

+   -1.6418    1.8251    0.0000 H   0  0  0

+   -0.7968   -2.9472    0.0000 H   0  0  0

+   -3.0697   -2.1159    0.0000 H   0  0  0

+    3.0468    2.6554    0.0000 H   0  0  0

+    3.8918   -2.1169    0.0000 H   0  0  0

+    5.3193    1.8243    0.0000 H   0  0  0

+    5.7408   -0.5559    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 17 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+79-81-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 98 98                          1 V2000

+  -10.3815    1.9323   -0.2289 C   0  0  0

+  -11.4269    1.7801    0.8374 C   0  0  0

+  -10.1384    3.0668   -0.8611 C   0  0  0

+   -9.5831    0.7606   -0.5838 C   0  0  0

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+   -9.0643    3.0756   -1.9180 C   0  0  0

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+   -7.6084   -0.5727   -0.3372 C   0  0  0

+   -6.4008   -0.7766    0.2531 C   0  0  0

+   -8.1238   -1.5548   -1.3575 C   0  0  0

+   -5.6308   -1.9065   -0.0891 C   0  0  0

+   -4.4261   -2.1099    0.4997 C   0  0  0

+   -3.6277   -3.2817    0.1448 C   0  0  0

+   -2.4415   -3.4820    0.7246 C   0  0  0

+   -4.1431   -4.2638   -0.8755 C   0  0  0

+   -1.1872   -3.4950   -0.1106 C   0  0  0

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+ 38 97  1  0

+ 38 98  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59-87-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -2.4438    0.1868    0.0032 C   0  0  0

+   -1.4996   -0.7580    0.0036 O   0  0  0

+   -1.8554    1.4542    0.0012 C   0  0  0

+   -3.9067   -0.0722   -0.0010 N   0  3  0

+   -0.2782   -0.1747    0.0020 C   0  0  0

+   -0.5029    1.2847    0.0004 C   0  0  0

+   -4.6903    0.8604   -0.0011 O   0  0  0

+   -4.3901   -1.4031   -0.0050 O   0  5  0

+    0.9419   -0.8196    0.0023 C   0  0  0

+    2.0757   -0.1073    0.0005 N   0  0  0

+    3.2162   -0.7101    0.0007 N   0  0  0

+    4.3574    0.0069   -0.0011 C   0  0  0

+    4.3071    1.3538   -0.0031 N   0  0  0

+    5.4313   -0.5607   -0.0008 O   0  0  0

+   -2.3462    2.3404    0.0000 H   0  0  0

+    0.2033    2.0110    0.0000 H   0  0  0

+    0.9797   -1.8319    0.0000 H   0  0  0

+    3.2540   -1.7224    0.0000 H   0  0  0

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+  5  6  2  0

+  3 15  1  0

+  6 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 13 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110690-43-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 63                          1 V2000

+    4.1181    0.3184    0.5177 N   0  0  0

+    2.7947    0.5122    0.3516 C   0  0  0

+    4.9223    0.2496   -0.5587 C   0  0  0

+    4.6358    0.1982    1.7870 C   0  0  0

+    1.8894   -0.6474    0.2182 C   0  0  0

+    2.3463    1.6406    0.3116 O   0  0  0

+    6.2471    0.0564   -0.4220 N   0  0  0

+    4.4453    0.3633   -1.6709 O   0  0  0

+    5.9606    0.0043    1.9507 C   0  0  0

+    0.5100   -0.4543    0.1644 C   0  0  0

+    2.4142   -1.9402    0.1398 C   0  0  0

+    6.7938   -0.0722    0.8037 C   0  0  0

+    7.0997   -0.0149   -1.6112 C   0  0  0

+    6.4873   -0.1152    3.1890 F   0  0  0

+   -0.3366   -1.5539    0.0385 C   0  0  0

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+    7.9924   -0.2474    0.9261 O   0  0  0

+    7.2336    1.2890   -2.1802 O   0  0  0

+   -1.7997   -1.3590   -0.0198 C   0  0  0

+    0.2019   -2.8418   -0.0329 C   0  0  0

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+   -6.1916   -3.1511   -0.3749 C   0  0  0

+   -4.2629   -4.6795   -0.3961 C   0  0  0

+   -5.7664   -0.8052   -0.1697 C   0  0  0

+   -6.6670   -1.8573   -0.2999 C   0  0  0

+   -3.8322   -5.7290   -0.4552 N   0  0  0

+   -6.2323    0.4658   -0.0906 O   0  0  0

+   -5.3691    1.4933    0.0357 C   0  0  0

+   -5.8766    2.8778    0.1219 C   0  0  0

+   -4.1739    1.2807    0.0786 O   0  0  0

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+   -7.2494    3.1262    0.0671 C   0  0  0

+   -5.4656    5.2350    0.3322 C   0  0  0

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+    1.9535   -3.9655    0.0000 H   0  0  0

+   -0.4160   -3.6477    0.0000 H   0  0  0

+    8.6284    0.9540    0.0000 H   0  0  0

+    9.3361    2.0064    0.0000 H   0  0  0

+    9.5276    3.1894    0.0000 H   0  0  0

+    8.6634    4.3364    0.0000 H   0  0  0

+    7.5164    3.4722    0.0000 H   0  0  0

+   -6.8324   -3.9389    0.0000 H   0  0  0

+   -7.6665   -1.6776    0.0000 H   0  0  0

+   -3.9841    3.7732    0.0000 H   0  0  0

+   -7.9051    2.3507    0.0000 H   0  0  0

+   -4.8162    6.0157    0.0000 H   0  0  0

+   -8.7160    4.6013    0.0000 H   0  0  0

+   -7.1742    6.4284    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  9 12  1  0

+ 16 20  2  0

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+ 37 56  1  0

+ 38 57  1  0

+ 39 58  1  0

+ 40 59  1  0

+ 41 60  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146177-58-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+    0.9223   -0.4995   -0.0016 C   0  0  0

+   -0.5345   -0.3910   -0.0008 C   0  0  0

+    1.6830    0.6726   -0.0014 C   0  0  0

+    1.7837   -1.5422    0.0029 N   0  0  0

+   -1.1210    0.8993    0.0001 C   0  0  0

+   -1.3126   -1.4722   -0.0014 N   0  0  0

+    1.0573    1.9217   -0.0005 C   0  0  0

+    3.0074    0.2701   -0.0018 N   0  0  0

+    3.0161   -1.0934    0.0000 C   0  0  0

+   -0.2946    2.0390    0.0007 C   0  0  0

+   -2.4531    1.0143    0.0008 N   0  0  0

+   -2.6211   -1.3341   -0.0011 C   0  0  0

+    4.1816    1.1462   -0.0018 C   0  0  0

+    4.1488   -1.8811    0.0031 N   0  0  0

+   -0.9207    3.4098    0.0012 C   0  0  0

+   -3.2012   -0.0666    0.0007 C   0  0  0

+   -3.5008   -2.5577   -0.0018 C   0  0  0

+   -4.7024    0.0659    0.0020 C   0  0  0

+    1.6425    2.7836    0.0000 H   0  0  0

+    4.8046    0.3112    0.0000 H   0  0  0

+    5.0166    1.7692    0.0000 H   0  0  0

+    3.5586    1.9812    0.0000 H   0  0  0

+    4.0613   -2.9192    0.0000 H   0  0  0

+    5.0916   -1.4378    0.0000 H   0  0  0

+    0.0269    3.8426    0.0000 H   0  0  0

+   -1.3535    4.3574    0.0000 H   0  0  0

+   -1.8683    2.9770    0.0000 H   0  0  0

+   -4.3467   -1.9496    0.0000 H   0  0  0

+   -4.1089   -3.4036    0.0000 H   0  0  0

+   -2.6549   -3.1658    0.0000 H   0  0  0

+   -4.6108    1.1037    0.0000 H   0  0  0

+   -5.7402    0.1575    0.0000 H   0  0  0

+   -4.7940   -0.9719    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-06-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    1.2616   -0.1071   -0.6606 C   0  0  0

+    0.2226   -0.6887    0.1928 N   0  0  0

+    2.3316    0.5117    0.2015 C   0  0  0

+   -0.9562   -0.2819    0.1078 C   0  0  0

+    3.5670    0.0834    0.1206 C   0  0  0

+   -2.4214    0.2237    0.0022 S   0  0  0

+    1.2535   -1.0423    0.0000 H   0  0  0

+    2.0697   -0.5779    0.0000 H   0  0  0

+    2.2426    1.4427    0.0000 H   0  0  0

+    3.7435   -0.8351    0.0000 H   0  0  0

+    4.2741    0.6955    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  3  5  2  0

+  4  6  2  0

+  1  7  1  0

+  1  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+509-14-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.0000    0.0000    0.0000 C   0  0  0

+    0.8458   -1.1937   -0.0762 N   0  3  0

+   -0.8458    0.0762   -1.1937 N   0  3  0

+   -0.8458   -0.0762    1.1937 N   0  3  0

+    0.8458    1.1937    0.0762 N   0  3  0

+    2.0587   -1.0822   -0.0691 O   0  0  0

+    0.3362   -2.2977   -0.1466 O   0  5  0

+   -2.0587    0.0691   -1.0822 O   0  0  0

+   -0.3362    0.1466   -2.2977 O   0  5  0

+   -0.3362   -0.1466    2.2977 O   0  0  0

+   -2.0587   -0.0691    1.0822 O   0  5  0

+    0.3362    2.2977    0.1466 O   0  0  0

+    2.0587    1.0822    0.0691 O   0  5  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

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+  3  9  1  0

+  4 10  2  0

+  4 11  1  0

+  5 12  2  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122-20-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 33                          1 V2000

+   -0.0470    0.0498    0.4121 N   0  0  0

+   -1.3634    0.4108    0.9552 C   0  0  0

+    0.9156    1.0126    0.9637 C   0  0  0

+    0.2973   -1.2620    0.9766 C   0  0  0

+   -2.4321    0.2070   -0.1205 C   0  0  0

+    1.4641    1.8887   -0.1644 C   0  0  0

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+   -3.8182    0.4235    0.4902 C   0  0  0

+   -2.2267    1.1442   -1.1796 O   0  0  0

+    2.3188    3.0097    0.4301 C   0  0  0

+    2.2650    1.0921   -1.0396 O   0  0  0

+    1.5105   -3.4030    0.5451 C   0  0  0

+    0.0819   -2.4160   -1.1358 O   0  0  0

+   -0.8073    1.1589    0.0000 H   0  0  0

+   -1.8586    1.2006    0.0000 H   0  0  0

+    1.2240    0.1329    0.0000 H   0  0  0

+    1.8420    0.9093    0.0000 H   0  0  0

+   -0.6281   -1.1499    0.0000 H   0  0  0

+   -0.1478   -2.0811    0.0000 H   0  0  0

+   -2.4165   -0.7251    0.0000 H   0  0  0

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+    1.8041   -1.6309    0.0000 H   0  0  0

+   -3.6743    1.3445    0.0000 H   0  0  0

+   -4.7392    0.5674    0.0000 H   0  0  0

+   -3.9621   -0.4975    0.0000 H   0  0  0

+   -2.0271    2.0548    0.0000 H   0  0  0

+    3.0601    2.4445    0.0000 H   0  0  0

+    2.8840    3.7510    0.0000 H   0  0  0

+    1.5775    3.5749    0.0000 H   0  0  0

+    2.9259    0.4347    0.0000 H   0  0  0

+    0.6426   -3.7432    0.0000 H   0  0  0

+    1.8507   -4.2709    0.0000 H   0  0  0

+    2.3784   -3.0628    0.0000 H   0  0  0

+   -0.8015   -2.7137    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 11 30  1  0

+ 12 31  1  0

+ 12 32  1  0

+ 12 33  1  0

+ 13 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50264-69-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -1.7687   -1.2666   -0.5684 C   0  0  0

+   -2.7738   -0.6893    0.2320 C   0  0  0

+   -1.0005   -0.2259   -1.0214 N   0  0  0

+   -1.7459   -2.6471   -0.7393 C   0  0  0

+   -2.4963    0.7526    0.1825 C   0  0  0

+   -3.7263   -1.4973    0.8459 C   0  0  0

+   -1.4347    0.8994   -0.5818 N   0  0  0

+    0.1663   -0.3781   -1.8941 C   0  0  0

+   -2.6938   -3.4223   -0.1318 C   0  0  0

+   -3.2551    1.8210    0.8540 C   0  0  0

+   -3.6777   -2.8518    0.6655 C   0  0  0

+    1.4205   -0.3883   -1.0587 C   0  0  0

+   -2.8764    3.1069    0.7135 O   0  0  0

+   -4.2228    1.5433    1.5348 O   0  0  0

+    1.9716    0.8041   -0.6237 C   0  0  0

+    2.0169   -1.5888   -0.7225 C   0  0  0

+    3.1225    0.7946    0.1434 C   0  0  0

+    1.2190    2.3117   -1.0411 Cl  0  0  0

+    3.1672   -1.5990    0.0442 C   0  0  0

+    3.7220   -0.4073    0.4753 C   0  0  0

+    5.1668   -0.4203    1.4376 Cl  0  0  0

+   -0.8659   -3.0554    0.0000 H   0  0  0

+   -4.6138   -1.1055    0.0000 H   0  0  0

+   -0.3917   -1.1717    0.0000 H   0  0  0

+    0.6099   -1.2409    0.0000 H   0  0  0

+   -2.6163   -4.3893    0.0000 H   0  0  0

+   -4.5095   -3.3511    0.0000 H   0  0  0

+   -2.6023    4.0375    0.0000 H   0  0  0

+    1.5022   -2.4111    0.0000 H   0  0  0

+    3.6363    1.6175    0.0000 H   0  0  0

+    3.6851   -2.4193    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+ 11 27  1  0

+ 13 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+185-75-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.7351   -0.0330   -0.2061 C   0  0  0

+   -2.2249    0.0638   -0.5232 C   0  0  0

+   -1.7218    0.0860    0.8150 O   0  0  0

+   -0.0475   -1.3905   -0.3889 C   0  0  0

+    0.1473    1.1805   -0.5047 C   0  0  0

+    1.3149   -1.3278    0.3173 C   0  0  0

+    1.3423    1.0962    0.2737 O   0  0  0

+    2.0508   -0.0679   -0.1449 C   0  0  0

+   -2.7432    0.9456    0.0000 H   0  0  0

+   -2.7614   -0.8071    0.0000 H   0  0  0

+   -1.0159   -1.7199    0.0000 H   0  0  0

+    0.1426   -2.3956    0.0000 H   0  0  0

+    0.4068    2.1699    0.0000 H   0  0  0

+   -0.7770    1.6186    0.0000 H   0  0  0

+    1.1665   -2.3399    0.0000 H   0  0  0

+    2.2802   -1.6661    0.0000 H   0  0  0

+    2.8372   -0.7220    0.0000 H   0  0  0

+    2.8253    0.6003    0.0000 H   0  0  0

+  1  2  1  0

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+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51230-49-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 23                          1 V2000

+    1.4260   -0.4988   -0.0009 C   0  0  0

+    0.0099   -0.0844   -0.0001 C   0  0  0

+    2.1692    0.6896   -0.0009 C   0  0  0

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+   -1.1984   -0.7724   -0.0004 C   0  0  0

+    1.3108    1.7330   -0.0001 O   0  0  0

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+   -3.8983   -0.9226   -0.0007 Cl  0  0  0

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+  1  2  1  0

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+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13345-21-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 37                          1 V2000

+   -0.0120   -0.1079   -0.0012 C   0  0  0

+   -1.3649    0.2763   -0.0010 C   0  0  0

+    0.9945    0.8747    0.0004 C   0  0  0

+    0.3389   -1.5286    0.0031 C   0  0  0

+   -2.3802   -0.7051   -0.0016 C   0  0  0

+   -1.6968    1.6511    0.0003 C   0  0  0

+    2.3901    0.4408    0.0001 C   0  0  0

+    0.6392    2.2364    0.0026 C   0  0  0

+    1.6716   -1.9074    0.0025 C   0  0  0

+   -0.7370   -2.5200    0.0074 C   0  0  0

+   -3.7196   -0.2921   -0.0014 C   0  0  0

+   -2.0281   -2.1214   -0.0030 C   0  0  0

+   -0.6640    2.6147    0.0009 C   0  0  0

+   -3.0469    2.0247    0.0006 C   0  0  0

+    2.6932   -0.9444   -0.0016 C   0  0  0

+    3.4324    1.3758    0.0005 C   0  0  0

+   -4.0315    1.0615   -0.0001 C   0  0  0

+   -4.7137   -1.2166   -0.0020 O   0  0  0

+    4.0437   -1.3471   -0.0028 C   0  0  0

+    4.7270    0.9490   -0.0007 C   0  0  0

+    5.0302   -0.4103   -0.0023 C   0  0  0

+    1.3938    2.9707    0.0000 H   0  0  0

+    1.9214   -2.9303    0.0000 H   0  0  0

+   -0.5046   -3.5470    0.0000 H   0  0  0

+   -2.7931   -2.8449    0.0000 H   0  0  0

+   -0.9083    3.6389    0.0000 H   0  0  0

+   -3.3097    3.0443    0.0000 H   0  0  0

+    3.2166    2.4064    0.0000 H   0  0  0

+   -5.0420    1.3575    0.0000 H   0  0  0

+   -5.4848   -1.9337    0.0000 H   0  0  0

+    4.2888   -2.3711    0.0000 H   0  0  0

+    5.5075    1.6558    0.0000 H   0  0  0

+    6.0374   -0.7173    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+  5 11  1  0

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+  7 15  1  0

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+ 11 17  2  0

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+ 15 19  1  0

+ 16 20  2  0

+ 19 21  2  0

+  8 13  2  0

+  9 15  2  0

+ 10 12  2  0

+ 14 17  1  0

+ 20 21  1  0

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+  9 23  1  0

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+ 12 25  1  0

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+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35572-78-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    1.0168   -0.2900   -0.0044 C   0  0  0

+   -0.2428   -0.8607    0.0213 C   0  0  0

+    1.1535    1.0836   -0.0393 C   0  0  0

+    2.2196   -1.1525    0.0115 N   0  3  0

+   -1.3690   -0.0586    0.0123 C   0  0  0

+    0.0240    1.8925   -0.0484 C   0  0  0

+    2.5264    1.7045   -0.0669 C   0  0  0

+    2.4730   -1.8619   -0.9456 O   0  0  0

+    2.9559   -1.1528    0.9817 O   0  5  0

+   -1.2394    1.3161   -0.0220 C   0  0  0

+   -2.7150   -0.6738    0.0399 N   0  3  0

+    0.1587    3.2823   -0.0836 N   0  0  0

+   -3.7075    0.0322    0.0320 O   0  0  0

+   -2.8300   -1.8859    0.0706 O   0  5  0

+   -0.3430   -1.8929    0.0000 H   0  0  0

+    2.9537    0.7596    0.0000 H   0  0  0

+    3.4713    2.1318    0.0000 H   0  0  0

+    2.0991    2.6494    0.0000 H   0  0  0

+   -2.0844    1.9173    0.0000 H   0  0  0

+    1.1027    3.7118    0.0000 H   0  0  0

+   -0.6852    3.8851    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  2  0

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+  6 10  2  0

+  2 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+495-48-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    1.7561    0.0919    0.0745 C   0  0  0

+    0.4318    0.3135    0.2125 N   0  3  0

+    2.6722    1.1341    0.2845 C   0  0  0

+    2.2260   -1.1833   -0.2741 C   0  0  0

+   -0.4066   -0.6475    0.0185 N   0  0  0

+    0.0284    1.4208    0.5202 O   0  5  0

+    4.0215    0.8980    0.1412 C   0  0  0

+    3.5796   -1.3995   -0.4127 C   0  0  0

+   -1.7738   -0.3793   -0.0373 C   0  0  0

+    4.4753   -0.3631   -0.2090 C   0  0  0

+   -2.2351    0.7564   -0.6938 C   0  0  0

+   -2.6796   -1.2495    0.5583 C   0  0  0

+   -3.5894    1.0185   -0.7469 C   0  0  0

+   -4.0328   -0.9804    0.5009 C   0  0  0

+   -4.4873    0.1531   -0.1480 C   0  0  0

+    2.3360    2.0898    0.0000 H   0  0  0

+    1.5826   -1.9659    0.0000 H   0  0  0

+    4.6736    1.6734    0.0000 H   0  0  0

+    3.9269   -2.3513    0.0000 H   0  0  0

+    5.4714   -0.5481    0.0000 H   0  0  0

+   -1.5917    1.5390    0.0000 H   0  0  0

+   -2.3952   -2.2219    0.0000 H   0  0  0

+   -3.8771    1.9900    0.0000 H   0  0  0

+   -4.6800   -1.7599    0.0000 H   0  0  0

+   -5.4779    0.3655    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  9 11  1  0

+  9 12  2  0

+ 11 13  2  0

+ 12 14  1  0

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+  8 10  2  0

+ 14 15  2  0

+  3 16  1  0

+  4 17  1  0

+  7 18  1  0

+  8 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98-88-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.3037    0.2064    0.0038 C   0  0  0

+    0.7168   -1.1293    0.0040 C   0  0  0

+    1.2595    1.2262    0.0002 C   0  0  0

+   -1.1318    0.5372    0.0010 C   0  0  0

+    2.0622   -1.4311    0.0008 C   0  0  0

+    2.6017    0.9086   -0.0029 C   0  0  0

+   -1.4869    1.6972    0.0008 O   0  0  0

+   -2.3153   -0.7328   -0.0018 Cl  0  0  0

+    3.0028   -0.4157   -0.0026 C   0  0  0

+    0.0124   -1.8918    0.0000 H   0  0  0

+    0.9600    2.2201    0.0000 H   0  0  0

+    2.3704   -2.4224    0.0000 H   0  0  0

+    3.3127    1.6649    0.0000 H   0  0  0

+    4.0144   -0.6489    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6  9  2  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+437-50-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -0.7564    0.5526    0.1834 C   0  0  0

+   -0.7936   -0.8466    0.2994 C   0  0  0

+    0.5568    1.2200    0.2772 C   0  0  0

+   -1.9239    1.2945   -0.0319 C   0  0  0

+    0.2795   -1.5934    0.5787 O   0  0  0

+   -2.0221   -1.4852    0.1302 C   0  0  0

+    1.7083    0.2987    0.1266 C   0  0  0

+    0.6826    2.4172    0.4609 O   0  0  0

+   -3.1303    0.6362   -0.1860 C   0  0  0

+   -1.8722    2.6491   -0.0885 O   0  0  0

+    1.4753   -1.0748    0.2767 C   0  0  0

+   -3.1701   -0.7519   -0.1122 C   0  0  0

+    2.9793    0.7891   -0.1598 C   0  0  0

+    2.5551   -1.9469    0.1054 C   0  0  0

+   -4.3523   -1.3968   -0.2809 O   0  0  0

+    4.0324   -0.0938   -0.3152 C   0  0  0

+    3.8083   -1.4607   -0.1853 C   0  0  0

+   -5.3418   -0.3919   -0.5114 C   0  0  0

+    5.2795    0.3714   -0.5930 O   0  0  0

+   -2.0680   -2.5149    0.0000 H   0  0  0

+   -4.0090    1.1749    0.0000 H   0  0  0

+   -1.8329    3.6791    0.0000 H   0  0  0

+    3.1483    1.8059    0.0000 H   0  0  0

+    2.3963   -2.9653    0.0000 H   0  0  0

+    4.6087   -2.1101    0.0000 H   0  0  0

+   -4.6074    0.3313    0.0000 H   0  0  0

+   -6.0650    0.3426    0.0000 H   0  0  0

+   -6.0763   -1.1151    0.0000 H   0  0  0

+    6.2452    0.7316    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  7 13  1  0

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+  6 20  1  0

+  9 21  1  0

+ 10 22  1  0

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+ 14 24  1  0

+ 17 25  1  0

+ 18 26  1  0

+ 18 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117-80-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -1.5051    0.7031   -0.0023 C   0  0  0

+   -1.5051   -0.7031   -0.0019 C   0  0  0

+   -0.2160    1.4285   -0.0016 C   0  0  0

+   -2.7112    1.3933    0.0024 C   0  0  0

+   -0.2160   -1.4285   -0.0008 C   0  0  0

+   -2.7112   -1.3933   -0.0021 C   0  0  0

+    1.0498    0.6718   -0.0004 C   0  0  0

+   -0.2001    2.6433   -0.0023 O   0  0  0

+   -3.9064    0.6908    0.0075 C   0  0  0

+    1.0498   -0.6718   -0.0001 C   0  0  0

+   -0.2001   -2.6433   -0.0001 O   0  0  0

+   -3.9064   -0.6908   -0.0026 C   0  0  0

+    2.5597    1.5283    0.0005 Cl  0  0  0

+    2.5597   -1.5283    0.0013 Cl  0  0  0

+   -2.7172    2.4355    0.0000 H   0  0  0

+   -2.7172   -2.4355    0.0000 H   0  0  0

+   -4.8110    1.2084    0.0000 H   0  0  0

+   -4.8110   -1.2084    0.0000 H   0  0  0

+  1  2  2  0

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+  7 10  2  0

+  9 12  1  0

+  4 15  1  0

+  6 16  1  0

+  9 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91254-96-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -0.1880   -0.2889    0.0017 C   0  0  0

+   -1.4315    0.4993   -0.0190 C   0  0  0

+    1.0992    0.4293   -0.0032 C   0  0  0

+   -0.2354   -1.5996    0.0293 C   0  0  0

+   -2.5971   -0.1027   -0.0149 C   0  0  0

+   -1.3309    1.9697   -0.0436 C   0  0  0

+    2.2195   -0.2594    0.0152 C   0  0  0

+    1.1048    1.8996   -0.0281 C   0  0  0

+   -1.5415   -2.2801    0.0398 C   0  0  0

+    1.0209   -2.3679    0.0498 C   0  0  0

+   -2.6556   -1.5742    0.0098 C   0  0  0

+   -3.8280    0.7056   -0.0357 C   0  0  0

+   -0.0033    2.6020   -0.0475 C   0  0  0

+   -2.4318    2.6889   -0.0621 C   0  0  0

+    2.1750   -1.7325    0.0404 C   0  0  0

+    3.4121    0.3838    0.0106 N   0  3  0

+   -1.5992   -3.6406    0.0684 O   0  0  0

+   -3.7454    2.0202   -0.0581 C   0  0  0

+    4.2359    0.1332   -0.8508 O   0  0  0

+    3.6602    1.2127    0.8679 O   0  5  0

+    2.0006    2.3901    0.0000 H   0  0  0

+    0.9976   -3.3889    0.0000 H   0  0  0

+   -3.5600   -2.0487    0.0000 H   0  0  0

+   -4.7415    0.2490    0.0000 H   0  0  0

+    0.0582    3.6214    0.0000 H   0  0  0

+   -2.3768    3.7087    0.0000 H   0  0  0

+    3.0463   -2.2653    0.0000 H   0  0  0

+   -1.6425   -4.6610    0.0000 H   0  0  0

+   -4.5989    2.5810    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+523-66-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.3040   -0.5559   -0.1353 C   0  0  0

+   -1.0118   -1.0562   -0.2145 C   0  0  0

+    0.5028    0.8388    0.0289 C   0  0  0

+    1.4128   -1.4154   -0.2106 C   0  0  0

+   -2.0581   -0.1417   -0.1260 C   0  0  0

+   -1.2500   -2.3810   -0.3718 O   0  0  0

+   -0.5415    1.6691    0.1082 N   0  0  0

+    1.8162    1.3342    0.1075 C   0  0  0

+    2.6698   -0.9025   -0.1305 C   0  0  0

+   -1.7861    1.2333    0.0371 C   0  0  0

+   -3.5221   -0.2540   -0.1629 C   0  0  0

+   -1.4747   -2.9180    0.9333 C   0  0  0

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+   -2.9776    1.8652    0.0906 O   0  0  0

+   -3.9939    0.9910   -0.0268 C   0  0  0

+    4.1390    0.9580    0.1020 O   0  0  0

+    5.0182   -0.1626   -0.0130 C   0  0  0

+    1.2742   -2.4283    0.0000 H   0  0  0

+    1.9808    2.3432    0.0000 H   0  0  0

+    3.4743   -1.5332    0.0000 H   0  0  0

+   -4.0703   -1.1169    0.0000 H   0  0  0

+   -2.4178   -2.5234    0.0000 H   0  0  0

+   -1.8693   -3.8611    0.0000 H   0  0  0

+   -0.5316   -3.3126    0.0000 H   0  0  0

+   -4.9847    1.2430    0.0000 H   0  0  0

+    4.2139   -0.7936    0.0000 H   0  0  0

+    5.6492   -0.9669    0.0000 H   0  0  0

+    5.8225    0.4684    0.0000 H   0  0  0

+  1  2  2  0

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+  3  7  2  0

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+  8 13  2  0

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+  7 10  1  0

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+  4 18  1  0

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+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 15 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118-79-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -1.2529   -0.0001    0.0005 C   0  0  0

+   -0.5581   -1.2011    0.0000 C   0  0  0

+   -0.5578    1.2012    0.0005 C   0  0  0

+   -2.6124   -0.0001   -0.0048 O   0  0  0

+    0.8245   -1.1986   -0.0004 C   0  0  0

+   -1.5014   -2.8400    0.0006 Br  0  0  0

+    0.8243    1.1987    0.0002 C   0  0  0

+   -1.5010    2.8402    0.0005 Br  0  0  0

+    1.5150   -0.0002   -0.0003 C   0  0  0

+    3.4060   -0.0002   -0.0002 Br  0  0  0

+   -3.6516   -0.0001    0.0000 H   0  0  0

+    1.3453   -2.0979    0.0000 H   0  0  0

+    1.3451    2.0979    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  9 10  1  0

+  7  9  1  0

+  4 11  1  0

+  5 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+504-78-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    1.3457   -0.8129   -0.0670 C   0  0  0

+   -0.0719   -1.4253   -0.1160 C   0  0  0

+    1.3618    0.6202    0.2351 N   0  0  0

+   -1.1336    0.0698    0.0799 S   0  0  0

+    0.1637    1.3285   -0.3047 C   0  0  0

+    1.6525   -1.9297    0.0000 H   0  0  0

+    2.4943   -0.6646    0.0000 H   0  0  0

+   -1.0607   -2.0283    0.0000 H   0  0  0

+    0.4605   -2.4538    0.0000 H   0  0  0

+    2.3710    1.1884    0.0000 H   0  0  0

+    0.8392    2.2692    0.0000 H   0  0  0

+   -0.7134    2.0849    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  5  1  0

+  1  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24903-48-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -1.4208   -0.1678   -0.0022 C   0  0  0

+   -2.8839   -0.2996   -0.0016 C   0  0  0

+   -0.8457    1.1283   -0.0004 C   0  0  0

+   -0.6087   -1.2941    0.0012 C   0  0  0

+   -3.6818    0.8642    0.0010 C   0  0  0

+   -3.4936   -1.5558   -0.0031 C   0  0  0

+    0.5424    1.2719   -0.0005 C   0  0  0

+   -1.7093    2.3058    0.0022 C   0  0  0

+    0.7799   -1.1508    0.0011 C   0  0  0

+   -3.0519    2.1804    0.0024 C   0  0  0

+   -5.0777    0.7375    0.0017 C   0  0  0

+   -4.8568   -1.6475   -0.0019 C   0  0  0

+    1.3552    0.1457   -0.0024 C   0  0  0

+    1.6410   -2.3301    0.0049 C   0  0  0

+   -5.6453   -0.5037   -0.0002 C   0  0  0

+    2.8170    0.2736   -0.0020 C   0  0  0

+    2.9851   -2.2082    0.0051 C   0  0  0

+    3.6126   -0.8943   -0.0034 C   0  0  0

+    3.4471    1.5182    0.0000 C   0  0  0

+    5.0078   -0.7448   -0.0024 C   0  0  0

+    4.7614    1.5905    0.0008 N   0  0  0

+    5.5330    0.5158   -0.0004 C   0  0  0

+   -1.0372   -2.2495    0.0000 H   0  0  0

+   -2.9084   -2.4241    0.0000 H   0  0  0

+    0.9706    2.2275    0.0000 H   0  0  0

+   -1.2800    3.2609    0.0000 H   0  0  0

+   -3.6507    3.0394    0.0000 H   0  0  0

+   -5.6829    1.5920    0.0000 H   0  0  0

+   -5.3123   -2.5904    0.0000 H   0  0  0

+    1.2094   -3.2841    0.0000 H   0  0  0

+   -6.6884   -0.5950    0.0000 H   0  0  0

+    3.5831   -3.0678    0.0000 H   0  0  0

+    2.8745    2.3949    0.0000 H   0  0  0

+    5.6343   -1.5838    0.0000 H   0  0  0

+    6.5733    0.6349    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+ 14 17  2  0

+ 16 18  2  0

+ 16 19  1  0

+ 18 20  1  0

+ 19 21  2  0

+ 20 22  2  0

+  8 10  2  0

+  9 13  2  0

+ 12 15  1  0

+ 17 18  1  0

+ 21 22  1  0

+  4 23  1  0

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+ 14 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+452-06-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+    0.7532    0.7399    0.0026 C   0  0  0

+    0.4978   -0.6455   -0.0006 C   0  0  0

+    2.1275    0.8732    0.0026 N   0  0  0

+   -0.3202    1.6171    0.0000 C   0  0  0

+   -0.7695   -1.0630   -0.0006 N   0  0  0

+    1.6945   -1.2621   -0.0023 N   0  0  0

+    2.6496   -0.3743   -0.0004 C   0  0  0

+   -1.5477    1.1220   -0.0054 N   0  0  0

+   -1.7601   -0.1883    0.0024 C   0  0  0

+   -3.0652   -0.6549    0.0022 N   0  0  0

+    2.6456    1.7398    0.0000 H   0  0  0

+   -0.1684    2.6153    0.0000 H   0  0  0

+    3.6365   -0.5875    0.0000 H   0  0  0

+   -3.8349   -0.0015    0.0000 H   0  0  0

+   -3.2462   -1.6482    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  9 10  1  0

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+  8  9  1  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+ 10 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-39-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    1.1892    0.6063    0.0675 C   0  0  0

+   -0.0438    1.2569    0.1577 N   0  0  0

+    1.7714    0.3864   -1.1748 C   0  0  0

+    1.8388    0.1828    1.2201 C   0  0  0

+   -1.2292    0.5220    0.0752 C   0  0  0

+    2.9901   -0.2570   -1.2602 C   0  0  0

+    3.0576   -0.4601    1.1273 C   0  0  0

+   -2.4515    1.1780    0.0037 C   0  0  0

+   -1.1877   -0.8668    0.0587 C   0  0  0

+    3.6314   -0.6824   -0.1110 C   0  0  0

+   -3.6213    0.4483   -0.0782 C   0  0  0

+   -2.3610   -1.5900   -0.0233 C   0  0  0

+   -3.5767   -0.9336   -0.0890 C   0  0  0

+   -0.0797    2.2902    0.0000 H   0  0  0

+    2.1962    1.3290    0.0000 H   0  0  0

+    1.3147   -0.7084    0.0000 H   0  0  0

+    3.5179    0.6320    0.0000 H   0  0  0

+    2.6290   -1.4009    0.0000 H   0  0  0

+   -2.4852    2.2113    0.0000 H   0  0  0

+   -0.2776   -1.3573    0.0000 H   0  0  0

+    4.5496   -1.1577    0.0000 H   0  0  0

+   -4.5333    0.9352    0.0000 H   0  0  0

+   -2.3314   -2.6235    0.0000 H   0  0  0

+   -4.4559   -1.4775    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  9 12  2  0

+ 11 13  2  0

+  7 10  2  0

+ 12 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+637-07-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    0.7412    0.7096    0.3252 C   0  0  0

+   -0.5461    1.0915    0.5362 O   0  0  0

+    1.3836    1.0551   -0.8545 C   0  0  0

+    1.4162   -0.0214    1.2922 C   0  0  0

+   -1.3593   -0.0649    0.3281 C   0  0  0

+    2.6922    0.6660   -1.0671 C   0  0  0

+    2.7243   -0.4086    1.0760 C   0  0  0

+   -2.7760    0.3621    0.0420 C   0  0  0

+   -0.8173   -0.8625   -0.8597 C   0  0  0

+   -1.3338   -0.9389    1.5836 C   0  0  0

+    3.3617   -0.0678   -0.1042 C   0  0  0

+   -3.7222   -0.5620   -0.1870 O   0  0  0

+   -3.0600    1.5363    0.0186 O   0  0  0

+    5.0056   -0.5562   -0.3739 Cl  0  0  0

+   -5.0871   -0.1505   -0.4627 C   0  0  0

+   -5.9579   -1.3887   -0.6855 C   0  0  0

+    1.2816    2.0494    0.0000 H   0  0  0

+    0.8882   -0.8701    0.0000 H   0  0  0

+    3.2232    1.5128    0.0000 H   0  0  0

+    2.8257   -1.4030    0.0000 H   0  0  0

+   -1.6440   -1.4243    0.0000 H   0  0  0

+   -0.2555   -1.6892    0.0000 H   0  0  0

+    0.0094   -0.3007    0.0000 H   0  0  0

+   -2.3329   -0.9680    0.0000 H   0  0  0

+   -1.3047   -1.9380    0.0000 H   0  0  0

+   -0.3347   -0.9098    0.0000 H   0  0  0

+   -4.6983    0.7703    0.0000 H   0  0  0

+   -5.9612    0.3341    0.0000 H   0  0  0

+   -6.7755   -0.8137    0.0000 H   0  0  0

+   -6.5329   -2.2063    0.0000 H   0  0  0

+   -5.1403   -1.9637    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

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+  8 12  1  0

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+ 10 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-63-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.6515   -0.4010    0.0000 C   0  0  0

+   -0.6515    0.4010    0.0000 C   0  0  0

+    1.8419    0.5601    0.0000 C   0  0  0

+   -1.8419   -0.5601    0.0000 C   0  0  0

+    3.0588   -0.1890    0.0000 O   0  0  0

+   -3.0588    0.1890    0.0000 O   0  0  0

+   -0.0566   -1.3039    0.0000 H   0  0  0

+    1.4686   -1.2066    0.0000 H   0  0  0

+    0.0566    1.3039    0.0000 H   0  0  0

+   -1.4686    1.2066    0.0000 H   0  0  0

+    2.5500    1.4630    0.0000 H   0  0  0

+    1.0248    1.3657    0.0000 H   0  0  0

+   -2.5500   -1.4630    0.0000 H   0  0  0

+   -1.0248   -1.3657    0.0000 H   0  0  0

+    4.0360   -0.7905    0.0000 H   0  0  0

+   -4.0360    0.7905    0.0000 H   0  0  0

+  1  2  1  0

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+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+612-58-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.2437    0.6557   -0.0028 C   0  0  0

+   -0.4495   -0.7464   -0.0009 C   0  0  0

+    1.0731    1.1521   -0.0024 C   0  0  0

+   -1.3509    1.5196    0.0007 C   0  0  0

+    0.6010   -1.5727    0.0017 N   0  0  0

+   -1.7645   -1.2441   -0.0014 C   0  0  0

+    2.1011    0.2523   -0.0001 C   0  0  0

+   -2.6093    1.0003    0.0059 C   0  0  0

+    1.8291   -1.1138    0.0026 C   0  0  0

+   -2.8141   -0.3782   -0.0036 C   0  0  0

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+    1.2594    2.1803    0.0000 H   0  0  0

+   -1.2096    2.5550    0.0000 H   0  0  0

+   -1.9351   -2.2750    0.0000 H   0  0  0

+   -3.4326    1.6438    0.0000 H   0  0  0

+    2.6250   -1.7909    0.0000 H   0  0  0

+   -3.7896   -0.7529    0.0000 H   0  0  0

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+  1  2  1  0

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+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+577-19-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    1.0825    0.3736    0.0027 C   0  0  0

+    0.2143   -0.7030    0.0001 C   0  0  0

+    2.4483    0.1599    0.0026 C   0  0  0

+    0.5494    1.7543   -0.0006 N   0  3  0

+    0.7132   -1.9934   -0.0026 C   0  0  0

+   -1.6540   -0.4113    0.0009 Br  0  0  0

+    2.9463   -1.1295    0.0000 C   0  0  0

+    1.3141    2.7024    0.0017 O   0  0  0

+   -0.6539    1.9425   -0.0056 O   0  5  0

+    2.0787   -2.2060   -0.0026 C   0  0  0

+    3.0992    0.9670    0.0000 H   0  0  0

+    0.0627   -2.8008    0.0000 H   0  0  0

+    3.9708   -1.2895    0.0000 H   0  0  0

+    2.4527   -3.1731    0.0000 H   0  0  0

+  1  2  2  0

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+  5 10  2  0

+  7 10  1  0

+  3 11  1  0

+  5 12  1  0

+  7 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2528-36-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 42                          1 V2000

+   -0.0330    0.8028   -0.0896 P   0  0  0

+   -0.0194   -0.2894   -1.2724 O   0  0  0

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+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

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+ 15 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 18 39  1  0

+ 19 40  1  0

+ 19 41  1  0

+ 19 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97461-39-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 30                          1 V2000

+    4.5639    0.2100   -0.3157 C   0  0  0

+    3.5961    0.5754    0.6701 O   0  0  0

+    3.8534   -0.1222   -1.6294 C   0  0  0

+    5.5296    1.3756   -0.5389 C   0  0  0

+    5.3450   -1.0144    0.1655 C   0  0  0

+    2.5315   -0.2352    0.4910 C   0  0  0

+    1.2305    0.3117    0.4246 C   0  0  0

+    2.6925   -1.4371    0.3866 O   0  0  0

+    0.1599   -0.5034    0.2444 C   0  0  0

+   -1.1433    0.0444    0.1779 C   0  0  0

+   -2.2888   -0.6474    0.0030 O   0  0  0

+   -1.4703    1.3807    0.2863 C   0  0  0

+   -3.3253    0.2019   -0.0088 C   0  0  0

+   -2.8653    1.4615    0.1623 C   0  0  0

+   -4.7459   -0.1784   -0.1787 N   0  3  0

+   -5.6107    0.6793   -0.1738 O   0  0  0

+   -5.0499   -1.3489   -0.3235 O   0  5  0

+    3.4274    0.7889    0.0000 H   0  0  0

+    2.9423   -0.5482    0.0000 H   0  0  0

+    4.2794   -1.0333    0.0000 H   0  0  0

+    6.3041    0.7340    0.0000 H   0  0  0

+    6.1712    2.1501    0.0000 H   0  0  0

+    4.7551    2.0172    0.0000 H   0  0  0

+    4.4971   -1.5553    0.0000 H   0  0  0

+    5.8859   -1.8623    0.0000 H   0  0  0

+    6.1929   -0.4735    0.0000 H   0  0  0

+    1.1037    1.3094    0.0000 H   0  0  0

+    0.2867   -1.5011    0.0000 H   0  0  0

+   -0.8268    2.1536    0.0000 H   0  0  0

+   -3.4176    2.3020    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  6  8  2  0

+  7  9  2  0

+  9 10  1  0

+ 10 11  1  0

+ 10 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 15 16  2  0

+ 15 17  1  0

+ 13 14  2  0

+  3 18  1  0

+  3 19  1  0

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+  4 21  1  0

+  4 22  1  0

+  4 23  1  0

+  5 24  1  0

+  5 25  1  0

+  5 26  1  0

+  7 27  1  0

+  9 28  1  0

+ 12 29  1  0

+ 14 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4368-56-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 51                          1 V2000

+   -0.7043    0.2002   -0.4701 C   0  0  0

+   -1.0067   -1.1387   -0.1368 C   0  0  0

+    0.6296    0.5904   -0.6148 C   0  0  0

+   -1.7960    1.1704   -0.6553 C   0  0  0

+   -2.4109   -1.5528    0.0177 C   0  0  0

+    0.0322   -2.0557    0.0435 C   0  0  0

+    1.6511   -0.3469   -0.4284 C   0  0  0

+    0.9396    1.9016   -0.9414 N   0  0  0

+   -3.1585    0.8191   -0.1989 C   0  0  0

+   -1.5803    2.2474   -1.1775 O   0  0  0

+   -3.4612   -0.5165    0.1236 C   0  0  0

+   -2.7039   -2.7325    0.0575 O   0  0  0

+    1.3592   -1.6397   -0.1069 C   0  0  0

+   -0.2513   -3.3727    0.3709 N   0  0  0

+    1.8750    2.6623   -0.1091 C   0  0  0

+   -4.1440    1.7955   -0.0942 C   0  0  0

+   -4.7435   -0.8488    0.5488 C   0  0  0

+    2.6671   -2.7980    0.1214 S   0  0  0

+    2.7433    3.5522   -1.0007 C   0  0  0

+    1.0905    3.5347    0.8729 C   0  0  0

+   -5.4126    1.4488    0.3352 C   0  0  0

+   -5.7131    0.1337    0.6424 C   0  0  0

+    3.9776   -2.0486   -0.0727 O   0  0  0

+    2.6283   -3.1584    1.4954 O   0  0  0

+    2.5753   -3.7040   -0.9695 O   0  0  0

+    3.7202    4.3466   -0.1315 C   0  0  0

+    2.0674    4.3291    1.7421 C   0  0  0

+    2.9357    5.2191    0.8505 C   0  0  0

+    2.6155   -0.0452    0.0000 H   0  0  0

+    0.0835    2.4385    0.0000 H   0  0  0

+   -1.2132   -3.6825    0.0000 H   0  0  0

+    0.4979   -4.0508    0.0000 H   0  0  0

+    2.5565    1.9162    0.0000 H   0  0  0

+   -3.8872    2.7728    0.0000 H   0  0  0

+   -5.0123   -1.8229    0.0000 H   0  0  0

+    2.5451    4.5431    0.0000 H   0  0  0

+    1.7744    3.8391    0.0000 H   0  0  0

+    0.4401    4.3080    0.0000 H   0  0  0

+    0.3280    2.8716    0.0000 H   0  0  0

+   -6.1420    2.1481    0.0000 H   0  0  0

+   -6.6851   -0.1427    0.0000 H   0  0  0

+    4.8548   -1.5470    0.0000 H   0  0  0

+    4.3706    3.5732    0.0000 H   0  0  0

+    4.4827    5.0097    0.0000 H   0  0  0

+    2.2656    3.3382    0.0000 H   0  0  0

+    3.0364    4.0423    0.0000 H   0  0  0

+    3.6722    5.9110    0.0000 H   0  0  0

+    2.2280    5.9404    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 13 18  1  0

+ 15 19  1  0

+ 15 20  1  0

+ 16 21  2  0

+ 17 22  2  0

+ 18 23  1  0

+ 18 24  2  0

+ 18 25  2  0

+ 19 26  1  0

+ 20 27  1  0

+ 26 28  1  0

+  7 13  2  0

+  9 11  2  0

+ 21 22  1  0

+ 27 28  1  0

+  7 29  1  0

+  8 30  1  0

+ 14 31  1  0

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+ 21 40  1  0

+ 22 41  1  0

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+ 26 43  1  0

+ 26 44  1  0

+ 27 45  1  0

+ 27 46  1  0

+ 28 47  1  0

+ 28 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+79-15-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    1.6952    0.0267   -0.0012 C   0  0  0

+    0.5400    0.9946    0.0017 C   0  0  0

+    2.9613    0.4886   -0.0005 N   0  0  0

+    1.4854   -1.1678    0.0009 O   0  0  0

+   -1.1527   -0.0053   -0.0002 Br  0  0  0

+    1.3159    1.7322    0.0000 H   0  0  0

+   -0.1052    1.8489    0.0000 H   0  0  0

+    3.7819   -0.1989    0.0000 H   0  0  0

+    3.1464    1.5430    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+446-86-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -1.2646    0.2333   -0.0212 C   0  0  0

+   -2.5046   -0.3908    0.2436 C   0  0  0

+    0.2062   -0.2962    0.7918 S   0  0  0

+   -1.2363    1.2304   -0.9072 N   0  0  0

+   -3.6474    0.0843   -0.4446 C   0  0  0

+   -2.9090   -1.3910    1.0375 N   0  0  0

+    1.6963    0.4759    0.4540 C   0  0  0

+   -2.3289    1.6276   -1.5219 C   0  0  0

+   -4.6969   -0.6868   -0.0044 N   0  0  0

+   -3.5124    1.0824   -1.2995 N   0  0  0

+   -4.1961   -1.5717    0.8981 C   0  0  0

+    2.9263   -0.1377   -0.0930 C   0  0  0

+    2.0115    1.8084    0.6266 N   0  0  0

+    3.8117    0.8310   -0.1844 N   0  0  0

+    3.1223   -1.5607   -0.4635 N   0  3  0

+    3.2883    1.9738    0.2336 C   0  0  0

+    1.1206    2.8509    1.1422 C   0  0  0

+    4.1946   -1.9328   -0.9056 O   0  0  0

+    2.0629   -2.4865   -0.3033 O   0  5  0

+   -2.3694    2.6035    0.0000 H   0  0  0

+   -5.6520   -0.4822    0.0000 H   0  0  0

+   -4.6281   -2.4477    0.0000 H   0  0  0

+    3.7619    2.8280    0.0000 H   0  0  0

+    1.8631    3.4855    0.0000 H   0  0  0

+    0.4860    3.5934    0.0000 H   0  0  0

+    0.3781    2.2163    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  2  0

+  7 13  1  0

+ 12 14  1  0

+ 12 15  1  0

+ 13 16  1  0

+ 13 17  1  0

+ 15 18  2  0

+ 15 19  1  0

+  8 10  2  0

+  9 11  1  0

+ 14 16  2  0

+  8 20  1  0

+  9 21  1  0

+ 11 22  1  0

+ 16 23  1  0

+ 17 24  1  0

+ 17 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+30269-02-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.0327   -0.7603    0.0121 C   0  0  0

+   -1.3684   -0.3079   -0.0057 C   0  0  0

+    1.0996    0.2567    0.0024 C   0  0  0

+    0.3144   -2.0413    0.0415 C   0  0  0

+   -1.6386    1.1409   -0.0324 C   0  0  0

+   -2.3465   -1.1822    0.0027 C   0  0  0

+    2.3564   -0.1302    0.0182 C   0  0  0

+    0.7374    1.6817   -0.0253 C   0  0  0

+   -0.7802   -3.0265    0.0568 C   0  0  0

+    1.7229   -2.4712    0.0590 C   0  0  0

+   -0.5111    2.0849   -0.0412 C   0  0  0

+   -2.8844    1.5621   -0.0484 C   0  0  0

+   -2.0354   -2.6214    0.0303 C   0  0  0

+   -3.7404   -0.7072   -0.0153 C   0  0  0

+    2.6815   -1.5676    0.0453 C   0  0  0

+    3.3504    0.7906    0.0092 N   0  3  0

+   -3.9891    0.5863   -0.0395 C   0  0  0

+   -3.1517    2.8902   -0.0726 N   0  0  0

+    4.2086    0.7519   -0.8543 O   0  0  0

+    3.3857    1.6570    0.8645 O   0  5  0

+    1.4784    2.3771    0.0000 H   0  0  0

+   -0.5680   -4.0203    0.0000 H   0  0  0

+    1.9544   -3.4607    0.0000 H   0  0  0

+   -0.7054    3.0824    0.0000 H   0  0  0

+   -2.7888   -3.3034    0.0000 H   0  0  0

+   -4.5070   -1.3743    0.0000 H   0  0  0

+    3.6535   -1.8643    0.0000 H   0  0  0

+   -4.9509    0.9143    0.0000 H   0  0  0

+   -2.3892    3.5620    0.0000 H   0  0  0

+   -4.1147    3.2147    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

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+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

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+  7 15  1  0

+  7 16  1  0

+ 12 17  1  0

+ 12 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  8 11  2  0

+  9 13  2  0

+ 10 15  2  0

+ 14 17  2  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134-32-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.4009    0.9238   -0.0026 C   0  0  0

+   -0.0142   -0.4391   -0.0010 C   0  0  0

+    0.5868    1.9232   -0.0018 C   0  0  0

+   -1.7680    1.2514    0.0010 C   0  0  0

+    1.3584   -0.7680    0.0007 C   0  0  0

+   -1.0022   -1.4360   -0.0018 C   0  0  0

+    1.9040    1.5775    0.0004 C   0  0  0

+   -2.6985    0.2582    0.0060 C   0  0  0

+    2.2964    0.2426    0.0010 C   0  0  0

+    1.7617   -2.1015    0.0018 N   0  0  0

+   -2.3170   -1.0820   -0.0039 C   0  0  0

+    0.3108    2.9311    0.0000 H   0  0  0

+   -2.0682    2.2523    0.0000 H   0  0  0

+   -0.7301   -2.4449    0.0000 H   0  0  0

+    2.6320    2.3271    0.0000 H   0  0  0

+   -3.7141    0.5043    0.0000 H   0  0  0

+    3.3136    0.0032    0.0000 H   0  0  0

+    1.0467   -2.8636    0.0000 H   0  0  0

+    2.7792   -2.3396    0.0000 H   0  0  0

+   -3.0506   -1.8262    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+  7  9  2  0

+  8 11  1  0

+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21232-47-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    1.8775    1.0081    0.1048 C   0  0  0

+    0.4959    1.1999    0.1891 N   0  0  0

+    2.4031   -0.2771    0.1143 C   0  0  0

+    2.7272    2.1028    0.0055 C   0  0  0

+   -0.3686    0.0988    0.1363 N   0  3  0

+    3.7703   -0.4637    0.0308 C   0  0  0

+    4.0923    1.9110   -0.0777 C   0  0  0

+   -1.6729    0.2864    0.0859 C   0  0  0

+    0.0844   -1.0318    0.1370 O   0  5  0

+    4.6147    0.6298   -0.0623 C   0  0  0

+    4.4290   -2.0699    0.0432 Cl  0  0  0

+   -2.6006   -0.8609    0.0298 C   0  0  0

+   -2.2428    1.6509    0.0903 C   0  0  0

+    6.3313    0.3927   -0.1670 Cl  0  0  0

+   -3.9343   -0.6261   -0.0206 C   0  0  0

+   -3.5883    1.8020    0.0378 C   0  0  0

+   -4.4361    0.6871   -0.0205 C   0  0  0

+   -5.0378   -1.9647   -0.0869 Cl  0  0  0

+   -6.1531    0.9347   -0.0874 Cl  0  0  0

+    1.7639   -1.1022    0.0000 H   0  0  0

+    2.3346    3.0699    0.0000 H   0  0  0

+    4.7336    2.7345    0.0000 H   0  0  0

+   -2.2346   -1.8384    0.0000 H   0  0  0

+   -1.6165    2.4859    0.0000 H   0  0  0

+   -3.9990    2.7616    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  5  9  1  0

+  6 10  2  0

+  6 11  1  0

+  8 12  1  0

+  8 13  2  0

+ 10 14  1  0

+ 12 15  2  0

+ 13 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+ 17 19  1  0

+  7 10  1  0

+ 16 17  2  0

+  3 20  1  0

+  4 21  1  0

+  7 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+354-33-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.6060    0.0000    0.0157 C   0  0  0

+   -0.8420    0.0000    0.5098 C   0  0  0

+    1.2603    1.1423    0.4892 F   0  0  0

+    1.2603   -1.1423    0.4893 F   0  0  0

+    0.6213    0.0000   -1.3832 F   0  0  0

+   -1.4964    1.1423    0.0362 F   0  0  0

+   -1.4964   -1.1423    0.0362 F   0  0  0

+   -1.8293    0.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+49852-85-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -1.2878    0.2480    0.1609 C   0  0  0

+   -2.5678   -0.3203    0.0340 C   0  0  0

+   -1.1043    1.6198   -0.0877 C   0  0  0

+   -0.1566   -0.5920    0.5570 C   0  0  0

+   -3.6571    0.4981   -0.3433 C   0  0  0

+   -2.7600   -1.6979    0.2825 C   0  0  0

+    0.2390    2.1785    0.0533 C   0  0  0

+   -2.2041    2.4145   -0.4617 C   0  0  0

+    1.1040   -0.0323    0.6816 C   0  0  0

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+   -4.0421   -2.2342    0.1486 C   0  0  0

+    1.3125    1.3342    0.4330 C   0  0  0

+    0.4788    3.5377   -0.1830 C   0  0  0

+    2.2664   -0.9001    1.0901 C   0  0  0

+   -5.1011   -1.4245   -0.2215 C   0  0  0

+    2.6019    1.8877    0.5637 C   0  0  0

+    1.7395    4.0380   -0.0467 C   0  0  0

+    3.1158   -1.6555   -0.5140 Br  0  0  0

+    2.7977    3.2128    0.3261 C   0  0  0

+   -2.0937    3.4445    0.0000 H   0  0  0

+    0.4234   -2.6553    0.0000 H   0  0  0

+   -4.2623    2.5058    0.0000 H   0  0  0

+   -5.7603    0.5369    0.0000 H   0  0  0

+   -1.7515   -3.5636    0.0000 H   0  0  0

+   -4.1746   -3.2616    0.0000 H   0  0  0

+   -0.3242    4.1922    0.0000 H   0  0  0

+    3.2399   -0.5460    0.0000 H   0  0  0

+    2.4173    0.1248    0.0000 H   0  0  0

+   -6.0574   -1.8229    0.0000 H   0  0  0

+    3.4228    1.2558    0.0000 H   0  0  0

+    1.8864    5.0635    0.0000 H   0  0  0

+    3.7594    3.5979    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 22 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67450-45-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 55                          1 V2000

+   -3.5291   -0.7434   -0.6533 N   0  0  0

+   -2.5323   -1.1508    0.3400 C   0  0  1

+   -4.6849   -0.0660   -0.2478 C   0  0  0

+   -3.3305   -1.0159   -1.9582 C   0  0  0

+   -2.5857   -2.6878    0.5245 C   0  0  1

+   -1.1109   -0.9244   -0.2320 C   0  0  0

+   -4.7782    1.3099   -0.4118 C   0  0  0

+   -5.7422   -0.7693    0.3137 C   0  0  0

+   -4.0078   -2.2038   -2.5915 C   0  0  0

+   -2.6066   -0.3050   -2.6229 O   0  0  0

+   -1.1690   -3.0601    1.0085 C   0  0  0

+   -3.5635   -3.0220    1.5686 N   0  0  0

+   -0.2313   -1.9389    0.5275 C   0  0  0

+   -5.9205    1.9762   -0.0105 C   0  0  0

+   -6.8820   -0.0990    0.7133 C   0  0  0

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+   -6.0384    3.6961   -0.2142 Cl  0  0  0

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+   -2.4185   -0.1655    0.0000 H   0  0  0

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+   -7.7265   -0.6192    0.0000 H   0  0  0

+   -3.8218   -3.2566    0.0000 H   0  0  0

+   -2.6468   -2.4906    0.0000 H   0  0  0

+   -3.4128   -1.3156    0.0000 H   0  0  0

+   -4.4833   -4.5245    0.0000 H   0  0  0

+   -3.4445   -5.4669    0.0000 H   0  0  0

+   -2.5021   -4.4281    0.0000 H   0  0  0

+   -2.3000   -3.0170    0.0000 H   0  0  0

+   -2.4695   -1.6247    0.0000 H   0  0  0

+   -3.8618   -1.7942    0.0000 H   0  0  0

+   11.8236   -1.2185    0.0000 H   0  0  0

+   10.2726    0.2010    0.0000 H   0  0  0

+   15.5097   -0.7727    0.0000 H   0  0  0

+    9.4050    3.0369    0.0000 H   0  0  0

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+ 22 52  1  0

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+ 26 54  1  0

+ 28 55  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82617-23-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -1.0676    0.3371   -0.3850 C   0  0  0

+   -2.3523   -0.4899   -0.4658 C   0  0  0

+   -1.9954    0.2573    0.6989 O   0  0  0

+    0.0582   -0.5419   -0.1241 O   0  0  0

+    1.2990   -0.0315   -0.0119 C   0  0  0

+    2.3440   -0.8474    0.2304 N   0  0  0

+    1.4767    1.1649   -0.1290 O   0  0  0

+   -0.7846    1.2903    0.0000 H   0  0  0

+   -3.3410   -0.3843    0.0000 H   0  0  0

+   -2.1229   -1.4574    0.0000 H   0  0  0

+    2.2059   -1.8321    0.0000 H   0  0  0

+    3.2658   -0.4746    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  5  7  2  0

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+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  6 11  1  0

+  6 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+149996-82-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+   -0.3202    0.0097    0.2604 N   0  0  0

+   -1.7449    0.0231    0.6013 C   0  0  0

+    0.3491    1.1706    0.1160 C   0  0  0

+    0.2950   -1.1132    0.1038 N   0  0  0

+   -2.5763    0.0465   -0.6829 C   0  0  0

+    1.5241    1.1596   -0.1651 O   0  0  0

+    1.4796   -1.1243   -0.1796 O   0  0  0

+   -2.2245   -0.7671    0.0000 H   0  0  0

+   -1.2953   -0.7846    0.0000 H   0  0  0

+   -0.1096    1.9732    0.0000 H   0  0  0

+   -2.5503    0.9705    0.0000 H   0  0  0

+   -3.5003    0.0725    0.0000 H   0  0  0

+   -2.6023   -0.8775    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

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+  2  9  1  0

+  3 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+115044-41-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.2058   -0.1705   -0.0830 C   0  0  0

+   -1.2019   -0.1165   -0.0210 C   0  0  0

+    0.9362    1.0054   -0.0641 C   0  0  0

+    1.1046   -1.2293   -0.1718 N   0  0  0

+   -1.8449    1.1450    0.0600 C   0  0  0

+   -1.9372   -1.2321   -0.0376 N   0  0  0

+    2.2870    0.6635   -0.1367 N   0  0  0

+    0.2861    2.2424    0.0173 C   0  0  0

+    2.3781   -0.7083   -0.2016 C   0  0  0

+   -1.0698    2.3183    0.0765 C   0  0  0

+   -3.1799    1.2017    0.1191 N   0  0  0

+   -3.2474   -1.1503    0.0211 C   0  0  0

+    3.4123    1.6015   -0.1450 C   0  0  0

+    3.4826   -1.3968   -0.2816 N   0  0  0

+   -3.8808    0.0906    0.1016 C   0  0  0

+   -4.0747   -2.4098    0.0017 C   0  0  0

+    4.5421   -1.1431    0.6230 O   0  0  0

+    0.8585   -2.2379    0.0000 H   0  0  0

+    0.8476    3.1157    0.0000 H   0  0  0

+   -1.5359    3.2460    0.0000 H   0  0  0

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+    4.2098    2.2662    0.0000 H   0  0  0

+    2.7476    2.3990    0.0000 H   0  0  0

+   -4.9179    0.1377    0.0000 H   0  0  0

+   -4.9425   -1.8398    0.0000 H   0  0  0

+   -4.6447   -3.2776    0.0000 H   0  0  0

+   -3.2069   -2.9798    0.0000 H   0  0  0

+    5.5518   -0.9013    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4130-42-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 43                          1 V2000

+   -2.5061   -0.8460    0.0179 C   0  0  0

+   -3.6683    0.1425   -0.0967 C   0  0  0

+   -2.5872   -1.5750    1.3606 C   0  0  0

+   -2.5884   -1.8642   -1.1211 C   0  0  0

+   -1.2005   -0.0985   -0.0698 C   0  0  0

+    0.0006   -0.7876    0.0116 C   0  0  0

+   -1.1988    1.2729   -0.2373 C   0  0  0

+    0.0016   -2.1373    0.1707 O   0  0  0

+    1.2011   -0.0966   -0.0700 C   0  0  0

+   -0.0014    1.9591   -0.3183 C   0  0  0

+    2.5078   -0.8421    0.0176 C   0  0  0

+    1.1974    1.2751   -0.2321 C   0  0  0

+   -0.0025    3.4550   -0.5009 C   0  0  0

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+    2.5909   -1.5695    1.3611 C   0  0  0

+    2.5907   -1.8616   -1.1202 C   0  0  0

+   -0.0061    4.1360    0.8692 C   0  0  0

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+   -3.6201   -1.7808    0.0000 H   0  0  0

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+   -1.5567   -1.9476    0.0000 H   0  0  0

+   -2.0940    1.7924    0.0000 H   0  0  0

+    0.0024   -3.1724    0.0000 H   0  0  0

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+    0.8951    2.9395    0.0000 H   0  0  0

+    0.8919    3.9759    0.0000 H   0  0  0

+    4.3402   -0.6398    0.0000 H   0  0  0

+    4.4562    0.8194    0.0000 H   0  0  0

+    2.9970    0.9354    0.0000 H   0  0  0

+    1.5625   -1.6870    0.0000 H   0  0  0

+    2.7084   -2.5979    0.0000 H   0  0  0

+    3.6193   -1.4520    0.0000 H   0  0  0

+    1.5590   -1.9455    0.0000 H   0  0  0

+    2.6746   -2.8933    0.0000 H   0  0  0

+    3.6224   -1.7777    0.0000 H   0  0  0

+    1.0289    4.1415    0.0000 H   0  0  0

+   -0.0116    5.1711    0.0000 H   0  0  0

+   -1.0411    4.1305    0.0000 H   0  0  0

+  2  1  1  0

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+ 16 39  1  0

+ 16 40  1  0

+ 17 41  1  0

+ 17 42  1  0

+ 17 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97-23-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    1.1195    0.5107   -0.8746 C   0  0  0

+    0.0000    0.0000   -1.7446 C   0  0  0

+    1.1365    1.8385   -0.4739 C   0  0  0

+    2.1264   -0.3448   -0.4707 C   0  0  0

+   -1.1195   -0.5107   -0.8745 C   0  0  0

+    2.1680    2.3062    0.3275 C   0  0  0

+    0.1443    2.6804   -0.8663 O   0  0  0

+    3.1541    0.1235    0.3284 C   0  0  0

+   -1.1365   -1.8385   -0.4738 C   0  0  0

+   -2.1264    0.3448   -0.4707 C   0  0  0

+    3.1756    1.4492    0.7248 C   0  0  0

+    4.4179   -0.9535    0.8350 Cl  0  0  0

+   -2.1680   -2.3062    0.3276 C   0  0  0

+   -0.1443   -2.6805   -0.8662 O   0  0  0

+   -3.1541   -0.1234    0.3284 C   0  0  0

+   -3.1756   -1.4491    0.7249 C   0  0  0

+   -4.4179    0.9535    0.8350 Cl  0  0  0

+    0.0946    0.9864    0.0000 H   0  0  0

+   -0.8070    0.5751    0.0000 H   0  0  0

+    1.9897   -1.3263    0.0000 H   0  0  0

+    2.3058    3.2875    0.0000 H   0  0  0

+   -0.6113    3.3215    0.0000 H   0  0  0

+   -1.9897    1.3263    0.0000 H   0  0  0

+    4.0784    1.8577    0.0000 H   0  0  0

+   -2.3059   -3.2875    0.0000 H   0  0  0

+    0.6113   -3.3217    0.0000 H   0  0  0

+   -4.0784   -1.8576    0.0000 H   0  0  0

+  1  2  1  0

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+  4 20  1  0

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+  7 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+869-01-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+   -0.5732   -0.2842   -0.2761 N   0  0  0

+    0.7418   -0.2001   -0.9163 C   0  0  0

+   -1.2678    0.8404   -0.0131 C   0  0  0

+   -1.0686   -1.4350    0.0310 N   0  0  0

+    1.8273   -0.1101    0.1581 C   0  0  0

+   -2.3066    1.1899   -0.7975 N   0  0  0

+   -0.9576    1.5392    0.9311 O   0  0  0

+   -2.1815   -1.5079    0.5206 O   0  0  0

+    3.2006   -0.0223   -0.5105 C   0  0  0

+    4.2861    0.0676    0.5640 C   0  0  0

+    0.3754   -0.9520    0.0000 H   0  0  0

+    1.2141   -0.8904    0.0000 H   0  0  0

+    2.1937    0.6418    0.0000 H   0  0  0

+    1.3550    0.5802    0.0000 H   0  0  0

+   -2.4720    2.0098    0.0000 H   0  0  0

+   -2.9340    0.6367    0.0000 H   0  0  0

+    2.8341   -0.7742    0.0000 H   0  0  0

+    3.6729   -0.7127    0.0000 H   0  0  0

+    4.3551   -0.7660    0.0000 H   0  0  0

+    5.1197    0.1366    0.0000 H   0  0  0

+    4.2171    0.9012    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  1  0

+  9 10  1  0

+  2 11  1  0

+  2 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  9 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 10 20  1  0

+ 10 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23702-49-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 28                          1 V2000

+    0.8384   -0.1265    0.0365 C   0  0  0

+   -0.5819   -0.4538    0.0257 C   0  0  0

+    1.2402    1.2130    0.1483 C   0  0  0

+    1.7764   -1.1754   -0.0609 C   0  0  0

+   -1.5192    0.6022    0.0302 C   0  0  0

+   -0.9917   -1.7985    0.0039 C   0  0  0

+    0.3048    2.1765    0.3472 O   0  0  0

+    2.5893    1.5023    0.0765 C   0  0  0

+    1.3131   -2.5114   -0.0971 C   0  0  0

+    3.1353   -0.8447   -0.1203 C   0  0  0

+   -0.9823    1.9735   -0.0349 C   0  0  0

+   -2.8690    0.2968    0.0777 C   0  0  0

+   -0.0059   -2.8114   -0.0621 C   0  0  0

+   -2.3651   -2.0706    0.0466 C   0  0  0

+    3.5170    0.4780   -0.0625 C   0  0  0

+   -1.6726    2.8971   -0.4205 O   0  0  0

+   -3.2725   -1.0327    0.0901 C   0  0  0

+    2.9100    2.4973    0.0000 H   0  0  0

+    2.0105   -3.2902    0.0000 H   0  0  0

+    3.8588   -1.5994    0.0000 H   0  0  0

+   -3.5811    1.0622    0.0000 H   0  0  0

+   -0.3025   -3.8139    0.0000 H   0  0  0

+   -2.7023   -3.0602    0.0000 H   0  0  0

+    4.5355    0.7138    0.0000 H   0  0  0

+   -4.2946   -1.2526    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  2  0

+  6 13  1  0

+  6 14  1  0

+  8 15  2  0

+ 11 16  2  0

+ 12 17  1  0

+  7 11  1  0

+  9 13  2  0

+ 10 15  1  0

+ 14 17  2  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 15 24  1  0

+ 17 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+39965-42-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+    4.8927    0.1577   -0.0368 C   0  0  0

+    3.5357    0.6971    0.0807 N   0  0  0

+    5.0141   -0.6385   -1.3377 C   0  0  0

+    5.9000    1.3093   -0.0478 C   0  0  0

+    5.1812   -0.7609    1.1522 C   0  0  0

+    2.4757   -0.1351    0.0617 C   0  0  0

+    1.1621    0.3920    0.0510 C   0  0  0

+    2.6482   -1.3406    0.0538 O   0  0  0

+    0.0955   -0.4455    0.0319 C   0  0  0

+   -1.2187    0.0819    0.0212 C   0  0  0

+   -2.3625   -0.6338    0.0022 O   0  0  0

+   -1.5582    1.4189    0.0343 C   0  0  0

+   -3.4109    0.2010   -0.0030 C   0  0  0

+   -2.9601    1.4750    0.0162 C   0  0  0

+   -4.8340   -0.2067   -0.0234 N   0  3  0

+   -5.7099    0.6396   -0.0264 O   0  0  0

+   -5.1287   -1.3884   -0.0371 O   0  5  0

+    3.3906    1.7002    0.0000 H   0  0  0

+    4.0121   -0.7913    0.0000 H   0  0  0

+    5.1669   -1.6405    0.0000 H   0  0  0

+    6.0161   -0.4857    0.0000 H   0  0  0

+    6.6629    0.6420    0.0000 H   0  0  0

+    6.5673    2.0722    0.0000 H   0  0  0

+    5.1371    1.9766    0.0000 H   0  0  0

+    4.2142   -1.0646    0.0000 H   0  0  0

+    5.4849   -1.7279    0.0000 H   0  0  0

+    6.1482   -0.4572    0.0000 H   0  0  0

+    1.0186    1.3953    0.0000 H   0  0  0

+    0.2390   -1.4489    0.0000 H   0  0  0

+   -0.9200    2.2063    0.0000 H   0  0  0

+   -3.5285    2.3142    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  6  7  1  0

+  6  8  2  0

+  7  9  2  0

+  9 10  1  0

+ 10 11  1  0

+ 10 12  2  0

+ 11 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 15 16  2  0

+ 15 17  1  0

+ 13 14  2  0

+  2 18  1  0

+  3 19  1  0

+  3 20  1  0

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+  4 22  1  0

+  4 23  1  0

+  4 24  1  0

+  5 25  1  0

+  5 26  1  0

+  5 27  1  0

+  7 28  1  0

+  9 29  1  0

+ 12 30  1  0

+ 14 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+15110-74-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    1.4617    0.4866   -0.0141 C   0  0  0

+    0.0250    0.1152   -0.0029 C   0  0  0

+    1.5821    1.8733   -0.0081 C   0  0  0

+    2.6143   -0.3013   -0.0234 C   0  0  0

+   -0.7522    1.2699    0.0102 C   0  0  0

+   -0.6015   -1.1325   -0.0042 C   0  0  0

+    0.1878    2.4504    0.0076 C   0  0  0

+    2.8288    2.4625   -0.0164 C   0  0  0

+    3.8570    0.2967   -0.0330 C   0  0  0

+    2.5025   -1.7773   -0.0225 N   0  3  0

+   -2.1283    1.1812    0.0223 C   0  0  0

+   -1.9784   -1.2117    0.0072 C   0  0  0

+    3.9667    1.6758   -0.0308 C   0  0  0

+    3.0908   -2.4321    0.8194 O   0  0  0

+    1.8223   -2.3371   -0.8636 O   0  5  0

+   -2.7425   -0.0585    0.0215 C   0  0  0

+   -4.2198   -0.1512    0.0351 N   0  3  0

+   -4.7616   -1.2420    0.0344 O   0  0  0

+   -4.8935    0.8635    0.0468 O   0  5  0

+   -0.0316   -1.9996    0.0000 H   0  0  0

+    0.6722    3.3680    0.0000 H   0  0  0

+   -0.6806    3.0183    0.0000 H   0  0  0

+    2.9135    3.4966    0.0000 H   0  0  0

+    4.7129   -0.2899    0.0000 H   0  0  0

+   -2.7035    2.0448    0.0000 H   0  0  0

+   -2.4428   -2.1395    0.0000 H   0  0  0

+    4.9040    2.1208    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+ 10 14  2  0

+ 10 15  1  0

+ 11 16  2  0

+ 16 17  1  0

+ 17 18  2  0

+ 17 19  1  0

+  5  7  1  0

+  9 13  1  0

+ 12 16  1  0

+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+144-48-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    2.1151    0.0270   -0.0012 C   0  0  0

+    0.9931    1.0331    0.0018 C   0  0  0

+    3.3960    0.4461   -0.0007 N   0  0  0

+    1.8653   -1.1598    0.0010 O   0  0  0

+   -0.9043   -0.0033   -0.0001 I   0  0  0

+    1.7933    1.7442    0.0000 H   0  0  0

+    0.3770    1.9086    0.0000 H   0  0  0

+    4.1930   -0.2686    0.0000 H   0  0  0

+    3.6164    1.4937    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6804-07-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -2.5884    0.6560   -0.0022 C   0  0  0

+   -2.6837   -0.7531   -0.0015 C   0  0  0

+   -1.3804    1.2419   -0.0024 N   0  3  0

+   -3.7635    1.4256    0.0032 C   0  0  0

+   -1.5404   -1.5064   -0.0015 N   0  3  0

+   -3.9406   -1.3570   -0.0003 C   0  0  0

+   -0.2757    0.4970   -0.0015 C   0  0  0

+   -1.2942    2.4568   -0.0030 O   0  5  0

+   -4.9767    0.8049    0.0090 C   0  0  0

+   -0.3532   -0.8956   -0.0021 C   0  0  0

+   -1.6165   -2.9204   -0.0012 O   0  5  0

+   -5.0659   -0.5835    0.0001 C   0  0  0

+    1.0441    1.1526   -0.0012 C   0  0  0

+    2.1254    0.4345   -0.0003 N   0  0  0

+    3.3801    1.0578    0.0000 N   0  0  0

+    4.5029    0.3122    0.0009 C   0  0  0

+    4.4186   -1.0320    0.0016 O   0  0  0

+    5.5912    0.8528    0.0011 O   0  0  0

+    5.6282   -1.8352    0.0026 C   0  0  0

+   -3.7087    2.4496    0.0000 H   0  0  0

+   -4.0196   -2.3794    0.0000 H   0  0  0

+   -5.8339    1.3678    0.0000 H   0  0  0

+    0.5071   -1.4538    0.0000 H   0  0  0

+   -5.9883   -1.0316    0.0000 H   0  0  0

+    1.1082    2.1761    0.0000 H   0  0  0

+    3.4442    2.0813    0.0000 H   0  0  0

+    5.0609   -2.6895    0.0000 H   0  0  0

+    6.4825   -2.4025    0.0000 H   0  0  0

+    6.1955   -0.9809    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 17 19  1  0

+  7 10  1  0

+  9 12  1  0

+  4 20  1  0

+  6 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 19 27  1  0

+ 19 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7327-87-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -4.6956   -0.9834    0.1011 C   0  0  0

+   -5.7083   -0.0890   -0.3297 C   0  0  0

+   -3.5404   -0.4292    0.6996 C   0  0  0

+   -4.8665   -2.3595   -0.0818 C   0  0  0

+   -5.4914    1.2942   -0.1304 C   0  0  0

+   -6.8673   -0.5946   -0.9273 C   0  0  0

+   -3.4554    0.8805    0.8300 N   0  0  0

+   -2.5118   -1.2511    1.1436 N   0  0  0

+   -6.0065   -2.8199   -0.6727 C   0  0  0

+   -4.3699    1.6883    0.4409 N   0  0  0

+   -6.4444    2.2230   -0.5304 N   0  0  0

+   -7.0054   -1.9423   -1.0864 C   0  0  0

+   -1.4008   -0.7040    1.7202 N   0  0  0

+   -6.2236    3.5565   -0.3325 N   0  0  0

+    9.0818   -0.0244   -0.1800 S   0  0  0

+    7.9950    0.9355   -0.6424 O   0  0  0

+   10.2023    0.8121    0.4208 O   0  0  0

+    8.5192   -0.7516    0.9035 O   0  0  0

+    9.6199   -0.5974   -1.3638 O   0  0  0

+   -4.0835   -2.9612    0.0000 H   0  0  0

+   -7.6648   -0.0122    0.0000 H   0  0  0

+   -2.6185   -2.2328    0.0000 H   0  0  0

+   -6.1721   -3.7934    0.0000 H   0  0  0

+   -7.3827    1.9151    0.0000 H   0  0  0

+   -7.9246   -2.3030    0.0000 H   0  0  0

+   -0.5801   -1.2531    0.0000 H   0  0  0

+   -1.3357    0.2813    0.0000 H   0  0  0

+   -5.2993    3.9039    0.0000 H   0  0  0

+   -6.9866    4.1833    0.0000 H   0  0  0

+    7.2549    1.5892    0.0000 H   0  0  0

+   10.9936    1.4028    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 14  1  0

+ 15 16  1  0

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+  7 10  2  0

+  9 12  1  0

+  4 20  1  0

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+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64224-21-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.2784   -0.3190    0.0355 C   0  0  0

+   -1.7260   -0.0136    0.0290 C   0  0  0

+    0.7268    0.5929   -0.0485 C   0  0  0

+    0.4475   -1.9540    0.1632 S   0  0  0

+   -2.5183   -0.3994   -1.0532 C   0  0  0

+   -2.2782    0.6252    1.0575 N   0  0  0

+    2.1014    0.4242   -0.0515 C   0  0  0

+    0.2691    2.0247   -0.1567 C   0  0  0

+    2.4461   -1.3311    0.0852 S   0  0  0

+   -3.8094   -0.1242   -1.0537 N   0  0  0

+   -3.5694    0.8954    1.0473 C   0  0  0

+    3.2677    1.6724   -0.1639 S   0  0  0

+   -4.3512    0.5153   -0.0317 C   0  0  0

+   -2.3936   -1.4201    0.0000 H   0  0  0

+    1.2486    2.3378    0.0000 H   0  0  0

+   -0.0440    3.0042    0.0000 H   0  0  0

+   -0.7104    1.7116    0.0000 H   0  0  0

+   -3.6957    1.9159    0.0000 H   0  0  0

+   -5.3574    0.7273    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 10 13  2  0

+  7  9  1  0

+ 11 13  1  0

+  5 14  1  0

+  8 15  1  0

+  8 16  1  0

+  8 17  1  0

+ 11 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+92-87-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.7416   -0.0001   -0.0015 C   0  0  0

+   -0.7416    0.0001   -0.0015 C   0  0  0

+    1.4397    1.1346   -0.4115 C   0  0  0

+    1.4397   -1.1333    0.4140 C   0  0  0

+   -1.4397   -1.1346   -0.4115 C   0  0  0

+   -1.4397    1.1333    0.4140 C   0  0  0

+    2.8187    1.1322   -0.4107 C   0  0  0

+    2.8182   -1.1313    0.4132 C   0  0  0

+   -2.8187   -1.1322   -0.4107 C   0  0  0

+   -2.8182    1.1313    0.4132 C   0  0  0

+    3.5124   -0.0004   -0.0016 C   0  0  0

+   -3.5124    0.0004   -0.0016 C   0  0  0

+    4.9086   -0.0006   -0.0016 N   0  0  0

+   -4.9087    0.0006   -0.0016 N   0  0  0

+    0.9530    2.0072    0.0000 H   0  0  0

+    0.9531   -2.0060    0.0000 H   0  0  0

+   -0.9530   -2.0072    0.0000 H   0  0  0

+   -0.9531    2.0060    0.0000 H   0  0  0

+    3.3078    2.0035    0.0000 H   0  0  0

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+    5.4081   -0.8660    0.0000 H   0  0  0

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+   -5.4082    0.8660    0.0000 H   0  0  0

+   -5.4084   -0.8646    0.0000 H   0  0  0

+  1  2  1  0

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+  3  7  1  0

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+  6 10  2  0

+  7 11  2  0

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+ 10 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1694-09-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 93 96                          1 V2000

+   -0.7754   -2.4487    0.8335 C   0  0  0

+   -2.0400   -1.7092    0.8520 C   0  0  0

+    0.3878   -1.8932    0.1376 C   0  0  0

+   -0.6723   -3.7411    1.5161 C   0  0  0

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+   -2.3155   -0.8105    1.8955 C   0  0  0

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+   -1.0402   -4.9212    0.8495 C   0  0  0

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+   -3.4943   -0.1249    1.9085 C   0  0  0

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+   -0.1168   -5.0089    3.4719 C   0  0  0

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+    9.5186   -0.0975   -2.5731 S   0  0  0

+   -9.8657    5.3107   -0.4781 O   0  0  0

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+   10.1832    1.0704   -2.1109 O   0  0  0

+   10.1208   -1.3731   -2.7445 O   0  0  0

+    8.9334    0.2691   -3.9294 O   0  0  0

+   14.2072   14.7671    7.1258 Na  0  3  0

+   -3.1338   -2.8051    0.0000 H   0  0  0

+   -1.5974   -0.2408    0.0000 H   0  0  0

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+ 43 91  1  0

+ 47 92  1  0

+ 50 93  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+634-67-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.7461   -1.9413    0.0023 Cl  0  0  0

+   -0.2609   -0.2744    0.0032 C   0  0  0

+    1.0821    0.0545    0.0008 C   0  0  0

+   -1.2194    0.7256    0.0007 C   0  0  0

+    2.2838   -1.1983   -0.0022 Cl  0  0  0

+    1.4687    1.3896    0.0011 C   0  0  0

+   -2.9050    0.3102   -0.0028 Cl  0  0  0

+   -0.8359    2.0546    0.0006 C   0  0  0

+    2.8258    1.7257   -0.0019 N   0  0  0

+    0.5048    2.3888    0.0039 C   0  0  0

+   -1.5590    2.8047    0.0000 H   0  0  0

+    3.5484    0.9751    0.0000 H   0  0  0

+    3.1145    2.7267    0.0000 H   0  0  0

+    0.7923    3.3902    0.0000 H   0  0  0

+  2  1  1  0

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+ 10  6  2  0

+  8 10  1  0

+  8 11  1  0

+  9 12  1  0

+  9 13  1  0

+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81-15-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 36                          1 V2000

+   -0.9482    0.0004   -0.0108 C   0  0  0

+   -0.2574   -1.1971   -0.0023 C   0  0  0

+   -0.2568    1.1972   -0.0016 C   0  0  0

+   -2.4550    0.0010   -0.0364 C   0  0  0

+    1.1246   -1.1976    0.0154 C   0  0  0

+   -0.9979   -2.4788   -0.0126 N   0  3  0

+    1.1257    1.1967    0.0161 C   0  0  0

+   -0.9964    2.4793   -0.0112 N   0  3  0

+   -2.9894    0.0050    1.3972 C   0  0  0

+   -2.9522    1.2485   -0.7695 C   0  0  0

+   -2.9531   -1.2500   -0.7629 C   0  0  0

+    1.8163   -0.0005    0.0250 C   0  0  0

+    1.8776   -2.5030    0.0247 C   0  0  0

+   -1.0414   -3.1488   -1.0288 O   0  0  0

+   -1.5636   -2.8633    0.9952 O   0  5  0

+    1.8796    2.5015    0.0261 C   0  0  0

+   -1.5750    2.8561    0.9922 O   0  0  0

+   -1.0263    3.1575   -1.0224 O   0  5  0

+    3.2963   -0.0010    0.0444 N   0  3  0

+    3.9191   -0.0008   -1.0023 O   0  0  0

+    3.8914   -0.0017    1.1072 O   0  5  0

+   -2.9816    1.0416    0.0000 H   0  0  0

+   -4.0259    0.0128    0.0000 H   0  0  0

+   -2.9972   -1.0316    0.0000 H   0  0  0

+   -1.9893    1.6323    0.0000 H   0  0  0

+   -3.3360    2.2114    0.0000 H   0  0  0

+   -3.9151    0.8647    0.0000 H   0  0  0

+   -3.9161   -0.8666    0.0000 H   0  0  0

+   -3.3365   -2.2130    0.0000 H   0  0  0

+   -1.9901   -1.6334    0.0000 H   0  0  0

+    0.9797   -3.0209    0.0000 H   0  0  0

+    2.3955   -3.4009    0.0000 H   0  0  0

+    2.7755   -1.9851    0.0000 H   0  0  0

+    2.7771    1.9829    0.0000 H   0  0  0

+    2.3982    3.3990    0.0000 H   0  0  0

+    0.9821    3.0201    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+ 13 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 16 34  1  0

+ 16 35  1  0

+ 16 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+10595-95-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+   -0.0834   -0.2422    0.1981 N   0  0  0

+   -1.4427    0.0976    0.6260 C   0  0  0

+    0.8259    0.6716    0.1526 N   0  0  0

+    0.2447   -1.6211   -0.1723 C   0  0  0

+   -2.2741    0.5043   -0.5923 C   0  0  0

+    1.9560    0.3891   -0.2031 O   0  0  0

+   -2.2052   -0.4969    0.0000 H   0  0  0

+   -1.2424   -0.8483    0.0000 H   0  0  0

+   -0.6959   -1.8449    0.0000 H   0  0  0

+    0.4685   -2.5617    0.0000 H   0  0  0

+    1.1853   -1.3973    0.0000 H   0  0  0

+   -1.8493    1.3728    0.0000 H   0  0  0

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+   -2.6989   -0.3642    0.0000 H   0  0  0

+  1  2  1  0

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+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+69533-68-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.7414   -0.2712    0.0001 C   0  0  0

+   -0.7414   -0.2711    0.0012 C   0  0  0

+    1.4169    0.9332    0.1946 C   0  0  0

+    1.4557   -1.4480   -0.1967 C   0  0  0

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+   -1.4557   -1.4486    0.1941 C   0  0  0

+    2.7969    0.9508    0.1891 C   0  0  0

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+    2.8364   -1.4183   -0.1969 C   0  0  0

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+   -0.6392    2.2017   -0.4172 C   0  0  0

+   -2.8365   -1.4188    0.1949 C   0  0  0

+    3.5041   -0.2222   -0.0037 C   0  0  0

+   -3.5041   -0.2221    0.0048 C   0  0  0

+    4.9841   -0.1967   -0.0083 N   0  3  0

+   -4.9841   -0.1966    0.0092 N   0  3  0

+    5.6104   -1.2275   -0.1777 O   0  0  0

+    5.5756    0.8550    0.1574 O   0  5  0

+   -5.6105   -1.2272    0.1797 O   0  0  0

+   -5.5755    0.8550   -0.1577 O   0  5  0

+    0.9583   -2.3545    0.0000 H   0  0  0

+   -0.9582   -2.3550    0.0000 H   0  0  0

+    3.2996    1.8543    0.0000 H   0  0  0

+    1.6045    2.5726    0.0000 H   0  0  0

+    0.4507    3.2186    0.0000 H   0  0  0

+    3.3694   -2.3043    0.0000 H   0  0  0

+   -3.2994    1.8543    0.0000 H   0  0  0

+   -0.4509    3.2184    0.0000 H   0  0  0

+   -1.6045    2.5723    0.0000 H   0  0  0

+   -3.3697   -2.3047    0.0000 H   0  0  0

+  1  2  1  0

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+  8 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+38246-95-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -1.0535   -0.4442    0.0026 C   0  0  0

+   -0.2846   -1.5983    0.0010 C   0  0  0

+   -0.4391    0.7995    0.0031 C   0  0  0

+   -2.4106   -0.5318   -0.0018 O   0  0  0

+    1.0939   -1.5103   -0.0003 C   0  0  0

+    0.9389    0.8894    0.0018 C   0  0  0

+   -2.9109    0.8068    0.0014 C   0  0  0

+    1.7097   -0.2659    0.0000 C   0  0  0

+   -4.4407    0.7795   -0.0034 C   0  0  0

+    3.1062   -0.1758   -0.0017 N   0  0  0

+    3.7337    1.0935   -0.0013 O   0  0  0

+   -0.7466   -2.5315    0.0000 H   0  0  0

+   -1.0172    1.6656    0.0000 H   0  0  0

+    1.6711   -2.3770    0.0000 H   0  0  0

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+   -4.4593    1.8207    0.0000 H   0  0  0

+   -5.4819    0.7609    0.0000 H   0  0  0

+   -4.4221   -0.2617    0.0000 H   0  0  0

+    3.6839   -1.0422    0.0000 H   0  0  0

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+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57011-48-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.0383    0.0355   -0.1796 C   0  0  0

+   -1.1548    0.8342    0.3491 C   0  0  0

+    1.2406    0.2436    0.7435 C   0  0  0

+   -0.2976   -1.3529   -0.2186 O   0  0  0

+   -2.3060    0.6350   -0.5348 N   0  0  0

+    2.3830   -0.5212    0.2373 N   0  0  0

+   -3.2545    0.1881   -0.1301 N   0  3  0

+    3.3324    0.0088   -0.0476 N   0  3  0

+   -4.2031   -0.2589    0.2747 N   0  5  0

+    4.2817    0.5389   -0.3325 N   0  5  0

+    0.2203    0.8926    0.0000 H   0  0  0

+   -0.4909    1.4060    0.0000 H   0  0  0

+   -1.5290    1.6265    0.0000 H   0  0  0

+    1.9045    0.8154    0.0000 H   0  0  0

+    0.8664    1.0359    0.0000 H   0  0  0

+   -0.5036   -2.2046    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  3  1  0

+  7  5  2  0

+  8  6  2  0

+  9  7  2  0

+ 10  8  2  0

+  1 11  1  0

+  2 12  1  0

+  2 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+367-25-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.7849    0.6570    0.0020 C   0  0  0

+   -1.1412   -0.6870    0.0005 C   0  0  0

+    0.5505    1.0165    0.0020 C   0  0  0

+   -1.7420    1.6105   -0.0020 F   0  0  0

+   -0.1553   -1.6640   -0.0012 C   0  0  0

+   -2.4921   -1.0542    0.0010 N   0  0  0

+    1.5311    0.0390    0.0003 C   0  0  0

+    1.1775   -1.2997   -0.0012 C   0  0  0

+    2.8352    0.3920   -0.0002 F   0  0  0

+    0.8179    2.0199    0.0000 H   0  0  0

+   -0.4193   -2.6683    0.0000 H   0  0  0

+   -3.2290   -0.3226    0.0000 H   0  0  0

+   -2.7572   -2.0582    0.0000 H   0  0  0

+    1.9149   -2.0308    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+88193-04-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 44                          1 V2000

+    0.7315   -0.5256    0.0016 C   0  0  0

+   -0.7318   -0.5258    0.0012 C   0  0  0

+    1.7472    0.5209    0.0008 C   0  0  0

+    1.1327   -1.8645   -0.0036 C   0  0  0

+   -1.7474    0.5208    0.0002 C   0  0  0

+   -1.1334   -1.8646    0.0024 C   0  0  0

+    3.1123    0.1442    0.0017 C   0  0  0

+    1.4056    1.8780   -0.0013 C   0  0  0

+   -0.0004   -2.6528   -0.0071 N   0  0  0

+    2.4985   -2.1823   -0.0040 C   0  0  0

+   -3.1126    0.1446    0.0005 C   0  0  0

+   -1.4047    1.8777    0.0001 C   0  0  0

+   -2.4992   -2.1820    0.0026 C   0  0  0

+    3.4543   -1.2219    0.0029 C   0  0  0

+    4.0994    1.1425    0.0010 C   0  0  0

+    2.3897    2.8220   -0.0024 C   0  0  0

+   -3.4549   -1.2214    0.0012 C   0  0  0

+   -4.0990    1.1436   -0.0004 C   0  0  0

+   -2.3882    2.8223    0.0002 C   0  0  0

+    4.9071   -1.6223    0.0039 C   0  0  0

+    3.7323    2.4545   -0.0006 C   0  0  0

+   -4.9078   -1.6214    0.0015 C   0  0  0

+   -3.7310    2.4553   -0.0015 C   0  0  0

+    0.3968    2.1679    0.0000 H   0  0  0

+   -0.0004   -3.7024    0.0000 H   0  0  0

+    2.7882   -3.1912    0.0000 H   0  0  0

+   -0.3957    2.1669    0.0000 H   0  0  0

+   -2.7891   -3.1908    0.0000 H   0  0  0

+    5.1155    0.8793    0.0000 H   0  0  0

+    2.1313    3.8393    0.0000 H   0  0  0

+   -5.1153    0.8811    0.0000 H   0  0  0

+   -2.1293    3.8395    0.0000 H   0  0  0

+    4.6282   -2.6342    0.0000 H   0  0  0

+    5.9190   -1.9012    0.0000 H   0  0  0

+    5.1860   -0.6104    0.0000 H   0  0  0

+    4.4724    3.1988    0.0000 H   0  0  0

+   -5.1864   -0.6094    0.0000 H   0  0  0

+   -5.9198   -1.9000    0.0000 H   0  0  0

+   -4.6292   -2.6334    0.0000 H   0  0  0

+   -4.4707    3.2000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  2  0

+ 11 17  1  0

+ 11 18  1  0

+ 12 19  2  0

+ 14 20  1  0

+ 15 21  2  0

+ 17 22  1  0

+ 18 23  2  0

+  6  9  1  0

+ 10 14  2  0

+ 13 17  2  0

+ 16 21  1  0

+ 19 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1210-35-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+   -1.2905    0.5367    0.0818 C   0  0  0

+   -1.6244   -0.7608    0.3957 C   0  0  0

+    0.0104    1.0362    0.5649 C   0  0  0

+   -2.1529    1.3457   -0.6574 C   0  0  0

+   -0.6753   -1.6164    1.1758 C   0  0  0

+   -2.8429   -1.2728   -0.0182 C   0  0  0

+    1.2795    0.4295    0.1267 C   0  0  0

+    0.0362    1.9703    1.3422 O   0  0  0

+   -3.3658    0.8272   -1.0701 C   0  0  0

+    0.5273   -2.0435    0.3790 C   0  0  0

+   -3.7066   -0.4753   -0.7488 C   0  0  0

+    1.4849   -0.9351    0.0216 C   0  0  0

+    2.3153    1.3242   -0.1972 C   0  0  0

+    2.7260   -1.3810   -0.4403 C   0  0  0

+    3.5329    0.8619   -0.6375 C   0  0  0

+    3.7339   -0.5015   -0.7642 C   0  0  0

+   -1.9795    2.3278    0.0000 H   0  0  0

+   -1.5757   -2.0451    0.0000 H   0  0  0

+   -0.6239   -2.6123    0.0000 H   0  0  0

+   -3.0154   -2.2550    0.0000 H   0  0  0

+   -4.1212    1.4783    0.0000 H   0  0  0

+    0.0801   -2.9349    0.0000 H   0  0  0

+    1.3566   -2.5973    0.0000 H   0  0  0

+   -4.6637   -0.7554    0.0000 H   0  0  0

+    2.1419    2.3063    0.0000 H   0  0  0

+    2.9107   -2.3610    0.0000 H   0  0  0

+    4.3101    1.4868    0.0000 H   0  0  0

+    4.6695   -0.8467    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  7 13  2  0

+ 12 14  2  0

+ 13 15  1  0

+ 14 16  1  0

+  9 11  1  0

+ 10 12  1  0

+ 15 16  2  0

+  4 17  1  0

+  5 18  1  0

+  5 19  1  0

+  6 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-63-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.7261    0.7740    0.0018 C   0  0  0

+   -1.1264   -0.5489    0.0005 C   0  0  0

+    0.6201    1.0889    0.0016 C   0  0  0

+   -1.7571    1.8731   -0.0029 C   0  0  0

+   -0.1805   -1.5573   -0.0010 C   0  0  0

+   -2.5938   -0.8922    0.0013 C   0  0  0

+    1.5656    0.0808    0.0001 C   0  0  0

+    1.1653   -1.2425   -0.0017 C   0  0  0

+    3.0330    0.4241    0.0003 C   0  0  0

+    0.9204    2.0814    0.0000 H   0  0  0

+   -1.0008    2.5825    0.0000 H   0  0  0

+   -2.4665    2.6294    0.0000 H   0  0  0

+   -2.5134    1.1637    0.0000 H   0  0  0

+   -0.4808   -2.5498    0.0000 H   0  0  0

+   -2.8300    0.1174    0.0000 H   0  0  0

+   -3.6034   -1.1284    0.0000 H   0  0  0

+   -2.3576   -1.9018    0.0000 H   0  0  0

+    1.8747   -1.9988    0.0000 H   0  0  0

+    3.2692   -0.5855    0.0000 H   0  0  0

+    4.0426    0.6603    0.0000 H   0  0  0

+    2.7968    1.4337    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  7  8  1  0

+  3 10  1  0

+  4 11  1  0

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+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+  6 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3077-85-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -0.2581    0.0087   -0.0025 C   0  0  0

+   -1.6589   -0.4517   -0.0013 C   0  0  0

+   -0.3003    1.4111   -0.0001 C   0  0  0

+    0.9678   -0.6517   -0.0004 C   0  0  0

+   -2.4569    0.7019    0.0018 C   0  0  0

+   -2.2541   -1.7111   -0.0033 C   0  0  0

+   -1.6256    1.8077    0.0025 N   0  0  0

+    0.8917    2.1287   -0.0006 C   0  0  0

+    2.1382    0.0766   -0.0019 C   0  0  0

+   -3.8426    0.5721    0.0032 C   0  0  0

+   -3.6279   -1.8192   -0.0022 C   0  0  0

+    2.0984    1.4622   -0.0034 C   0  0  0

+    3.4424   -0.6235    0.0009 N   0  3  0

+   -4.4182   -0.6800    0.0015 C   0  0  0

+    4.4779    0.0177   -0.0005 O   0  0  0

+    3.4800   -1.8410    0.0045 O   0  5  0

+    1.0003   -1.6909    0.0000 H   0  0  0

+   -1.6637   -2.5669    0.0000 H   0  0  0

+   -1.9504    2.7954    0.0000 H   0  0  0

+    0.8723    3.1683    0.0000 H   0  0  0

+   -4.4439    1.4203    0.0000 H   0  0  0

+   -4.0735   -2.7586    0.0000 H   0  0  0

+    2.9862    2.0034    0.0000 H   0  0  0

+   -5.4539   -0.7712    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+  9 13  1  0

+ 10 14  2  0

+ 13 15  2  0

+ 13 16  1  0

+  5  7  1  0

+  9 12  2  0

+ 11 14  1  0

+  4 17  1  0

+  6 18  1  0

+  7 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 14 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+501-53-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.1257    0.9886    0.4007 C   0  0  0

+   -0.8773    0.0193   -0.0027 O   0  0  0

+    1.4999    0.4100    0.1824 C   0  0  0

+   -2.1822    0.3192    0.1037 C   0  0  0

+    2.3866    1.0382   -0.6717 C   0  0  0

+    1.8757   -0.7463    0.8407 C   0  0  0

+   -3.3813   -0.8397   -0.3786 Cl  0  0  0

+   -2.5226    1.3995    0.5367 O   0  0  0

+    3.6473    0.5073   -0.8720 C   0  0  0

+    3.1361   -1.2770    0.6405 C   0  0  0

+    4.0210   -0.6517   -0.2183 C   0  0  0

+    0.6361    1.8534    0.0000 H   0  0  0

+   -0.6628    1.6105    0.0000 H   0  0  0

+    2.2775    2.0364    0.0000 H   0  0  0

+    1.1363   -1.4258    0.0000 H   0  0  0

+    4.3875    1.1859    0.0000 H   0  0  0

+    3.2447   -2.2753    0.0000 H   0  0  0

+    4.9736   -0.9694    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

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+  8  4  2  0

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+ 11  9  2  0

+ 10 11  1  0

+  1 12  1  0

+  1 13  1  0

+  5 14  1  0

+  6 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+131-92-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 74 82                          1 V2000

+    1.8688    0.9497    0.0783 C   0  0  0

+    1.6766   -0.4450    0.1582 C   0  0  0

+    3.1685    1.4684    0.1313 C   0  0  0

+    0.6362    1.5513   -0.0503 N   0  0  0

+    0.2213   -0.6668    0.0740 C   0  0  0

+    2.7629   -1.3003    0.2887 C   0  0  0

+    4.2651    0.5955    0.2634 C   0  0  0

+    3.3879    2.9229    0.0486 C   0  0  0

+   -0.3650    0.6061   -0.0589 C   0  0  0

+   -0.5731   -1.8093    0.0955 C   0  0  0

+    4.0546   -0.7882    0.3417 C   0  0  0

+    5.6348    1.1354    0.3191 C   0  0  0

+    4.7614    3.4655    0.1041 C   0  0  0

+    2.4401    3.6758   -0.0655 O   0  0  0

+   -1.7587    0.7089   -0.1659 C   0  0  0

+   -1.9461   -1.7049   -0.0052 C   0  0  0

+    5.1392   -1.6499    0.4725 N   0  0  0

+    5.8567    2.5939    0.2363 C   0  0  0

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+    4.9787    4.8384    0.0265 C   0  0  0

+   -2.5478   -0.4546   -0.1448 C   0  0  0

+   -2.3943    2.0317   -0.2995 C   0  0  0

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+    6.2683    5.3363    0.0794 C   0  0  0

+   -4.0181   -0.3514   -0.2573 C   0  0  0

+   -3.8644    2.1348   -0.4118 C   0  0  0

+   -1.7106    3.0367   -0.3168 O   0  0  0

+    6.3834   -3.6504   -0.1931 C   0  0  0

+    4.5744   -2.7546   -1.3695 O   0  0  0

+    7.3458    4.4789    0.2102 C   0  0  0

+   -4.6544    0.9703   -0.3913 C   0  0  0

+   -4.7016   -1.3567   -0.2398 O   0  0  0

+   -4.4727    3.3788   -0.5385 C   0  0  0

+    6.5605   -4.6970   -1.0995 C   0  0  0

+    7.2309   -3.5405    0.9110 C   0  0  0

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+   -6.6338    2.3347   -0.6262 C   0  0  0

+   -6.8379   -0.0650   -0.4803 N   0  0  0

+    8.3999   -5.5068    0.2025 C   0  0  0

+   -7.8445   -0.1726    0.4094 C   0  0  0

+   -8.7653   -1.3271    0.3476 C   0  0  0

+   -7.9951    0.6799    1.2627 O   0  0  0

+   -9.8091   -1.4415    1.2677 C   0  0  0

+   -8.5987   -2.3047   -0.6346 C   0  0  0

+  -10.6650   -2.5212    1.2041 C   0  0  0

+   -9.4620   -3.3797   -0.6870 C   0  0  0

+  -10.4911   -3.4897    0.2311 C   0  0  0

+    0.4797    2.5780    0.0000 H   0  0  0

+    2.6131   -2.3280    0.0000 H   0  0  0

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+  -10.3114   -0.5325    0.0000 H   0  0  0

+   -7.5934   -2.5656    0.0000 H   0  0  0

+  -11.6722   -2.2680    0.0000 H   0  0  0

+   -8.9638   -4.2910    0.0000 H   0  0  0

+  -11.1141   -4.3207    0.0000 H   0  0  0

+  1  2  2  0

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+ 47 70  1  0

+ 48 71  1  0

+ 49 72  1  0

+ 50 73  1  0

+ 51 74  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+30517-66-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.2297   -0.1130   -0.0994 C   0  0  0

+   -1.5995   -0.0673    0.1432 C   0  0  0

+    0.4749    1.1013   -0.1328 C   0  0  0

+    0.3428   -1.3024   -0.3160 O   0  0  0

+   -2.6212   -1.1743    0.2811 C   0  0  0

+   -2.2659    1.1368    0.3034 C   0  0  0

+    1.9398    1.0494   -0.3099 C   0  0  0

+   -0.1909    2.3227    0.0142 C   0  0  0

+    1.6559   -1.3940   -0.0804 C   0  0  0

+   -3.8467   -0.4231    0.8771 C   0  0  0

+   -3.1320   -1.5613   -1.1295 C   0  0  0

+   -3.5963    0.9423    0.5049 O   0  0  0

+   -1.5533    2.3378    0.2359 C   0  0  0

+    2.5218   -0.2912   -0.0793 C   0  0  0

+    2.6074    2.0204   -0.6179 O   0  0  0

+    0.4999    3.4881   -0.0604 O   0  0  0

+    2.2003   -2.6546    0.1780 C   0  0  0

+   -5.0026   -0.8699    0.1553 O   0  0  0

+   -4.6272   -1.8402   -0.8336 C   0  0  0

+    3.8933   -0.4487    0.1388 C   0  0  0

+    3.5502   -2.8033    0.4081 C   0  0  0

+    4.4030   -1.7133    0.3859 C   0  0  0

+    4.7188    0.6276    0.1083 O   0  0  0

+   -1.9291   -1.9370    0.0000 H   0  0  0

+   -3.9398   -1.4487    0.0000 H   0  0  0

+   -3.3210   -2.5737    0.0000 H   0  0  0

+   -2.2559   -2.1026    0.0000 H   0  0  0

+   -2.0579    3.2355    0.0000 H   0  0  0

+    1.0250    4.3740    0.0000 H   0  0  0

+    1.5882   -3.4828    0.0000 H   0  0  0

+   -5.6087   -2.1520    0.0000 H   0  0  0

+   -4.3764   -2.8390    0.0000 H   0  0  0

+    3.9499   -3.7524    0.0000 H   0  0  0

+    5.4227   -1.8574    0.0000 H   0  0  0

+    5.3456    1.4448    0.0000 H   0  0  0

+  1  2  1  0

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+ 17 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 21 33  1  0

+ 22 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89911-79-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.5939   -0.7151   -0.6504 N   0  0  0

+   -0.7462   -0.4737   -1.1909 C   0  0  0

+    1.6956    0.1876   -0.9935 C   0  0  0

+    0.8027   -1.7194    0.1318 N   0  0  0

+   -1.6538    0.0637   -0.0826 C   0  0  0

+    2.1618    0.9241    0.2639 C   0  0  0

+    1.9169   -1.9200    0.5811 O   0  0  0

+   -2.9910    0.4994   -0.6850 C   0  0  0

+   -1.8797   -0.9614    0.8871 O   0  0  0

+    3.4438    1.6999   -0.0453 C   0  0  0

+    1.1448    1.8342    0.6875 O   0  0  0

+   -3.8388    1.0013    0.3501 O   0  0  0

+   -1.4316   -0.9749    0.0000 H   0  0  0

+   -0.5555   -1.3011    0.0000 H   0  0  0

+    1.9217   -0.6308    0.0000 H   0  0  0

+    2.5355    0.0629    0.0000 H   0  0  0

+   -1.3039    0.8373    0.0000 H   0  0  0

+    2.7561    0.3177    0.0000 H   0  0  0

+   -3.6985    0.0299    0.0000 H   0  0  0

+   -2.8764   -0.3419    0.0000 H   0  0  0

+   -2.0624   -1.7906    0.0000 H   0  0  0

+    3.8834    0.9735    0.0000 H   0  0  0

+    4.1702    2.1395    0.0000 H   0  0  0

+    3.0042    2.4263    0.0000 H   0  0  0

+    0.5121    2.4004    0.0000 H   0  0  0

+   -4.5694    1.4338    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  4  7  2  0

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+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16045-92-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.4477   -0.0505    0.3892 C   0  0  0

+   -0.5853   -0.9589   -0.2807 C   0  0  0

+    1.8349   -0.5254    0.0412 C   0  0  0

+    0.2278    1.6415   -0.1936 Cl  0  0  0

+   -1.9726   -0.4841    0.0673 C   0  0  0

+    2.6789   -0.9029    1.0143 O   0  0  0

+    2.1875   -0.5662   -1.1138 O   0  0  0

+   -3.0445   -1.1341   -0.4124 O   0  0  0

+   -2.1199    0.4818    0.7781 O   0  0  0

+   -0.4750    0.2969    0.0000 H   0  0  0

+   -1.0606   -1.8227    0.0000 H   0  0  0

+    0.1837   -1.5760    0.0000 H   0  0  0

+    3.5789   -1.3055    0.0000 H   0  0  0

+   -3.8876   -1.6453    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  5  9  2  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  6 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2835-95-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.7452    0.6979    0.0019 C   0  0  0

+   -1.0987   -0.6440    0.0004 C   0  0  0

+    0.5925    1.0614    0.0018 C   0  0  0

+   -1.7098    1.6551   -0.0023 O   0  0  0

+   -0.1189   -1.6189   -0.0011 C   0  0  0

+   -2.5530   -1.0390    0.0010 C   0  0  0

+    1.5752    0.0813    0.0003 C   0  0  0

+    1.2151   -1.2610   -0.0012 C   0  0  0

+    2.9241    0.4435   -0.0002 N   0  0  0

+    0.8594    2.0673    0.0000 H   0  0  0

+   -2.4486    2.3882    0.0000 H   0  0  0

+   -0.3868   -2.6246    0.0000 H   0  0  0

+   -2.8258   -0.0346    0.0000 H   0  0  0

+   -3.5574   -1.3118    0.0000 H   0  0  0

+   -2.2802   -2.0434    0.0000 H   0  0  0

+    1.9510   -1.9969    0.0000 H   0  0  0

+    3.6604   -0.2920    0.0000 H   0  0  0

+    3.1929    1.4489    0.0000 H   0  0  0

+  1  2  2  0

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+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+591-12-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    1.1520   -0.0774   -0.0019 C   0  0  0

+    0.0367   -0.8305   -0.0013 O   0  0  0

+    0.9042    1.2137   -0.0007 C   0  0  0

+    2.5438   -0.6554    0.0022 C   0  0  0

+   -1.0813   -0.0869    0.0004 C   0  0  0

+   -0.6057    1.3539    0.0009 C   0  0  0

+   -2.2234   -0.4814    0.0007 O   0  0  0

+    1.5824    1.9612    0.0000 H   0  0  0

+    2.1567   -1.5875    0.0000 H   0  0  0

+    3.4759   -1.0425    0.0000 H   0  0  0

+    2.9309    0.2767    0.0000 H   0  0  0

+   -0.4369    2.3490    0.0000 H   0  0  0

+   -1.5853    1.5972    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6 12  1  0

+  6 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+128714-76-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.1327    0.5709   -0.0014 C   0  0  0

+   -1.2410    0.8729    0.0130 C   0  0  0

+    1.0802    1.6226    0.0234 C   0  0  0

+    0.5526   -0.7790   -0.0346 C   0  0  0

+   -2.1934   -0.1740   -0.0117 C   0  0  0

+   -1.6683    2.2184    0.0525 C   0  0  0

+    2.5191    1.2946    0.0079 C   0  0  0

+    0.6448    2.9431    0.0622 C   0  0  0

+    1.9810   -1.0931   -0.0500 C   0  0  0

+   -0.4033   -1.8009   -0.0528 C   0  0  0

+   -3.6152    0.1692    0.0041 C   0  0  0

+   -1.7618   -1.5018   -0.0498 C   0  0  0

+   -0.7090    3.2446    0.0770 C   0  0  0

+   -3.0482    2.5094    0.0661 C   0  0  0

+    2.9309   -0.0613   -0.0312 C   0  0  0

+    3.4732    2.3018    0.0310 C   0  0  0

+    2.4259   -2.5054   -0.0842 N   0  3  0

+   -3.9907    1.4943    0.0423 C   0  0  0

+   -4.6416   -0.8978   -0.0204 N   0  3  0

+    4.3075   -0.3648   -0.0461 C   0  0  0

+    4.8253    1.9791    0.0156 C   0  0  0

+    2.6026   -3.0626   -1.1528 O   0  0  0

+    2.6458   -3.2080    1.1254 O   0  5  0

+   -5.6384   -0.7683   -0.7081 O   0  0  0

+   -4.4642   -2.0687    0.7559 O   0  5  0

+    5.2350    0.6573   -0.0225 C   0  0  0

+    1.3499    3.7220    0.0000 H   0  0  0

+   -0.0918   -2.8043    0.0000 H   0  0  0

+   -2.4676   -2.2801    0.0000 H   0  0  0

+   -1.0195    4.2483    0.0000 H   0  0  0

+   -3.3660    3.5108    0.0000 H   0  0  0

+    3.1737    3.3089    0.0000 H   0  0  0

+   -5.0122    1.7401    0.0000 H   0  0  0

+    4.6265   -1.3659    0.0000 H   0  0  0

+    5.5432    2.7462    0.0000 H   0  0  0

+    6.2608    0.4299    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 20  1  0

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+  8 13  2  0

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+ 14 31  1  0

+ 16 32  1  0

+ 18 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 26 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7203-90-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.3185   -0.3869    0.0045 C   0  0  0

+    0.5545   -1.4757    0.0035 C   0  0  0

+    0.1936    0.9110    0.0033 C   0  0  0

+   -1.6752   -0.5919    0.0010 N   0  0  0

+    1.9173   -1.2635    0.0012 C   0  0  0

+    1.5588    1.1110    0.0010 C   0  0  0

+   -2.4799    0.4163    0.0020 N   0  0  0

+    2.4199    0.0270    0.0000 C   0  0  0

+   -3.8652    0.2070   -0.0016 N   0  0  0

+    4.1364    0.2864   -0.0028 Cl  0  0  0

+   -4.3999   -1.1569   -0.0064 C   0  0  0

+   -4.7791    1.3520   -0.0005 C   0  0  0

+    0.1773   -2.4476    0.0000 H   0  0  0

+   -0.4540    1.7280    0.0000 H   0  0  0

+    2.5704   -2.0762    0.0000 H   0  0  0

+    1.9426    2.0803    0.0000 H   0  0  0

+   -5.3705   -0.7764    0.0000 H   0  0  0

+   -4.7804   -2.1275    0.0000 H   0  0  0

+   -3.4293   -1.5374    0.0000 H   0  0  0

+   -3.9643    2.0024    0.0000 H   0  0  0

+   -5.4295    2.1668    0.0000 H   0  0  0

+   -5.5939    0.7016    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

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+  6  8  2  0

+  2 13  1  0

+  3 14  1  0

+  5 15  1  0

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+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92758-43-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 38                          1 V2000

+   -0.0472   -0.3855   -0.0016 C   0  0  0

+   -1.4487   -0.2684   -0.0015 C   0  0  0

+    0.7511    0.7721    0.0000 C   0  0  0

+    0.5707   -1.7123    0.0026 C   0  0  0

+   -2.0374    1.0160   -0.0001 C   0  0  0

+   -2.2574   -1.4276   -0.0022 C   0  0  0

+    2.2045    0.6151   -0.0001 C   0  0  0

+    0.1408    2.0398    0.0014 C   0  0  0

+    1.9511   -1.8274    0.0021 C   0  0  0

+   -0.2944   -2.8922    0.0069 C   0  0  0

+   -1.2115    2.1595    0.0005 C   0  0  0

+   -3.4409    1.1210    0.0000 C   0  0  0

+   -1.6380   -2.7499   -0.0026 C   0  0  0

+   -3.6476   -1.2837   -0.0020 C   0  0  0

+    2.7686   -0.6854   -0.0019 C   0  0  0

+    3.0466    1.7337    0.0010 C   0  0  0

+   -4.2196   -0.0273   -0.0011 C   0  0  0

+   -4.0460    2.3734    0.0018 N   0  0  0

+    4.1713   -0.8202   -0.0025 C   0  0  0

+    4.3993    1.5647    0.0003 C   0  0  0

+    4.9587    0.2893   -0.0014 C   0  0  0

+    0.7408    2.9071    0.0000 H   0  0  0

+    2.3938   -2.7846    0.0000 H   0  0  0

+    0.1321   -3.8568    0.0000 H   0  0  0

+   -1.6497    3.1188    0.0000 H   0  0  0

+   -2.2500   -3.6088    0.0000 H   0  0  0

+   -4.2633   -2.1400    0.0000 H   0  0  0

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+   -5.2705    0.0615    0.0000 H   0  0  0

+   -3.4530    3.2455    0.0000 H   0  0  0

+   -5.0978    2.4509    0.0000 H   0  0  0

+    4.6099   -1.7793    0.0000 H   0  0  0

+    5.0299    2.4101    0.0000 H   0  0  0

+    6.0079    0.1820    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

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+ 12 18  1  0

+ 15 19  1  0

+ 16 20  2  0

+ 19 21  2  0

+  8 11  2  0

+  9 15  1  0

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+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+112022-10-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 42                          1 V2000

+   -1.0754    0.6658    0.0009 C   0  0  0

+   -2.0709    1.6360   -0.0595 C   0  0  0

+    0.2696    1.0512    0.0207 C   0  0  0

+   -1.4080   -0.6491    0.0461 O   0  0  0

+   -3.3800    1.2662   -0.0786 O   0  0  0

+   -1.7280    2.9766   -0.0997 C   0  0  0

+    0.6001    2.4096   -0.0204 C   0  0  0

+    1.3329    0.0306    0.0852 C   0  0  0

+   -2.7165   -1.0200    0.0324 C   0  0  0

+   -3.7135   -0.0518   -0.0385 C   0  0  0

+   -0.3962    3.3589   -0.0801 C   0  0  0

+    2.6272    0.4061    0.1041 N   0  0  0

+    1.0416   -1.1494    0.1213 O   0  0  0

+   -3.0588   -2.3613    0.0780 C   0  0  0

+   -5.0449   -0.4328   -0.0581 C   0  0  0

+    3.6830   -0.6074    0.1681 C   0  0  0

+   -4.3904   -2.7352    0.0634 C   0  0  0

+   -5.3805   -1.7740   -0.0177 C   0  0  0

+    5.0499    0.0800    0.1774 C   0  0  0

+    6.1087   -0.9363    0.2416 N   0  0  0

+    6.0524   -1.6848   -1.0211 C   0  0  0

+    7.3876   -0.2137    0.2473 C   0  0  0

+   -2.4726    3.6998    0.0000 H   0  0  0

+    1.5961    2.7019    0.0000 H   0  0  0

+   -0.1486    4.3670    0.0000 H   0  0  0

+    2.8752    1.4140    0.0000 H   0  0  0

+   -2.3161   -3.0865    0.0000 H   0  0  0

+   -5.7911    0.2888    0.0000 H   0  0  0

+    2.8841   -1.2702    0.0000 H   0  0  0

+    4.2512   -1.4761    0.0000 H   0  0  0

+   -4.6456   -3.7414    0.0000 H   0  0  0

+   -6.3788   -2.0584    0.0000 H   0  0  0

+    5.8488    0.7428    0.0000 H   0  0  0

+    4.4817    0.9487    0.0000 H   0  0  0

+    5.0173   -1.6069    0.0000 H   0  0  0

+    5.9745   -2.7199    0.0000 H   0  0  0

+    7.0875   -1.7627    0.0000 H   0  0  0

+    7.8982   -1.1174    0.0000 H   0  0  0

+    8.2913    0.2969    0.0000 H   0  0  0

+    6.8770    0.6900    0.0000 H   0  0  0

+  1  2  2  0

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+  7 11  1  0

+  9 10  2  0

+ 17 18  1  0

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+ 21 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4752-10-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+    0.7102   -0.5304    0.0016 C   0  0  0

+   -0.7102   -0.5304    0.0015 C   0  0  0

+    1.3642    0.7153    0.0003 C   0  0  0

+    1.4005   -1.7494   -0.0027 C   0  0  0

+   -1.3643    0.7153    0.0000 C   0  0  0

+   -1.4005   -1.7495    0.0032 C   0  0  0

+    0.6404    1.8136   -0.0010 N   0  0  0

+    3.0981    0.8014    0.0010 Cl  0  0  0

+    0.6968   -2.9165   -0.0070 C   0  0  0

+   -0.6404    1.8136   -0.0011 N   0  0  0

+   -3.0981    0.8014   -0.0008 Cl  0  0  0

+   -0.6967   -2.9166    0.0049 C   0  0  0

+    2.4511   -1.7638    0.0000 H   0  0  0

+   -2.4511   -1.7639    0.0000 H   0  0  0

+    1.2135   -3.8313    0.0000 H   0  0  0

+   -1.2133   -3.8315    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  7 10  2  0

+  9 12  1  0

+  4 13  1  0

+  6 14  1  0

+  9 15  1  0

+ 12 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20930-10-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 53                          1 V2000

+    1.3024    0.2391    0.2391 C   0  0  0

+    1.2723   -1.2354   -0.0707 C   0  0  0

+    2.5455    0.8515   -0.3533 C   0  0  0

+    0.1295    0.8775   -0.3310 O   0  0  0

+    1.3068    0.4340    1.6981 C   0  0  0

+    1.4849   -2.1576    0.9366 C   0  0  0

+    1.0262   -1.6658   -1.3614 C   0  0  0

+    2.4397    1.7989   -1.3547 C   0  0  0

+    3.7912    0.4702    0.1084 C   0  0  0

+   -1.1002    0.5226    0.0870 C   0  0  0

+    1.3103    0.5894    2.8617 C   0  0  0

+    1.4572   -3.5104    0.6524 C   0  0  0

+    0.9985   -3.0181   -1.6454 C   0  0  0

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+    4.9316    1.0320   -0.4350 C   0  0  0

+   -2.1910    1.0347   -0.5167 N   0  0  0

+   -1.2265   -0.2593    1.0084 O   0  0  0

+    1.3147    0.7843    4.3208 C   0  0  0

+    1.2170   -3.9405   -0.6390 C   0  0  0

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+   -2.1146    2.0002    0.0000 H   0  0  0

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+    0.3465    0.8062    0.0000 H   0  0  0

+    1.0834   -4.8997    0.0000 H   0  0  0

+    5.5721    2.5923    0.0000 H   0  0  0

+   -2.8720   -0.0631    0.0000 H   0  0  0

+   -3.6837    2.3177    0.0000 H   0  0  0

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+   -3.9297   -1.5520    0.0000 H   0  0  0

+   -3.0365   -0.7274    0.0000 H   0  0  0

+   -5.9659    2.3652    0.0000 H   0  0  0

+   -6.8591    1.5406    0.0000 H   0  0  0

+   -6.2119   -1.5045    0.0000 H   0  0  0

+   -4.9961   -1.8729    0.0000 H   0  0  0

+   -7.2021    0.6545    0.0000 H   0  0  0

+   -6.9904   -0.5762    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  1  5  1  0

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+ 25 48  1  0

+ 25 49  1  0

+ 26 50  1  0

+ 26 51  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+70249-46-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.2201    0.2729    0.0038 C   0  0  0

+    0.2734   -0.9224    0.0036 C   0  0  0

+    0.8396    1.2805    0.0010 C   0  0  0

+   -1.6360    0.6202    0.0008 C   0  0  0

+    1.7393   -0.7960    0.0007 C   0  0  0

+   -0.7010   -2.0302    0.0061 C   0  0  0

+    2.0786    0.4879   -0.0005 C   0  0  0

+    0.4696    2.5368    0.0003 C   0  0  0

+   -2.5030   -0.3637   -0.0020 C   0  0  0

+   -1.9525    2.0586    0.0008 C   0  0  0

+    2.7999   -1.8208   -0.0012 C   0  0  0

+   -1.9926   -1.7525    0.0086 C   0  0  0

+    3.4981    0.8742   -0.0026 C   0  0  0

+   -0.9515    2.9205    0.0023 C   0  0  0

+   -3.9842   -0.0865   -0.0046 C   0  0  0

+    4.0664   -1.4712   -0.0037 C   0  0  0

+    4.4380   -0.0458   -0.0035 C   0  0  0

+   -4.7003   -1.3231   -0.0074 O   0  0  0

+   -0.3573   -3.0716    0.0000 H   0  0  0

+    1.2362    3.3210    0.0000 H   0  0  0

+   -2.9929    2.4053    0.0000 H   0  0  0

+    2.5292   -2.8836    0.0000 H   0  0  0

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+   -4.9893    0.3523    0.0000 H   0  0  0

+    4.8474   -2.2411    0.0000 H   0  0  0

+    5.4948    0.2473    0.0000 H   0  0  0

+   -5.2499   -2.2722    0.0000 H   0  0  0

+  1  2  2  0

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+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+616-69-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    1.0169   -0.2627   -0.0050 C   0  0  0

+   -0.2405   -0.8359    0.0213 C   0  0  0

+    1.1488    1.1131   -0.0412 C   0  0  0

+    2.2223   -1.1215    0.0119 N   0  3  0

+   -1.3664   -0.0335    0.0114 C   0  0  0

+    0.0233    1.9152   -0.0511 C   0  0  0

+    2.5198    1.7381   -0.0693 C   0  0  0

+    2.4772   -1.8321   -0.9440 O   0  0  0

+    2.9593   -1.1177    0.9816 O   0  5  0

+   -1.2345    1.3418   -0.0248 C   0  0  0

+   -2.7129   -0.6474    0.0400 N   0  3  0

+    0.1671    3.4149   -0.0896 C   0  0  0

+   -3.7048    0.0595    0.0312 O   0  0  0

+   -2.8291   -1.8594    0.0722 O   0  5  0

+   -0.3396   -1.8677    0.0000 H   0  0  0

+    2.9498    0.7949    0.0000 H   0  0  0

+    3.4630    2.1681    0.0000 H   0  0  0

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+   -2.0785    1.9435    0.0000 H   0  0  0

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+  1  2  2  0

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+  7 17  1  0

+  7 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+114460-38-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+   -0.5089    0.5476   -0.0177 C   0  0  0

+   -1.4807   -0.4629   -0.0591 C   0  0  0

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+   -0.9300    1.8993    0.0192 C   0  0  0

+   -2.8076   -0.1193    0.2607 C   0  0  0

+   -1.5153   -1.7836   -0.4294 N   0  0  0

+    1.8217    1.3755   -0.2008 C   0  0  0

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+   -2.2694    2.2117    0.3150 C   0  0  0

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+   -2.7189   -2.3418   -0.0807 C   0  0  0

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+    1.3137    2.6836   -0.3694 C   0  0  0

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+    2.8279   -1.1574    0.3130 C   0  0  0

+    3.6949   -0.1020    0.0243 C   0  0  0

+    3.3339   -2.3867    0.5944 O   0  0  0

+    0.8350   -1.7747    0.0000 H   0  0  0

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+   -0.3361    3.9093    0.0000 H   0  0  0

+   -4.1822    1.4582    0.0000 H   0  0  0

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+   -2.9352   -3.3486    0.0000 H   0  0  0

+   -1.0784   -3.3638    0.0000 H   0  0  0

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+    4.7121   -0.2620    0.0000 H   0  0  0

+    3.7259   -3.3389    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 29  1  0

+ 16 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+19996-03-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.4857    1.2038    0.3393 C   0  0  0

+   -1.1727   -0.0014    0.4721 C   0  0  0

+    0.9540    1.2060    0.0601 C   0  0  0

+   -1.1539    2.4412    0.4633 C   0  0  0

+   -0.4832   -1.2055    0.3379 C   0  0  0

+   -2.6520   -0.0029    0.7594 C   0  0  0

+    1.6446    0.0017   -0.0739 C   0  0  0

+    1.6184    2.4444   -0.0682 C   0  0  0

+   -0.4543    3.5966    0.3283 C   0  0  0

+    0.9562   -1.2045    0.0588 C   0  0  0

+   -1.1479   -2.4441    0.4668 C   0  0  0

+   -3.5661   -0.0026   -0.7947 Cl  0  0  0

+    3.3490    0.0035   -0.4038 Cl  0  0  0

+    0.9165    3.5984    0.0684 C   0  0  0

+    1.6231   -2.4414   -0.0706 C   0  0  0

+   -0.4461   -3.5981    0.3307 C   0  0  0

+    0.9236   -3.5969    0.0651 C   0  0  0

+   -2.1948    2.4669    0.0000 H   0  0  0

+   -3.1725   -0.9047    0.0000 H   0  0  0

+   -2.1309   -0.9043    0.0000 H   0  0  0

+    2.6592    2.4725    0.0000 H   0  0  0

+   -0.9661    4.5033    0.0000 H   0  0  0

+   -2.1887   -2.4721    0.0000 H   0  0  0

+    1.4262    4.5063    0.0000 H   0  0  0

+    2.6640   -2.4674    0.0000 H   0  0  0

+   -0.9560   -4.5059    0.0000 H   0  0  0

+    1.4352   -4.5037    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  1  0

+  7 13  1  0

+  8 14  2  0

+ 10 15  1  0

+ 11 16  2  0

+ 15 17  2  0

+  7 10  1  0

+  9 14  1  0

+ 16 17  1  0

+  4 18  1  0

+  6 19  1  0

+  6 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 11 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+ 17 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+495-18-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.3109    0.0981   -0.0010 C   0  0  0

+   -1.1536    0.3005   -0.0002 C   0  0  0

+    1.1706    1.1979    0.0003 C   0  0  0

+    0.8399   -1.1933    0.0027 C   0  0  0

+   -1.9810   -0.7634   -0.0015 N   0  0  0

+   -1.6115    1.4265    0.0017 O   0  0  0

+    2.5360    1.0021   -0.0005 C   0  0  0

+    2.2076   -1.3753    0.0018 C   0  0  0

+   -3.3836   -0.5696   -0.0007 O   0  0  0

+    3.0540   -0.2810   -0.0027 C   0  0  0

+    0.7833    2.1606    0.0000 H   0  0  0

+    0.2060   -2.0149    0.0000 H   0  0  0

+   -1.5901   -1.7246    0.0000 H   0  0  0

+    3.1761    1.8188    0.0000 H   0  0  0

+    2.6022   -2.3350    0.0000 H   0  0  0

+   -4.4115   -0.4276    0.0000 H   0  0  0

+    4.0819   -0.4231    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  8 10  2  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1671-82-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.0795    0.2520   -0.0391 C   0  0  0

+   -0.9547   -0.7620    0.1324 N   0  0  0

+    1.3957    0.1295   -0.0287 N   0  3  0

+   -0.7497    1.3569   -0.2212 N   0  0  0

+   -2.2128   -0.2286    0.0534 C   0  0  0

+   -0.6201   -2.1699    0.3605 C   0  0  0

+    1.9428   -0.7013   -0.7315 O   0  0  0

+    2.0624    0.8595    0.6828 O   0  5  0

+   -2.0633    1.0905   -0.1729 C   0  0  0

+   -3.0804   -0.7351    0.0000 H   0  0  0

+   -1.5975   -2.4022    0.0000 H   0  0  0

+   -0.3878   -3.1473    0.0000 H   0  0  0

+    0.3573   -1.9376    0.0000 H   0  0  0

+   -2.8040    1.7692    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+  9 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+123-91-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.7137   -1.1478    0.2744 C   0  0  0

+   -0.7137   -1.1478   -0.2744 C   0  0  0

+    1.4133    0.0000   -0.2080 O   0  0  0

+   -1.4133    0.0000    0.2080 O   0  0  0

+    0.7137    1.1478    0.2744 C   0  0  0

+   -0.7137    1.1478   -0.2744 C   0  0  0

+    0.5308   -2.1392    0.0000 H   0  0  0

+    1.6555   -1.5076    0.0000 H   0  0  0

+   -1.6555   -1.5076    0.0000 H   0  0  0

+   -0.5308   -2.1392    0.0000 H   0  0  0

+    1.6555    1.5076    0.0000 H   0  0  0

+    0.5308    2.1392    0.0000 H   0  0  0

+   -0.5308    2.1392    0.0000 H   0  0  0

+   -1.6555    1.5076    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  6  1  0

+  1  7  1  0

+  1  8  1  0

+  2  9  1  0

+  2 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+625-86-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    1.0966   -0.0768   -0.0018 C   0  0  0

+    0.0000   -0.8522   -0.0013 O   0  0  0

+    0.7069    1.2106   -0.0006 C   0  0  0

+    2.5219   -0.5662    0.0021 C   0  0  0

+   -1.0966   -0.0768    0.0003 C   0  0  0

+   -0.7069    1.2106    0.0008 C   0  0  0

+   -2.5220   -0.5662    0.0009 C   0  0  0

+    1.3081    2.0207    0.0000 H   0  0  0

+    2.1943   -1.5203    0.0000 H   0  0  0

+    3.4760   -0.8938    0.0000 H   0  0  0

+    2.8495    0.3879    0.0000 H   0  0  0

+   -1.3081    2.0207    0.0000 H   0  0  0

+   -2.8496    0.3879    0.0000 H   0  0  0

+   -3.4761   -0.8938    0.0000 H   0  0  0

+   -2.1944   -1.5203    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  5  6  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2381-16-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 36                          1 V2000

+   -0.6473   -0.0794   -0.0020 C   0  0  0

+   -2.0859   -0.3824   -0.0016 C   0  0  0

+   -0.2260    1.3226    0.0000 C   0  0  0

+    0.2935   -1.0956    0.0015 C   0  0  0

+   -3.0141    0.6797    0.0008 C   0  0  0

+   -2.5415   -1.7018   -0.0030 C   0  0  0

+    1.1263    1.6451    0.0001 C   0  0  0

+   -1.2425    2.3734    0.0023 C   0  0  0

+    1.6551   -0.7772    0.0010 C   0  0  0

+   -2.5529    2.0644    0.0022 C   0  0  0

+   -4.3856    0.3887    0.0012 C   0  0  0

+   -3.8945   -1.9552   -0.0020 C   0  0  0

+    2.0801    0.6244   -0.0017 C   0  0  0

+    2.6398   -1.7851    0.0051 C   0  0  0

+   -4.8078   -0.9087   -0.0006 C   0  0  0

+    3.4598    0.9143   -0.0016 C   0  0  0

+    3.9538   -1.4383    0.0050 C   0  0  0

+    4.3587   -0.1045   -0.0034 C   0  0  0

+    5.8313    0.2157   -0.0033 C   0  0  0

+   -0.0134   -2.0979    0.0000 H   0  0  0

+   -1.8568   -2.4956    0.0000 H   0  0  0

+    1.4286    2.6488    0.0000 H   0  0  0

+   -0.9476    3.3793    0.0000 H   0  0  0

+   -3.2601    2.8382    0.0000 H   0  0  0

+   -5.0867    1.1680    0.0000 H   0  0  0

+   -4.2382   -2.9455    0.0000 H   0  0  0

+    2.3607   -2.7955    0.0000 H   0  0  0

+   -5.8348   -1.1185    0.0000 H   0  0  0

+    3.7899    1.9092    0.0000 H   0  0  0

+    4.6813   -2.1930    0.0000 H   0  0  0

+    6.0540   -0.8086    0.0000 H   0  0  0

+    6.8556    0.4384    0.0000 H   0  0  0

+    5.6086    1.2400    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 13 16  1  0

+ 14 17  2  0

+ 16 18  2  0

+ 18 19  1  0

+  8 10  2  0

+  9 13  2  0

+ 12 15  1  0

+ 17 18  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 19 31  1  0

+ 19 32  1  0

+ 19 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99026-65-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -0.4990   -0.1558    0.1343 C   0  0  0

+   -1.8675    0.3714    0.0027 C   0  0  0

+    0.5140    0.6634    0.2886 C   0  0  0

+   -0.3017   -1.6160    0.0944 C   0  0  0

+   -2.0851    1.6646    0.0391 C   0  0  0

+   -2.9756   -0.5854   -0.1689 C   0  0  0

+    1.8743    0.1142    0.4184 C   0  0  0

+    0.2750    2.1162    0.3290 C   0  0  0

+    0.9142   -2.1035    0.2107 C   0  0  0

+   -1.4670   -2.4968   -0.0748 C   0  0  0

+   -0.9512    2.5884    0.2129 C   0  0  0

+   -3.4620    2.1699   -0.0943 C   0  0  0

+   -2.6851   -2.0265   -0.2042 C   0  0  0

+   -4.2041   -0.1312   -0.2878 C   0  0  0

+    2.0585   -1.1896    0.3782 C   0  0  0

+    2.9317    0.9463    0.5779 N   0  0  0

+    1.1156   -3.4501    0.1768 O   0  0  0

+   -4.4571    1.3203   -0.2483 C   0  0  0

+    3.9762    0.8791   -0.2712 C   0  0  0

+    5.2070    1.7114   -0.0190 C   0  0  0

+    3.9257    0.1488   -1.2381 O   0  0  0

+    1.0959    2.7843    0.0000 H   0  0  0

+   -1.3200   -3.5449    0.0000 H   0  0  0

+   -1.1178    3.6336    0.0000 H   0  0  0

+   -3.6489    3.2116    0.0000 H   0  0  0

+   -3.4942   -2.7088    0.0000 H   0  0  0

+   -5.0172   -0.8086    0.0000 H   0  0  0

+    3.0420   -1.5805    0.0000 H   0  0  0

+    2.6177    1.9570    0.0000 H   0  0  0

+    1.2721   -4.4968    0.0000 H   0  0  0

+   -5.4528    1.6790    0.0000 H   0  0  0

+    5.7999    0.8347    0.0000 H   0  0  0

+    6.0837    2.3043    0.0000 H   0  0  0

+    4.6141    2.5881    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

+  7 16  1  0

+  9 17  1  0

+ 12 18  2  0

+ 16 19  1  0

+ 19 20  1  0

+ 19 21  2  0

+  8 11  2  0

+  9 15  1  0

+ 10 13  2  0

+ 14 18  1  0

+  8 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 20 32  1  0

+ 20 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91-22-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    0.0184    0.7353   -0.0028 C   0  0  0

+   -0.0102   -0.6816   -0.0009 C   0  0  0

+    1.2530    1.4045   -0.0020 C   0  0  0

+   -1.1984    1.4423    0.0003 C   0  0  0

+    1.2046   -1.3896    0.0014 C   0  0  0

+   -1.1827   -1.3231   -0.0008 N   0  0  0

+    2.4084    0.6845    0.0007 C   0  0  0

+   -2.3608    0.7246    0.0050 C   0  0  0

+    2.3828   -0.7089    0.0018 C   0  0  0

+   -2.3182   -0.6676   -0.0025 C   0  0  0

+    1.2846    2.4487    0.0000 H   0  0  0

+   -1.2124    2.4868    0.0000 H   0  0  0

+    1.2026   -2.4342    0.0000 H   0  0  0

+    3.3264    1.1831    0.0000 H   0  0  0

+   -3.2808    1.2195    0.0000 H   0  0  0

+    3.2827   -1.2394    0.0000 H   0  0  0

+   -3.2148   -1.2037    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7  9  1  0

+  8 10  2  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+623-05-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -2.4470   -0.3515   -0.4399 C   0  0  0

+   -3.1222    0.3799    0.5854 O   0  0  0

+   -0.9575   -0.2045   -0.2639 C   0  0  0

+   -0.1733   -1.3239   -0.0565 C   0  0  0

+   -0.3768    1.0495   -0.3159 C   0  0  0

+    1.1925   -1.1918    0.1047 C   0  0  0

+    0.9882    1.1869   -0.1553 C   0  0  0

+    1.7768    0.0654    0.0582 C   0  0  0

+    3.1200    0.1980    0.2168 O   0  0  0

+   -3.3349   -0.8714    0.0000 H   0  0  0

+   -2.1291   -1.3301    0.0000 H   0  0  0

+   -3.8201    1.1359    0.0000 H   0  0  0

+   -0.6038   -2.2585    0.0000 H   0  0  0

+   -0.9736    1.8877    0.0000 H   0  0  0

+    1.7871   -2.0316    0.0000 H   0  0  0

+    1.4160    2.1227    0.0000 H   0  0  0

+    4.1439    0.2991    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  3  2  0

+  5  3  1  0

+  6  4  1  0

+  7  5  2  0

+  8  6  2  0

+  9  8  1  0

+  7  8  1  0

+  1 10  1  0

+  1 11  1  0

+  2 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1849-36-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.0468    0.0001   -0.0011 C   0  0  0

+   -2.5269    0.0000   -0.0007 N   0  3  0

+   -0.3571    1.1986    0.0007 C   0  0  0

+   -0.3569   -1.1988    0.0027 C   0  0  0

+   -3.1359   -1.0548   -0.0023 O   0  0  0

+   -3.1359    1.0549    0.0010 O   0  5  0

+    1.0239    1.2025    0.0009 C   0  0  0

+    1.0237   -1.2027    0.0029 C   0  0  0

+    1.7204    0.0001   -0.0007 C   0  0  0

+    3.4824    0.0001   -0.0011 S   0  0  0

+   -0.8776    2.0958    0.0000 H   0  0  0

+   -0.8774   -2.0960    0.0000 H   0  0  0

+    1.5406    2.1019    0.0000 H   0  0  0

+    1.5404   -2.1021    0.0000 H   0  0  0

+    4.5197    0.0001    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  7  9  2  0

+  9 10  1  0

+  8  9  1  0

+  3 11  1  0

+  4 12  1  0

+  7 13  1  0

+  8 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-97-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+    0.4467    0.1124   -0.0388 C   0  0  0

+   -0.0329   -1.2781   -0.0194 C   0  0  0

+    1.8936    0.3335    0.0893 C   0  0  0

+   -0.4726    1.1359   -0.1817 C   0  0  0

+   -1.3906   -1.5544    0.0860 C   0  0  0

+    0.9347   -2.3626   -0.1740 C   0  0  0

+    2.7711   -0.7472   -0.1657 C   0  0  0

+    2.4559    1.5248    0.5444 C   0  0  0

+   -1.8462    0.8717   -0.0823 C   0  0  0

+   -0.0417    2.5356   -0.5464 C   0  0  0

+   -2.3160   -0.5074    0.0845 C   0  0  0

+   -1.8664   -2.9807    0.2057 C   0  0  0

+    2.2478   -2.1004   -0.3154 C   0  0  0

+    4.1542   -0.5298   -0.2132 C   0  0  0

+    3.8177    1.7239    0.4875 C   0  0  0

+   -2.8025    1.9031   -0.1560 C   0  0  0

+   -3.6983   -0.7398    0.2223 C   0  0  0

+    4.6635    0.7002    0.0824 C   0  0  0

+   -4.1260    1.6087   -0.0381 C   0  0  0

+   -4.5684    0.3036    0.1542 C   0  0  0

+    0.6024   -3.3565    0.0000 H   0  0  0

+    1.8322    2.3670    0.0000 H   0  0  0

+    0.9599    2.2272    0.0000 H   0  0  0

+    0.2667    3.5372    0.0000 H   0  0  0

+   -1.0433    2.8440    0.0000 H   0  0  0

+   -2.8606   -2.6491    0.0000 H   0  0  0

+   -2.1980   -3.9749    0.0000 H   0  0  0

+   -0.8722   -3.3123    0.0000 H   0  0  0

+    2.9225   -2.9023    0.0000 H   0  0  0

+    4.8026   -1.3532    0.0000 H   0  0  0

+    4.1943    2.7019    0.0000 H   0  0  0

+   -2.4906    2.9036    0.0000 H   0  0  0

+   -4.0622   -1.7226    0.0000 H   0  0  0

+    5.6999    0.8558    0.0000 H   0  0  0

+   -4.8260    2.3887    0.0000 H   0  0  0

+   -5.5987    0.1117    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  3  7  2  0

+  3  8  1  0

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+  5 11  1  0

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+ 14 18  2  0

+ 16 19  2  0

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+  7 13  1  0

+  9 11  2  0

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+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+70458-96-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+    0.3635   -0.3901    0.0961 C   0  0  0

+    0.9520    0.8829   -0.0180 C   0  0  0

+    1.1542   -1.5155    0.1976 N   0  0  0

+   -1.0219   -0.4991    0.0993 C   0  0  0

+    2.4210    0.9825   -0.0257 C   0  0  0

+    0.1517    2.0231   -0.1218 C   0  0  0

+    2.4927   -1.4638    0.1936 C   0  0  0

+    0.5028   -2.8224    0.3153 C   0  0  0

+   -1.8029    0.6404   -0.0092 C   0  0  0

+    3.1818   -0.2730    0.0879 C   0  0  0

+    2.9838    2.0593   -0.1226 O   0  0  0

+   -1.2089    1.9009   -0.1125 C   0  0  0

+    0.2889   -3.4131   -1.0798 C   0  0  0

+   -3.1912    0.5292   -0.0058 N   0  0  0

+    4.6511   -0.2582    0.0877 C   0  0  0

+   -1.9837    3.0031   -0.2128 F   0  0  0

+   -3.5576   -0.1409    1.2480 C   0  0  0

+   -3.5437   -0.3868   -1.0975 C   0  0  0

+    5.3134    0.9113   -0.0172 O   0  0  0

+    5.2695   -1.3006    0.1820 O   0  0  0

+   -5.0631   -0.4084    1.2671 C   0  0  0

+   -5.0492   -0.6543   -1.0784 C   0  0  0

+   -5.4156   -1.3244    0.1754 N   0  0  0

+   -1.4667   -1.4302    0.0000 H   0  0  0

+    0.5862    2.9590    0.0000 H   0  0  0

+    3.0253   -2.3476    0.0000 H   0  0  0

+   -0.0994   -1.9845    0.0000 H   0  0  0

+   -0.5193   -2.9642    0.0000 H   0  0  0

+   -0.6813   -3.0618    0.0000 H   0  0  0

+   -0.0624   -4.3833    0.0000 H   0  0  0

+    1.2591   -3.7644    0.0000 H   0  0  0

+   -3.6087   -1.1715    0.0000 H   0  0  0

+   -2.5645   -0.4211    0.0000 H   0  0  0

+   -3.5491   -1.4186    0.0000 H   0  0  0

+   -2.5297   -0.5779    0.0000 H   0  0  0

+    5.8219    1.8092    0.0000 H   0  0  0

+   -5.0577    0.6234    0.0000 H   0  0  0

+   -6.0771   -0.2173    0.0000 H   0  0  0

+   -4.9981    0.3763    0.0000 H   0  0  0

+   -6.0423   -0.3741    0.0000 H   0  0  0

+   -5.8494   -2.2607    0.0000 H   0  0  0

+  1  2  1  0

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+  7 10  2  0

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+ 19 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+32784-82-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 54                          1 V2000

+  -12.6148   -0.6813    0.3166 C   0  0  0

+  -13.5393    0.1839    0.8708 C   0  0  0

+  -11.3702   -0.8295    0.9002 C   0  0  0

+  -13.0249   -1.6007   -1.1295 S   0  0  0

+  -13.2196    0.9010    2.0087 C   0  0  0

+  -11.0506   -0.1125    2.0378 C   0  0  0

+  -12.6202   -0.7610   -2.3326 O   0  0  0

+  -12.1547   -2.7241   -1.1324 O   0  0  0

+  -14.4443   -1.6598   -1.1598 O   0  0  0

+  -11.9754    0.7528    2.5922 C   0  0  0

+  -11.6271    1.5341    3.8328 C   0  0  0

+   11.0618   -0.9443    0.1920 C   0  0  0

+   10.0383    0.0134    0.8055 C   0  0  0

+   12.2605   -0.9223    0.9696 O   0  0  0

+    8.7549   -0.0101   -0.0270 C   0  0  0

+   13.2311   -1.8908    0.3091 S   0  0  0

+    7.7722    0.9093    0.5620 N   0  0  0

+   14.1212   -0.8417   -0.8732 C   0  0  0

+   14.0653   -2.2866    1.3893 O   0  0  0

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+    6.5707    0.8393   -0.2803 C   0  0  0

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+    6.8698   -0.0562    0.0000 H   0  0  0

+    6.2865    2.3008    0.0000 H   0  0  0

+    5.2010    2.6737    0.0000 H   0  0  0

+    3.4625    1.1826    0.0000 H   0  0  0

+    4.5480    0.8097    0.0000 H   0  0  0

+    0.3125    1.6646    0.0000 H   0  0  0

+    0.5353    0.3482    0.0000 H   0  0  0

+    1.8517    0.5710    0.0000 H   0  0  0

+  1  2  2  0

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+ 26 53  1  0

+ 26 54  1  0

+ 26 55  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6313-44-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+   -0.0064   -2.1002   -0.5727 N   0  3  0

+   -0.0619   -3.2903   -0.3194 O   0  5  0

+    0.0421   -1.7256   -1.7306 O   0  0  0

+   -0.0041   -1.1191    0.5153 C   0  0  0

+    1.2550   -0.3092    0.4546 C   0  0  0

+   -1.2573   -0.3004    0.4521 C   0  0  0

+    1.2703    1.0058   -0.0075 C   0  0  0

+    2.4440   -0.8874    0.8690 C   0  0  0

+   -1.2634    1.0128   -0.0155 C   0  0  0

+   -2.4503   -0.8684    0.8691 C   0  0  0

+    0.0065    1.6431   -0.4400 C   0  0  0

+    2.4659    1.7232   -0.0608 C   0  0  0

+    3.6258   -0.1737    0.8184 C   0  0  0

+   -2.4542    1.7377   -0.0734 C   0  0  0

+   -3.6272   -0.1469    0.8149 C   0  0  0

+    0.0115    2.6503   -1.1205 O   0  0  0

+    3.6405    1.1298    0.3530 C   0  0  0

+   -3.6330    1.1542    0.3427 C   0  0  0

+   -0.8744   -1.5888    0.0000 H   0  0  0

+    2.4888   -1.8754    0.0000 H   0  0  0

+   -2.5025   -1.8560    0.0000 H   0  0  0

+    2.4300    2.7115    0.0000 H   0  0  0

+    4.4844   -0.6646    0.0000 H   0  0  0

+   -2.4111    2.7257    0.0000 H   0  0  0

+   -4.4891   -0.6320    0.0000 H   0  0  0

+    4.4858    1.6432    0.0000 H   0  0  0

+   -4.4744    1.6740    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

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+  5  4  1  0

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+  8  5  1  0

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+  8 20  1  0

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+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+103395-25-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    0.9881   -0.7038    0.0834 C   0  0  0

+   -0.1885   -0.2139    0.3016 C   0  0  0

+    1.9652    0.3577   -0.1542 C   0  0  0

+    1.3439   -2.1177    0.0716 C   0  0  0

+   -0.0793    1.2513    0.2233 C   0  0  0

+   -1.2647   -1.1905    0.5561 C   0  0  0

+    1.1759    1.5938   -0.0430 C   0  0  0

+    3.2006   -0.0087   -0.3883 C   0  0  0

+    0.3890   -2.9864    0.3026 C   0  0  0

+    2.7570   -2.4302   -0.2014 C   0  0  0

+   -1.0945    2.3084    0.3878 C   0  0  0

+   -0.9796   -2.4804    0.5480 C   0  0  0

+   -2.6722   -0.7222    0.8224 C   0  0  0

+    1.5401    3.0132   -0.1718 C   0  0  0

+    3.5911   -1.4277   -0.4120 C   0  0  0

+   -0.7644    3.5750    0.2725 C   0  0  0

+   -3.5696   -0.5988   -0.7365 Cl  0  0  0

+    0.6288    3.9500   -0.0245 C   0  0  0

+    3.9733    0.7489    0.0000 H   0  0  0

+    0.5955   -4.0486    0.0000 H   0  0  0

+    3.1072   -3.4540    0.0000 H   0  0  0

+   -2.1416    2.0353    0.0000 H   0  0  0

+   -1.7952   -3.1915    0.0000 H   0  0  0

+   -1.9087    0.0446    0.0000 H   0  0  0

+   -3.0182    0.3031    0.0000 H   0  0  0

+    2.5858    3.2916    0.0000 H   0  0  0

+    4.6488   -1.6561    0.0000 H   0  0  0

+   -1.5326    4.3371    0.0000 H   0  0  0

+    0.9155    4.9934    0.0000 H   0  0  0

+  1  2  2  0

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+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 18 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+61-57-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.5690   -0.0431   -0.0014 C   0  0  0

+   -1.9292    0.2435   -0.0016 N   0  0  0

+    0.7771    1.0539   -0.0011 S   0  0  0

+    0.0302   -1.2178    0.0045 N   0  0  0

+   -2.9137   -0.6647   -0.0018 C   0  0  0

+   -2.5159    1.5919    0.0047 C   0  0  0

+    2.0766   -0.1725   -0.0009 C   0  0  0

+    1.3457   -1.3137    0.0037 C   0  0  0

+   -4.1431   -0.1329   -0.0020 N   0  0  0

+   -2.7099   -1.8634   -0.0014 O   0  0  0

+   -4.0351    1.3336    0.0014 C   0  0  0

+    3.5460    0.0081   -0.0006 N   0  3  0

+    4.2792   -0.9645   -0.0006 O   0  0  0

+    4.0218    1.1294   -0.0005 O   0  5  0

+   -1.5543    1.9210    0.0000 H   0  0  0

+   -2.7664    2.5769    0.0000 H   0  0  0

+    1.8007   -2.2225    0.0000 H   0  0  0

+   -5.0125   -0.6594    0.0000 H   0  0  0

+   -4.1242    2.3461    0.0000 H   0  0  0

+   -5.0515    1.3264    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+  7  8  2  0

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+  6 15  1  0

+  6 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+119631-01-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -1.3378    0.3230   -0.0039 C   0  0  0

+   -1.1694   -1.1343   -0.0013 C   0  0  0

+   -0.2758    1.1193   -0.0036 N   0  0  0

+   -2.6526    0.8555   -0.0009 C   0  0  0

+    0.0491   -1.6672    0.0006 N   0  0  0

+   -2.3201   -1.9498   -0.0012 C   0  0  0

+    0.9430    0.5873   -0.0008 C   0  0  0

+   -3.7204    0.0051    0.0043 C   0  0  0

+   -2.8522    2.2334   -0.0029 N   0  0  0

+    1.1123   -0.8714    0.0001 C   0  0  0

+   -3.5526   -1.3776   -0.0036 C   0  0  0

+    2.0912    1.4034   -0.0006 C   0  0  0

+   -5.1150    0.5762    0.0080 C   0  0  0

+    2.4204   -1.4049    0.0012 C   0  0  0

+    3.3277    0.8260    0.0021 C   0  0  0

+    3.4866   -0.5682   -0.0002 C   0  0  0

+    4.4588    1.6399    0.0023 N   0  0  0

+    4.8770   -1.1494    0.0010 C   0  0  0

+   -2.2252   -2.9904    0.0000 H   0  0  0

+   -2.0316    2.8802    0.0000 H   0  0  0

+   -3.8226    2.6207    0.0000 H   0  0  0

+   -4.3978   -1.9919    0.0000 H   0  0  0

+    1.9967    2.4440    0.0000 H   0  0  0

+   -4.7190    1.5431    0.0000 H   0  0  0

+   -6.0819    0.9722    0.0000 H   0  0  0

+   -5.5110   -0.3907    0.0000 H   0  0  0

+    2.5652   -2.4397    0.0000 H   0  0  0

+    5.4114    1.2105    0.0000 H   0  0  0

+    4.3543    2.6795    0.0000 H   0  0  0

+    4.4740   -2.1134    0.0000 H   0  0  0

+    5.8410   -1.5524    0.0000 H   0  0  0

+    5.2800   -0.1854    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+103139-94-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.8002   -0.3831   -0.0023 C   0  0  0

+   -0.6560   -0.4992   -0.0014 C   0  0  0

+    1.3800    0.9102   -0.0013 C   0  0  0

+    1.5840   -1.4602    0.0015 N   0  0  0

+   -1.4228    0.6689    0.0004 C   0  0  0

+   -1.5120   -1.5464   -0.0020 N   0  0  0

+    0.5476    2.0455    0.0001 C   0  0  0

+    2.7114    1.0322   -0.0021 N   0  0  0

+    2.8917   -1.3153    0.0011 C   0  0  0

+   -0.8036    1.9213    0.0014 C   0  0  0

+   -2.7451    0.2595    0.0009 N   0  0  0

+   -2.7467   -1.1041   -0.0006 C   0  0  0

+    1.1665    3.4196    0.0012 C   0  0  0

+    3.4652   -0.0448   -0.0037 C   0  0  0

+    3.7778   -2.5343    0.0054 C   0  0  0

+   -3.9238    1.1295    0.0033 C   0  0  0

+   -3.8753   -1.8976   -0.0014 N   0  0  0

+   -1.3912    2.7772    0.0000 H   0  0  0

+    2.1131    2.9933    0.0000 H   0  0  0

+    1.5928    4.3662    0.0000 H   0  0  0

+    0.2199    3.8459    0.0000 H   0  0  0

+    4.4989    0.0519    0.0000 H   0  0  0

+    2.9380   -3.1447    0.0000 H   0  0  0

+    4.3882   -3.3741    0.0000 H   0  0  0

+    4.6176   -1.9239    0.0000 H   0  0  0

+   -3.3073    1.9648    0.0000 H   0  0  0

+   -4.7591    1.7460    0.0000 H   0  0  0

+   -4.5403    0.2942    0.0000 H   0  0  0

+   -4.8170   -1.4607    0.0000 H   0  0  0

+   -3.7828   -2.9316    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+ 16 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2243-62-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+    0.4395    0.5549    0.0023 C   0  0  0

+   -0.4392   -0.5550    0.0012 C   0  0  0

+    1.8332    0.3320    0.0014 C   0  0  0

+   -0.0884    1.8562   -0.0017 C   0  0  0

+   -1.8334   -0.3320    0.0020 C   0  0  0

+    0.0883   -1.8559   -0.0016 C   0  0  0

+    2.3121   -0.9607   -0.0004 C   0  0  0

+    2.7178    1.4096    0.0020 N   0  0  0

+   -1.4372    2.0431   -0.0065 C   0  0  0

+   -2.3121    0.9604    0.0038 C   0  0  0

+   -2.7180   -1.4095    0.0005 N   0  0  0

+    1.4375   -2.0431   -0.0034 C   0  0  0

+    0.5539    2.6812    0.0000 H   0  0  0

+   -0.5542   -2.6808    0.0000 H   0  0  0

+    3.3439   -1.1298    0.0000 H   0  0  0

+    3.7494    1.2391    0.0000 H   0  0  0

+    2.3496    2.3882    0.0000 H   0  0  0

+   -1.8218    3.0154    0.0000 H   0  0  0

+   -3.3439    1.1295    0.0000 H   0  0  0

+   -3.7496   -1.2390    0.0000 H   0  0  0

+   -2.3499   -2.3881    0.0000 H   0  0  0

+    1.8221   -3.0154    0.0000 H   0  0  0

+  1  2  1  0

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+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+53527-28-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 69 72                          1 V2000

+   -0.7708    1.2583   -0.1674 C   0  0  2

+   -1.7127    0.1476    0.3529 C   0  0  2

+    0.6292    1.1774    0.3776 C   0  0  1

+   -1.5987    2.4884    0.0699 C   0  0  0

+   -0.6768    1.1145   -1.6034 O   0  0  0

+   -1.1486   -1.2021   -0.0205 C   0  0  1

+   -2.9408    0.6261   -0.4718 C   0  0  2

+   -2.0767    0.2146    1.8352 C   0  0  0

+    1.1423   -0.2243    0.0504 C   0  0  2

+    1.5184    2.2180   -0.3339 C   0  0  0

+    0.6569    1.5140    1.8656 C   0  0  0

+   -2.8883    2.1259   -0.1443 C   0  0  0

+    0.2463   -1.3068    0.6431 C   0  0  0

+   -1.9953   -2.2603    0.4999 O   0  0  0

+   -4.1888    0.0390    0.1362 C   0  0  0

+    2.6183   -0.4568    0.3227 C   0  0  2

+    2.9708    2.0060    0.1267 C   0  0  0

+   -4.0440    3.0123   -0.0538 C   0  0  0

+   -2.0802   -3.4322   -0.1490 C   0  0  0

+   -4.8995   -0.6819   -0.5221 O   0  0  0

+    3.4113    0.6329   -0.3880 C   0  0  1

+    3.0352   -1.8093   -0.2979 C   0  0  0

+    2.9129   -0.5387    1.8154 C   0  0  0

+   -5.1578    2.5804   -0.2661 O   0  0  0

+   -2.9591   -4.5307    0.3912 C   0  0  0

+   -1.4520   -3.6064   -1.1663 O   0  0  0

+    4.9135    0.4701   -0.3899 C   0  0  0

+    4.5257   -1.9964    0.0139 C   0  0  0

+    5.3391   -0.9531   -0.7416 C   0  0  0

+    5.4859    1.3985   -1.4893 C   0  0  0

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+ 30 66  1  0

+ 31 67  1  0

+ 31 68  1  0

+ 31 69  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24280-93-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+   -3.2989    0.0504   -0.6494 C   0  0  0

+   -2.6794   -0.9381    0.1253 C   0  0  0

+   -2.7191    1.2849   -0.7927 C   0  0  0

+   -4.5744   -0.5611   -1.1729 C   0  0  0

+   -1.4575   -0.6550    0.7557 C   0  0  0

+   -3.5244   -2.1385    0.0933 C   0  0  0

+   -1.5063    1.5631   -0.1664 C   0  0  0

+   -3.3944    2.3413   -1.6287 C   0  0  0

+   -4.6210   -1.9177   -0.6518 O   0  0  0

+   -0.8808    0.5941    0.6047 C   0  0  0

+   -0.8448   -1.6014    1.5100 O   0  0  0

+   -3.2720   -3.1808    0.6654 O   0  0  0

+   -0.9351    2.7856   -0.3107 O   0  0  0

+    0.4306    0.9026    1.2801 C   0  0  0

+   -1.3629    3.5751    0.8010 C   0  0  0

+    1.5607    0.6793    0.3084 C   0  0  0

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+    6.3776   -1.3015   -1.8060 O   0  0  0

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+   -4.8403    0.3411    0.0000 H   0  0  0

+   -5.5075   -0.6794    0.0000 H   0  0  0

+   -2.6020    2.8479    0.0000 H   0  0  0

+   -3.9010    3.1337    0.0000 H   0  0  0

+   -4.1868    1.8347    0.0000 H   0  0  0

+   -0.3337   -2.3909    0.0000 H   0  0  0

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+   -0.1102    1.6721    0.0000 H   0  0  0

+   -0.5360    4.0232    0.0000 H   0  0  0

+   -1.8110    4.4020    0.0000 H   0  0  0

+   -2.1898    3.1270    0.0000 H   0  0  0

+    1.6077   -0.2601    0.0000 H   0  0  0

+    3.0709   -0.4293    0.0000 H   0  0  0

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+    3.2486    3.4131    0.0000 H   0  0  0

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+    5.3642    0.4161    0.0000 H   0  0  0

+    4.3611    0.8763    0.0000 H   0  0  0

+    7.2702   -1.5980    0.0000 H   0  0  0

+  1  2  2  0

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+  6  9  1  0

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+ 19 39  1  0

+ 19 40  1  0

+ 20 41  1  0

+ 20 42  1  0

+ 22 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4406-41-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+    0.8910    0.4224   -0.1101 C   0  0  0

+   -0.4425    0.8451   -0.1423 N   0  0  0

+    1.2670   -0.7442   -0.7625 C   0  0  0

+    1.8425    1.1720    0.5696 C   0  0  0

+   -1.4228    0.0137    0.2628 C   0  0  0

+    2.5843   -1.1588   -0.7289 C   0  0  0

+    3.1577    0.7521    0.5995 C   0  0  0

+   -2.8661    0.4192    0.1090 C   0  0  0

+   -1.1435   -1.0608    0.7512 O   0  0  0

+    3.5279   -0.4134   -0.0465 C   0  0  0

+   -3.1734    0.6598   -1.3704 C   0  0  0

+   -3.7685   -0.6952    0.6426 C   0  0  0

+   -0.6279    1.7683    0.0000 H   0  0  0

+    0.6034   -1.4123    0.0000 H   0  0  0

+    1.6747    2.0986    0.0000 H   0  0  0

+    2.7546   -2.0849    0.0000 H   0  0  0

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+   -4.5003   -0.1026    0.0000 H   0  0  0

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+   -3.0367   -1.2878    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1878-66-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.7429    0.0079   -0.6813 C   0  0  0

+   -0.0711   -1.1911   -0.5344 C   0  0  0

+   -0.0694    1.2035   -0.5121 C   0  0  0

+   -2.2084    0.0120   -1.0321 C   0  0  0

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+    1.2758    1.2004   -0.1960 C   0  0  0

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+    1.9489    0.0004   -0.0487 C   0  0  0

+   -4.3683   -0.0018    0.1640 O   0  0  0

+   -2.4780   -0.0152    1.3085 O   0  0  0

+    3.6389   -0.0043    0.3484 Cl  0  0  0

+   -0.5929   -2.0782    0.0000 H   0  0  0

+   -0.5877    2.0927    0.0000 H   0  0  0

+   -1.6974    0.9054    0.0000 H   0  0  0

+   -2.7327    0.8976    0.0000 H   0  0  0

+    1.7923   -2.0850    0.0000 H   0  0  0

+    1.7969    2.0879    0.0000 H   0  0  0

+   -5.3975   -0.0012    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  7  9  1  0

+  7 10  2  0

+  8 11  1  0

+  6  8  1  0

+  2 12  1  0

+  3 13  1  0

+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  6 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146177-64-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+   -0.4312    0.2901    0.0053 C   0  0  0

+   -1.6557   -0.5066   -0.0318 C   0  0  0

+   -0.5393    1.7026    0.0647 C   0  0  0

+    0.7696   -0.2839   -0.0100 N   0  0  0

+   -2.8873    0.1532   -0.0075 C   0  0  0

+   -1.9077   -1.8341   -0.0886 N   0  0  0

+   -1.8124    2.3014    0.0868 C   0  0  0

+    0.5712    2.4487    0.0993 N   0  0  0

+    1.8570    0.4705    0.0247 C   0  0  0

+   -2.9409    1.5478    0.0506 C   0  0  0

+   -3.8536   -0.8369   -0.0520 N   0  0  0

+   -3.2038   -2.0347   -0.1008 C   0  0  0

+   -1.9249    3.8029    0.1504 C   0  0  0

+    1.7491    1.8700    0.0782 C   0  0  0

+    3.1961   -0.1655    0.0082 C   0  0  0

+   -5.3047   -0.6354   -0.0472 C   0  0  0

+   -3.8164   -3.2697   -0.1551 N   0  0  0

+    4.2306    0.4006   -0.7357 C   0  0  0

+    3.4274   -1.3284    0.7411 C   0  0  0

+    5.4749   -0.1954   -0.7469 C   0  0  0

+    4.6762   -1.9158    0.7223 C   0  0  0

+    5.6972   -1.3526   -0.0217 C   0  0  0

+   -3.8619    2.0177    0.0000 H   0  0  0

+   -0.8938    3.8802    0.0000 H   0  0  0

+   -2.0022    4.8340    0.0000 H   0  0  0

+   -2.9560    3.7256    0.0000 H   0  0  0

+    2.6050    2.4500    0.0000 H   0  0  0

+   -5.1625    0.3887    0.0000 H   0  0  0

+   -6.3288   -0.4932    0.0000 H   0  0  0

+   -5.4469   -1.6595    0.0000 H   0  0  0

+   -4.8483   -3.3349    0.0000 H   0  0  0

+   -3.2440   -4.1307    0.0000 H   0  0  0

+    4.2027    1.4342    0.0000 H   0  0  0

+    2.6130   -1.9654    0.0000 H   0  0  0

+    6.2936    0.4360    0.0000 H   0  0  0

+    4.7095   -2.9492    0.0000 H   0  0  0

+    6.6333   -1.7916    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 11 16  1  0

+ 12 17  1  0

+ 15 18  1  0

+ 15 19  2  0

+ 18 20  2  0

+ 19 21  1  0

+ 20 22  1  0

+  7 10  2  0

+  9 14  1  0

+ 11 12  1  0

+ 21 22  2  0

+ 10 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 22 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+119-65-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    0.0527    0.7260   -0.0028 C   0  0  0

+    0.0218   -0.6932   -0.0008 C   0  0  0

+    1.2874    1.3909   -0.0022 C   0  0  0

+   -1.1718    1.4180    0.0006 C   0  0  0

+    1.2303   -1.4075    0.0016 C   0  0  0

+   -1.2254   -1.3377   -0.0010 C   0  0  0

+    2.4398    0.6647    0.0002 C   0  0  0

+   -2.3287    0.6990    0.0056 C   0  0  0

+    2.4107   -0.7288    0.0021 C   0  0  0

+   -2.3289   -0.6268   -0.0029 N   0  0  0

+    1.3231    2.4356    0.0000 H   0  0  0

+   -1.1936    2.4631    0.0000 H   0  0  0

+    1.2240   -2.4528    0.0000 H   0  0  0

+   -1.2752   -2.3819    0.0000 H   0  0  0

+    3.3603    1.1602    0.0000 H   0  0  0

+   -3.2423    1.2070    0.0000 H   0  0  0

+    3.3100   -1.2617    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7  9  1  0

+  8 10  2  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+32534-81-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -1.1934    0.0073   -0.6556 C   0  0  0

+   -0.5268   -1.1974   -0.4827 C   0  0  0

+   -0.5142    1.2054   -0.4817 C   0  0  0

+   -2.5083    0.0143   -1.0003 O   0  0  0

+    0.8128   -1.2022   -0.1375 C   0  0  0

+   -1.4488   -2.8313   -0.7194 Br  0  0  0

+    0.8249    1.1962   -0.1366 C   0  0  0

+   -1.4197    2.8489   -0.7159 Br  0  0  0

+   -3.2180    0.0143    0.1585 C   0  0  0

+    1.4881   -0.0067    0.0354 C   0  0  0

+    1.7216   -2.8436    0.0988 Br  0  0  0

+    1.7508    2.8279    0.1004 Br  0  0  0

+   -4.6054    0.0207    0.1238 C   0  0  0

+   -2.5571    0.0022    1.3782 C   0  0  0

+    3.3191   -0.0164    0.5078 Br  0  0  0

+   -5.3244    0.0208    1.3031 C   0  0  0

+   -3.2811    0.0024    2.5549 C   0  0  0

+   -4.6631    0.0145    2.5176 C   0  0  0

+   -4.6030    1.0509    0.0000 H   0  0  0

+   -1.5269   -0.0074    0.0000 H   0  0  0

+   -6.3546    0.0258    0.0000 H   0  0  0

+   -3.2858   -1.0278    0.0000 H   0  0  0

+   -4.6725   -1.0157    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+  9 13  1  0

+  9 14  2  0

+ 10 15  1  0

+ 13 16  2  0

+ 14 17  1  0

+ 16 18  1  0

+  7 10  1  0

+ 17 18  2  0

+ 13 19  1  0

+ 14 20  1  0

+ 16 21  1  0

+ 17 22  1  0

+ 18 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5776-39-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -2.3639    1.2835   -0.3387 C   0  0  0

+   -3.1050    0.1919    0.3003 C   0  0  0

+   -1.0682    1.0559   -0.8096 C   0  0  0

+   -2.9757    2.5477   -0.4599 C   0  0  0

+   -2.5583   -1.0113    0.4366 N   0  3  0

+   -4.4118    0.4510    0.7668 C   0  0  0

+   -0.5307   -0.2231   -0.6464 C   0  0  0

+   -4.2349    2.7295    0.0159 C   0  0  0

+   -1.3294   -1.2676    0.0023 C   0  0  0

+   -3.3276   -2.0788    1.0807 C   0  0  0

+   -4.9461    1.6898    0.6150 C   0  0  0

+    0.7696   -0.5338   -1.0936 C   0  0  0

+   -0.7606   -2.5508    0.1531 C   0  0  0

+    1.2557   -1.7896   -0.9155 C   0  0  0

+    0.4973   -2.7856   -0.3003 C   0  0  0

+    9.9996    0.8333    0.3797 Cl  0  0  0

+   -0.4511    1.8294    0.0000 H   0  0  0

+   -2.3913    3.3463    0.0000 H   0  0  0

+   -5.0338   -0.3187    0.0000 H   0  0  0

+   -4.6327    3.6356    0.0000 H   0  0  0

+   -4.1304   -1.5003    0.0000 H   0  0  0

+   -3.9061   -2.8816    0.0000 H   0  0  0

+   -2.5248   -2.6573    0.0000 H   0  0  0

+   -5.9311    1.7850    0.0000 H   0  0  0

+    1.4206    0.2114    0.0000 H   0  0  0

+   -1.3744   -3.3270    0.0000 H   0  0  0

+    2.2355   -1.9284    0.0000 H   0  0  0

+    0.8530   -3.7090    0.0000 H   0  0  0

+   10.9892    0.8333    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 12 14  2  0

+ 13 15  2  0

+  7  9  1  0

+  8 11  1  0

+ 14 15  1  0

+  3 17  1  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+476-66-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 31                          1 V2000

+    0.7258   -0.1091    0.0607 C   0  0  0

+   -0.7258    0.1087    0.0607 C   0  0  0

+    1.5969    0.9759    0.1482 C   0  0  0

+    1.1935   -1.4365   -0.0405 C   0  0  0

+   -1.5968   -0.9759    0.1482 C   0  0  0

+   -1.1935    1.4366   -0.0407 C   0  0  0

+    1.0862    2.2296    0.2582 O   0  0  0

+    2.9633    0.7233    0.1372 C   0  0  0

+    0.1772   -2.4941   -0.1642 C   0  0  0

+    2.5636   -1.6666   -0.0362 C   0  0  0

+   -1.0861   -2.2296    0.2583 O   0  0  0

+   -2.9636   -0.7231    0.1371 C   0  0  0

+   -0.1771    2.4940   -0.1645 C   0  0  0

+   -2.5633    1.6666   -0.0364 C   0  0  0

+    3.4321   -0.5888    0.0495 C   0  0  0

+    3.8445    1.7549    0.2115 O   0  0  0

+    0.4620   -3.5792   -0.6341 O   0  0  0

+   -3.4321    0.5886    0.0498 C   0  0  0

+   -3.8448   -1.7547    0.2110 O   0  0  0

+   -0.4620    3.5792   -0.6341 O   0  0  0

+    4.7728   -0.8155    0.0485 O   0  0  0

+   -4.7727    0.8155    0.0488 O   0  0  0

+    2.9336   -2.6404    0.0000 H   0  0  0

+   -2.9332    2.6404    0.0000 H   0  0  0

+    4.5211    2.5470    0.0000 H   0  0  0

+   -4.5214   -2.5468    0.0000 H   0  0  0

+    5.8000   -0.9892    0.0000 H   0  0  0

+   -5.7998    0.9893    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  8 15  1  0

+  8 16  1  0

+  9 17  2  0

+ 12 18  2  0

+ 12 19  1  0

+ 13 20  2  0

+ 15 21  1  0

+ 18 22  1  0

+  7 13  1  0

+  9 11  1  0

+ 10 15  2  0

+ 14 18  1  0

+ 10 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 19 26  1  0

+ 21 27  1  0

+ 22 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+102-32-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.4557    0.2157   -0.6353 C   0  0  0

+    0.3376   -0.9082   -0.4987 C   0  0  0

+    0.0711    1.4710   -0.3943 C   0  0  0

+   -1.8963    0.0726   -1.0539 C   0  0  0

+    1.6640   -0.7780   -0.1194 C   0  0  0

+    1.3936    1.6079   -0.0155 C   0  0  0

+   -2.7621   -0.0815    0.1699 C   0  0  0

+    2.1942    0.4855    0.1233 C   0  0  0

+    2.4456   -1.8826    0.0159 O   0  0  0

+   -4.0902   -0.2252    0.0386 O   0  0  0

+   -2.2608   -0.0758    1.2692 O   0  0  0

+    3.4954    0.6184    0.4958 O   0  0  0

+   -0.0820   -1.8251    0.0000 H   0  0  0

+   -0.5297    2.2808    0.0000 H   0  0  0

+   -1.5047    1.0018    0.0000 H   0  0  0

+   -2.5257    0.8605    0.0000 H   0  0  0

+    1.8085    2.5270    0.0000 H   0  0  0

+    3.0281   -2.7058    0.0000 H   0  0  0

+   -5.0927   -0.3337    0.0000 H   0  0  0

+    4.4986    0.7209    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  7 10  1  0

+  7 11  2  0

+  8 12  1  0

+  6  8  1  0

+  2 13  1  0

+  3 14  1  0

+  4 15  1  0

+  4 16  1  0

+  6 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+39860-12-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.1859    0.7495   -0.0036 C   0  0  0

+    0.1378   -0.6172   -0.0013 C   0  0  0

+    0.9859    1.4380   -0.0025 N   0  0  0

+   -1.5277    1.1385   -0.0013 C   0  0  0

+    1.5214   -0.6854    0.0011 N   0  0  0

+   -0.8718   -1.5677   -0.0023 C   0  0  0

+    1.9900    0.5971    0.0003 C   0  0  0

+   -2.5172    0.1811    0.0031 C   0  0  0

+    2.3311   -1.9063    0.0041 C   0  0  0

+   -2.1920   -1.1673   -0.0055 C   0  0  0

+    3.3220    0.9539    0.0018 N   0  0  0

+   -3.9644    0.6014    0.0061 C   0  0  0

+   -1.7781    2.1468    0.0000 H   0  0  0

+   -0.6345   -2.5792    0.0000 H   0  0  0

+    1.4653   -2.4805    0.0000 H   0  0  0

+    2.9053   -2.7722    0.0000 H   0  0  0

+    3.1969   -1.3321    0.0000 H   0  0  0

+   -2.9476   -1.8804    0.0000 H   0  0  0

+    4.0566    0.2192    0.0000 H   0  0  0

+    3.5910    1.9574    0.0000 H   0  0  0

+   -3.6746    1.5991    0.0000 H   0  0  0

+   -4.9621    0.8912    0.0000 H   0  0  0

+   -4.2542   -0.3963    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  5  7  1  0

+  8 10  1  0

+  4 13  1  0

+  6 14  1  0

+  9 15  1  0

+  9 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+935-95-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.0002   -1.1966   -0.0009 C   0  0  0

+   -1.2012   -0.5018   -0.0007 C   0  0  0

+    1.2012   -0.5016   -0.0006 C   0  0  0

+   -0.0002   -2.5561    0.0042 O   0  0  0

+   -1.1988    0.8821   -0.0002 C   0  0  0

+   -2.7058   -1.3678   -0.0005 Cl  0  0  0

+    1.1988    0.8819   -0.0001 C   0  0  0

+    2.7058   -1.3676   -0.0014 Cl  0  0  0

+   -0.0001    1.5727   -0.0003 C   0  0  0

+   -2.7010    1.7521    0.0001 Cl  0  0  0

+    2.7011    1.7518    0.0009 Cl  0  0  0

+   -0.0002   -3.5967    0.0000 H   0  0  0

+   -0.0001    2.6133    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  5 10  1  0

+  7 11  1  0

+  7  9  1  0

+  4 12  1  0

+  9 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+62-73-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    1.6863   -0.1520   -0.1466 P   0  0  0

+    0.2607    0.5961   -0.1340 O   0  0  0

+    2.8411    0.9003   -0.5353 O   0  0  0

+    1.9852   -0.7619    1.3131 O   0  0  0

+    1.6604   -1.2463   -1.1427 O   0  0  0

+   -0.6905   -0.3724   -0.0805 C   0  0  0

+    4.0215    0.1394   -0.7991 C   0  0  0

+    1.8692    0.3167    2.2432 C   0  0  0

+   -1.9667   -0.0424   -0.0587 C   0  0  0

+   -3.1822   -1.2800    0.0097 Cl  0  0  0

+   -2.4318    1.6297   -0.0985 Cl  0  0  0

+   -0.4136   -1.3704    0.0000 H   0  0  0

+    3.4604   -0.7311    0.0000 H   0  0  0

+    4.8920   -0.4217    0.0000 H   0  0  0

+    4.5826    1.0099    0.0000 H   0  0  0

+    2.8990    0.4274    0.0000 H   0  0  0

+    1.7585    1.3465    0.0000 H   0  0  0

+    0.8394    0.2060    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  6  9  2  0

+  9 10  1  0

+  9 11  1  0

+  6 12  1  0

+  7 13  1  0

+  7 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-88-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.9696    0.0001    0.0021 C   0  0  0

+   -0.2783   -1.1972    0.0012 C   0  0  0

+   -0.2786    1.1971    0.0013 C   0  0  0

+   -2.4766    0.0000   -0.0024 C   0  0  0

+    1.1039   -1.1972   -0.0004 C   0  0  0

+    1.1040    1.1971   -0.0004 C   0  0  0

+    1.7951    0.0002   -0.0013 C   0  0  0

+   -0.7967   -2.0952    0.0000 H   0  0  0

+   -0.7971    2.0951    0.0000 H   0  0  0

+   -2.4767    1.0369    0.0000 H   0  0  0

+   -3.5135   -0.0001    0.0000 H   0  0  0

+   -2.4765   -1.0369    0.0000 H   0  0  0

+    1.6224   -2.0952    0.0000 H   0  0  0

+    1.6224    2.0951    0.0000 H   0  0  0

+    2.8320    0.0003    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  6  7  2  0

+  2  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1194-65-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.0001   -0.2117   -0.0014 C   0  0  0

+   -1.2083    0.4908   -0.0003 C   0  0  0

+    1.2085    0.4908   -0.0003 C   0  0  0

+   -0.0003   -1.6437    0.0022 C   0  0  0

+   -1.1999    1.8718    0.0019 C   0  0  0

+   -2.7157   -0.3703   -0.0023 Cl  0  0  0

+    1.2004    1.8714    0.0020 C   0  0  0

+    2.7158   -0.3706   -0.0022 Cl  0  0  0

+   -0.0004   -2.7797    0.0051 N   0  0  0

+    0.0001    2.5597    0.0030 C   0  0  0

+   -2.1007    2.3974    0.0000 H   0  0  0

+    2.1013    2.3969    0.0000 H   0  0  0

+    0.0002    3.6027    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  3  0

+  5 10  2  0

+  7 10  1  0

+  5 11  1  0

+  7 12  1  0

+ 10 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3153-55-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 43                          1 V2000

+    1.0028   -0.1147   -0.1450 C   0  0  0

+   -0.3685   -0.3769   -0.1296 C   0  0  0

+    1.4880    1.3101   -0.1608 C   0  0  1

+    1.8993   -1.1629   -0.1514 C   0  0  0

+   -1.3233    0.7569   -0.1510 C   0  0  0

+   -0.8343   -1.6901   -0.0889 C   0  0  0

+    0.5551    2.2132    0.6431 C   0  0  0

+    2.8332    1.3739    0.4271 N   0  0  0

+    1.4354   -2.4701   -0.1039 C   0  0  0

+    3.3817   -0.9275   -0.2389 C   0  0  0

+   -0.8736    2.0247    0.2150 C   0  0  0

+   -2.6485    0.5689   -0.5293 C   0  0  0

+    0.0782   -2.7389   -0.0697 C   0  0  0

+   -2.1698   -1.9432   -0.0677 O   0  0  0

+    3.7071    0.5486   -0.4061 C   0  0  0

+    3.2938    2.7608    0.2776 C   0  0  0

+   -1.7461    3.0933    0.1906 C   0  0  0

+   -3.5138    1.6452   -0.5459 C   0  0  0

+   -0.3615   -4.0249   -0.0197 O   0  0  0

+   -2.5320   -2.1356    1.3012 C   0  0  0

+   -3.0628    2.9034   -0.1890 C   0  0  0

+    1.8535    2.2786    0.0000 H   0  0  0

+    1.4221    2.7789    0.0000 H   0  0  0

+    0.1956    3.1840    0.0000 H   0  0  0

+    2.1123   -3.2534    0.0000 H   0  0  0

+    3.4155   -1.9622    0.0000 H   0  0  0

+    4.4125   -1.0228    0.0000 H   0  0  0

+   -3.0290   -0.3939    0.0000 H   0  0  0

+    4.6618    0.1484    0.0000 H   0  0  0

+    4.2717    1.4163    0.0000 H   0  0  0

+    4.2762    2.4345    0.0000 H   0  0  0

+    3.6201    3.7432    0.0000 H   0  0  0

+    2.3114    3.0871    0.0000 H   0  0  0

+   -1.3704    4.0579    0.0000 H   0  0  0

+   -4.5347    1.4736    0.0000 H   0  0  0

+   -0.6964   -5.0044    0.0000 H   0  0  0

+   -3.0176   -1.2214    0.0000 H   0  0  0

+   -3.4462   -2.6212    0.0000 H   0  0  0

+   -2.0464   -3.0498    0.0000 H   0  0  0

+   -3.7177    3.7051    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  2  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+ 11 17  1  0

+ 12 18  2  0

+ 13 19  1  0

+ 14 20  1  0

+ 17 21  2  0

+  7 11  1  0

+  9 13  1  0

+ 10 15  1  0

+ 18 21  1  0

+  3 22  1  0

+  7 23  1  0

+  7 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 12 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 16 32  1  0

+ 16 33  1  0

+ 17 34  1  0

+ 18 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 21 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+96-13-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 11                          1 V2000

+   -0.6980    0.9048   -0.1881 C   0  0  0

+   -1.8460    1.7709    0.3342 C   0  0  0

+    0.5786    1.2258    0.5916 C   0  0  0

+   -1.1499   -0.9939    0.0476 Br  0  0  0

+   -3.0384    1.4711   -0.3941 O   0  0  0

+    2.0538    0.1129   -0.0796 Br  0  0  0

+   -0.4837    1.9619    0.0000 H   0  0  0

+   -1.0200    2.4644    0.0000 H   0  0  0

+   -2.3367    2.7313    0.0000 H   0  0  0

+    1.4046    1.9193    0.0000 H   0  0  0

+    0.0878    2.1862    0.0000 H   0  0  0

+   -4.0844    1.2081    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35212-22-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 39                          1 V2000

+    0.9486    0.7138   -0.4645 C   0  0  0

+    0.4763   -0.6111   -0.4675 C   0  0  0

+    2.3172    0.9437   -0.4670 C   0  0  0

+    0.0733    1.7397   -0.4649 O   0  0  0

+   -0.9827   -0.8261   -0.4545 C   0  0  0

+    1.3716   -1.6803   -0.4791 C   0  0  0

+    3.1941   -0.1280   -0.4763 C   0  0  0

+   -1.2246    1.5812   -0.1827 C   0  0  0

+   -1.8146    0.3561   -0.1626 C   0  0  0

+   -1.4738   -1.9201   -0.6734 O   0  0  0

+    2.7158   -1.4368   -0.4835 C   0  0  0

+    4.5325    0.0985   -0.4785 O   0  0  0

+   -3.2588    0.2126    0.1433 C   0  0  0

+    4.9446    0.1519    0.8887 C   0  0  0

+   -4.2099    0.8355   -0.6632 C   0  0  0

+   -3.6701   -0.5501    1.2346 C   0  0  0

+    5.9862   -0.9378    1.1503 C   0  0  0

+    5.5559    1.5231    1.1839 C   0  0  0

+   -5.5522    0.6981   -0.3741 C   0  0  0

+   -5.0155   -0.6805    1.5143 C   0  0  0

+   -5.9546   -0.0560    0.7137 C   0  0  0

+    2.6758    1.8984    0.0000 H   0  0  0

+    1.0245   -2.6393    0.0000 H   0  0  0

+   -1.8186    2.4102    0.0000 H   0  0  0

+    3.3726   -2.2169    0.0000 H   0  0  0

+    4.6049   -0.8097    0.0000 H   0  0  0

+   -3.9686    1.8264    0.0000 H   0  0  0

+   -3.1057   -1.3995    0.0000 H   0  0  0

+    5.2490   -1.6425    0.0000 H   0  0  0

+    6.6909   -1.6750    0.0000 H   0  0  0

+    6.7234   -0.2331    0.0000 H   0  0  0

+    6.4874    1.1078    0.0000 H   0  0  0

+    5.9712    2.4546    0.0000 H   0  0  0

+    4.6244    1.9384    0.0000 H   0  0  0

+   -6.1207    1.5448    0.0000 H   0  0  0

+   -5.2630   -1.6698    0.0000 H   0  0  0

+   -6.9435   -0.3052    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  9 13  1  0

+ 12 14  1  0

+ 13 15  1  0

+ 13 16  2  0

+ 14 17  1  0

+ 14 18  1  0

+ 15 19  2  0

+ 16 20  1  0

+ 19 21  1  0

+  7 11  1  0

+  8  9  2  0

+ 20 21  2  0

+  3 22  1  0

+  6 23  1  0

+  8 24  1  0

+ 11 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

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+ 18 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+117929-12-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    0.7315   -0.0037   -0.0260 C   0  0  0

+   -0.7316   -0.0038    0.0228 C   0  0  0

+    1.4162    1.2274    0.0219 C   0  0  0

+    1.4250   -1.2074   -0.1620 C   0  0  0

+   -1.4163    1.2272   -0.0249 C   0  0  0

+   -1.4247   -1.2077    0.1591 C   0  0  0

+    2.8174    1.2102    0.0571 C   0  0  0

+    0.6755    2.4322    0.0147 C   0  0  0

+    2.7896   -1.1877   -0.1391 C   0  0  0

+    0.6631   -2.4858   -0.3793 C   0  0  0

+   -2.8176    1.2102   -0.0570 C   0  0  0

+   -0.6756    2.4321   -0.0205 C   0  0  0

+   -2.7894   -1.1878    0.1387 C   0  0  0

+   -0.6626   -2.4864    0.3738 C   0  0  0

+    3.4763    0.0165   -0.0194 C   0  0  0

+   -3.4763    0.0165    0.0208 C   0  0  0

+    4.9558    0.0035    0.0254 N   0  3  0

+   -4.9559    0.0034   -0.0212 N   0  3  0

+    5.5578   -1.0532   -0.0418 O   0  0  0

+    5.5711    1.0494    0.1295 O   0  5  0

+   -5.5577   -1.0533    0.0471 O   0  0  0

+   -5.5714    1.0494   -0.1242 O   0  5  0

+    3.3525    2.1042    0.0000 H   0  0  0

+    1.1839    3.3416    0.0000 H   0  0  0

+    3.3194   -2.0848    0.0000 H   0  0  0

+    0.4778   -3.5111    0.0000 H   0  0  0

+    1.6389   -2.8510    0.0000 H   0  0  0

+   -3.3527    2.1042    0.0000 H   0  0  0

+   -1.1841    3.3415    0.0000 H   0  0  0

+   -3.3193   -2.0849    0.0000 H   0  0  0

+   -1.6382   -2.8519    0.0000 H   0  0  0

+   -0.4766   -3.5115    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  6 14  1  0

+  7 15  2  0

+ 11 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+ 17 19  2  0

+ 17 20  1  0

+ 18 21  2  0

+ 18 22  1  0

+  8 12  2  0

+  9 15  1  0

+ 10 14  1  0

+ 13 16  1  0

+  7 23  1  0

+  8 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 14 31  1  0

+ 14 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1613-37-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.4805    0.9496   -0.0027 C   0  0  0

+   -0.0081   -0.3864   -0.0016 C   0  0  0

+    0.4522    2.0033   -0.0020 C   0  0  0

+   -1.8630    1.1967    0.0014 C   0  0  0

+    1.3076   -0.6268    0.0006 N   0  3  0

+   -0.9386   -1.4403   -0.0022 C   0  0  0

+    1.7814    1.6881   -0.0002 C   0  0  0

+   -2.7335    0.1501    0.0063 C   0  0  0

+    2.1796    0.3535    0.0021 C   0  0  0

+    1.7685   -1.9657    0.0016 O   0  5  0

+   -2.2710   -1.1646   -0.0039 C   0  0  0

+    0.1367    2.9994    0.0000 H   0  0  0

+   -2.2214    2.1782    0.0000 H   0  0  0

+   -0.6082   -2.4316    0.0000 H   0  0  0

+    2.4989    2.4478    0.0000 H   0  0  0

+   -3.7619    0.3349    0.0000 H   0  0  0

+    3.1997    0.1270    0.0000 H   0  0  0

+   -2.9586   -1.9513    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7  9  2  0

+  8 11  1  0

+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86-42-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 49                          1 V2000

+    2.4894   -0.6745   -0.3462 C   0  0  0

+    1.3709   -1.5406   -0.3998 C   0  0  0

+    3.6563   -1.1047    0.3293 C   0  0  0

+    2.4585    0.5942   -0.9414 C   0  0  0

+    0.2054   -1.1643   -1.0503 N   0  0  0

+    1.4777   -2.7769    0.2182 C   0  0  0

+    4.7684   -0.2475    0.3845 C   0  0  0

+    3.6889   -2.3130    0.9035 N   0  0  0

+    3.5547    1.3997   -0.8685 C   0  0  0

+   -0.7475   -0.3854   -0.3841 C   0  0  0

+    2.6579   -3.1246    0.8609 C   0  0  0

+    4.7080    0.9774   -0.2093 C   0  0  0

+   -1.9721   -0.1215   -0.9844 C   0  0  0

+   -0.4716    0.1195    0.8797 C   0  0  0

+    6.0858    2.0311   -0.1372 Cl  0  0  0

+   -2.9116    0.6471   -0.3265 C   0  0  0

+   -1.4126    0.8881    1.5364 C   0  0  0

+   -4.2404    0.9331   -0.9773 C   0  0  0

+   -2.6328    1.1558    0.9338 C   0  0  0

+   -5.2892    0.1456   -0.3157 N   0  0  0

+   -3.5588    1.9127    1.5811 O   0  0  0

+   -6.5714    0.7702   -0.6675 C   0  0  0

+   -5.2799   -1.1822   -0.9441 C   0  0  0

+   -7.2580    1.2757    0.6029 C   0  0  0

+   -5.2391   -2.2598    0.1412 C   0  0  0

+    1.6231    1.0043    0.0000 H   0  0  0

+   -0.2398   -1.9816    0.0000 H   0  0  0

+    0.7571   -3.3659    0.0000 H   0  0  0

+    5.6134   -0.6375    0.0000 H   0  0  0

+    3.4236    2.3211    0.0000 H   0  0  0

+    2.8338   -4.0385    0.0000 H   0  0  0

+   -2.3760   -0.9599    0.0000 H   0  0  0

+    0.4418    0.2979    0.0000 H   0  0  0

+   -1.0074    1.7260    0.0000 H   0  0  0

+   -3.8354    1.7710    0.0000 H   0  0  0

+   -4.9591    1.5244    0.0000 H   0  0  0

+   -4.2794    2.5017    0.0000 H   0  0  0

+   -7.3999    0.3462    0.0000 H   0  0  0

+   -6.5622   -0.1604    0.0000 H   0  0  0

+   -6.0938   -0.7309    0.0000 H   0  0  0

+   -6.0728   -1.6696    0.0000 H   0  0  0

+   -6.7062    2.0252    0.0000 H   0  0  0

+   -8.0075    1.8275    0.0000 H   0  0  0

+   -7.8098    0.5262    0.0000 H   0  0  0

+   -6.1691   -2.2950    0.0000 H   0  0  0

+   -5.2039   -3.1898    0.0000 H   0  0  0

+   -4.3091   -2.2246    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  7 12  2  0

+ 10 13  1  0

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+ 20 23  1  0

+ 22 24  1  0

+ 23 25  1  0

+  8 11  2  0

+  9 12  1  0

+ 17 19  2  0

+  4 26  1  0

+  5 27  1  0

+  6 28  1  0

+  7 29  1  0

+  9 30  1  0

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+ 24 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+ 25 45  1  0

+ 25 46  1  0

+ 25 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+95-33-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -2.8339    0.4605   -0.4333 C   0  0  0

+   -2.6772   -0.6803    0.3861 C   0  0  0

+   -1.7401    1.2424   -0.5640 N   0  0  0

+   -4.1124    0.6453   -1.0085 C   0  0  0

+   -0.9829   -0.5454    0.9037 S   0  0  0

+   -3.6947   -1.5714    0.6177 C   0  0  0

+   -0.6004    0.9660    0.0298 C   0  0  0

+   -5.1242   -0.2474   -0.7679 C   0  0  0

+   -4.9314   -1.3624    0.0347 C   0  0  0

+    0.9181    1.8581   -0.0228 S   0  0  0

+    2.3075    1.2739    0.8666 N   0  0  0

+    3.0444    0.3828   -0.0394 C   0  0  0

+    4.5349    0.4261    0.3035 C   0  0  0

+    2.5260   -1.0479    0.1191 C   0  0  0

+    5.3025   -0.5020   -0.6401 C   0  0  0

+    3.2936   -1.9760   -0.8245 C   0  0  0

+    4.7840   -1.9327   -0.4815 C   0  0  0

+   -4.4015    1.6151    0.0000 H   0  0  0

+   -3.4190   -2.5451    0.0000 H   0  0  0

+   -6.0788    0.0885    0.0000 H   0  0  0

+   -5.6456   -2.0793    0.0000 H   0  0  0

+    2.9110    2.0863    0.0000 H   0  0  0

+    3.4620    1.3046    0.0000 H   0  0  0

+    5.4370    0.8847    0.0000 H   0  0  0

+    4.2848    1.4067    0.0000 H   0  0  0

+    1.6503   -0.5407    0.0000 H   0  0  0

+    1.8722   -1.8204    0.0000 H   0  0  0

+    6.1782   -1.0093    0.0000 H   0  0  0

+    5.9563    0.2704    0.0000 H   0  0  0

+    2.3915   -2.4346    0.0000 H   0  0  0

+    3.5437   -2.9566    0.0000 H   0  0  0

+    4.6865   -2.9400    0.0000 H   0  0  0

+    5.7711   -2.1556    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 15 28  1  0

+ 15 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+82-86-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 22                          1 V2000

+   -0.4093   -0.0358   -0.0021 C   0  0  0

+    0.2851   -1.1278   -0.0013 C   0  0  0

+    0.4028    1.1801   -0.0011 C   0  0  0

+   -1.8718    0.0229    0.0017 C   0  0  0

+    1.7145   -0.7735    0.0004 C   0  0  0

+   -0.4637   -2.4012   -0.0021 C   0  0  0

+    1.8007    0.7110    0.0003 C   0  0  0

+   -0.2190    2.3345   -0.0008 C   0  0  0

+   -2.5385   -1.1064    0.0063 C   0  0  0

+   -2.4806    1.3642    0.0007 C   0  0  0

+    2.6424   -1.5439    0.0019 O   0  0  0

+   -1.7829   -2.3770   -0.0038 C   0  0  0

+    2.7998    1.3865    0.0008 O   0  0  0

+   -1.6875    2.4186   -0.0017 C   0  0  0

+    0.0723   -3.3585    0.0000 H   0  0  0

+    0.3703    3.2600    0.0000 H   0  0  0

+   -3.6357   -1.1082    0.0000 H   0  0  0

+   -3.5712    1.4840    0.0000 H   0  0  0

+   -2.3341   -3.3257    0.0000 H   0  0  0

+   -2.1492    3.4139    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+ 10 14  2  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 14 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1086-00-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+   -0.2895   -0.4448   -0.1733 C   0  0  0

+   -1.5866    0.2377   -0.0322 C   0  0  0

+    0.8013    0.2473   -0.4019 C   0  0  0

+   -0.2504   -1.9127   -0.0455 C   0  0  0

+   -1.6620    1.5435   -0.1341 C   0  0  0

+   -2.7862   -0.5794    0.2246 C   0  0  0

+    2.0879   -0.4560   -0.5394 C   0  0  0

+    0.7217    1.7134   -0.5176 C   0  0  0

+   -1.4971   -2.6473    0.2163 C   0  0  0

+    0.9000   -2.5381   -0.1687 C   0  0  0

+   -0.4402    2.3249   -0.3905 C   0  0  0

+   -2.9697    2.2052    0.0106 C   0  0  0

+   -2.6546   -2.0401    0.3311 C   0  0  0

+   -3.9526    0.0144    0.3534 C   0  0  0

+    2.1293   -1.7684   -0.4317 C   0  0  0

+    3.3514    0.3220   -0.8026 C   0  0  0

+   -4.0461    1.4811    0.2399 C   0  0  0

+    4.1140    0.7783    0.7661 Cl  0  0  0

+    1.6373    2.3006    0.0000 H   0  0  0

+   -1.4703   -3.7347    0.0000 H   0  0  0

+    0.9334   -3.6253    0.0000 H   0  0  0

+   -0.4862    3.4117    0.0000 H   0  0  0

+   -3.0370    3.2908    0.0000 H   0  0  0

+   -3.5592   -2.6442    0.0000 H   0  0  0

+   -4.8614   -0.5833    0.0000 H   0  0  0

+    3.0891   -2.2802    0.0000 H   0  0  0

+    3.3298    1.4095    0.0000 H   0  0  0

+    2.3966    0.8430    0.0000 H   0  0  0

+   -5.0220    1.9615    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  3  7  1  0

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+ 10 21  1  0

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+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+612-64-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+    0.4000   -0.0725    0.0643 C   0  0  0

+   -0.9923   -0.1127    0.1600 N   0  0  0

+    1.1838   -0.5214    1.1201 C   0  0  0

+    1.0052    0.4113   -1.0896 C   0  0  0

+   -1.7009    0.8896    0.9598 C   0  0  0

+   -1.6549   -1.0324   -0.4558 N   0  0  0

+    2.5608   -0.4806    1.0217 C   0  0  0

+    2.3823    0.4492   -1.1808 C   0  0  0

+   -2.0799    2.0761    0.0712 C   0  0  0

+   -2.8695   -1.0675   -0.3723 O   0  0  0

+    3.1595    0.0063   -0.1257 C   0  0  0

+    0.9625   -1.4055    0.0000 H   0  0  0

+    0.6919    1.2671    0.0000 H   0  0  0

+   -2.6065    0.9918    0.0000 H   0  0  0

+   -2.1647    0.1051    0.0000 H   0  0  0

+    2.8786   -1.3347    0.0000 H   0  0  0

+    2.6035    1.3333    0.0000 H   0  0  0

+   -1.2118    2.3534    0.0000 H   0  0  0

+   -2.3572    2.9442    0.0000 H   0  0  0

+   -2.9480    1.7988    0.0000 H   0  0  0

+    4.0677    0.0813    0.0000 H   0  0  0

+  1  2  1  0

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+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+698-63-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.7135    0.1628   -0.0029 C   0  0  0

+   -0.2670   -0.7481   -0.0032 O   0  0  0

+    0.1668    1.4003   -0.0001 C   0  0  0

+    2.1632   -0.1357    0.0002 N   0  3  0

+   -1.4627   -0.1209   -0.0005 C   0  0  0

+   -1.2251    1.2391    0.0015 C   0  0  0

+    2.9724    0.7746    0.0001 O   0  0  0

+    2.5469   -1.2917    0.0028 O   0  5  0

+   -2.7307   -0.7450   -0.0005 C   0  0  0

+   -3.7399   -0.0695    0.0020 O   0  0  0

+    0.6702    2.2801    0.0000 H   0  0  0

+   -1.9209    1.9762    0.0000 H   0  0  0

+   -2.7978   -1.7564    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  2  0

+  5  6  2  0

+  3 11  1  0

+  6 12  1  0

+  9 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+31876-38-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  9                          1 V2000

+   -0.0279    0.6882    0.0014 C   0  0  0

+   -1.0645   -0.3870    0.0000 C   0  0  0

+    1.0038   -0.3791    0.0000 C   0  0  0

+   -0.0286    1.9023   -0.0009 O   0  0  0

+    0.0294   -1.3689   -0.0013 C   0  0  0

+   -2.2796   -0.4309    0.0004 O   0  0  0

+    2.3526   -0.3853    0.0004 O   0  0  0

+    0.0616   -2.4101    0.0000 H   0  0  0

+    3.3943   -0.3901    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  5  2  0

+  5  8  1  0

+  7  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+62450-06-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -0.0758    0.4830    0.0019 C   0  0  0

+   -0.5801   -0.8317    0.0004 C   0  0  0

+    1.3930    0.3638    0.0016 C   0  0  0

+   -0.9612    1.5527   -0.0016 C   0  0  0

+    0.4830   -1.7070   -0.0008 N   0  0  0

+   -1.9609   -1.0036    0.0008 C   0  0  0

+    1.6800   -1.0094   -0.0001 C   0  0  0

+    2.4305    1.2929    0.0021 C   0  0  0

+   -2.2628    1.3415   -0.0064 N   0  0  0

+   -0.4314    2.9635    0.0005 C   0  0  0

+   -2.7764    0.1178    0.0027 C   0  0  0

+   -2.5604   -2.3862   -0.0012 C   0  0  0

+    3.0067   -1.4278   -0.0015 C   0  0  0

+    3.7388    0.8590    0.0010 C   0  0  0

+   -4.1581   -0.0428    0.0026 N   0  0  0

+    4.0241   -0.4976   -0.0012 C   0  0  0

+    0.3991   -2.7460    0.0000 H   0  0  0

+    2.2183    2.3134    0.0000 H   0  0  0

+    0.5444    2.5971    0.0000 H   0  0  0

+   -0.0650    3.9393    0.0000 H   0  0  0

+   -1.4072    3.3299    0.0000 H   0  0  0

+   -3.5167   -1.9715    0.0000 H   0  0  0

+   -2.9751   -3.3425    0.0000 H   0  0  0

+   -1.6041   -2.8009    0.0000 H   0  0  0

+    3.2317   -2.4456    0.0000 H   0  0  0

+    4.5163    1.5533    0.0000 H   0  0  0

+   -4.7800    0.7937    0.0000 H   0  0  0

+   -4.5716   -0.9996    0.0000 H   0  0  0

+    5.0163   -0.8170    0.0000 H   0  0  0

+  1  2  2  0

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+ 12 22  1  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+80-05-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 34                          1 V2000

+    0.0398   -1.5221   -0.0257 C   0  0  0

+   -1.2127   -0.6841   -0.0146 C   0  0  0

+    1.2474   -0.6207   -0.0065 C   0  0  0

+    0.0591   -2.4269    1.2079 C   0  0  0

+    0.0662   -2.3831   -1.2902 C   0  0  0

+   -1.7264   -0.1952   -1.2012 C   0  0  0

+   -1.8494   -0.4104    1.1821 C   0  0  0

+    2.5170   -1.1674   -0.0281 C   0  0  0

+    1.0837    0.7520    0.0270 C   0  0  0

+   -2.8748    0.5729   -1.1938 C   0  0  0

+   -2.9978    0.3570    1.1949 C   0  0  0

+    3.6257   -0.3432   -0.0110 C   0  0  0

+    2.1888    1.5803    0.0442 C   0  0  0

+   -3.5124    0.8533    0.0058 C   0  0  0

+    3.4642    1.0339    0.0279 C   0  0  0

+   -4.6420    1.6089    0.0158 O   0  0  0

+    4.5532    1.8467    0.0452 O   0  0  0

+   -0.9765   -2.4490    0.0000 H   0  0  0

+    0.0812   -3.4625    0.0000 H   0  0  0

+    1.0947   -2.4048    0.0000 H   0  0  0

+   -0.9692   -2.4148    0.0000 H   0  0  0

+    0.0979   -3.4185    0.0000 H   0  0  0

+    1.1016   -2.3514    0.0000 H   0  0  0

+   -1.0790    0.6134    0.0000 H   0  0  0

+   -2.3438   -1.3207    0.0000 H   0  0  0

+    2.6372   -2.1962    0.0000 H   0  0  0

+    0.1314    1.1596    0.0000 H   0  0  0

+   -2.3764    1.4810    0.0000 H   0  0  0

+   -3.6477   -0.4496    0.0000 H   0  0  0

+    4.5768   -0.7536    0.0000 H   0  0  0

+    2.0656    2.6088    0.0000 H   0  0  0

+   -5.5030    2.1848    0.0000 H   0  0  0

+    5.3833    2.4663    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 10 28  1  0

+ 11 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2304-85-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    0.7360   -0.2452    0.0019 C   0  0  0

+   -0.7360   -0.2452    0.0014 C   0  0  0

+    1.3986    0.8870    0.0008 C   0  0  0

+    1.4362   -1.5422   -0.0025 C   0  0  0

+   -1.3985    0.8870   -0.0001 C   0  0  0

+   -1.4362   -1.5422    0.0022 C   0  0  0

+    0.6597    2.1610   -0.0006 C   0  0  0

+    2.8711    0.8619    0.0014 C   0  0  0

+    0.7348   -2.6521   -0.0073 C   0  0  0

+    2.9085   -1.5637   -0.0020 C   0  0  0

+   -0.6597    2.1610   -0.0009 C   0  0  0

+   -2.8711    0.8619   -0.0005 C   0  0  0

+   -0.7349   -2.6521    0.0036 C   0  0  0

+   -2.9085   -1.5637    0.0019 C   0  0  0

+    3.5803   -0.4306    0.0032 C   0  0  0

+    3.4943    1.8945   -0.0001 O   0  0  0

+   -3.5803   -0.4306    0.0009 C   0  0  0

+   -3.4942    1.8945   -0.0023 O   0  0  0

+    1.2108    3.1176    0.0000 H   0  0  0

+    1.2676   -3.6190    0.0000 H   0  0  0

+    3.4479   -2.5269    0.0000 H   0  0  0

+   -1.2108    3.1176    0.0000 H   0  0  0

+   -1.2677   -3.6190    0.0000 H   0  0  0

+   -3.4479   -2.5269    0.0000 H   0  0  0

+    4.6841   -0.4490    0.0000 H   0  0  0

+   -4.6841   -0.4490    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  6 14  1  0

+  8 15  1  0

+  8 16  2  0

+ 12 17  1  0

+ 12 18  2  0

+  7 11  2  0

+  9 13  1  0

+ 10 15  2  0

+ 14 17  2  0

+  7 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 17 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+19337-19-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    0.5233    1.3156   -0.0911 C   0  0  0

+    1.7049    0.4538   -0.0602 C   0  0  0

+    0.6493    2.5243   -0.0153 O   0  0  0

+   -0.8218    0.7201   -0.2202 C   0  0  0

+    2.9352    0.9986    0.0523 C   0  0  0

+   -1.9518    1.5421   -0.2499 C   0  0  0

+   -0.9674   -0.6669   -0.3189 C   0  0  0

+    4.1235    0.1318    0.0834 C   0  0  0

+   -3.2043    0.9836   -0.3704 C   0  0  0

+   -2.2225   -1.2186   -0.4392 C   0  0  0

+    5.3997    0.6923    0.1999 C   0  0  0

+    3.9827   -1.2578    0.0023 C   0  0  0

+   -3.3461   -0.3975   -0.4626 C   0  0  0

+    6.5085   -0.1270    0.2282 C   0  0  0

+    5.1011   -2.0632    0.0320 C   0  0  0

+   -4.6162   -0.9598   -0.5841 N   0  0  0

+    6.3611   -1.5003    0.1418 C   0  0  0

+   -5.5709   -0.6702    0.3221 C   0  0  0

+   -6.9785   -1.1686    0.1191 C   0  0  0

+   -5.2971   -0.0084    1.3009 O   0  0  0

+    1.5941   -0.5816    0.0000 H   0  0  0

+    3.0461    2.0340    0.0000 H   0  0  0

+   -1.8429    2.5777    0.0000 H   0  0  0

+   -0.1264   -1.2809    0.0000 H   0  0  0

+   -4.0476    1.5944    0.0000 H   0  0  0

+   -2.3352   -2.2538    0.0000 H   0  0  0

+    5.5153    1.7271    0.0000 H   0  0  0

+    3.0331   -1.6851    0.0000 H   0  0  0

+    7.4619    0.2916    0.0000 H   0  0  0

+    4.9951   -3.0991    0.0000 H   0  0  0

+   -4.5526   -1.9991    0.0000 H   0  0  0

+    7.2032   -2.1127    0.0000 H   0  0  0

+   -7.3260   -0.1870    0.0000 H   0  0  0

+   -7.9601   -1.5161    0.0000 H   0  0  0

+   -6.6310   -2.1502    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  2  0

+  6  4  2  0

+  7  4  1  0

+  8  5  1  0

+  9  6  1  0

+ 10  7  2  0

+ 11  8  2  0

+ 12  8  1  0

+ 13  9  2  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 13  1  0

+ 17 14  2  0

+ 18 16  1  0

+ 19 18  1  0

+ 20 18  2  0

+ 10 13  1  0

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+  2 21  1  0

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+  6 23  1  0

+  7 24  1  0

+  9 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+79-21-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.5415   -0.0025   -0.0014 C   0  0  0

+   -0.6367    0.6406    0.0008 O   0  0  0

+    1.8282    0.7820    0.0001 C   0  0  0

+    0.5704   -1.2104    0.0005 O   0  0  0

+   -1.7125   -0.0153   -0.0004 O   0  0  0

+    2.3362   -0.0512    0.0000 H   0  0  0

+    2.6614    1.2900    0.0000 H   0  0  0

+    1.3202    1.6152    0.0000 H   0  0  0

+   -2.5457   -0.5233    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+968-81-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+   -0.6586    2.4200   -0.0684 S   0  0  0

+   -1.6952    0.9954   -0.0434 C   0  0  0

+    0.7909    1.9894    0.6070 N   0  0  0

+   -0.3852    2.6746   -1.4394 O   0  0  0

+   -1.2479    3.3423    0.8378 O   0  0  0

+   -2.5104    0.7565    1.0490 C   0  0  0

+   -1.6942    0.1243   -1.1192 C   0  0  0

+    1.5263    1.0049    0.0535 C   0  0  0

+   -3.3249   -0.3560    1.0759 C   0  0  0

+   -2.5028   -0.9922   -1.1074 C   0  0  0

+    2.7059    0.6545    0.6031 N   0  0  0

+    1.1255    0.4329   -0.9418 O   0  0  0

+   -3.3257   -1.2436   -0.0046 C   0  0  0

+    3.5052   -0.4157    0.0014 C   0  0  0

+   -4.1919   -2.4332    0.0160 C   0  0  0

+    4.9896   -0.1517    0.2622 C   0  0  0

+    3.1094   -1.7576    0.6207 C   0  0  0

+   -4.1897   -3.3872   -1.1506 C   0  0  0

+   -4.9074   -2.6456    0.9716 O   0  0  0

+    5.8244   -1.2693   -0.3662 C   0  0  0

+    3.9443   -2.8753   -0.0077 C   0  0  0

+    5.4286   -2.6113    0.2531 C   0  0  0

+    1.3640    2.8111    0.0000 H   0  0  0

+   -3.0859    1.5765    0.0000 H   0  0  0

+   -0.7410   -0.1840    0.0000 H   0  0  0

+   -4.2770   -0.0443    0.0000 H   0  0  0

+   -1.9205   -1.8074    0.0000 H   0  0  0

+    3.2790    1.4762    0.0000 H   0  0  0

+    2.5191   -0.5924    0.0000 H   0  0  0

+    5.8752    0.3166    0.0000 H   0  0  0

+    4.6638    0.7957    0.0000 H   0  0  0

+    2.2307   -1.2765    0.0000 H   0  0  0

+    2.4525   -2.5140    0.0000 H   0  0  0

+   -5.1915   -3.3895    0.0000 H   0  0  0

+   -4.1874   -4.3890    0.0000 H   0  0  0

+   -3.1879   -3.3849    0.0000 H   0  0  0

+    6.7031   -1.7504    0.0000 H   0  0  0

+    6.4813   -0.5129    0.0000 H   0  0  0

+    3.0587   -3.3436    0.0000 H   0  0  0

+    4.2701   -3.8227    0.0000 H   0  0  0

+    5.4504   -3.6129    0.0000 H   0  0  0

+    6.4216   -2.7437    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  6  9  1  0

+  7 10  2  0

+  8 11  1  0

+  8 12  2  0

+  9 13  2  0

+ 11 14  1  0

+ 13 15  1  0

+ 14 16  1  0

+ 14 17  1  0

+ 15 18  1  0

+ 15 19  2  0

+ 16 20  1  0

+ 17 21  1  0

+ 20 22  1  0

+ 10 13  1  0

+ 21 22  1  0

+  3 23  1  0

+  6 24  1  0

+  7 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 14 29  1  0

+ 16 30  1  0

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+ 18 34  1  0

+ 18 35  1  0

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+ 20 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 21 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+161697-02-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+   -0.9693   -0.0137   -0.0013 C   0  0  0

+   -1.2452   -1.3996   -0.1298 C   0  0  0

+    0.2989    0.4088    0.0346 N   0  0  0

+   -2.0353    0.8959    0.0924 C   0  0  0

+   -0.2337   -2.2718   -0.2140 N   0  0  0

+   -2.5804   -1.8392   -0.1667 C   0  0  0

+    1.2835   -0.4695   -0.0500 C   0  0  0

+   -3.3314    0.4303    0.0582 C   0  0  0

+   -1.7630    2.3718    0.2289 C   0  0  0

+    1.0051   -1.8422   -0.1773 C   0  0  0

+   -3.5947   -0.9391   -0.0795 C   0  0  0

+    2.6906   -0.0041   -0.0109 C   0  0  0

+   -4.3916    1.3315    0.1510 N   0  0  0

+    3.6493   -0.7323    0.6925 C   0  0  0

+    3.0614    1.1599   -0.6821 C   0  0  0

+   -5.7726    0.8440    0.1154 C   0  0  0

+    4.9574   -0.2946    0.7249 C   0  0  0

+    4.3729    1.5880   -0.6426 C   0  0  0

+    5.3185    0.8644    0.0612 C   0  0  0

+   -2.7899   -2.8523    0.0000 H   0  0  0

+   -0.7456    2.1841    0.0000 H   0  0  0

+   -1.5753    3.3892    0.0000 H   0  0  0

+   -2.7804    2.5595    0.0000 H   0  0  0

+    1.7839   -2.5232    0.0000 H   0  0  0

+   -4.5742   -1.2719    0.0000 H   0  0  0

+   -4.2038    2.3488    0.0000 H   0  0  0

+    3.4811   -1.7531    0.0000 H   0  0  0

+    2.3273    1.8888    0.0000 H   0  0  0

+   -6.1170    1.8195    0.0000 H   0  0  0

+   -6.7481    0.4996    0.0000 H   0  0  0

+   -5.4282   -0.1315    0.0000 H   0  0  0

+    5.6965   -1.0185    0.0000 H   0  0  0

+    4.5467    2.6078    0.0000 H   0  0  0

+    6.3044    1.1778    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+ 12 14  1  0

+ 12 15  2  0

+ 13 16  1  0

+ 14 17  2  0

+ 15 18  1  0

+ 17 19  1  0

+  7 10  1  0

+  8 11  1  0

+ 18 19  2  0

+  6 20  1  0

+  9 21  1  0

+  9 22  1  0

+  9 23  1  0

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+ 11 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-65-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.0701    0.0000    0.0000 C   0  0  0

+   -0.5801   -1.4422    0.0297 C   0  0  0

+   -0.5801    0.6953   -1.2638 C   0  0  0

+   -0.5801    0.7468    1.2341 C   0  0  0

+    1.3589    0.0000    0.0000 O   0  0  0

+   -1.4050   -1.1505    0.0000 H   0  0  0

+   -0.8718   -2.2671    0.0000 H   0  0  0

+    0.2448   -1.7339    0.0000 H   0  0  0

+    0.1254    1.2128    0.0000 H   0  0  0

+   -1.0976    1.4008    0.0000 H   0  0  0

+   -1.2856    0.1778    0.0000 H   0  0  0

+    0.1425    1.2403    0.0000 H   0  0  0

+   -1.0736    1.4694    0.0000 H   0  0  0

+   -1.3027    0.2533    0.0000 H   0  0  0

+    2.2339    0.0000    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

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+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3366-61-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+   -0.3834    0.1251   -0.2272 C   0  0  0

+   -1.8571    0.0403   -0.0825 C   0  0  0

+    0.2283    1.3614   -0.4281 C   0  0  0

+    0.3928   -1.0311   -0.1568 C   0  0  0

+   -2.5576   -1.0096   -0.6752 C   0  0  0

+   -2.5432    1.0069    0.6511 C   0  0  0

+    1.5986    1.4377   -0.5618 C   0  0  0

+    1.7623   -0.9497   -0.2911 C   0  0  0

+   -3.9271   -1.0867   -0.5391 C   0  0  0

+   -3.9132    0.9258    0.7847 C   0  0  0

+    2.3695    0.2836   -0.4966 C   0  0  0

+   -4.6100   -0.1186    0.1886 C   0  0  0

+    3.7593    0.3635   -0.6330 N   0  0  0

+   -5.9971   -0.1984    0.3249 N   0  0  0

+    4.5608   -0.1643    0.3133 C   0  0  0

+    6.0528   -0.1976    0.1041 C   0  0  0

+    4.0812   -0.6124    1.3332 O   0  0  0

+   -0.3388    2.2204    0.0000 H   0  0  0

+   -0.0643   -1.9534    0.0000 H   0  0  0

+   -2.0468   -1.9032    0.0000 H   0  0  0

+   -2.0981    1.9350    0.0000 H   0  0  0

+    2.0584    2.3586    0.0000 H   0  0  0

+    2.3318   -1.8071    0.0000 H   0  0  0

+   -4.3749   -2.0135    0.0000 H   0  0  0

+   -4.4253    1.8187    0.0000 H   0  0  0

+    4.0264    1.3576    0.0000 H   0  0  0

+   -6.5621    0.6620    0.0000 H   0  0  0

+   -6.4597   -1.1179    0.0000 H   0  0  0

+    6.0298   -1.2267    0.0000 H   0  0  0

+    7.0819   -0.2206    0.0000 H   0  0  0

+    6.0758    0.8315    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

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+  7 11  2  0

+  9 12  1  0

+ 11 13  1  0

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+ 13 15  1  0

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+ 15 17  2  0

+  8 11  1  0

+ 10 12  2  0

+  3 18  1  0

+  4 19  1  0

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+  8 23  1  0

+  9 24  1  0

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+ 13 26  1  0

+ 14 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+130536-39-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 20                          1 V2000

+    1.1296   -1.1859    0.3795 C   0  0  0

+   -0.2371   -0.5670    0.1863 C   0  0  0

+    2.3395   -0.2357    0.3748 C   0  0  0

+    1.9193   -0.9517   -0.7883 O   0  0  0

+   -0.3406    0.8129    0.0137 C   0  0  0

+   -1.3096   -1.3299    0.1831 N   0  0  0

+    2.0747    1.2378    0.1767 C   0  0  0

+    0.8450    1.6849    0.0146 C   0  0  0

+   -1.6125    1.3728   -0.1649 C   0  0  0

+   -2.5192   -0.8293    0.0172 C   0  0  0

+   -2.7088    0.5289   -0.1614 C   0  0  0

+    1.0586   -2.2211    0.0000 H   0  0  0

+    3.3610   -0.4178    0.0000 H   0  0  0

+    2.8684    1.9062    0.0000 H   0  0  0

+    0.6974    2.7120    0.0000 H   0  0  0

+   -1.7374    2.4029    0.0000 H   0  0  0

+   -3.3398   -1.4643    0.0000 H   0  0  0

+   -3.6693    0.9215    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  5  8  1  0

+  5  9  2  0

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+  3  4  1  0

+  7  8  2  0

+ 10 11  2  0

+  1 12  1  0

+  3 13  1  0

+  7 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+52214-84-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    2.7966   -1.2836    0.0391 C   0  0  0

+    1.3080   -1.1600   -0.1607 C   0  0  0

+    3.3935    0.1017    0.2954 C   0  0  0

+    3.1570   -0.8576    1.4637 C   0  0  0

+    0.8093   -0.2904   -1.1133 C   0  0  0

+    0.4436   -1.9203    0.6047 C   0  0  0

+    5.0984    0.3819   -0.2197 Cl  0  0  0

+    2.2932    1.5225    0.1484 Cl  0  0  0

+   -0.5547   -0.1757   -1.2986 C   0  0  0

+   -0.9215   -1.8092    0.4231 C   0  0  0

+   -1.4245   -0.9338   -0.5281 C   0  0  0

+   -2.7669   -0.8227   -0.7086 O   0  0  0

+   -3.1714    0.3874   -0.0652 C   0  0  0

+   -4.6483    0.3305    0.2291 C   0  0  0

+   -2.3965    0.5528    1.2437 C   0  0  0

+   -2.8799    1.5756   -0.9840 C   0  0  0

+   -5.2522    1.3648    0.8351 O   0  0  0

+   -5.2887   -0.6462   -0.0803 O   0  0  0

+    3.1479   -2.1313    0.0000 H   0  0  0

+    3.5957   -1.6635    0.0000 H   0  0  0

+    4.0670   -0.7401    0.0000 H   0  0  0

+    1.3021    0.4836    0.0000 H   0  0  0

+    0.7323   -2.7913    0.0000 H   0  0  0

+   -0.8403    0.6963    0.0000 H   0  0  0

+   -1.4130   -2.5841    0.0000 H   0  0  0

+   -2.2050   -0.3446    0.0000 H   0  0  0

+   -1.4991    0.7443    0.0000 H   0  0  0

+   -2.5880    1.4502    0.0000 H   0  0  0

+   -1.9887    1.3570    0.0000 H   0  0  0

+   -2.6613    2.4667    0.0000 H   0  0  0

+   -3.7710    1.7942    0.0000 H   0  0  0

+   -5.7149    2.1572    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  5  9  2  0

+  6 10  1  0

+  9 11  1  0

+ 11 12  1  0

+ 12 13  1  0

+ 13 14  1  0

+ 13 15  1  0

+ 13 16  1  0

+ 14 17  1  0

+ 14 18  2  0

+  3  4  1  0

+ 10 11  2  0

+  1 19  1  0

+  4 20  1  0

+  4 21  1  0

+  5 22  1  0

+  6 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+922-63-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+   -0.1585    0.6062    0.1024 C   0  0  0

+   -1.0281   -0.4861    0.6695 C   0  0  0

+    1.2499    0.3418   -0.1904 C   0  0  0

+   -0.6748    1.8132   -0.1377 C   0  0  0

+   -1.6774   -1.2669   -0.4749 C   0  0  0

+    1.7181   -0.7569    0.0233 O   0  0  0

+   -0.6807   -1.4074    0.0000 H   0  0  0

+   -0.0554   -0.6390    0.0000 H   0  0  0

+    1.8665    1.1094    0.0000 H   0  0  0

+   -0.0844    2.6012    0.0000 H   0  0  0

+   -1.6524    1.9305    0.0000 H   0  0  0

+   -2.4344   -0.6374    0.0000 H   0  0  0

+   -2.3069   -2.0239    0.0000 H   0  0  0

+   -0.9204   -1.8964    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  4 10  1  0

+  4 11  1  0

+  5 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+99-08-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.3984    0.1399    0.0033 C   0  0  0

+    0.5586   -0.8574    0.0029 C   0  0  0

+   -0.0130    1.4676    0.0010 C   0  0  0

+   -1.8357   -0.2136    0.0001 N   0  3  0

+    1.9011   -0.5273    0.0001 C   0  0  0

+    1.3291    1.7977   -0.0018 C   0  0  0

+   -2.6790    0.6652    0.0004 O   0  0  0

+   -2.1752   -1.3834   -0.0030 O   0  5  0

+    2.2863    0.8001   -0.0023 C   0  0  0

+    2.9445   -1.6147    0.0001 C   0  0  0

+    0.2696   -1.8531    0.0000 H   0  0  0

+   -0.7308    2.2157    0.0000 H   0  0  0

+    1.6180    2.7934    0.0000 H   0  0  0

+    3.2931    1.0477    0.0000 H   0  0  0

+    2.1964   -2.3325    0.0000 H   0  0  0

+    3.6623   -2.3628    0.0000 H   0  0  0

+    3.6926   -0.8969    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6  9  1  0

+  2 11  1  0

+  3 12  1  0

+  6 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7576-88-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.2923    0.5624   -0.0043 C   0  0  0

+   -0.1278   -0.8465   -0.0019 C   0  0  0

+    0.7870    1.3535   -0.0035 N   0  0  0

+   -1.5870    1.1052   -0.0016 C   0  0  0

+    1.1042   -1.3660    0.0010 N   0  0  0

+   -1.2633   -1.6772   -0.0023 C   0  0  0

+    1.9867    0.8179   -0.0005 C   0  0  0

+   -2.6771    0.2631    0.0033 C   0  0  0

+    2.1481   -0.5686    0.0018 C   0  0  0

+   -2.5056   -1.1277   -0.0049 C   0  0  0

+    3.2014    1.7099    0.0004 C   0  0  0

+   -3.9642    0.8000    0.0065 N   0  0  0

+    3.5353   -1.1572    0.0051 C   0  0  0

+   -1.7230    2.1427    0.0000 H   0  0  0

+   -1.1509   -2.7176    0.0000 H   0  0  0

+   -3.3459   -1.7514    0.0000 H   0  0  0

+    3.8208    0.8665    0.0000 H   0  0  0

+    4.0448    2.3293    0.0000 H   0  0  0

+    2.5820    2.5533    0.0000 H   0  0  0

+   -4.0982    1.8378    0.0000 H   0  0  0

+   -4.7960    0.1651    0.0000 H   0  0  0

+    3.1266   -2.1205    0.0000 H   0  0  0

+    4.4986   -1.5659    0.0000 H   0  0  0

+    3.9440   -0.1939    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+  7  9  1  0

+  8 10  1  0

+  4 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6373-74-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 46                          1 V2000

+    1.5436   -1.3617   -0.7567 C   0  0  0

+    0.8060   -1.4776    0.4148 C   0  0  0

+    2.9190   -1.6219   -0.7464 N   0  0  0

+    0.9154   -0.9934   -1.9392 C   0  0  0

+   -0.5503   -1.2210    0.4046 C   0  0  0

+    1.6015   -1.9525    1.9135 S   0  0  0

+    3.3814   -2.9381   -0.8162 C   0  0  0

+   -0.4423   -0.7424   -1.9505 C   0  0  0

+   -1.1776   -0.8470   -0.7770 C   0  0  0

+    1.6359   -3.3730    1.8990 O   0  0  0

+    2.7346   -1.1036    2.0349 O   0  0  0

+    0.6756   -1.5730    3.0603 O   0  0  0

+    4.7269   -3.2152   -0.6100 C   0  0  0

+    2.4955   -3.9741   -1.0864 C   0  0  0

+   -2.5531   -0.5868   -0.7873 N   0  0  0

+    5.1806   -4.5179   -0.6793 C   0  0  0

+    2.9559   -5.2740   -1.1542 C   0  0  0

+   -3.0234    0.6959   -0.4963 C   0  0  0

+    4.2972   -5.5457   -0.9535 C   0  0  0

+   -4.3884    0.9278   -0.3830 C   0  0  0

+   -2.1268    1.7416   -0.3136 C   0  0  0

+   -4.8500    2.1972   -0.0947 C   0  0  0

+   -5.3471   -0.1842   -0.5717 N   0  3  0

+   -2.5952    3.0081   -0.0255 C   0  0  0

+   -3.9552    3.2365    0.0813 C   0  0  0

+   -6.3654   -0.0076   -1.2162 O   0  0  0

+   -5.1176   -1.2758   -0.0825 O   0  5  0

+   -4.4537    4.5958    0.3898 N   0  3  0

+   -3.6667    5.5124    0.5450 O   0  0  0

+   -5.6508    4.7977    0.4883 O   0  5  0

+   12.8125    9.9137   -0.4887 Na  0  3  0

+    3.5887   -0.8427    0.0000 H   0  0  0

+    1.2740   -0.0305    0.0000 H   0  0  0

+   -0.9145   -2.1818    0.0000 H   0  0  0

+   -0.4210    0.2849    0.0000 H   0  0  0

+    5.4039   -2.4423    0.0000 H   0  0  0

+    1.4853   -3.7866    0.0000 H   0  0  0

+   -3.2175   -1.3706    0.0000 H   0  0  0

+    6.1901   -4.7094    0.0000 H   0  0  0

+    2.2822   -6.0498    0.0000 H   0  0  0

+    4.6306   -6.5176    0.0000 H   0  0  0

+   -1.1154    1.5604    0.0000 H   0  0  0

+   -5.8607    2.3822    0.0000 H   0  0  0

+   -1.9400    3.7996    0.0000 H   0  0  0

+   -0.2751   -1.1833    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  2  0

+  6 11  2  0

+  6 12  1  0

+  7 13  2  0

+  7 14  1  0

+  9 15  1  0

+ 13 16  1  0

+ 14 17  2  0

+ 15 18  1  0

+ 16 19  2  0

+ 18 20  2  0

+ 18 21  1  0

+ 20 22  1  0

+ 20 23  1  0

+ 21 24  2  0

+ 22 25  2  0

+ 23 26  2  0

+ 23 27  1  0

+ 25 28  1  0

+ 28 29  2  0

+ 28 30  1  0

+  8  9  2  0

+ 17 19  1  0

+ 24 25  1  0

+  3 32  1  0

+  4 33  1  0

+  5 34  1  0

+  8 35  1  0

+ 13 36  1  0

+ 14 37  1  0

+ 15 38  1  0

+ 16 39  1  0

+ 17 40  1  0

+ 19 41  1  0

+ 21 42  1  0

+ 22 43  1  0

+ 24 44  1  0

+ 12 45  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-03-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.4727    0.3886   -0.5237 C   0  0  0

+   -0.8809    0.0308   -0.0925 N   0  3  0

+    1.4937   -0.2420    0.4254 C   0  0  0

+   -1.6738    0.9038    0.2118 O   0  0  0

+   -1.2133   -1.1397   -0.0382 O   0  5  0

+    2.9074    0.1317   -0.0250 C   0  0  0

+    1.1314    1.0203    0.0000 H   0  0  0

+    0.0260    1.1844    0.0000 H   0  0  0

+    0.8351   -0.8737    0.0000 H   0  0  0

+    1.9404   -1.0378    0.0000 H   0  0  0

+    3.1406   -0.7506    0.0000 H   0  0  0

+    3.7897    0.3649    0.0000 H   0  0  0

+    2.6742    1.0140    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  2  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+110-88-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.6514   -1.1545    0.2862 C   0  0  0

+   -0.6856   -1.1609   -0.2148 O   0  0  0

+    1.3481   -0.0133   -0.2148 O   0  0  0

+   -1.3255    0.0131    0.2862 C   0  0  0

+    0.6741    1.1414    0.2862 C   0  0  0

+   -0.6625    1.1742   -0.2148 O   0  0  0

+    0.4724   -2.1412    0.0000 H   0  0  0

+    1.5885   -1.5113    0.0000 H   0  0  0

+   -2.0904    0.6615    0.0000 H   0  0  0

+   -2.1031   -0.6200    0.0000 H   0  0  0

+    1.6181    1.4796    0.0000 H   0  0  0

+    0.5146    2.1314    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  4  6  1  0

+  5  6  1  0

+  1  7  1  0

+  1  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+37853-59-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    2.6633    0.2735   -0.0828 C   0  0  0

+    3.2040   -0.8694   -0.6542 C   0  0  0

+    3.4936    1.1944    0.5409 C   0  0  0

+    1.3229    0.4938   -0.1386 O   0  0  0

+    4.5681   -1.0884   -0.6012 C   0  0  0

+    2.0761   -2.1267   -1.5043 Br  0  0  0

+    4.8567    0.9711    0.5913 C   0  0  0

+    2.7607    2.7536    1.3203 Br  0  0  0

+    0.7568   -0.1063    1.0282 C   0  0  0

+    5.3936   -0.1693    0.0208 C   0  0  0

+   -0.7583    0.1066    1.0272 C   0  0  0

+    7.2588   -0.4722    0.0921 Br  0  0  0

+   -1.3230   -0.4949   -0.1396 O   0  0  0

+   -2.6634   -0.2746   -0.0857 C   0  0  0

+   -3.2036    0.8680   -0.6594 C   0  0  0

+   -3.4943   -1.1944    0.5378 C   0  0  0

+   -4.5667    1.0896   -0.6038 C   0  0  0

+   -2.0754    2.1208   -1.5159 Br  0  0  0

+   -4.8572   -0.9684    0.5910 C   0  0  0

+   -2.7631   -2.7562    1.3138 Br  0  0  0

+   -5.3926    0.1736    0.0232 C   0  0  0

+   -7.2571    0.4800    0.0981 Br  0  0  0

+    4.9078   -2.0489    0.0000 H   0  0  0

+    5.4705    1.7842    0.0000 H   0  0  0

+    0.4121   -1.0650    0.0000 H   0  0  0

+    1.6250   -0.6394    0.0000 H   0  0  0

+   -0.4144    1.0656    0.0000 H   0  0  0

+   -1.6273    0.6383    0.0000 H   0  0  0

+   -4.9045    2.0508    0.0000 H   0  0  0

+   -5.4724   -1.7804    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  9 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+ 15 18  1  0

+ 16 19  1  0

+ 16 20  1  0

+ 17 21  1  0

+ 21 22  1  0

+  7 10  1  0

+ 19 21  2  0

+  5 23  1  0

+  7 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 11 27  1  0

+ 11 28  1  0

+ 17 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+39208-00-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 35                          1 V2000

+    1.4527   -0.3331    0.0068 C   0  0  0

+    2.2650   -1.4736    0.0058 C   0  0  0

+    2.0384    0.9388    0.0039 C   0  0  0

+    0.0963   -0.4604    0.0047 N   0  0  0

+    3.6346   -1.3375    0.0021 C   0  0  0

+    3.3983    1.0651    0.0003 C   0  0  0

+   -0.6503    0.5915    0.0056 N   0  0  0

+    4.2074   -0.0682   -0.0007 C   0  0  0

+   -2.0102    0.4638    0.0036 C   0  0  0

+    5.5921    0.0680   -0.0044 N   0  0  0

+   -2.8200    1.6051    0.0045 C   0  0  0

+   -2.5931   -0.8080   -0.0052 C   0  0  0

+    6.1969    1.4023   -0.0074 C   0  0  0

+    6.4453   -1.1230   -0.0054 C   0  0  0

+   -4.1794    1.4781    0.0025 C   0  0  0

+   -3.9528   -0.9363   -0.0073 C   0  0  0

+   -4.7634    0.2052   -0.0005 C   0  0  0

+   -6.2272    0.0677   -0.0027 C   0  0  0

+   -6.7327   -1.0347   -0.0054 O   0  0  0

+    1.8330   -2.4245    0.0000 H   0  0  0

+    1.4350    1.7913    0.0000 H   0  0  0

+    4.2439   -2.1857    0.0000 H   0  0  0

+    3.8328    2.0148    0.0000 H   0  0  0

+   -2.3844    2.5543    0.0000 H   0  0  0

+   -1.9883   -1.6595    0.0000 H   0  0  0

+    7.1481    0.9711    0.0000 H   0  0  0

+    6.6281    2.3535    0.0000 H   0  0  0

+    5.2457    1.8335    0.0000 H   0  0  0

+    5.5963   -1.7312    0.0000 H   0  0  0

+    7.0535   -1.9720    0.0000 H   0  0  0

+    7.2943   -0.5148    0.0000 H   0  0  0

+   -4.7836    2.3300    0.0000 H   0  0  0

+   -4.3878   -1.8858    0.0000 H   0  0  0

+   -6.8317    0.9194    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  5  8  2  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 10 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 15 17  1  0

+ 17 18  1  0

+ 18 19  2  0

+  6  8  1  0

+ 16 17  2  0

+  2 20  1  0

+  3 21  1  0

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+  6 23  1  0

+ 11 24  1  0

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+ 14 29  1  0

+ 14 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 16 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16354-55-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+   -0.4332   -0.0739   -0.0660 C   0  0  0

+    0.0394   -1.4552    0.0416 C   0  0  0

+    0.4695    0.9731   -0.1463 C   0  0  0

+   -1.8821    0.1756   -0.0806 C   0  0  0

+    1.4026   -1.7268    0.0646 C   0  0  0

+   -0.9377   -2.5396    0.1246 C   0  0  0

+    1.8419    0.7061   -0.1242 C   0  0  0

+   -0.0245    2.3926   -0.2575 C   0  0  0

+   -2.7705   -0.9164    0.0088 C   0  0  0

+   -2.3858    1.4734   -0.1811 C   0  0  0

+    2.3182   -0.6747   -0.0155 C   0  0  0

+    1.8901   -3.1484    0.1759 C   0  0  0

+   -2.2586   -2.2799    0.1031 C   0  0  0

+    2.7888    1.7465   -0.2039 C   0  0  0

+    0.0717    3.0745    1.1088 C   0  0  0

+   -4.1518   -0.6765   -0.0052 C   0  0  0

+   -3.7473    1.6766   -0.1919 C   0  0  0

+    3.7077   -0.9127    0.0045 C   0  0  0

+    4.1146    1.4494   -0.1793 C   0  0  0

+   -4.6215    0.6007   -0.1046 C   0  0  0

+    4.5684    0.1355   -0.0759 C   0  0  0

+   -0.6066   -3.5332    0.0000 H   0  0  0

+   -0.9409    2.8997    0.0000 H   0  0  0

+   -0.8254    1.7178    0.0000 H   0  0  0

+   -1.7319    2.2915    0.0000 H   0  0  0

+    0.8994   -3.4881    0.0000 H   0  0  0

+    2.2298   -4.1391    0.0000 H   0  0  0

+    2.8808   -2.8087    0.0000 H   0  0  0

+   -2.9356   -3.0790    0.0000 H   0  0  0

+    2.4733    2.7452    0.0000 H   0  0  0

+    1.1087    2.9282    0.0000 H   0  0  0

+    0.2180    4.1115    0.0000 H   0  0  0

+   -0.9653    3.2208    0.0000 H   0  0  0

+   -4.8226   -1.4808    0.0000 H   0  0  0

+   -4.1262    2.6530    0.0000 H   0  0  0

+    4.0735   -1.8940    0.0000 H   0  0  0

+    4.8125    2.2303    0.0000 H   0  0  0

+   -5.6546    0.7727    0.0000 H   0  0  0

+    5.5993   -0.0494    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  7 11  2  0

+  9 13  1  0

+ 17 20  1  0

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+  8 23  1  0

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+ 13 29  1  0

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+ 15 31  1  0

+ 15 32  1  0

+ 15 33  1  0

+ 16 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+141-78-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.3195   -0.4821    0.0000 O   0  0  0

+   -0.9467   -0.0367    0.0000 C   0  0  0

+    1.4216    0.4632    0.0000 C   0  0  0

+   -2.0906   -1.0178    0.0000 C   0  0  0

+   -1.1694    1.1509    0.0000 O   0  0  0

+    2.7479   -0.2997    0.0000 C   0  0  0

+    2.0678    1.3397    0.0000 H   0  0  0

+    0.6237    1.2043    0.0000 H   0  0  0

+   -2.7996   -0.1912    0.0000 H   0  0  0

+   -2.9172   -1.7268    0.0000 H   0  0  0

+   -1.3816   -1.8444    0.0000 H   0  0  0

+    2.2049   -1.2437    0.0000 H   0  0  0

+    3.6919   -0.8427    0.0000 H   0  0  0

+    3.2909    0.6443    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

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+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2784-94-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 35                          1 V2000

+   -0.9443   -0.1421   -0.2081 C   0  0  0

+   -2.2981    0.1474    0.0005 N   0  0  0

+    0.0280    0.5098    0.5385 C   0  0  0

+   -0.5742   -1.0855   -1.1577 C   0  0  0

+   -3.0507    0.8970   -1.0083 C   0  0  0

+   -2.9620   -0.2994    1.2277 C   0  0  0

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+    0.7609   -1.3709   -1.3635 C   0  0  0

+   -2.7408    2.3890   -0.8714 C   0  0  0

+   -3.4045   -1.7551    1.0671 C   0  0  0

+    1.7338   -0.7146   -0.6208 C   0  0  0

+    2.4000    0.9188    1.1288 N   0  3  0

+   -1.4432    2.6570   -1.4066 O   0  0  0

+   -2.2648   -2.6123    1.1588 O   0  0  0

+    3.0876   -1.0037   -0.8298 N   0  0  0

+    2.2292    1.1059    2.3201 O   0  0  0

+    3.4239    1.3033    0.5926 O   0  5  0

+    3.4782   -1.9944   -1.8358 C   0  0  0

+   -0.1435    1.4014    0.0000 H   0  0  0

+   -1.1617   -1.7777    0.0000 H   0  0  0

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+   -3.5562    0.1428    0.0000 H   0  0  0

+   -3.2273    0.5689    0.0000 H   0  0  0

+   -3.8699   -0.3001    0.0000 H   0  0  0

+    0.9336   -2.2622    0.0000 H   0  0  0

+   -2.8021    3.2949    0.0000 H   0  0  0

+   -3.6466    2.4513    0.0000 H   0  0  0

+   -4.2366   -1.3918    0.0000 H   0  0  0

+   -3.8621   -2.5393    0.0000 H   0  0  0

+   -0.5540    2.8406    0.0000 H   0  0  0

+   -1.5392   -3.1580    0.0000 H   0  0  0

+    3.6745   -0.3109    0.0000 H   0  0  0

+    2.6335   -2.3274    0.0000 H   0  0  0

+    3.8112   -2.8391    0.0000 H   0  0  0

+    4.3229   -1.6614    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+ 13 30  1  0

+ 14 31  1  0

+ 15 32  1  0

+ 18 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+150-69-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -1.0081   -0.5404   -0.2932 C   0  0  0

+   -0.3350   -1.6592    0.1795 C   0  0  0

+   -0.3045    0.6198   -0.5863 C   0  0  0

+   -2.3964   -0.5843   -0.4797 N   0  0  0

+    1.0336   -1.6170    0.3576 C   0  0  0

+    1.0645    0.6606   -0.4077 C   0  0  0

+   -3.1834    0.3466    0.0952 C   0  0  0

+    1.7362   -0.4572    0.0644 C   0  0  0

+   -4.5017    0.3794   -0.1828 N   0  0  0

+   -2.7040    1.1568    0.8647 O   0  0  0

+    3.0839   -0.4162    0.2404 O   0  0  0

+    3.5108    0.8928   -0.1420 C   0  0  0

+    5.0265    1.0064    0.0331 C   0  0  0

+   -0.8218   -2.5521    0.0000 H   0  0  0

+   -0.8166    1.4985    0.0000 H   0  0  0

+   -2.8099   -1.5135    0.0000 H   0  0  0

+    1.5464   -2.4953    0.0000 H   0  0  0

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+   -5.0320   -0.4884    0.0000 H   0  0  0

+    3.5669    1.9083    0.0000 H   0  0  0

+    2.5112    1.0801    0.0000 H   0  0  0

+    5.1025   -0.0078    0.0000 H   0  0  0

+    6.0407    1.0824    0.0000 H   0  0  0

+    4.9505    2.0206    0.0000 H   0  0  0

+  1  2  1  0

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+  9 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+86853-91-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 34                          1 V2000

+   -0.2398    0.0360   -0.0011 C   0  0  0

+   -1.6365    0.3057   -0.0014 C   0  0  0

+    0.6988    1.0505    0.0014 C   0  0  0

+   -0.0185   -1.3958    0.0022 C   0  0  0

+   -2.3677   -0.8834   -0.0056 C   0  0  0

+   -2.1101    1.6166    0.0016 C   0  0  0

+    2.0875    0.5871   -0.0005 C   0  0  0

+    0.2065    2.3645    0.0060 C   0  0  0

+   -1.3794   -1.9893    0.0032 C   0  0  0

+    1.2965   -1.7860    0.0032 C   0  0  0

+   -3.7419   -0.7039   -0.0071 C   0  0  0

+   -1.1391    2.6366    0.0055 C   0  0  0

+   -3.5096    1.7372   -0.0003 C   0  0  0

+    2.3336   -0.8125   -0.0013 C   0  0  0

+    3.1552    1.4822   -0.0020 C   0  0  0

+   -1.6389   -3.1771    0.0053 O   0  0  0

+   -4.2634    0.5920   -0.0040 C   0  0  0

+    3.6693   -1.2554   -0.0012 C   0  0  0

+    4.4478    1.0092   -0.0028 C   0  0  0

+    4.6939   -0.3586   -0.0030 C   0  0  0

+    0.8859    3.1615    0.0000 H   0  0  0

+    1.5380   -2.8051    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 25  1  0

+ 15 26  1  0

+ 17 27  1  0

+ 18 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+116374-64-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 52                          1 V2000

+   -0.6319   -0.3819   -0.4075 C   0  0  0

+   -1.9489   -0.0069   -0.0318 C   0  0  0

+    0.3361    0.6210   -0.6226 C   0  0  0

+   -0.3094   -1.7395   -0.5539 C   0  0  0

+   -2.9388   -1.0665    0.1865 C   0  0  0

+   -2.2789    1.2685    0.1192 N   0  0  0

+   -0.0607    1.9630   -0.4506 C   0  0  0

+    1.6240    0.3006   -0.9875 N   0  0  0

+   -1.2465   -2.7047   -0.3396 C   0  0  0

+    1.0642   -2.1273   -0.9461 N   0  3  0

+   -2.5496   -2.3898    0.0177 C   0  0  0

+   -4.3172   -0.7351    0.5773 C   0  0  0

+   -1.3977    2.2519   -0.0731 C   0  0  0

+    0.8493    3.0154   -0.6467 C   0  0  0

+    2.4177    0.2703    0.2482 C   0  0  0

+    1.4554   -1.9187   -2.0806 O   0  0  0

+    1.8033   -2.6549   -0.1344 O   0  5  0

+   -5.2170   -1.7194    0.7747 O   0  0  0

+   -4.6453    0.4264    0.7222 O   0  0  0

+   -1.7812    3.5967    0.0959 C   0  0  0

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+    6.2600   -1.4942    0.2755 C   0  0  0

+    1.4817   -0.7018    0.0000 H   0  0  0

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+    5.2516   -1.5848    0.0000 H   0  0  0

+    6.3506   -2.5026    0.0000 H   0  0  0

+    7.2684   -1.4036    0.0000 H   0  0  0

+  1  2  2  0

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+ 27 45  1  0

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+ 27 47  1  0

+ 28 48  1  0

+ 28 49  1  0

+ 28 50  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+122551-89-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+    0.0145    0.2957   -0.0040 C   0  0  0

+   -1.1913   -0.2684    0.0007 C   0  0  0

+   -0.1993    1.7913   -0.0128 C   0  0  0

+    1.3402   -0.4209    0.0044 C   0  0  0

+   -2.2203    0.7764   -0.0044 C   0  0  0

+   -1.4982   -1.9770    0.0114 Cl  0  0  0

+   -1.6407    1.9913   -0.0124 O   0  0  0

+    2.2742    0.0260   -1.4717 Cl  0  0  0

+    2.2719    0.0561    1.4724 Cl  0  0  0

+   -3.4188    0.5752   -0.0025 O   0  0  0

+    0.8499    1.8424    0.0000 H   0  0  0

+   -0.1525    2.8407    0.0000 H   0  0  0

+    1.3143   -1.4711    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5  7  1  0

+  3 11  1  0

+  3 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97629-28-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -0.7855    0.2457    0.0158 C   0  0  0

+   -0.1948   -1.0086   -0.0568 C   0  0  0

+    0.0031    1.3776    0.0821 C   0  0  0

+   -2.2603    0.3703    0.0159 N   0  3  0

+    1.1891   -1.1252   -0.0622 C   0  0  0

+   -0.9941   -2.1560   -0.1241 N   0  0  0

+    1.3866    1.2611    0.0763 C   0  0  0

+   -2.8127    1.0670   -0.8166 O   0  0  0

+   -2.9216   -0.2239    0.8484 O   0  5  0

+    1.9775    0.0064    0.0036 C   0  0  0

+    1.8303   -2.4867   -0.1405 C   0  0  0

+    2.1860    2.4085    0.1440 N   0  0  0

+    3.4792   -0.1201   -0.0022 C   0  0  0

+   -0.4396    2.3201    0.0000 H   0  0  0

+   -2.0317   -2.0677    0.0000 H   0  0  0

+   -0.5518   -3.0987    0.0000 H   0  0  0

+    0.8882   -2.9304    0.0000 H   0  0  0

+    2.2740   -3.4288    0.0000 H   0  0  0

+    2.7724   -2.0430    0.0000 H   0  0  0

+    3.2235    2.3202    0.0000 H   0  0  0

+    1.7437    3.3512    0.0000 H   0  0  0

+    3.3918   -1.1577    0.0000 H   0  0  0

+    4.5168   -0.2075    0.0000 H   0  0  0

+    3.5666    0.9175    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+ 10 13  1  0

+  7 10  1  0

+  3 14  1  0

+  6 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+129134-96-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 55                          1 V2000

+    0.2320    0.5976    0.2146 C   0  0  0

+   -0.9902    1.2679    0.2960 C   0  0  0

+    1.4820    1.1875   -0.0063 C   0  0  0

+    0.4221   -0.8474    0.3401 C   0  0  0

+   -2.2034    0.4241    0.5492 C   0  0  2

+   -0.9249    2.6162    0.1362 C   0  0  0

+    2.3759    0.1597   -0.0037 N   0  0  0

+    1.5156    2.5719   -0.1647 C   0  0  0

+    1.7239   -1.0468    0.2028 C   0  0  0

+   -0.7872   -1.7163    0.5712 C   0  0  0

+   -2.0144   -0.9901   -0.0001 C   0  0  1

+   -3.4171    1.0745   -0.1248 C   0  0  0

+    0.3013    3.2406   -0.0879 C   0  0  0

+    3.8211    0.3078   -0.1924 C   0  0  0

+   -3.2079   -1.7983    0.2807 N   0  0  0

+   -4.6408    0.1743    0.0652 C   0  0  2

+    4.5578   -0.2258    1.0487 C   0  0  0

+    4.2760   -0.5617   -1.3827 C   0  0  0

+   -4.3216   -1.2207   -0.4775 C   0  0  0

+   -2.9581   -3.1308   -0.2851 C   0  0  0

+   -5.8286    0.7600   -0.7009 C   0  0  0

+    5.4346   -1.4010    0.5693 C   0  0  0

+    5.6496   -1.1238   -0.9394 C   0  0  0

+   -3.0571   -0.1674    0.0000 H   0  0  0

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+    4.0905    1.3109    0.0000 H   0  0  0

+   -5.4556   -0.4697    0.0000 H   0  0  0

+    5.5717   -0.0008    0.0000 H   0  0  0

+    4.7685    0.7912    0.0000 H   0  0  0

+    3.2565   -0.7598    0.0000 H   0  0  0

+    4.1741   -1.5953    0.0000 H   0  0  0

+   -5.3602   -1.2108    0.0000 H   0  0  0

+   -4.5725   -2.2285    0.0000 H   0  0  0

+   -3.9789   -3.3222    0.0000 H   0  0  0

+   -2.7667   -4.1516    0.0000 H   0  0  0

+   -1.9373   -2.9394    0.0000 H   0  0  0

+   -5.3693    1.6915    0.0000 H   0  0  0

+   -6.7601    1.2193    0.0000 H   0  0  0

+   -6.2879   -0.1715    0.0000 H   0  0  0

+    4.6614   -2.0944    0.0000 H   0  0  0

+    6.1947   -2.1087    0.0000 H   0  0  0

+    6.5244   -1.6836    0.0000 H   0  0  0

+    6.1281   -0.2020    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  1  0

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+  4 10  1  0

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+ 18 23  1  0

+  7  9  1  0

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+ 16 19  1  0

+ 22 23  1  0

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+ 10 28  1  0

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+ 21 46  1  0

+ 21 47  1  0

+ 22 48  1  0

+ 22 49  1  0

+ 23 50  1  0

+ 23 51  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+619-15-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -1.4870    0.1049   -0.0059 C   0  0  0

+   -0.7437   -1.0562    0.0925 C   0  0  0

+   -0.8492    1.3272   -0.1104 C   0  0  0

+   -2.9657    0.0394   -0.0056 N   0  3  0

+    0.6375   -0.9954    0.0864 C   0  0  0

+    0.5315    1.3879   -0.1165 C   0  0  0

+   -3.6207    1.0626   -0.0923 O   0  0  0

+   -3.5275   -1.0378    0.0814 O   0  5  0

+    1.2750    0.2264   -0.0181 C   0  0  0

+    1.4479   -2.2614    0.1942 C   0  0  0

+    2.7538    0.2914   -0.0246 N   0  3  0

+    3.3450    0.8034    0.9091 O   0  0  0

+    3.3794   -0.1670   -0.9637 O   0  5  0

+   -1.2200   -1.9740    0.0000 H   0  0  0

+   -1.4045    2.1995    0.0000 H   0  0  0

+    1.0078    2.3057    0.0000 H   0  0  0

+    0.5770   -2.8189    0.0000 H   0  0  0

+    2.0054   -3.1323    0.0000 H   0  0  0

+    2.3188   -1.7039    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

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+  5 10  1  0

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+ 11 12  2  0

+ 11 13  1  0

+  6  9  1  0

+  2 14  1  0

+  3 15  1  0

+  6 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+98033-25-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+    0.0355   -0.7446    0.0020 C   0  0  0

+   -1.1229    0.0597    0.0010 C   0  0  0

+    1.3754   -0.1583    0.0014 C   0  0  0

+   -0.0923   -2.1483   -0.0024 C   0  0  0

+   -2.3813   -0.5554    0.0011 C   0  0  0

+   -1.3339    1.3976    0.0006 N   0  0  0

+    2.4961   -1.0212    0.0020 C   0  0  0

+    1.5668    1.2258   -0.0003 C   0  0  0

+   -1.3736   -2.7295   -0.0073 C   0  0  0

+    1.0661   -2.9590   -0.0014 C   0  0  0

+   -2.4859   -1.9472    0.0015 C   0  0  0

+   -3.3059    0.4692    0.0008 N   0  0  0

+   -2.6135    1.6389    0.0005 C   0  0  0

+    2.3031   -2.4210    0.0037 C   0  0  0

+    3.7870   -0.4723    0.0015 C   0  0  0

+    2.8490    1.7354   -0.0012 C   0  0  0

+   -4.7636    0.3232    0.0003 C   0  0  0

+   -3.2348    3.0118    0.0001 C   0  0  0

+    3.9517    0.8799    0.0003 C   0  0  0

+    3.0397    3.0808   -0.0033 O   0  0  0

+    0.7421    1.8724    0.0000 H   0  0  0

+   -1.4715   -3.7729    0.0000 H   0  0  0

+    0.9613   -4.0017    0.0000 H   0  0  0

+   -3.4334   -2.3949    0.0000 H   0  0  0

+    3.1381   -3.0542    0.0000 H   0  0  0

+    4.6244   -1.1023    0.0000 H   0  0  0

+   -4.8680    1.3659    0.0000 H   0  0  0

+   -5.8063    0.2188    0.0000 H   0  0  0

+   -4.6592   -0.7195    0.0000 H   0  0  0

+   -2.2801    3.4439    0.0000 H   0  0  0

+   -3.6669    3.9665    0.0000 H   0  0  0

+   -4.1895    2.5797    0.0000 H   0  0  0

+    4.9190    1.2830    0.0000 H   0  0  0

+    3.1868    4.1184    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

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+  4 10  1  0

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+ 15 19  2  0

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+  9 11  2  0

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+ 17 27  1  0

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+ 17 29  1  0

+ 18 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67-64-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+    0.0000    0.0235   -0.0015 C   0  0  0

+   -1.3051    0.7770    0.0005 C   0  0  0

+    1.3051    0.7770    0.0005 C   0  0  0

+    0.0000   -1.1841    0.0004 O   0  0  0

+   -0.7400    1.7558    0.0000 H   0  0  0

+   -2.2839    1.3421    0.0000 H   0  0  0

+   -1.8702   -0.2018    0.0000 H   0  0  0

+    1.8702   -0.2018    0.0000 H   0  0  0

+    2.2839    1.3421    0.0000 H   0  0  0

+    0.7400    1.7558    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115459-65-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.1863   -0.5554   -0.0300 C   0  0  0

+    1.1630   -1.5458    0.0897 C   0  0  0

+    0.5680    0.7842   -0.1303 C   0  0  0

+   -1.2441   -0.9233   -0.0567 C   0  0  0

+    2.4973   -1.1956    0.1082 C   0  0  0

+    1.9055    1.1202   -0.1104 C   0  0  0

+   -2.1840    0.0348   -0.1723 O   0  0  0

+   -1.5728   -2.0898    0.0257 O   0  0  0

+    2.8684    0.1334    0.0085 C   0  0  0

+   -3.5900   -0.3269   -0.1985 C   0  0  0

+    4.3019    0.5016    0.0296 N   0  3  0

+   -4.4395    0.9382   -0.3357 C   0  0  1

+    4.6317    1.6709   -0.0581 O   0  0  0

+    5.1517   -0.3646    0.1345 O   0  5  0

+   -5.9210    0.5571   -0.3633 C   0  0  0

+   -5.2849    1.0706    0.8088 O   0  0  0

+    0.8892   -2.5435    0.0000 H   0  0  0

+   -0.1520    1.5272    0.0000 H   0  0  0

+    3.2231   -1.9329    0.0000 H   0  0  0

+    2.1872    2.1157    0.0000 H   0  0  0

+   -4.5086   -0.8030    0.0000 H   0  0  0

+   -3.2207   -1.2934    0.0000 H   0  0  0

+   -3.8834    1.8107    0.0000 H   0  0  0

+   -6.8237    1.0626    0.0000 H   0  0  0

+   -6.0545   -0.4689    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

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+  6  9  1  0

+ 15 16  1  0

+  2 17  1  0

+  3 18  1  0

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+  6 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 15 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-93-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -0.5682    0.0003   -0.0016 C   0  0  0

+   -2.0521    0.0005   -0.0020 C   0  0  0

+    0.1311    1.1640   -0.3140 C   0  0  0

+    0.1308   -1.1625    0.3169 C   0  0  0

+   -2.7513   -1.0943   -0.5055 C   0  0  0

+   -2.7514    1.0934    0.5066 C   0  0  0

+    1.5115    1.1581   -0.3122 C   0  0  0

+    1.5108   -1.1570    0.3156 C   0  0  0

+   -4.1317   -1.0890   -0.5029 C   0  0  0

+   -4.1314    1.0880    0.5042 C   0  0  0

+    2.2002   -0.0001   -0.0010 C   0  0  0

+   -4.8206    0.0005   -0.0018 C   0  0  0

+    3.6804   -0.0004   -0.0007 N   0  3  0

+    4.2892   -1.0192    0.2731 O   0  0  0

+    4.2896    1.0182   -0.2742 O   0  5  0

+   -0.3663    2.0477    0.0000 H   0  0  0

+   -0.3667   -2.0462    0.0000 H   0  0  0

+   -2.2657   -1.9846    0.0000 H   0  0  0

+   -2.2663    1.9839    0.0000 H   0  0  0

+    2.0148    2.0385    0.0000 H   0  0  0

+    2.0135   -2.0377    0.0000 H   0  0  0

+   -4.6227   -1.9763    0.0000 H   0  0  0

+   -4.6220    1.9755    0.0000 H   0  0  0

+   -5.8347    0.0010    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+  6 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2687-25-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 19                          1 V2000

+   -0.0240   -0.7124   -0.0014 C   0  0  0

+   -1.2343   -0.0358   -0.0006 C   0  0  0

+    1.1717    0.0056   -0.0009 C   0  0  0

+   -0.0023   -2.1124    0.0031 N   0  0  0

+   -1.2534    1.3468    0.0007 C   0  0  0

+   -2.5289   -0.8073   -0.0017 C   0  0  0

+    1.1432    1.3920    0.0004 C   0  0  0

+    2.3973   -0.6715   -0.0012 N   0  0  0

+   -0.0682    2.0585    0.0012 C   0  0  0

+   -0.8948   -2.6463    0.0000 H   0  0  0

+    0.9063   -2.6184    0.0000 H   0  0  0

+   -2.1620    1.8528    0.0000 H   0  0  0

+   -3.0613    0.0861    0.0000 H   0  0  0

+   -3.4223   -1.3397    0.0000 H   0  0  0

+   -1.9965   -1.7007    0.0000 H   0  0  0

+    2.0330    1.9304    0.0000 H   0  0  0

+    2.4169   -1.7113    0.0000 H   0  0  0

+    3.2880   -0.1346    0.0000 H   0  0  0

+   -0.0879    3.0983    0.0000 H   0  0  0

+  1  2  1  0

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+  7 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+106-43-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -2.0169   -0.0001    0.0018 C   0  0  0

+   -1.3261   -1.1973    0.0013 C   0  0  0

+   -1.3259    1.1975    0.0014 C   0  0  0

+   -3.5239   -0.0001   -0.0037 C   0  0  0

+    0.0562   -1.1979    0.0006 C   0  0  0

+    0.0560    1.1981    0.0006 C   0  0  0

+    0.7482   -0.0001    0.0002 C   0  0  0

+    2.4842    0.0000   -0.0008 Cl  0  0  0

+   -1.8450   -2.0954    0.0000 H   0  0  0

+   -1.8448    2.0956    0.0000 H   0  0  0

+   -3.5239    1.0371    0.0000 H   0  0  0

+   -4.5611   -0.0001    0.0000 H   0  0  0

+   -3.5239   -1.0373    0.0000 H   0  0  0

+    0.5745   -2.0964    0.0000 H   0  0  0

+    0.5743    2.0966    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  7  8  1  0

+  6  7  1  0

+  2  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+10213-75-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 33                          1 V2000

+    1.1622    0.5758   -0.0873 C   0  0  0

+   -0.0982   -0.2246   -0.4212 C   0  0  0

+    2.3728   -0.0755   -0.7591 C   0  0  0

+    1.0058    2.0097   -0.5977 C   0  0  0

+   -1.2289    0.3837    0.2063 O   0  0  0

+    3.3713   -0.5212    0.3110 C   0  0  0

+    1.1949    2.9878    0.5635 C   0  0  0

+   -2.3684   -0.4055   -0.1413 C   0  0  0

+    4.5304   -1.2678   -0.3524 C   0  0  0

+   -3.6200    0.1948    0.5021 C   0  0  0

+    5.5289   -1.7135    0.7178 C   0  0  0

+   -4.7937   -0.6181    0.1441 C   0  0  0

+   -5.6996   -1.2455   -0.1323 N   0  0  0

+    2.0185    1.1528    0.0000 H   0  0  0

+   -0.7346   -1.0377    0.0000 H   0  0  0

+    0.5952   -0.9897    0.0000 H   0  0  0

+    1.5081   -0.6398    0.0000 H   0  0  0

+    2.4545   -1.1048    0.0000 H   0  0  0

+    0.1623    2.6052    0.0000 H   0  0  0

+    0.1162    1.4856    0.0000 H   0  0  0

+    4.2644   -0.0030    0.0000 H   0  0  0

+    3.3166    0.5099    0.0000 H   0  0  0

+    2.2087    2.7918    0.0000 H   0  0  0

+    1.3909    4.0016    0.0000 H   0  0  0

+    0.1811    3.1838    0.0000 H   0  0  0

+   -2.9682   -1.2460    0.0000 H   0  0  0

+   -1.6435   -1.1407    0.0000 H   0  0  0

+    3.6373   -1.7860    0.0000 H   0  0  0

+    4.5851   -2.2989    0.0000 H   0  0  0

+   -3.0202    1.0353    0.0000 H   0  0  0

+   -4.3449    0.9300    0.0000 H   0  0  0

+    5.1080   -2.6564    0.0000 H   0  0  0

+    6.4718   -2.1344    0.0000 H   0  0  0

+    5.9498   -0.7706    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  1  0

+ 12 13  3  0

+  1 14  1  0

+  2 15  1  0

+  2 16  1  0

+  3 17  1  0

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+  4 19  1  0

+  4 20  1  0

+  6 21  1  0

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+  9 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 11 32  1  0

+ 11 33  1  0

+ 11 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+75321-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -0.5528    0.0427   -0.0037 C   0  0  0

+   -1.8567    0.0940   -0.0033 C   0  0  0

+    0.2395    1.2867   -0.0220 C   0  0  0

+    0.1466   -1.2546    0.0203 C   0  0  0

+   -2.5487    1.3965   -0.0212 C   0  0  0

+   -2.6559   -1.1443    0.0155 C   0  0  0

+    1.7076    1.1615   -0.0208 C   0  0  0

+   -0.3713    2.4474   -0.0381 C   0  0  0

+    1.4588   -1.2713    0.0199 C   0  0  0

+   -0.6454   -2.4958    0.0437 C   0  0  0

+   -1.8486    2.5056   -0.0377 C   0  0  0

+   -4.0221    1.3870   -0.0191 C   0  0  0

+   -1.9640   -2.4441    0.0327 C   0  0  0

+   -3.9655   -1.0578    0.0159 C   0  0  0

+    2.2527   -0.0361   -0.0038 C   0  0  0

+    2.4887    2.2685   -0.0376 N   0  3  0

+    2.1007   -2.4644    0.0420 N   0  3  0

+   -4.6597    0.2360   -0.0018 C   0  0  0

+    3.3978    2.3603   -0.8429 O   0  0  0

+    2.2816    3.1719    0.7527 O   0  5  0

+    2.8954   -2.7120    0.9311 O   0  0  0

+    1.8829   -3.2893   -0.8273 O   0  5  0

+    0.1709    3.3067    0.0000 H   0  0  0

+   -0.1745   -3.3962    0.0000 H   0  0  0

+   -2.3216    3.4049    0.0000 H   0  0  0

+   -4.5408    2.2608    0.0000 H   0  0  0

+   -2.5041   -3.3048    0.0000 H   0  0  0

+   -4.5157   -1.9121    0.0000 H   0  0  0

+    3.2662   -0.1093    0.0000 H   0  0  0

+   -5.6758    0.2428    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

+  5 11  2  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  2  0

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+ 12 18  2  0

+ 16 19  2  0

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+  8 11  1  0

+  9 15  1  0

+ 10 13  2  0

+ 14 18  1  0

+  8 23  1  0

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+ 11 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+117-39-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -2.3275    0.4384    0.0409 C   0  0  0

+   -1.7125   -0.8152   -0.1215 C   0  0  0

+   -1.4747    1.6352    0.1193 C   0  0  0

+   -3.7227    0.5331    0.1307 C   0  0  0

+   -0.3680   -0.8982   -0.2013 O   0  0  0

+   -2.4989   -1.9549   -0.1975 C   0  0  0

+   -0.0718    1.4446    0.0249 C   0  0  0

+   -1.9555    2.7483    0.2604 O   0  0  0

+   -4.4889   -0.6149    0.0585 C   0  0  0

+   -4.3170    1.7430    0.2879 O   0  0  0

+    0.4244    0.1852   -0.1309 C   0  0  0

+   -3.8785   -1.8530   -0.1134 C   0  0  0

+    0.7713    2.5109    0.0900 O   0  0  0

+    1.8846    0.0042   -0.2268 C   0  0  0

+   -4.6410   -2.9736   -0.1891 O   0  0  0

+    2.6036   -0.4835    0.8682 C   0  0  0

+    2.5525    0.3146   -1.4147 C   0  0  0

+    3.9718   -0.6511    0.7729 C   0  0  0

+    3.9176    0.1448   -1.5023 C   0  0  0

+    4.6319   -0.3341   -0.4129 C   0  0  0

+    4.6745   -1.1250    1.8364 O   0  0  0

+    5.9776   -0.4992   -0.5045 O   0  0  0

+   -2.0592   -2.8732    0.0000 H   0  0  0

+   -5.5049   -0.5485    0.0000 H   0  0  0

+   -4.7659    2.6569    0.0000 H   0  0  0

+    1.4028    3.3096    0.0000 H   0  0  0

+   -5.2138   -3.8154    0.0000 H   0  0  0

+    2.2459   -1.4368    0.0000 H   0  0  0

+    2.3947    1.3205    0.0000 H   0  0  0

+    4.2736    1.0987    0.0000 H   0  0  0

+    5.5186   -1.6943    0.0000 H   0  0  0

+    6.9882   -0.6232    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  4 10  1  0

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+  6 12  2  0

+  7 13  1  0

+ 11 14  1  0

+ 12 15  1  0

+ 14 16  2  0

+ 14 17  1  0

+ 16 18  1  0

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+ 18 20  2  0

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+ 20 22  1  0

+  7 11  2  0

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+ 19 20  1  0

+  6 23  1  0

+  9 24  1  0

+ 10 25  1  0

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+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 19 30  1  0

+ 21 31  1  0

+ 22 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75776-00-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 43                          1 V2000

+    0.8375    0.0016   -0.7682 C   0  0  0

+    1.4305   -1.2069   -0.3515 C   0  0  0

+    1.4378    1.2060   -0.3491 C   0  0  0

+   -0.2880    0.0057   -1.5634 N   0  0  0

+    2.5930   -1.1692    0.4628 C   0  0  0

+    0.8869   -2.4461   -0.7303 C   0  0  0

+    2.5999    1.1599    0.4649 C   0  0  0

+    0.9016    2.4491   -0.7256 C   0  0  0

+   -1.5588    0.0059   -0.9774 C   0  0  0

+    3.1260   -0.0067    0.8353 N   0  0  0

+    3.1761   -2.3857    0.8726 C   0  0  0

+    1.4797   -3.5977   -0.3132 C   0  0  0

+    3.1902    2.3721    0.8771 C   0  0  0

+    1.5011    3.5965   -0.3064 C   0  0  0

+   -2.6934    0.0100   -1.7791 C   0  0  0

+   -1.6858   -0.0038    0.4056 C   0  0  0

+    2.6223   -3.5653    0.4861 C   0  0  0

+    2.6435    3.5557    0.4928 C   0  0  0

+   -3.9469    0.0098   -1.2010 C   0  0  0

+   -2.9397   -0.0040    0.9837 C   0  0  0

+   -4.0738    0.0054    0.1823 C   0  0  0

+   -5.3443    0.0057    0.7682 N   0  0  0

+   -5.4782    0.0011    2.2271 C   0  0  0

+   -0.2862    0.9587    0.0000 H   0  0  0

+   -0.0656   -2.4756    0.0000 H   0  0  0

+   -0.0507    2.4845    0.0000 H   0  0  0

+    4.1291   -2.3819    0.0000 H   0  0  0

+    0.9950   -4.4182    0.0000 H   0  0  0

+    4.1431    2.3623    0.0000 H   0  0  0

+    1.0220    4.4203    0.0000 H   0  0  0

+   -2.6918    0.9630    0.0000 H   0  0  0

+   -1.6494   -0.9561    0.0000 H   0  0  0

+    3.1446   -4.3624    0.0000 H   0  0  0

+    3.1712    4.3492    0.0000 H   0  0  0

+   -3.9635    0.9626    0.0000 H   0  0  0

+   -2.9436   -0.9570    0.0000 H   0  0  0

+   -5.3605    0.9585    0.0000 H   0  0  0

+   -5.5109    0.9535    0.0000 H   0  0  0

+   -6.4306   -0.0316    0.0000 H   0  0  0

+   -5.4455   -0.9513    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

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+  7 13  1  0

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+ 13 18  2  0

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+ 19 21  1  0

+ 21 22  1  0

+ 22 23  1  0

+  7 10  1  0

+ 12 17  1  0

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+ 20 21  2  0

+  4 24  1  0

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+ 17 33  1  0

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+ 19 35  1  0

+ 20 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+ 23 39  1  0

+ 23 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1072-83-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.0306    0.0164   -0.0013 C   0  0  0

+   -1.3827   -0.0047   -0.0004 C   0  0  0

+    0.8336    1.1440   -0.0001 C   0  0  0

+    0.8633   -1.0824    0.0026 N   0  0  0

+   -2.1168   -1.3208   -0.0019 C   0  0  0

+   -2.0055    1.0379    0.0015 O   0  0  0

+    2.1572    0.7007   -0.0016 C   0  0  0

+    2.1427   -0.6556    0.0002 C   0  0  0

+    0.5132    2.1293    0.0000 H   0  0  0

+    0.5569   -2.0722    0.0000 H   0  0  0

+   -3.0217   -0.8161    0.0000 H   0  0  0

+   -2.6215   -2.2257    0.0000 H   0  0  0

+   -1.2119   -1.8255    0.0000 H   0  0  0

+    3.0014    1.3014    0.0000 H   0  0  0

+    2.9801   -1.2658    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  3  7  1  0

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+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  5 13  1  0

+  7 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+141511-31-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 42                          1 V2000

+   -0.2748   -0.0510   -0.0029 C   0  0  0

+   -1.7417   -0.1300   -0.0022 C   0  0  0

+    0.3463    1.2233   -0.0013 C   0  0  0

+    0.4966   -1.2062    0.0005 C   0  0  0

+   -2.4975    1.0619    0.0002 C   0  0  0

+   -2.3957   -1.3635   -0.0033 C   0  0  0

+    1.7391    1.3173   -0.0011 C   0  0  0

+   -0.4740    2.4312    0.0011 C   0  0  0

+    1.8889   -1.1122    0.0003 C   0  0  0

+   -1.8202    2.3546    0.0014 C   0  0  0

+   -3.8966    0.9875    0.0010 C   0  0  0

+   -3.7717   -1.4042   -0.0021 C   0  0  0

+    2.5103    0.1624   -0.0023 C   0  0  0

+    2.7090   -2.3203    0.0045 C   0  0  0

+   -4.5135   -0.2299   -0.0005 C   0  0  0

+    3.9772    0.2409   -0.0015 C   0  0  0

+    4.0552   -2.2438    0.0048 C   0  0  0

+   -5.9920   -0.2997    0.0008 N   0  3  0

+    4.7322   -0.9512   -0.0022 C   0  0  0

+    4.6326    1.4739    0.0005 C   0  0  0

+   -6.5506   -1.3821   -0.0006 O   0  0  0

+   -6.6501    0.7252    0.0033 O   0  5  0

+    6.1319   -0.8756   -0.0014 C   0  0  0

+    5.9982    1.5157    0.0017 C   0  0  0

+    6.7445    0.3440    0.0001 C   0  0  0

+    0.0343   -2.1457    0.0000 H   0  0  0

+   -1.8427   -2.2527    0.0000 H   0  0  0

+    2.2015    2.2568    0.0000 H   0  0  0

+   -0.0104    3.3701    0.0000 H   0  0  0

+   -2.3875    3.2347    0.0000 H   0  0  0

+   -4.4682    1.8648    0.0000 H   0  0  0

+   -4.2635   -2.3286    0.0000 H   0  0  0

+    2.2452   -3.2591    0.0000 H   0  0  0

+    4.6225   -3.1239    0.0000 H   0  0  0

+    4.0796    2.3631    0.0000 H   0  0  0

+    6.7054   -1.7517    0.0000 H   0  0  0

+    6.4878    2.4413    0.0000 H   0  0  0

+    7.7903    0.3972    0.0000 H   0  0  0

+  1  2  1  0

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+  2  5  1  0

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+  3  7  1  0

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+  8 10  2  0

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+ 10 30  1  0

+ 11 31  1  0

+ 12 32  1  0

+ 14 33  1  0

+ 17 34  1  0

+ 20 35  1  0

+ 23 36  1  0

+ 24 37  1  0

+ 25 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+19473-49-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 18                          1 V2000

+   -1.6729   -0.9095   -0.5905 C   0  0  1

+   -2.6415    0.0233    0.1392 C   0  0  0

+   -0.4823   -1.1866    0.2909 C   0  0  0

+   -2.3533   -2.1726   -0.9058 N   0  0  0

+   -3.8502    0.3047   -0.7557 C   0  0  0

+    0.5956   -0.3889    0.2332 O   0  0  0

+   -0.4982   -2.1269    1.0496 O   0  0  0

+   -4.8043    1.2234   -0.0370 C   0  0  0

+   -4.5410    1.6181    1.0907 O   0  0  0

+   -5.8423    1.5747   -0.5812 O   0  0  0

+    9.1840    0.6688   -0.1161 K   0  3  0

+   -1.2286   -0.0916    0.0000 H   0  0  0

+   -1.8074    0.4364    0.0000 H   0  0  0

+   -2.7488    0.9479    0.0000 H   0  0  0

+   -3.2837   -2.2000    0.0000 H   0  0  0

+   -1.8643   -2.9646    0.0000 H   0  0  0

+   -4.6842   -0.1085    0.0000 H   0  0  0

+   -3.7428   -0.6199    0.0000 H   0  0  0

+    1.3438    0.1648    0.0000 H   0  0  0

+   -6.7239    1.8731    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

+  5  8  1  0

+  8  9  2  0

+  8 10  1  0

+  1 12  1  0

+  2 13  1  0

+  2 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+146795-36-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+   -1.0643   -0.2532    0.0714 C   0  0  0

+   -2.2204    0.6061    0.0177 C   0  0  0

+    0.3000    0.2964    0.1207 C   0  0  0

+   -1.2938   -1.6135    0.0804 C   0  0  0

+   -3.4272    0.0083   -0.0249 C   0  0  0

+    1.3599   -0.5347    0.1703 N   0  0  0

+    0.4711    1.5007    0.1167 O   0  0  0

+   -3.0207   -1.7253    0.0181 S   0  0  0

+   -4.7652    0.6388   -0.0830 N   0  3  0

+    2.6572   -0.0195    0.0842 C   0  0  0

+   -5.7650   -0.0561   -0.1167 O   0  0  0

+   -4.8664    1.8525   -0.0973 O   0  5  0

+    3.7434   -0.8805   -0.0003 C   0  0  0

+    2.8611    1.3543    0.0771 C   0  0  0

+    5.0250   -0.3675   -0.0859 C   0  0  0

+    4.1431    1.8614   -0.0086 C   0  0  0

+    5.2241    1.0035   -0.0873 C   0  0  0

+    6.0830   -1.2036   -0.1677 F   0  0  0

+   -2.1277    1.6373    0.0000 H   0  0  0

+   -0.6002   -2.3821    0.0000 H   0  0  0

+    1.2119   -1.5594    0.0000 H   0  0  0

+    3.5941   -1.9050    0.0000 H   0  0  0

+    2.0500    1.9978    0.0000 H   0  0  0

+    4.2948    2.8856    0.0000 H   0  0  0

+    6.1864    1.3855    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  9 11  2  0

+  9 12  1  0

+ 10 13  1  0

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+ 14 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+  5  8  1  0

+ 16 17  2  0

+  2 19  1  0

+  4 20  1  0

+  6 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 16 24  1  0

+ 17 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5410-97-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+   -0.4828   -0.6212   -0.0010 C   0  0  0

+   -1.9546   -0.5175   -0.0007 C   0  0  0

+   -0.0094    0.6985   -0.0003 C   0  0  0

+    0.4111   -1.6862    0.0032 C   0  0  0

+   -2.2382    0.8552    0.0001 C   0  0  0

+   -2.9893   -1.4469   -0.0015 C   0  0  0

+   -1.0705    1.5350    0.0003 O   0  0  0

+    1.3612    0.9266    0.0000 C   0  0  0

+    1.7685   -1.4402    0.0015 C   0  0  0

+   -3.5638    1.2733    0.0010 C   0  0  0

+   -4.2984   -1.0132   -0.0015 C   0  0  0

+    2.2392   -0.1372   -0.0003 C   0  0  0

+   -4.5819    0.3434    0.0010 C   0  0  0

+    3.6977    0.1157   -0.0004 N   0  3  0

+    4.4779   -0.8196   -0.0007 O   0  0  0

+    4.1176    1.2590   -0.0002 O   0  5  0

+    0.0580   -2.6636    0.0000 H   0  0  0

+   -2.7768   -2.4642    0.0000 H   0  0  0

+    1.7253    1.9000    0.0000 H   0  0  0

+    2.4394   -2.2339    0.0000 H   0  0  0

+   -3.7879    2.2881    0.0000 H   0  0  0

+   -5.0739   -1.7050    0.0000 H   0  0  0

+   -5.5709    0.6627    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

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+ 12 14  1  0

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+  5  7  1  0

+  9 12  2  0

+ 11 13  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+104-83-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.9676    0.0032   -0.6013 C   0  0  0

+   -0.2924   -1.1951   -0.4604 C   0  0  0

+   -0.2913    1.1996   -0.4539 C   0  0  0

+   -2.4401    0.0048   -0.9218 C   0  0  0

+    1.0591   -1.1973   -0.1722 C   0  0  0

+    1.0606    1.1987   -0.1655 C   0  0  0

+   -3.3889   -0.0030    0.6114 Cl  0  0  0

+    1.7367    0.0001   -0.0245 C   0  0  0

+    3.4346   -0.0018    0.3371 Cl  0  0  0

+   -0.8136   -2.0853    0.0000 H   0  0  0

+   -0.8109    2.0908    0.0000 H   0  0  0

+   -1.9261    0.8992    0.0000 H   0  0  0

+   -2.9605    0.8955    0.0000 H   0  0  0

+    1.5780   -2.0889    0.0000 H   0  0  0

+    1.5812    2.0893    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  8  9  1  0

+  6  8  2  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+135-73-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    1.8043    0.4336   -0.0929 C   0  0  0

+    2.6664   -0.7710    0.1839 C   0  0  0

+    2.3189    1.5033   -0.3417 O   0  0  0

+    0.3398    0.3109   -0.0673 C   0  0  0

+    4.5616   -0.2626    0.0617 Br  0  0  0

+   -0.4622    1.4293   -0.3243 C   0  0  0

+   -0.2554   -0.9260    0.2084 C   0  0  0

+   -1.8329    1.3090   -0.2991 C   0  0  0

+   -1.6160   -1.0406    0.2323 C   0  0  0

+   -2.4184    0.0737   -0.0177 C   0  0  0

+   -3.8948   -0.0565    0.0096 C   0  0  0

+   -4.5073   -1.1900   -0.5229 C   0  0  0

+   -4.6760    0.9518    0.5731 C   0  0  0

+   -5.8823   -1.3055   -0.4947 C   0  0  0

+   -6.0497    0.8252    0.5956 C   0  0  0

+   -6.6524   -0.2995    0.0605 C   0  0  0

+    1.7633   -1.2661    0.0000 H   0  0  0

+    3.0501   -1.7267    0.0000 H   0  0  0

+   -0.0323    2.3652    0.0000 H   0  0  0

+    0.3288   -1.7741    0.0000 H   0  0  0

+   -2.4211    2.1544    0.0000 H   0  0  0

+   -2.0466   -1.9761    0.0000 H   0  0  0

+   -3.9433   -2.0517    0.0000 H   0  0  0

+   -4.2656    1.8964    0.0000 H   0  0  0

+   -6.2992   -2.2472    0.0000 H   0  0  0

+   -6.6187    1.6836    0.0000 H   0  0  0

+   -7.6789   -0.3825    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  2  0

+  4  1  1  0

+  5  2  1  0

+  6  4  2  0

+  7  4  1  0

+  8  6  1  0

+  9  7  2  0

+ 10  8  2  0

+ 11 10  1  0

+ 12 11  2  0

+ 13 11  1  0

+ 14 12  1  0

+ 15 13  2  0

+ 16 14  2  0

+  9 10  1  0

+ 15 16  1  0

+  2 17  1  0

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+  6 19  1  0

+  7 20  1  0

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+  9 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+541-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+    1.0991   -0.1118   -0.0018 C   0  0  0

+    0.0000   -0.8873   -0.0012 N   0  0  0

+    0.6716    1.3048   -0.0006 C   0  0  0

+    2.2470   -0.5070    0.0015 O   0  0  0

+   -1.0991   -0.1118    0.0002 C   0  0  0

+   -0.6716    1.3048    0.0006 C   0  0  0

+   -2.2470   -0.5070    0.0006 O   0  0  0

+    0.0000   -1.8962    0.0000 H   0  0  0

+    1.2732    2.1147    0.0000 H   0  0  0

+   -1.2732    2.1147    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  5  6  1  0

+  2  8  1  0

+  3  9  1  0

+  6 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2832-40-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    2.8406    0.2319   -0.0241 C   0  0  0

+    1.5006    0.4784    0.0588 N   0  0  0

+    3.7462    1.2941   -0.1629 C   0  0  0

+    3.3191   -1.0802    0.0345 C   0  0  0

+    0.6713   -0.5014    0.1864 N   0  0  0

+    5.1043    1.0322   -0.2456 C   0  0  0

+    3.2940    2.5731   -0.2162 O   0  0  0

+    4.6734   -1.3218   -0.0494 C   0  0  0

+   -0.6692   -0.2549    0.2693 C   0  0  0

+    5.5634   -0.2699   -0.1917 C   0  0  0

+    5.1884   -2.7367    0.0144 C   0  0  0

+   -1.5699   -1.3156    0.4076 C   0  0  0

+   -1.1446    1.0598    0.2221 C   0  0  0

+   -2.9210   -1.0626    0.4914 C   0  0  0

+   -2.4968    1.3042    0.3066 C   0  0  0

+   -3.3901    0.2457    0.4387 C   0  0  0

+   -4.7607    0.4979    0.5236 N   0  0  0

+   -5.6117   -0.1102   -0.3265 C   0  0  0

+   -7.0991    0.0562   -0.1511 C   0  0  0

+   -5.1803   -0.7912   -1.2326 O   0  0  0

+    2.6529   -1.8730    0.0000 H   0  0  0

+    5.7802    1.8167    0.0000 H   0  0  0

+    2.9488    3.5494    0.0000 H   0  0  0

+    6.5819   -0.4569    0.0000 H   0  0  0

+    4.2154   -3.0909    0.0000 H   0  0  0

+    5.5426   -3.7097    0.0000 H   0  0  0

+    6.1614   -2.3825    0.0000 H   0  0  0

+   -1.2238   -2.2915    0.0000 H   0  0  0

+   -0.4765    1.8509    0.0000 H   0  0  0

+   -3.5927   -1.8507    0.0000 H   0  0  0

+   -2.8475    2.2785    0.0000 H   0  0  0

+   -4.9859    1.5086    0.0000 H   0  0  0

+   -6.9840    1.0853    0.0000 H   0  0  0

+   -8.1282    0.1713    0.0000 H   0  0  0

+   -7.2142   -0.9729    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

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+ 14 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+35282-68-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+   -2.4152   -0.4110   -0.0017 C   0  0  0

+   -3.4001    0.5801   -0.0008 C   0  0  0

+   -1.0926   -0.0651   -0.0007 N   0  0  0

+   -2.7888   -1.7578    0.0021 C   0  0  0

+   -4.7326    0.2235   -0.0014 C   0  0  0

+   -3.0076    2.0351    0.0013 C   0  0  0

+   -0.1859   -0.9827   -0.0015 N   0  0  0

+   -4.1248   -2.0992    0.0068 C   0  0  0

+   -5.0948   -1.1119   -0.0029 C   0  0  0

+   -4.1843    2.8459    0.0019 O   0  0  0

+    1.1341   -0.6374   -0.0005 C   0  0  0

+    2.1192   -1.6313   -0.0014 C   0  0  0

+    1.5063    0.7112   -0.0043 C   0  0  0

+    3.4495   -1.2791   -0.0008 C   0  0  0

+    2.8391    1.0555   -0.0037 C   0  0  0

+    3.8158    0.0640    0.0007 C   0  0  0

+    5.1629    0.4164    0.0018 N   0  0  0

+    5.5505    1.8292    0.0034 C   0  0  0

+    6.1926   -0.6257    0.0013 C   0  0  0

+   -2.0582   -2.5035    0.0000 H   0  0  0

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+   -2.0369    1.6510    0.0000 H   0  0  0

+   -2.5162    2.9562    0.0000 H   0  0  0

+   -4.4053   -3.1048    0.0000 H   0  0  0

+   -6.1048   -1.3761    0.0000 H   0  0  0

+   -5.0440    3.4382    0.0000 H   0  0  0

+    1.8453   -2.6387    0.0000 H   0  0  0

+    0.7742    1.4555    0.0000 H   0  0  0

+    4.1849   -2.0200    0.0000 H   0  0  0

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+    5.4500   -1.3595    0.0000 H   0  0  0

+    6.9264   -1.3683    0.0000 H   0  0  0

+    6.9352    0.1081    0.0000 H   0  0  0

+  1  2  2  0

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+  8  9  1  0

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+ 18 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+ 19 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6271-79-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    0.6907   -0.2699    0.3366 C   0  0  0

+   -0.6907    0.2701    0.3364 C   0  0  0

+    1.7540    0.5329   -0.0733 C   0  0  0

+    0.9284   -1.5794    0.7523 C   0  0  0

+   -1.7539   -0.5327   -0.0735 C   0  0  0

+   -0.9285    1.5797    0.7518 C   0  0  0

+    3.0375    0.0287   -0.0724 C   0  0  0

+    2.2131   -2.0793    0.7516 C   0  0  0

+   -3.0375   -0.0288   -0.0724 C   0  0  0

+   -2.2132    2.0794    0.7513 C   0  0  0

+    3.2713   -1.2787    0.3369 C   0  0  0

+    4.1669    0.8806   -0.5081 N   0  3  0

+   -3.2715    1.2786    0.3370 C   0  0  0

+   -4.1668   -0.8807   -0.5081 N   0  3  0

+    4.5717   -1.7872    0.3366 N   0  0  0

+    4.3596    1.9574    0.0275 O   0  0  0

+    4.9037    0.5047   -1.4022 O   0  5  0

+   -4.5719    1.7870    0.3369 N   0  0  0

+   -4.3593   -1.9576    0.0274 O   0  0  0

+   -4.9037   -0.5048   -1.4021 O   0  5  0

+    1.6183    1.5228    0.0000 H   0  0  0

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+  1  2  1  0

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+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  7 12  1  0

+  9 13  2  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  2  0

+ 12 17  1  0

+ 13 18  1  0

+ 14 19  2  0

+ 14 20  1  0

+  8 11  1  0

+ 10 13  1  0

+  3 21  1  0

+  4 22  1  0

+  5 23  1  0

+  6 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+ 18 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+329-65-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.1677    0.2199   -0.4627 C   0  0  0

+    0.5753   -0.8660   -0.0387 C   0  0  0

+    0.4310    1.4580   -0.6045 C   0  0  0

+   -1.6320    0.0525   -0.7769 C   0  0  2

+    1.9231   -0.7151    0.2451 C   0  0  0

+    1.7753    1.6155   -0.3230 C   0  0  0

+   -2.4569    0.3054    0.4867 C   0  0  0

+   -1.8701   -1.2772   -1.2430 O   0  0  0

+    2.5257    0.5311    0.1023 C   0  0  0

+    2.6553   -1.7823    0.6627 O   0  0  0

+   -3.8843    0.1421    0.1804 N   0  0  0

+    3.8483    0.6843    0.3797 O   0  0  0

+   -4.6157    0.3971    1.4286 C   0  0  0

+    0.1533   -1.7871    0.0000 H   0  0  0

+   -0.1564    2.2834    0.0000 H   0  0  0

+   -1.5391    1.0614    0.0000 H   0  0  0

+    2.1925    2.5388    0.0000 H   0  0  0

+   -1.8167    1.0907    0.0000 H   0  0  0

+   -2.9430    1.1943    0.0000 H   0  0  0

+   -2.0487   -2.2745    0.0000 H   0  0  0

+    3.2285   -2.6177    0.0000 H   0  0  0

+   -3.9963   -0.8648    0.0000 H   0  0  0

+    4.8547    0.8009    0.0000 H   0  0  0

+   -4.2822    1.3538    0.0000 H   0  0  0

+   -5.5724    0.7306    0.0000 H   0  0  0

+   -4.9492   -0.5596    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+ 11 13  1  0

+  6  9  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  7 19  1  0

+  8 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+118-55-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.6567   -0.1794    0.0363 C   0  0  0

+    0.2289    0.1766    0.1202 C   0  0  0

+    2.6325    0.8260   -0.0132 C   0  0  0

+    2.0463   -1.5216    0.0114 C   0  0  0

+   -0.7106   -0.7878    0.0613 O   0  0  0

+   -0.1011    1.3397    0.2424 O   0  0  0

+    3.9731    0.4791   -0.0921 C   0  0  0

+    2.2672    2.1320    0.0154 O   0  0  0

+    3.3825   -1.8475   -0.0672 C   0  0  0

+   -2.0264   -0.4521    0.0054 C   0  0  0

+    4.3434   -0.8506   -0.1217 C   0  0  0

+   -2.9992   -1.4364    0.1002 C   0  0  0

+   -2.3991    0.8765   -0.1410 C   0  0  0

+   -4.3362   -1.0926    0.0430 C   0  0  0

+   -3.7370    1.2150   -0.1976 C   0  0  0

+   -4.7047    0.2312   -0.1086 C   0  0  0

+    1.3304   -2.2692    0.0000 H   0  0  0

+    4.6982    1.2177    0.0000 H   0  0  0

+    1.9884    3.1288    0.0000 H   0  0  0

+    3.6708   -2.8416    0.0000 H   0  0  0

+    5.3469   -1.1044    0.0000 H   0  0  0

+   -2.7233   -2.4340    0.0000 H   0  0  0

+   -1.6767    1.6177    0.0000 H   0  0  0

+   -5.0608   -1.8317    0.0000 H   0  0  0

+   -4.0160    2.2117    0.0000 H   0  0  0

+   -5.7068    0.4901    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  7 11  2  0

+ 10 12  2  0

+ 10 13  1  0

+ 12 14  1  0

+ 13 15  2  0

+ 14 16  2  0

+  9 11  1  0

+ 15 16  1  0

+  4 17  1  0

+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+920-37-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+   -0.0500    0.4887   -0.0018 C   0  0  0

+   -1.3381   -0.1369   -0.0005 C   0  0  0

+    0.0451    1.8167    0.0009 C   0  0  0

+    1.3876   -0.4844    0.0002 Cl  0  0  0

+   -2.3599   -0.6333    0.0006 N   0  0  0

+    0.9773    2.2694    0.0000 H   0  0  0

+   -0.8130    2.3976    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  3  0

+  3  6  1  0

+  3  7  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+22996-17-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -0.1364    0.5053   -0.0124 C   0  0  0

+   -0.2516   -0.8721    0.0363 C   0  0  0

+    1.1118    1.0942   -0.0554 C   0  0  0

+   -1.3525    1.3488   -0.0246 N   0  3  0

+    0.8818   -1.6640    0.0421 C   0  0  0

+   -1.6155   -1.5113    0.0836 C   0  0  0

+    2.2527    0.3015   -0.0497 C   0  0  0

+   -2.1547    1.2476   -0.9355 O   0  0  0

+   -1.5511    2.1441    0.8763 O   0  5  0

+    2.1334   -1.0814   -0.0007 C   0  0  0

+   -1.4742   -2.9325    0.1289 O   0  0  0

+    3.5169    0.8939   -0.0926 N   0  0  0

+    1.1981    2.1296    0.0000 H   0  0  0

+    0.7914   -2.6991    0.0000 H   0  0  0

+   -1.9475   -0.5268    0.0000 H   0  0  0

+   -2.6312   -1.7301    0.0000 H   0  0  0

+    2.9847   -1.6771    0.0000 H   0  0  0

+   -1.3714   -3.9664    0.0000 H   0  0  0

+    4.3691    0.2996    0.0000 H   0  0  0

+    3.6055    1.9291    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 10  2  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+  6 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55691-69-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.6602    0.0642    0.0049 C   0  0  0

+   -0.7977    0.0732    0.0053 C   0  0  0

+    1.4306    1.1010    0.0653 C   0  0  0

+    1.4417   -1.1692   -0.0731 C   0  0  0

+   -1.3981    1.2371    0.0727 C   0  0  0

+   -1.4559   -1.2421   -0.0716 C   0  0  0

+    2.8213    0.6212    0.0380 C   0  0  0

+    0.7564    2.4111    0.1413 C   0  0  0

+    2.8368   -0.7043   -0.0432 C   0  0  0

+    0.7761   -2.2949   -0.1441 C   0  0  0

+   -0.5640    2.4572    0.1434 C   0  0  0

+   -2.7505    1.3206    0.0770 N   0  3  0

+   -0.6956   -2.3204   -0.1350 C   0  0  0

+   -2.8071   -1.3435   -0.0767 N   0  3  0

+    4.1000    1.3547    0.0822 C   0  0  0

+    4.1190   -1.4240   -0.0878 C   0  0  0

+   -3.3220    1.9916   -0.7636 O   0  0  0

+   -3.3947    0.7245    0.9215 O   0  5  0

+   -3.3698   -2.0259    0.7607 O   0  0  0

+   -3.4590   -0.7522   -0.9187 O   0  5  0

+    5.2428    0.7074    0.0456 C   0  0  0

+    5.2551   -0.7628   -0.0443 C   0  0  0

+    1.3007    3.2693    0.0000 H   0  0  0

+    1.2873   -3.1732    0.0000 H   0  0  0

+   -1.0225    3.3641    0.0000 H   0  0  0

+   -1.1555   -3.2266    0.0000 H   0  0  0

+    4.0972    2.3709    0.0000 H   0  0  0

+    4.1269   -2.4402    0.0000 H   0  0  0

+    6.1186    1.2228    0.0000 H   0  0  0

+    6.1382   -1.2657    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  5 12  1  0

+  6 13  2  0

+  6 14  1  0

+  7 15  1  0

+  9 16  1  0

+ 12 17  2  0

+ 12 18  1  0

+ 14 19  2  0

+ 14 20  1  0

+ 15 21  2  0

+ 16 22  2  0

+  7  9  2  0

+  8 11  2  0

+ 10 13  1  0

+ 21 22  1  0

+  8 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 13 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 21 29  1  0

+ 22 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+484-47-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 42                          1 V2000

+    0.3262    0.7184    0.0203 C   0  0  0

+    0.2830   -0.6655   -0.0093 C   0  0  0

+    1.5351    1.5652    0.0361 C   0  0  0

+   -0.9806    1.1478    0.0262 N   0  0  0

+    1.4519   -1.5758   -0.0301 C   0  0  0

+   -1.0078   -1.0344   -0.0155 N   0  0  0

+    1.7238    2.5373   -0.9489 C   0  0  0

+    2.4933    1.4019    1.0397 C   0  0  0

+   -1.7706    0.0347    0.0004 C   0  0  0

+    1.5410   -2.6216    0.8878 C   0  0  0

+    2.4647   -1.3935   -0.9716 C   0  0  0

+    2.8558    3.3253   -0.9277 C   0  0  0

+    3.6201    2.1968    1.0485 C   0  0  0

+   -3.2490    0.0329   -0.0035 C   0  0  0

+    2.6319   -3.4665    0.8633 C   0  0  0

+    3.5504   -2.2446   -0.9862 C   0  0  0

+    3.8030    3.1546    0.0662 C   0  0  0

+   -3.9466   -0.8796   -0.7962 C   0  0  0

+   -3.9532    0.9400    0.7903 C   0  0  0

+    3.6357   -3.2774   -0.0694 C   0  0  0

+   -5.3264   -0.8763   -0.7948 C   0  0  0

+   -5.3325    0.9327    0.7824 C   0  0  0

+   -6.0182    0.0288   -0.0099 C   0  0  0

+   -1.2920    2.0938    0.0000 H   0  0  0

+    0.8892    3.0808    0.0000 H   0  0  0

+    2.7133    0.4306    0.0000 H   0  0  0

+    0.6662   -3.0977    0.0000 H   0  0  0

+    2.7047   -0.4269    0.0000 H   0  0  0

+    2.6434    4.2983    0.0000 H   0  0  0

+    4.4572    1.6572    0.0000 H   0  0  0

+    2.3987   -4.4347    0.0000 H   0  0  0

+    4.4272   -1.7722    0.0000 H   0  0  0

+    4.6239    3.7185    0.0000 H   0  0  0

+   -3.5064   -1.7730    0.0000 H   0  0  0

+   -3.5176    1.8356    0.0000 H   0  0  0

+    4.4279   -3.8810    0.0000 H   0  0  0

+   -5.7688   -1.7686    0.0000 H   0  0  0

+   -5.7778    1.8235    0.0000 H   0  0  0

+   -7.0141    0.0270    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  2  0

+  5 11  1  0

+  7 12  1  0

+  8 13  2  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  2  0

+ 12 17  2  0

+ 14 18  2  0

+ 14 19  1  0

+ 15 20  2  0

+ 18 21  1  0

+ 19 22  2  0

+ 21 23  2  0

+  6  9  2  0

+ 13 17  1  0

+ 16 20  1  0

+ 22 23  1  0

+  4 24  1  0

+  7 25  1  0

+  8 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+ 23 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1609-47-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    1.1672   -0.0971   -0.0007 C   0  0  0

+    0.0000    0.5768    0.0002 O   0  0  0

+    2.3321    0.5754    0.0001 O   0  0  0

+    1.1672   -1.3112    0.0029 O   0  0  0

+   -1.1672   -0.0971   -0.0006 C   0  0  0

+    3.5896   -0.1506   -0.0008 C   0  0  0

+   -2.3321    0.5754    0.0002 O   0  0  0

+   -1.1672   -1.3112   -0.0021 O   0  0  0

+    4.7525    0.8437    0.0004 C   0  0  0

+   -3.5896   -0.1506   -0.0006 C   0  0  0

+   -4.7525    0.8437    0.0006 C   0  0  0

+    2.9885   -0.9633    0.0000 H   0  0  0

+    4.3291   -0.8397    0.0000 H   0  0  0

+    5.4094    0.0754    0.0000 H   0  0  0

+    5.5208    1.5006    0.0000 H   0  0  0

+    4.0956    1.6120    0.0000 H   0  0  0

+   -4.3291   -0.8397    0.0000 H   0  0  0

+   -2.9885   -0.9633    0.0000 H   0  0  0

+   -4.0956    1.6120    0.0000 H   0  0  0

+   -5.5208    1.5006    0.0000 H   0  0  0

+   -5.4094    0.0754    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  5  8  2  0

+  6  9  1  0

+  7 10  1  0

+ 10 11  1  0

+  6 12  1  0

+  6 13  1  0

+  9 14  1  0

+  9 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1068-57-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+    0.4940    0.0108   -0.0014 C   0  0  0

+   -0.6670    0.6953    0.0009 N   0  0  0

+    1.8059    0.7525    0.0001 C   0  0  0

+    0.4830   -1.2019    0.0005 O   0  0  0

+   -1.8562    0.0230   -0.0004 N   0  0  0

+   -0.6578    1.7129    0.0000 H   0  0  0

+    2.3068   -0.1334    0.0000 H   0  0  0

+    2.6918    1.2534    0.0000 H   0  0  0

+    1.3050    1.6384    0.0000 H   0  0  0

+   -2.7329    0.5398    0.0000 H   0  0  0

+   -1.8654   -0.9947    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-96-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.4844    0.0806   -0.3540 C   0  0  0

+   -0.7425    0.7454    0.2736 C   0  0  0

+    1.7416    0.8621    0.0326 C   0  0  0

+    0.5936   -1.2627    0.1213 O   0  0  0

+   -1.9496   -0.0050   -0.0976 N   0  0  0

+   -0.4005   -0.4962    0.0000 H   0  0  0

+   -0.0872    1.5738    0.0000 H   0  0  0

+   -1.4460    1.5333    0.0000 H   0  0  0

+    2.2992   -0.0350    0.0000 H   0  0  0

+    2.6387    1.4197    0.0000 H   0  0  0

+    1.1840    1.7592    0.0000 H   0  0  0

+    0.6792   -2.3155    0.0000 H   0  0  0

+   -2.8811    0.4931    0.0000 H   0  0  0

+   -1.9152   -1.0607    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97-84-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+    1.2127   -0.5705   -0.1034 C   0  0  0

+   -0.1237   -0.2786    0.5820 C   0  0  0

+    2.1825    0.4751    0.2490 N   0  0  0

+    1.7377   -1.9305    0.3611 C   0  0  0

+   -1.2623   -0.4538   -0.4249 C   0  0  0

+    3.3783    0.2350   -0.5698 C   0  0  0

+    1.6107    1.7506   -0.2027 C   0  0  0

+   -2.5453   -0.1734    0.2333 N   0  0  0

+   -2.5400    1.2546    0.5777 C   0  0  0

+   -3.5902   -0.3587   -0.7826 C   0  0  0

+    0.5450   -1.3494    0.0000 H   0  0  0

+    0.4691    0.5587    0.0000 H   0  0  0

+   -0.6632    0.5940    0.0000 H   0  0  0

+    0.7806   -2.3000    0.0000 H   0  0  0

+    2.1072   -2.8876    0.0000 H   0  0  0

+    2.6948   -1.5610    0.0000 H   0  0  0

+   -1.8552   -1.2911    0.0000 H   0  0  0

+   -0.7229   -1.3265    0.0000 H   0  0  0

+    3.1763   -0.7709    0.0000 H   0  0  0

+    4.3842    0.0330    0.0000 H   0  0  0

+    3.5803    1.2409    0.0000 H   0  0  0

+    2.5469    2.1703    0.0000 H   0  0  0

+    1.1910    2.6868    0.0000 H   0  0  0

+    0.6745    1.3309    0.0000 H   0  0  0

+   -1.5141    1.2508    0.0000 H   0  0  0

+   -2.5362    2.2805    0.0000 H   0  0  0

+   -3.5659    1.2584    0.0000 H   0  0  0

+   -3.7693    0.6515    0.0000 H   0  0  0

+   -4.6004   -0.5378    0.0000 H   0  0  0

+   -3.4111   -1.3689    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  3  7  1  0

+  5  8  1  0

+  8  9  1  0

+  8 10  1  0

+  1 11  1  0

+  2 12  1  0

+  2 13  1  0

+  4 14  1  0

+  4 15  1  0

+  4 16  1  0

+  5 17  1  0

+  5 18  1  0

+  6 19  1  0

+  6 20  1  0

+  6 21  1  0

+  7 22  1  0

+  7 23  1  0

+  7 24  1  0

+  9 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+527-17-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+   -1.2792    0.6700    0.0014 C   0  0  0

+   -1.2792   -0.6701    0.0007 C   0  0  0

+    0.0000    1.4086    0.0009 C   0  0  0

+   -2.5843    1.4235   -0.0037 C   0  0  0

+    0.0000   -1.4086   -0.0001 C   0  0  0

+   -2.5843   -1.4236    0.0011 C   0  0  0

+    1.2792    0.6701   -0.0003 C   0  0  0

+    0.0000    2.6230    0.0012 O   0  0  0

+    1.2792   -0.6700   -0.0006 C   0  0  0

+    0.0000   -2.6230    0.0001 O   0  0  0

+    2.5843    1.4236   -0.0003 C   0  0  0

+    2.5843   -1.4235   -0.0009 C   0  0  0

+   -2.0304    2.3829    0.0000 H   0  0  0

+   -3.5437    1.9774    0.0000 H   0  0  0

+   -3.1382    0.4641    0.0000 H   0  0  0

+   -3.1382   -0.4642    0.0000 H   0  0  0

+   -3.5437   -1.9775    0.0000 H   0  0  0

+   -2.0304   -2.3830    0.0000 H   0  0  0

+    3.1382    0.4642    0.0000 H   0  0  0

+    3.5437    1.9775    0.0000 H   0  0  0

+    2.0304    2.3830    0.0000 H   0  0  0

+    2.0304   -2.3829    0.0000 H   0  0  0

+    3.5437   -1.9774    0.0000 H   0  0  0

+    3.1382   -0.4641    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  5  9  1  0

+  5 10  2  0

+  7 11  1  0

+  9 12  1  0

+  7  9  2  0

+  4 13  1  0

+  4 14  1  0

+  4 15  1  0

+  6 16  1  0

+  6 17  1  0

+  6 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1025-15-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 33                          1 V2000

+    1.1358   -0.8250    0.3419 N   0  0  0

+    0.0306   -1.4390   -0.1251 C   0  0  0

+    1.1078    0.4935    0.6194 C   0  0  0

+    2.3658   -1.5922    0.5535 C   0  0  0

+   -1.1026   -0.7344   -0.3145 N   0  0  0

+    0.0560   -2.6277   -0.3758 O   0  0  0

+   -0.0254    1.1981    0.4301 N   0  0  0

+    2.1044    1.0472    1.0400 O   0  0  0

+    3.1932   -1.5723   -0.7060 C   0  0  0

+   -1.1307    0.5841   -0.0364 C   0  0  0

+   -2.3039   -1.4017   -0.8220 C   0  0  0

+   -0.0555    2.6316    0.7309 C   0  0  0

+    4.4019   -1.0675   -0.6877 C   0  0  0

+   -2.1526    1.2192   -0.2064 O   0  0  0

+   -3.1180   -1.9195    0.3357 C   0  0  0

+    0.3358    3.4111   -0.4981 C   0  0  0

+   -4.3456   -1.4982    0.5135 C   0  0  0

+   -0.5008    4.2729   -1.0211 C   0  0  0

+    1.6207   -2.1989    0.0000 H   0  0  0

+    2.6986   -2.4936    0.0000 H   0  0  0

+    3.3933   -2.5121    0.0000 H   0  0  0

+   -2.3070   -0.4409    0.0000 H   0  0  0

+   -3.1469   -0.9406    0.0000 H   0  0  0

+   -0.7063    3.3385    0.0000 H   0  0  0

+   -0.9469    2.2730    0.0000 H   0  0  0

+    5.1659   -1.6502    0.0000 H   0  0  0

+    4.5245   -0.1145    0.0000 H   0  0  0

+   -3.0049   -2.8737    0.0000 H   0  0  0

+    1.2855    3.5572    0.0000 H   0  0  0

+   -4.5299   -0.5552    0.0000 H   0  0  0

+   -5.0701   -2.1293    0.0000 H   0  0  0

+   -0.2384    5.1972    0.0000 H   0  0  0

+   -1.4325    4.0380    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  7 12  1  0

+  9 13  2  0

+ 10 14  2  0

+ 11 15  1  0

+ 12 16  1  0

+ 15 17  2  0

+ 16 18  2  0

+  7 10  1  0

+  4 19  1  0

+  4 20  1  0

+  9 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+98601-00-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 40                          1 V2000

+   -0.8409   -0.2846    0.0845 C   0  0  0

+   -2.2727   -0.5985    0.0369 C   0  0  0

+   -0.4383    1.0690    0.0058 C   0  0  0

+    0.1178   -1.2884    0.2105 C   0  0  0

+   -3.1967    0.4634   -0.0857 C   0  0  0

+   -2.7345   -1.9136    0.1103 C   0  0  0

+    0.9278    1.3881    0.0511 C   0  0  0

+   -1.4137    2.0852   -0.1169 C   0  0  0

+    1.4613   -0.9450    0.2528 C   0  0  0

+   -2.7305    1.7965   -0.1603 C   0  0  0

+   -4.5679    0.1739   -0.1311 C   0  0  0

+   -4.0767   -2.1630    0.0634 C   0  0  0

+    1.8557    0.4007    0.1698 C   0  0  0

+   -0.9721    3.5236   -0.2005 C   0  0  0

+    2.4991   -1.9892    0.3853 C   0  0  0

+   -4.9890   -1.1215   -0.0573 C   0  0  0

+    3.3238    0.7391    0.2200 C   0  0  2

+    3.7509   -1.7116    0.0484 C   0  0  0

+    4.1306   -0.3520   -0.4805 C   0  0  1

+    3.7427    0.8409    1.5825 O   0  0  0

+    3.8882   -0.2945   -1.8876 O   0  0  0

+   -0.1709   -2.2961    0.0000 H   0  0  0

+   -2.0525   -2.7096    0.0000 H   0  0  0

+    1.2310    2.3915    0.0000 H   0  0  0

+   -3.4257    2.5810    0.0000 H   0  0  0

+   -5.2687    0.9534    0.0000 H   0  0  0

+   -4.4202   -3.1533    0.0000 H   0  0  0

+    0.0300    3.2160    0.0000 H   0  0  0

+   -0.6645    4.5257    0.0000 H   0  0  0

+   -1.9742    3.8312    0.0000 H   0  0  0

+    2.2043   -2.9951    0.0000 H   0  0  0

+   -6.0158   -1.3324    0.0000 H   0  0  0

+    3.0823    1.7591    0.0000 H   0  0  0

+    4.4718   -2.4726    0.0000 H   0  0  0

+    5.1615   -0.1621    0.0000 H   0  0  0

+    4.7613    1.0884    0.0000 H   0  0  0

+    2.8683   -0.0526    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 11 16  2  0

+ 13 17  1  0

+ 15 18  2  0

+ 17 19  1  0

+ 17 20  1  0

+ 19 21  1  0

+  8 10  2  0

+  9 13  2  0

+ 12 16  1  0

+ 18 19  1  0

+  4 22  1  0

+  6 23  1  0

+  7 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 14 28  1  0

+ 14 29  1  0

+ 14 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6052-68-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    3.4622    0.5763    0.0613 C   0  0  0

+    4.2621    0.0387   -0.6673 O   0  0  0

+    3.7482    1.7679    0.6091 O   0  0  0

+    2.1407   -0.0880    0.3501 C   0  0  0

+    0.9964    0.8246   -0.1154 C   0  0  0

+    2.0707   -1.3688   -0.3632 N   0  0  0

+   -0.2832    0.0318   -0.0182 C   0  0  0

+    0.9584   -2.1427    0.2062 C   0  0  0

+   -1.6560    0.4774   -0.0589 C   0  0  0

+   -0.3008   -1.3135    0.1330 C   0  0  0

+   -2.4483   -0.6926    0.0811 C   0  0  0

+   -2.2456    1.7379   -0.1981 C   0  0  0

+   -1.5943   -1.7528    0.1956 N   0  0  0

+   -3.8391   -0.6117    0.0824 C   0  0  0

+   -3.6175    1.7870   -0.1927 C   0  0  0

+   -4.3946    0.6481   -0.0579 C   0  0  0

+    3.9894    2.7727    0.0000 H   0  0  0

+    1.1978   -0.5108    0.0000 H   0  0  0

+    1.7286    1.5537    0.0000 H   0  0  0

+    0.3555    1.6352    0.0000 H   0  0  0

+    2.9732   -1.8721    0.0000 H   0  0  0

+    0.2855   -2.9269    0.0000 H   0  0  0

+    1.6511   -2.9095    0.0000 H   0  0  0

+   -1.6754    2.5997    0.0000 H   0  0  0

+   -1.8825   -2.7451    0.0000 H   0  0  0

+   -4.4284   -1.4606    0.0000 H   0  0  0

+   -4.0838    2.7092    0.0000 H   0  0  0

+   -5.4236    0.7428    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  1  0

+  4  1  1  0

+  5  4  1  0

+  6  4  1  0

+  7  5  1  0

+  8  6  1  0

+  9  7  1  0

+ 10  7  2  0

+ 11  9  2  0

+ 12  9  1  0

+ 13 10  1  0

+ 14 11  1  0

+ 15 12  2  0

+ 16 14  2  0

+  8 10  1  0

+ 11 13  1  0

+ 15 16  1  0

+  3 17  1  0

+  4 18  1  0

+  5 19  1  0

+  5 20  1  0

+  6 21  1  0

+  8 22  1  0

+  8 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67730-10-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+    0.9399   -0.4206   -0.0012 N   0  0  0

+   -0.4235   -0.2127   -0.0006 C   0  0  0

+    1.5425    0.8142   -0.0005 C   0  0  0

+    1.6953   -1.5591    0.0027 C   0  0  0

+   -0.6085    1.1813    0.0006 C   0  0  0

+   -1.4704   -1.0267   -0.0008 N   0  0  0

+    0.6106    1.7545    0.0006 N   0  0  0

+    2.9527    0.8979   -0.0009 C   0  0  0

+    3.0424   -1.4916    0.0018 C   0  0  0

+   -1.9147    1.6949    0.0011 C   0  0  0

+   -2.7062   -0.5591    0.0000 C   0  0  0

+    3.6895   -0.2439   -0.0021 C   0  0  0

+   -2.9603    0.8129    0.0004 C   0  0  0

+   -3.7742   -1.4516   -0.0008 N   0  0  0

+    1.2320   -2.4770    0.0000 H   0  0  0

+    3.4177    1.8150    0.0000 H   0  0  0

+    3.5983   -2.3566    0.0000 H   0  0  0

+   -2.0816    2.7095    0.0000 H   0  0  0

+    4.7166   -0.1953    0.0000 H   0  0  0

+   -3.9285    1.1592    0.0000 H   0  0  0

+   -4.7397   -1.0980    0.0000 H   0  0  0

+   -3.5977   -2.4646    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  2  0

+ 10 13  2  0

+ 11 14  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 13  1  0

+  4 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+ 14 21  1  0

+ 14 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78468-34-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+   -1.1109    0.1122    0.0037 C   0  0  0

+   -0.4657   -1.1086    0.0031 C   0  0  0

+   -0.3767    1.2843    0.0027 C   0  0  0

+   -2.5900    0.1665   -0.0006 N   0  3  0

+    0.9228   -1.1586    0.0014 C   0  0  0

+    1.0052    1.2381    0.0010 C   0  0  0

+   -3.1599    1.2429   -0.0001 O   0  0  0

+   -3.2373   -0.8653   -0.0048 O   0  5  0

+    1.6570    0.0203    0.0004 C   0  0  0

+    1.5787   -2.3918    0.0003 N   0  0  0

+    3.1632   -0.0291   -0.0019 C   0  0  0

+    3.6834    1.3018   -0.0026 O   0  0  0

+   -1.0181   -1.9891    0.0000 H   0  0  0

+   -0.8649    2.2020    0.0000 H   0  0  0

+    1.5542    2.1208    0.0000 H   0  0  0

+    1.0280   -3.2734    0.0000 H   0  0  0

+    2.6175   -2.4279    0.0000 H   0  0  0

+    3.0119   -1.0575    0.0000 H   0  0  0

+    4.1679   -0.2957    0.0000 H   0  0  0

+    4.0618    2.2699    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  9 11  1  0

+ 11 12  1  0

+  6  9  1  0

+  2 13  1  0

+  3 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+42286-46-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+   -0.0766    0.2007   -0.0020 C   0  0  0

+   -1.4012    0.6925   -0.0014 C   0  0  0

+    0.9974    1.1064   -0.0003 C   0  0  0

+    0.1953   -1.2380    0.0015 C   0  0  0

+   -2.5139   -0.1787   -0.0026 C   0  0  0

+   -1.6166    2.0894    0.0011 C   0  0  0

+    2.3692    0.5832   -0.0005 C   0  0  0

+    0.7536    2.4900    0.0021 C   0  0  0

+    1.4960   -1.7057    0.0009 C   0  0  0

+   -0.9324   -2.1848    0.0054 C   0  0  0

+   -2.3205   -1.6360   -0.0047 C   0  0  0

+   -3.8034    0.3503   -0.0014 C   0  0  0

+   -0.5149    2.9700    0.0024 C   0  0  0

+   -2.9317    2.5879    0.0018 C   0  0  0

+    2.5862   -0.8143   -0.0025 C   0  0  0

+    3.4640    1.4508    0.0007 C   0  0  0

+   -0.7377   -3.3841    0.0080 O   0  0  0

+   -3.2780   -2.3839   -0.0054 O   0  0  0

+   -3.9998    1.7228    0.0010 C   0  0  0

+    3.9037   -1.3050   -0.0031 C   0  0  0

+    4.7416    0.9382    0.0000 C   0  0  0

+    4.9538   -0.4356   -0.0019 C   0  0  0

+    1.5654    3.1624    0.0000 H   0  0  0

+    1.6744   -2.7445    0.0000 H   0  0  0

+   -4.6349   -0.2975    0.0000 H   0  0  0

+   -0.6790    4.0112    0.0000 H   0  0  0

+   -3.0988    3.6286    0.0000 H   0  0  0

+    3.3124    2.4939    0.0000 H   0  0  0

+   -4.9810    2.1078    0.0000 H   0  0  0

+    4.0794   -2.3443    0.0000 H   0  0  0

+    5.5670    1.5938    0.0000 H   0  0  0

+    5.9392   -0.8099    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

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+ 16 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+ 21 31  1  0

+ 22 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2945-96-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 59 61                          1 V2000

+    2.5407   -1.8098    0.2323 C   0  0  0

+    3.0646   -2.9687   -0.3734 C   0  0  0

+    3.3960   -0.8302    0.7351 C   0  0  0

+    1.1917   -1.6428    0.3220 N   0  0  0

+    4.4033   -3.1548   -0.4789 C   0  0  0

+    1.9648   -4.1935   -1.0018 S   0  0  0

+    4.7893   -1.0119    0.6310 C   0  0  0

+    2.8922    0.2858    1.3179 O   0  0  0

+    0.6532   -0.5317   -0.0513 N   0  0  0

+    5.2963   -2.1850    0.0186 C   0  0  0

+    1.7154   -3.8316   -2.3531 O   0  0  0

+    2.4880   -5.4414   -0.5678 O   0  0  0

+    0.6367   -4.0274   -0.2773 O   0  0  0

+    5.6831   -0.0485    1.1257 C   0  0  0

+   -0.6966   -0.3645    0.0385 C   0  0  0

+    6.6855   -2.3655   -0.0850 C   0  0  0

+    7.0403   -0.2575    1.0081 C   0  0  0

+   -1.2840    0.8455   -0.3679 C   0  0  0

+   -1.4994   -1.3998    0.5302 C   0  0  0

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+   -6.6951    1.3913    0.0402 C   0  0  0

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+   -7.4905    0.3501    0.5329 C   0  0  0

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+  -10.8214    1.8725    0.3271 N   0  0  0

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+   -2.1679    2.2966    0.0000 H   0  0  0

+   -4.5070   -1.7440    0.0000 H   0  0  0

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+   -2.9108   -2.9670    0.0000 H   0  0  0

+   -6.7136    3.4154    0.0000 H   0  0  0

+   -7.0992   -0.5761    0.0000 H   0  0  0

+   -9.0505    3.6717    0.0000 H   0  0  0

+   -9.4351   -0.3072    0.0000 H   0  0  0

+  -11.2198    2.7957    0.0000 H   0  0  0

+  -11.4217    1.0659    0.0000 H   0  0  0

+   -0.3610   -3.9026    0.0000 H   0  0  0

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+ 34 56  1  0

+ 36 57  1  0

+ 36 58  1  0

+ 13 59  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+110-58-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.7262   -0.4021    0.0000 C   0  0  0

+   -0.5760    0.4010    0.0000 C   0  0  0

+    1.9175    0.5580    0.0000 C   0  0  0

+   -1.7673   -0.5591    0.0000 C   0  0  0

+    3.2198   -0.2451    0.0000 C   0  0  0

+   -3.0176    0.2120    0.0000 N   0  0  0

+    0.0173   -1.3045    0.0000 H   0  0  0

+    1.5426   -1.2085    0.0000 H   0  0  0

+    0.1329    1.3034    0.0000 H   0  0  0

+   -1.3924    1.2074    0.0000 H   0  0  0

+    2.6264    1.4604    0.0000 H   0  0  0

+    1.1010    1.3643    0.0000 H   0  0  0

+   -2.4762   -1.4615    0.0000 H   0  0  0

+   -0.9509   -1.3655    0.0000 H   0  0  0

+    2.6175   -1.2218    0.0000 H   0  0  0

+    4.1965   -0.8474    0.0000 H   0  0  0

+    3.8221    0.7316    0.0000 H   0  0  0

+   -2.9843    1.3590    0.0000 H   0  0  0

+   -4.0276   -0.3327    0.0000 H   0  0  0

+  1  2  1  0

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+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2479-46-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+    0.8522    0.3662    0.9039 C   0  0  0

+   -0.0462    0.0066   -0.0895 C   0  0  0

+    1.6803    1.4277    0.7199 O   0  0  0

+    0.9008   -0.3555    2.0883 C   0  0  0

+   -0.8900   -1.0767    0.1015 C   0  0  0

+    2.8428    0.9362    0.2137 C   0  0  0

+    0.0549   -1.4317    2.2783 C   0  0  0

+   -1.7711   -1.4319   -0.8700 O   0  0  0

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+   -0.6279    0.7799    0.0000 H   0  0  0

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+    2.1442   -0.9624    0.0000 H   0  0  0

+    5.9092    1.8339    0.0000 H   0  0  0

+    4.2335   -1.8611    0.0000 H   0  0  0

+   -4.1807   -1.6459    0.0000 H   0  0  0

+   -2.1916    0.6267    0.0000 H   0  0  0

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+   -3.8762    1.7993    0.0000 H   0  0  0

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+   -6.2548    2.5783    0.0000 H   0  0  0

+   -7.1874    1.1858    0.0000 H   0  0  0

+  1  2  1  0

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+ 20 35  1  0

+ 20 36  1  0

+ 22 37  1  0

+ 22 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+191-26-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 39                          1 V2000

+    0.5273   -0.4643   -0.0023 C   0  0  0

+   -0.5272    0.4638   -0.0015 C   0  0  0

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+ 21 33  1  0

+ 22 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+103393-71-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 32                          1 V2000

+    1.5825   -0.1237   -0.0413 C   0  0  0

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+    0.2330   -2.0137   -0.4971 C   0  0  0

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+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-11-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+    0.8478   -1.2483    0.0000 C   0  0  0

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+    0.0024   -2.4160   -0.0583 O   0  0  0

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+    0.0035   -3.5328   -0.9288 N   0  3  0

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+  5 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+551-92-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+    0.3079    0.3085   -0.0533 C   0  0  0

+   -0.7085   -0.5960    0.0968 N   0  0  0

+   -0.2662    1.5132   -0.2341 C   0  0  0

+    1.7592    0.0190   -0.0174 N   0  3  0

+   -1.8690    0.0879    0.0025 C   0  0  0

+   -0.5641   -2.0369    0.3188 C   0  0  0

+   -1.5968    1.3488   -0.1954 N   0  0  0

+    2.2184   -0.8782   -0.7013 O   0  0  0

+    2.4942    0.6781    0.6961 O   0  5  0

+   -3.2499   -0.5064    0.1082 C   0  0  0

+    0.2184    2.3970    0.0000 H   0  0  0

+   -1.5670   -2.1374    0.0000 H   0  0  0

+   -0.4636   -3.0398    0.0000 H   0  0  0

+    0.4388   -1.9364    0.0000 H   0  0  0

+   -3.6483    0.4194    0.0000 H   0  0  0

+   -4.1757   -0.9048    0.0000 H   0  0  0

+   -2.8515   -1.4322    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89459-43-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

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+   -2.4011    3.5963    0.0000 H   0  0  0

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+ 23 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89213-87-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+417420                          1 V2000

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+214417  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+74494-65-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 50                          1 V2000

+   -0.7353    0.0535   -0.1233 C   0  0  0

+   -2.0160   -0.4154    0.1515 C   0  0  0

+   -0.5345    1.4429   -0.1520 C   0  0  0

+    0.2332   -0.8352   -0.3730 O   0  0  0

+   -3.0777    0.4521    0.3520 C   0  0  0

+   -2.5467   -1.8260    0.3071 C   0  0  1

+   -1.6025    2.3270    0.0331 C   0  0  0

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+    1.4913   -0.4314   -0.1590 C   0  0  0

+   -4.2325   -0.2285    0.5858 O   0  0  0

+   -2.8659    1.8322    0.2887 C   0  0  0

+   -3.9294   -1.5758    0.9792 C   0  0  1

+   -2.9069   -2.3756   -1.0889 C   0  0  0

+   -1.3975    3.6664   -0.0377 O   0  0  0

+    1.8853    0.9158   -0.1726 C   0  0  0

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+   -4.4511   -2.3898   -1.1047 C   0  0  0

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+    2.2406   -3.2268   -1.1884 C   0  0  0

+    5.9757   -1.3141    0.6790 C   0  0  0

+   -1.6293   -2.2920    0.0000 H   0  0  0

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+    6.4633   -2.2203    0.0000 H   0  0  0

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+ 28 45  1  0

+ 28 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67274-52-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+    2.2562   -0.3447    0.3492 N   0  0  0

+    0.8661   -0.2299    0.2372 C   0  0  0

+    3.0590    0.3700   -0.4640 C   0  0  0

+    2.8194   -1.2072    1.3206 O   0  0  0

+    0.1102   -1.3153   -0.1852 C   0  0  0

+    0.2390    0.9682    0.5539 C   0  0  0

+    3.3834   -0.1429   -1.8434 C   0  0  0

+    3.5204    1.4259   -0.0855 O   0  0  0

+   -1.2619   -1.1989   -0.2942 C   0  0  0

+   -1.1331    1.0781    0.4428 C   0  0  0

+   -1.8826   -0.0033    0.0168 C   0  0  0

+   -3.3531    0.1179   -0.1011 N   0  3  0

+   -3.9013    1.1706    0.1725 O   0  0  0

+   -4.0150   -0.8350   -0.4718 O   0  5  0

+    3.3604   -2.0356    0.0000 H   0  0  0

+    0.5307   -2.2109    0.0000 H   0  0  0

+    0.7847    1.7935    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 18  1  0

+  7 19  1  0

+  7 20  1  0

+  9 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+118-91-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+    0.0796    0.6210    0.0027 C   0  0  0

+    0.4974   -0.7126    0.0006 C   0  0  0

+    1.0309    1.6438    0.0022 C   0  0  0

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+    1.8465   -1.0096   -0.0021 C   0  0  0

+   -0.6757   -1.9923    0.0017 Cl  0  0  0

+    2.3740    1.3320   -0.0004 C   0  0  0

+   -1.7595    2.2339    0.0015 O   0  0  0

+   -2.1852    0.0554   -0.0053 O   0  0  0

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+    0.7275    2.6361    0.0000 H   0  0  0

+    2.1588   -1.9991    0.0000 H   0  0  0

+    3.0813    2.0912    0.0000 H   0  0  0

+   -2.0670    3.2250    0.0000 H   0  0  0

+    3.7938   -0.2192    0.0000 H   0  0  0

+  1  2  2  0

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+  5 12  1  0

+  7 13  1  0

+  8 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+108-94-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.9494   -0.0001    0.1277 C   0  0  0

+   -0.2203   -1.2987    0.3928 C   0  0  0

+   -0.2206    1.2986    0.3928 C   0  0  0

+   -2.0826   -0.0003   -0.2897 O   0  0  0

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+   -1.2517   -1.6784    0.0000 H   0  0  0

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+  7 16  1  0

+  7 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61477-96-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 63 66                          1 V2000

+   -3.9145   -0.6471    1.6454 C   0  0  1

+   -4.5612   -1.4153    0.5720 N   0  0  0

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+   -3.7905    1.0488    0.9540 S   0  0  0

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+ 35 59  1  0

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+ 36 61  1  0

+ 36 62  1  0

+ 36 63  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+105467-77-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 43                          1 V2000

+   -1.1740    0.1873   -0.0014 C   0  0  0

+   -2.4658   -0.5133    0.0052 C   0  0  0

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+   -2.5285   -1.9079    0.0111 C   0  0  0

+   -0.0064    2.2768   -0.0081 N   0  0  0

+   -2.4171    2.3437   -0.0037 C   0  0  0

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+   -3.5989    1.6976    0.0010 C   0  0  0

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+  8 10  2  0

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+ 20 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 22 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2150-54-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 84 89                          1 V2000

+    6.7057   -1.7918    0.1569 O   0  0  0

+    7.4982   -0.7095   -0.0379 C   0  0  0

+    8.8982   -0.8391   -0.0074 C   0  0  0

+    6.9333    0.5447   -0.2766 C   0  0  0

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+    9.5082   -2.0887    0.2247 C   0  0  0

+    5.5792    0.6821   -0.3131 N   0  0  0

+    7.7571    1.6683   -0.4793 C   0  0  0

+    9.1082    1.5558   -0.4468 C   0  0  0

+   11.1076    0.1705   -0.1831 C   0  0  0

+    8.7475   -3.1952    0.4241 O   0  0  0

+   10.8831   -2.1775    0.2471 C   0  0  0

+    4.8548    0.1846    0.6312 N   0  0  0

+    7.0229    3.2417   -0.7790 S   0  0  0

+   11.6711   -1.0493    0.0434 C   0  0  0

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+   13.7098   -2.5170   -0.3733 O   0  0  0

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+   -6.9194   -0.5335    0.1855 C   0  0  0

+   -7.5652   -1.6418   -0.3950 C   0  0  0

+   -7.6599    0.5725    0.6069 C   0  0  0

+   -6.6118   -3.0299   -0.9136 S   0  0  0

+   -8.9110   -1.6551   -0.5608 C   0  0  0

+   -7.0395    1.6379    1.1702 O   0  0  0

+   -9.0564    0.5696    0.4403 C   0  0  0

+   -7.3176   -3.5952   -2.0097 O   0  0  0

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+   -6.6759   -4.0669    0.1986 O   0  0  0

+   -9.6872   -0.5530   -0.1513 C   0  0  0

+   -9.8404    1.6663    0.8526 C   0  0  0

+  -11.0814   -0.5525   -0.3160 C   0  0  0

+   -9.2548    2.7512    1.4207 O   0  0  0

+  -11.2061    1.6279    0.6736 C   0  0  0

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+  -13.5636    0.5087   -0.1272 S   0  0  0

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+  -11.5538   -1.4459    0.0000 H   0  0  0

+   -8.7748    3.6405    0.0000 H   0  0  0

+  -11.7323    2.4906    0.0000 H   0  0  0

+  -15.0118   -0.4931    0.0000 H   0  0  0

+  2  1  1  0

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+ 48 80  1  0

+ 51 81  1  0

+ 52 82  1  0

+ 53 83  1  0

+ 58 84  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+613-50-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.9761    0.5863   -0.0028 C   0  0  0

+   -1.3883   -0.7696   -0.0012 C   0  0  0

+    0.3939    0.8951   -0.0021 C   0  0  0

+   -1.9552    1.5971    0.0008 C   0  0  0

+   -0.4114   -1.7808    0.0006 C   0  0  0

+   -2.6909   -1.0686   -0.0010 N   0  0  0

+    1.3104   -0.1115    0.0001 C   0  0  0

+   -3.2688    1.2221    0.0057 C   0  0  0

+    0.9073   -1.4456    0.0008 C   0  0  0

+   -3.6058   -0.1294   -0.0022 C   0  0  0

+    2.7540    0.2153    0.0003 N   0  3  0

+    3.5808   -0.6791    0.0023 O   0  0  0

+    3.1151    1.3785   -0.0015 O   0  5  0

+    0.7048    1.8819    0.0000 H   0  0  0

+   -1.6876    2.5965    0.0000 H   0  0  0

+   -0.6942   -2.7760    0.0000 H   0  0  0

+   -4.0126    1.9412    0.0000 H   0  0  0

+    1.6224   -2.1933    0.0000 H   0  0  0

+   -4.6046   -0.3993    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  4  8  1  0

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+  7  9  1  0

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+  3 14  1  0

+  4 15  1  0

+  5 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2426-07-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -3.1221   -0.2961   -0.4480 C   0  0  0

+   -4.3733   -0.2948    0.4327 C   0  0  0

+   -3.8827    0.8882   -0.2012 O   0  0  0

+   -1.8748   -0.2950    0.4380 C   0  0  0

+   -0.6237   -0.2963   -0.4426 C   0  0  0

+    0.6236   -0.2953    0.4434 C   0  0  0

+    1.8748   -0.2966   -0.4372 C   0  0  0

+    3.1221   -0.2955    0.4488 C   0  0  0

+    4.3732   -0.2968   -0.4319 C   0  0  0

+    3.8829    0.8881    0.1988 O   0  0  0

+   -3.1222   -1.2345    0.0000 H   0  0  0

+   -5.2796   -0.0514    0.0000 H   0  0  0

+   -4.4966   -1.2251    0.0000 H   0  0  0

+   -1.4053    0.5175    0.0000 H   0  0  0

+   -2.3442    0.5176    0.0000 H   0  0  0

+   -1.0932   -1.1088    0.0000 H   0  0  0

+   -0.1543   -1.1089    0.0000 H   0  0  0

+    1.0931    0.5172    0.0000 H   0  0  0

+    0.1542    0.5173    0.0000 H   0  0  0

+    1.4053   -1.1091    0.0000 H   0  0  0

+    2.3442   -1.1092    0.0000 H   0  0  0

+    3.1220   -1.2339    0.0000 H   0  0  0

+    4.4949   -1.2273    0.0000 H   0  0  0

+    5.2798   -0.0545    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  4  5  1  0

+  5  6  1  0

+  6  7  1  0

+  7  8  1  0

+  8  9  1  0

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+  9 10  1  0

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+  6 19  1  0

+  7 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1330-78-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 49                          1 V2000

+    0.0819   -1.3720   -0.0994 P   0  0  0

+   -1.1972   -2.3447   -0.0002 O   0  0  0

+    0.1189   -0.4014    1.1846 O   0  0  0

+    1.4266   -2.2563   -0.1427 O   0  0  0

+   -0.0125   -0.5570   -1.3312 O   0  0  0

+   -2.2872   -1.5465    0.1472 C   0  0  0

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+    2.4700   -1.3858   -0.1219 C   0  0  0

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+    3.0802   -1.0614    1.0808 C   0  0  0

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+   -2.2752   -0.2309    0.0000 H   0  0  0

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+   -1.9912    1.0128    0.0000 H   0  0  0

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+   -4.5282   -1.2364    0.0000 H   0  0  0

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+   -4.0057    1.1505    0.0000 H   0  0  0

+   -5.3917    1.0875    0.0000 H   0  0  0

+   -5.3287   -0.2985    0.0000 H   0  0  0

+   -0.0691    4.4474    0.0000 H   0  0  0

+   -2.0732    4.4087    0.0000 H   0  0  0

+   -3.4034    4.0145    0.0000 H   0  0  0

+   -3.0092    2.6843    0.0000 H   0  0  0

+    6.3795    0.5982    0.0000 H   0  0  0

+    6.5043    1.9800    0.0000 H   0  0  0

+    5.1225    2.1048    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

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+ 16 21  1  0

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+ 24 42  1  0

+ 24 43  1  0

+ 24 44  1  0

+ 26 45  1  0

+ 26 46  1  0

+ 26 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+83-72-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.4463    0.7365   -0.0023 C   0  0  0

+   -0.8471   -0.6113   -0.0015 C   0  0  0

+    0.9954    1.0639   -0.0013 C   0  0  0

+   -1.4057    1.7427    0.0017 C   0  0  0

+    0.1809   -1.6766    0.0003 C   0  0  0

+   -2.1992   -0.9281   -0.0019 C   0  0  0

+    1.9949   -0.0304    0.0006 C   0  0  0

+    1.3585    2.2227   -0.0024 O   0  0  0

+   -2.7513    1.4104    0.0065 C   0  0  0

+    1.6029   -1.3212    0.0013 C   0  0  0

+   -0.1542   -2.8454    0.0006 O   0  0  0

+   -3.1448    0.0861   -0.0032 C   0  0  0

+    3.3148    0.2684    0.0015 O   0  0  0

+   -1.1145    2.7419    0.0000 H   0  0  0

+   -2.5019   -1.9239    0.0000 H   0  0  0

+   -3.4698    2.1633    0.0000 H   0  0  0

+    2.3202   -2.0753    0.0000 H   0  0  0

+   -4.1580   -0.1520    0.0000 H   0  0  0

+    4.3299    0.4982    0.0000 H   0  0  0

+  1  2  2  0

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+  4 14  1  0

+  6 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64808-48-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+   -3.2920    0.5991    0.3926 C   0  0  0

+   -4.5739    0.1118    0.0628 C   0  0  0

+   -2.2623   -0.2824    0.6802 N   0  0  0

+   -3.0688    1.9701    0.4211 C   0  0  0

+   -5.6053    1.0199   -0.2257 C   0  0  0

+   -4.8186   -1.2823    0.0225 C   0  0  0

+   -1.5787   -0.9088   -0.3494 C   0  0  0

+   -4.0981    2.8429    0.1279 C   0  0  0

+   -5.3636    2.3620   -0.1858 C   0  0  0

+   -4.5835   -1.9713   -1.1018 O   0  0  0

+   -5.2853   -1.9121    1.1088 O   0  0  0

+   -0.6326   -1.9148   -0.0642 C   0  0  0

+   -1.8251   -0.5539   -1.6699 C   0  0  0

+   -3.8125    4.5548    0.1659 Cl  0  0  0

+    0.0506   -2.5387   -1.1195 C   0  0  0

+   -0.3735   -2.2923    1.2769 C   0  0  0

+   -1.1432   -1.1790   -2.6933 C   0  0  0

+   -0.2070   -2.1656   -2.4179 C   0  0  0

+    0.6418   -1.7314    1.9461 O   0  0  0

+   -1.1440   -3.2101    1.8750 O   0  0  0

+   12.4584    0.3893    0.0223 Na  0  3  0

+   21.1002    0.9538   -0.0019 Na  0  3  0

+   -1.5912    0.4753    0.0000 H   0  0  0

+   -2.1191    2.3201    0.0000 H   0  0  0

+   -6.5611    0.6868    0.0000 H   0  0  0

+   -6.1423    3.0085    0.0000 H   0  0  0

+   -2.4909    0.2085    0.0000 H   0  0  0

+    0.7161   -3.3013    0.0000 H   0  0  0

+   -0.4337   -0.4572    0.0000 H   0  0  0

+    0.5789   -1.5278    0.0000 H   0  0  0

+   -5.8879   -2.7253    0.0000 H   0  0  0

+   -1.7948   -3.9853    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6 10  2  0

+  6 11  1  0

+  7 12  1  0

+  7 13  2  0

+  8 14  1  0

+ 12 15  2  0

+ 12 16  1  0

+ 13 17  1  0

+ 15 18  1  0

+ 16 19  2  0

+ 16 20  1  0

+  8  9  1  0

+ 17 18  2  0

+  3 23  1  0

+  4 24  1  0

+  5 25  1  0

+  9 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 11 31  1  0

+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+628-02-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.7328   -0.7637    0.0000 C   0  0  0

+   -0.4111    0.2524    0.0000 C   0  0  0

+    2.0519   -0.0352    0.0000 C   0  0  0

+   -1.7504   -0.4873    0.0000 C   0  0  0

+    3.2061   -0.7311    0.0000 N   0  0  0

+    2.0750    1.1774    0.0000 O   0  0  0

+   -2.8942    0.5289    0.0000 C   0  0  0

+   -4.2335   -0.2109    0.0000 C   0  0  0

+   -0.1214   -1.5299    0.0000 H   0  0  0

+    1.3976   -1.6990    0.0000 H   0  0  0

+    0.4431    1.0187    0.0000 H   0  0  0

+   -1.0759    1.1877    0.0000 H   0  0  0

+   -2.6046   -1.2535    0.0000 H   0  0  0

+   -1.0857   -1.4226    0.0000 H   0  0  0

+    3.1843   -1.8784    0.0000 H   0  0  0

+    4.2106   -0.1763    0.0000 H   0  0  0

+   -2.0400    1.2951    0.0000 H   0  0  0

+   -3.5590    1.4642    0.0000 H   0  0  0

+   -4.7883    0.7935    0.0000 H   0  0  0

+   -5.2379   -0.7657    0.0000 H   0  0  0

+   -3.6787   -1.2153    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  3  6  2  0

+  4  7  1  0

+  7  8  1  0

+  1  9  1  0

+  1 10  1  0

+  2 11  1  0

+  2 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  7 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7381-01-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 47                          1 V2000

+    0.4483   -0.5643    0.0497 C   0  0  0

+   -0.7749   -0.0769    0.7826 C   0  0  0

+    1.6555   -0.4843    0.6313 O   0  0  0

+    0.3419   -1.0318   -1.0593 O   0  0  0

+   -2.0108   -0.2806   -0.0961 C   0  0  0

+    2.8341   -0.9540   -0.0749 C   0  0  0

+   -3.2527    0.2143    0.6480 C   0  0  0

+    4.0699   -0.7503    0.8038 C   0  0  0

+   -4.4886    0.0106   -0.2306 C   0  0  0

+    5.5424   -1.3370   -0.0784 S   0  0  0

+   -5.7305    0.5055    0.5134 C   0  0  0

+    5.5536   -2.7533   -0.1942 O   0  0  0

+    5.8728   -0.4876   -1.1685 O   0  0  0

+    6.6682   -1.0704    0.9105 O   0  0  0

+   -6.9663    0.3017   -0.3652 C   0  0  0

+   -8.2083    0.7966    0.3788 C   0  0  0

+   -9.4441    0.5929   -0.4998 C   0  0  0

+  -10.6860    1.0878    0.2442 C   0  0  0

+  -11.9219    0.8841   -0.6344 C   0  0  0

+  -13.1638    1.3790    0.1096 C   0  0  0

+   14.4879    4.2764   -0.1291 Na  0  3  0

+   -0.1541    0.6282    0.0000 H   0  0  0

+   -1.2303    0.7448    0.0000 H   0  0  0

+   -2.6316   -0.9857    0.0000 H   0  0  0

+   -1.5554   -1.1023    0.0000 H   0  0  0

+    2.2133   -1.6590    0.0000 H   0  0  0

+    3.2895   -1.7757    0.0000 H   0  0  0

+   -2.6319    0.9194    0.0000 H   0  0  0

+   -3.7081    1.0360    0.0000 H   0  0  0

+    4.6907   -0.0452    0.0000 H   0  0  0

+    3.6145    0.0714    0.0000 H   0  0  0

+   -5.1094   -0.6945    0.0000 H   0  0  0

+   -4.0332   -0.8111    0.0000 H   0  0  0

+   -5.1097    1.2106    0.0000 H   0  0  0

+   -6.1860    1.3271    0.0000 H   0  0  0

+   -7.5871   -0.4034    0.0000 H   0  0  0

+   -6.5108   -0.5199    0.0000 H   0  0  0

+   -7.5875    1.5017    0.0000 H   0  0  0

+   -8.6637    1.6183    0.0000 H   0  0  0

+  -10.0649   -0.1122    0.0000 H   0  0  0

+   -8.9887   -0.2288    0.0000 H   0  0  0

+  -10.0652    1.7929    0.0000 H   0  0  0

+  -11.1414    1.9095    0.0000 H   0  0  0

+  -12.5427    0.1790    0.0000 H   0  0  0

+  -11.4665    0.0624    0.0000 H   0  0  0

+  -12.8160    2.2517    0.0000 H   0  0  0

+  -14.0365    1.7268    0.0000 H   0  0  0

+  -13.5116    0.5063    0.0000 H   0  0  0

+    7.5823   -0.8539    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  7  9  1  0

+  8 10  1  0

+  9 11  1  0

+ 10 12  2  0

+ 10 13  2  0

+ 10 14  1  0

+ 11 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 19 20  1  0

+  2 22  1  0

+  2 23  1  0

+  5 24  1  0

+  5 25  1  0

+  6 26  1  0

+  6 27  1  0

+  7 28  1  0

+  7 29  1  0

+  8 30  1  0

+  8 31  1  0

+  9 32  1  0

+  9 33  1  0

+ 11 34  1  0

+ 11 35  1  0

+ 15 36  1  0

+ 15 37  1  0

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+ 17 40  1  0

+ 17 41  1  0

+ 18 42  1  0

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+ 19 44  1  0

+ 19 45  1  0

+ 20 46  1  0

+ 20 47  1  0

+ 20 48  1  0

+ 14 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+97-18-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    1.2673    1.1748   -0.1405 C   0  0  0

+   -0.2423    2.0776   -0.2443 S   0  0  0

+    1.6847    0.3864   -1.2113 C   0  0  0

+    2.0464    1.2515    1.0055 C   0  0  0

+   -1.3967    0.7773    0.0407 C   0  0  0

+    2.8727   -0.3211   -1.1247 C   0  0  0

+    0.9276    0.3122   -2.3391 O   0  0  0

+    3.2313    0.5422    1.0846 C   0  0  0

+   -2.7617    1.0086   -0.1156 C   0  0  0

+   -0.9480   -0.4818    0.4159 C   0  0  0

+    3.6426   -0.2439    0.0231 C   0  0  0

+    3.3962   -1.3042   -2.4563 Cl  0  0  0

+    4.2047    0.6392    2.5187 Cl  0  0  0

+   -3.6654   -0.0177    0.1093 C   0  0  0

+   -3.2064    2.2393   -0.4876 O   0  0  0

+   -1.8558   -1.5009    0.6385 C   0  0  0

+   -3.2117   -1.2690    0.4882 C   0  0  0

+   -5.3671    0.2667   -0.0838 Cl  0  0  0

+   -1.2930   -3.0749    1.1070 Cl  0  0  0

+    2.2681    2.2400    0.0000 H   0  0  0

+   -0.0806    0.2134    0.0000 H   0  0  0

+    0.0463   -0.6758    0.0000 H   0  0  0

+    4.5343   -0.7246    0.0000 H   0  0  0

+   -3.5507    3.1921    0.0000 H   0  0  0

+   -3.8614   -2.0463    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

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+  8 13  1  0

+  9 14  1  0

+  9 15  1  0

+ 10 16  2  0

+ 14 17  2  0

+ 14 18  1  0

+ 16 19  1  0

+  8 11  2  0

+ 16 17  1  0

+  4 20  1  0

+  7 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 15 24  1  0

+ 17 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1163-05-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    1.1944    0.0324    0.0038 C   0  0  0

+    1.1627   -1.3844   -0.0004 C   0  0  0

+    2.4880    0.7237    0.0025 C   0  0  0

+   -0.0006    0.7491    0.0032 C   0  0  0

+   -0.0010   -2.0293    0.0010 N   0  3  0

+    2.3759   -2.1181   -0.0057 C   0  0  0

+    3.6712   -0.0483   -0.0028 C   0  0  0

+    2.5718    2.1165    0.0060 C   0  0  0

+   -1.1956    0.0332   -0.0015 C   0  0  0

+   -1.1643   -1.3840    0.0064 C   0  0  0

+   -0.0013   -3.4453   -0.0028 O   0  5  0

+    3.5753   -1.5043   -0.0073 C   0  0  0

+    4.9132    0.5969   -0.0041 C   0  0  0

+    3.8080    2.7225    0.0042 C   0  0  0

+   -2.4890    0.7248   -0.0028 C   0  0  0

+   -2.3777   -2.1173    0.0082 C   0  0  0

+    4.9697    1.9611   -0.0002 C   0  0  0

+   -3.6719   -0.0471   -0.0081 C   0  0  0

+   -2.5734    2.1177    0.0016 C   0  0  0

+   -3.5770   -1.5030    0.0136 C   0  0  0

+   -4.9136    0.6000   -0.0094 C   0  0  0

+   -3.7996    2.7212    0.0006 C   0  0  0

+   -4.9646    1.9645   -0.0055 C   0  0  0

+   -0.0003    1.7957    0.0000 H   0  0  0

+    2.3388   -3.1640    0.0000 H   0  0  0

+    1.7007    2.6967    0.0000 H   0  0  0

+    4.4497   -2.0794    0.0000 H   0  0  0

+    5.7963    0.0352    0.0000 H   0  0  0

+    3.8731    3.7671    0.0000 H   0  0  0

+   -2.3410   -3.1632    0.0000 H   0  0  0

+    5.9006    2.4394    0.0000 H   0  0  0

+   -1.7020    2.6973    0.0000 H   0  0  0

+   -4.4517   -2.0777    0.0000 H   0  0  0

+   -5.7982    0.0406    0.0000 H   0  0  0

+   -3.8617    3.7659    0.0000 H   0  0  0

+   -5.8935    2.4466    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  2  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 13 17  1  0

+ 15 18  2  0

+ 15 19  1  0

+ 16 20  2  0

+ 18 21  1  0

+ 19 22  2  0

+ 21 23  2  0

+  7 12  1  0

+  9 10  1  0

+ 14 17  2  0

+ 18 20  1  0

+ 22 23  1  0

+  4 24  1  0

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+  8 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 17 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+ 21 34  1  0

+ 22 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115609-71-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+    0.7956   -0.5545    0.0016 C   0  0  0

+   -0.6640   -0.6155    0.0011 C   0  0  0

+    1.4154    0.6978    0.0010 C   0  0  0

+    1.7720   -1.4904   -0.0027 N   0  0  0

+   -1.3960    0.5982    0.0000 C   0  0  0

+   -1.3116   -1.7795    0.0012 N   0  0  0

+    2.7775    0.4514    0.0017 N   0  0  0

+    0.6492    1.8661    0.0006 C   0  0  0

+    2.9440   -0.9019    0.0003 C   0  0  0

+   -0.7071    1.8259   -0.0010 C   0  0  0

+   -2.7325    0.5582   -0.0005 N   0  0  0

+   -2.6273   -1.7939    0.0003 C   0  0  0

+    3.8423    1.4577    0.0014 C   0  0  0

+    4.1604   -1.5531   -0.0023 N   0  0  0

+   -1.4878    3.1150   -0.0022 C   0  0  0

+   -3.3503   -0.6022    0.0001 C   0  0  0

+   -4.8567   -0.6444    0.0000 C   0  0  0

+    1.1289    2.7868    0.0000 H   0  0  0

+   -3.1316   -2.7013    0.0000 H   0  0  0

+    4.5554    0.7032    0.0000 H   0  0  0

+    4.5968    2.1708    0.0000 H   0  0  0

+    3.1292    2.2122    0.0000 H   0  0  0

+    4.1937   -2.5907    0.0000 H   0  0  0

+    5.0424   -1.0055    0.0000 H   0  0  0

+   -0.5998    3.6528    0.0000 H   0  0  0

+   -2.0256    4.0030    0.0000 H   0  0  0

+   -2.3758    2.5772    0.0000 H   0  0  0

+   -4.8858    0.3933    0.0000 H   0  0  0

+   -5.8944   -0.6735    0.0000 H   0  0  0

+   -4.8276   -1.6821    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

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+  4  9  2  0

+  5 10  1  0

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+  6 12  2  0

+  7 13  1  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  2  0

+ 16 17  1  0

+  7  9  1  0

+  8 10  2  0

+ 12 16  1  0

+  8 18  1  0

+ 12 19  1  0

+ 13 20  1  0

+ 13 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+56-57-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.0115   -0.4494   -0.0184 C   0  0  0

+   -1.3405   -0.0252   -0.0085 C   0  0  0

+    1.0311    0.5193    0.0312 C   0  0  0

+    0.3081   -1.8206   -0.0829 C   0  0  0

+   -1.6280    1.2799    0.0469 N   0  3  0

+   -2.3604   -0.9916   -0.0581 C   0  0  0

+    0.6685    1.8351    0.0871 C   0  0  0

+    2.4574    0.1232    0.0227 N   0  3  0

+   -0.7067   -2.7266   -0.1353 C   0  0  0

+   -0.6795    2.1853    0.0929 C   0  0  0

+   -2.9825    1.6925    0.0558 O   0  5  0

+   -2.0371   -2.3121   -0.1144 C   0  0  0

+    2.8418   -0.7841    0.7385 O   0  0  0

+    3.2465    0.7047   -0.7003 O   0  5  0

+    1.3014   -2.1437    0.0000 H   0  0  0

+   -3.3625   -0.6968    0.0000 H   0  0  0

+    1.4017    2.5791    0.0000 H   0  0  0

+   -0.4855   -3.7475    0.0000 H   0  0  0

+   -0.9420    3.1963    0.0000 H   0  0  0

+   -2.7982   -3.0275    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+  8 14  1  0

+  7 10  2  0

+  9 12  1  0

+  4 15  1  0

+  6 16  1  0

+  7 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+93673-37-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+    0.0903    0.2439    0.1310 C   0  0  0

+   -0.4573   -1.0637   -0.0197 C   0  0  0

+    1.5465    0.3730    0.2057 C   0  0  0

+   -0.7151    1.3869    0.2024 C   0  0  0

+   -1.8605   -1.2224   -0.0917 C   0  0  0

+    0.4008   -2.1677   -0.0945 C   0  0  0

+    2.3359   -0.7633    0.1288 C   0  0  0

+    2.1843    1.6908    0.3600 C   0  0  0

+   -2.1032    1.2415    0.1255 C   0  0  0

+   -2.6116   -0.0547   -0.0094 C   0  0  0

+   -2.8174   -2.3118   -0.2342 C   0  0  0

+    1.7521   -2.0151   -0.0215 C   0  0  0

+    3.8343   -0.6243    0.2106 C   0  0  1

+    3.4685    1.8361    0.0494 C   0  0  0

+   -3.0406    2.2915    0.1821 C   0  0  0

+   -4.0256   -0.3631   -0.0962 C   0  0  0

+   -4.0869   -1.8150   -0.2376 C   0  0  0

+    4.2725    0.6738   -0.4641 C   0  0  2

+    4.2370   -0.6081    1.5816 O   0  0  0

+   -4.3753    2.0085    0.0954 C   0  0  0

+   -4.8921    0.7198   -0.0277 C   0  0  0

+    4.0951    0.5595   -1.8774 O   0  0  0

+   -0.2828    2.3388    0.0000 H   0  0  0

+   -0.0052   -3.1312    0.0000 H   0  0  0

+    1.5799    2.5439    0.0000 H   0  0  0

+   -2.5704   -3.3277    0.0000 H   0  0  0

+    2.3625   -2.8639    0.0000 H   0  0  0

+    3.9036   -1.6675    0.0000 H   0  0  0

+    3.9010    2.7880    0.0000 H   0  0  0

+   -2.7152    3.2851    0.0000 H   0  0  0

+   -4.9627   -2.3860    0.0000 H   0  0  0

+    5.3078    0.8195    0.0000 H   0  0  0

+    5.2817   -0.5661    0.0000 H   0  0  0

+   -5.0482    2.8087    0.0000 H   0  0  0

+   -5.9264    0.5669    0.0000 H   0  0  0

+    3.2162   -0.0068    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  7 13  1  0

+  8 14  2  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  2  0

+ 13 18  1  0

+ 13 19  1  0

+ 15 20  2  0

+ 16 21  2  0

+ 18 22  1  0

+  7 12  1  0

+  9 10  1  0

+ 14 18  1  0

+ 16 17  1  0

+ 20 21  1  0

+  4 23  1  0

+  6 24  1  0

+  8 25  1  0

+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5131-58-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.4737    0.2475    0.0341 C   0  0  0

+    0.1736   -0.9723   -0.1210 C   0  0  0

+    0.2619    1.4079    0.1813 C   0  0  0

+   -1.9526    0.3046    0.0353 N   0  3  0

+    1.5605   -1.0242   -0.1279 C   0  0  0

+   -0.5707   -2.1448   -0.2693 N   0  0  0

+    1.6424    1.3597    0.1749 C   0  0  0

+   -2.5347    1.0307   -0.7504 O   0  0  0

+   -2.5876   -0.3745    0.8222 O   0  5  0

+    2.2961    0.1429    0.0202 C   0  0  0

+    3.6920    0.0951    0.0134 N   0  0  0

+   -0.2215    2.3242    0.0000 H   0  0  0

+    2.0439   -1.9404    0.0000 H   0  0  0

+   -1.6057   -2.1013    0.0000 H   0  0  0

+   -0.0909   -3.0629    0.0000 H   0  0  0

+    2.1895    2.2394    0.0000 H   0  0  0

+    4.1790   -0.8193    0.0000 H   0  0  0

+    4.2404    0.9740    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  4  9  1  0

+  5 10  2  0

+ 10 11  1  0

+  7 10  1  0

+  3 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  7 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+116-29-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 26                          1 V2000

+    0.8705    0.6227    0.5469 C   0  0  0

+   -0.5823    1.1961    1.3625 S   0  0  0

+    1.3279    1.2699   -0.5875 C   0  0  0

+    1.5559   -0.4696    1.0436 C   0  0  0

+   -1.9548    0.3524    0.6489 C   0  0  0

+   -0.4886    0.7202    2.6981 O   0  0  0

+   -0.7263    2.5578    0.9827 O   0  0  0

+    2.4686    0.8205   -1.2279 C   0  0  0

+    0.4703    2.6464   -1.2066 Cl  0  0  0

+    2.6967   -0.9203    0.4036 C   0  0  0

+   -2.3803   -0.8500    1.1826 C   0  0  0

+   -2.6092    0.8957   -0.4406 C   0  0  0

+    3.1518   -0.2764   -0.7344 C   0  0  0

+    3.5578   -2.2922    1.0280 Cl  0  0  0

+   -3.4569   -1.5119    0.6236 C   0  0  0

+   -3.6862    0.2345   -1.0006 C   0  0  0

+    4.5836   -0.8410   -1.5376 Cl  0  0  0

+   -4.1091   -0.9711   -0.4704 C   0  0  0

+   -5.4617   -1.8021   -1.1731 Cl  0  0  0

+    0.9440   -1.2060    0.0000 H   0  0  0

+    3.0814    1.5561    0.0000 H   0  0  0

+   -1.6358   -1.4519    0.0000 H   0  0  0

+   -2.5411    1.8507    0.0000 H   0  0  0

+   -3.5244   -2.4669    0.0000 H   0  0  0

+   -4.4314    0.8356    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  2  7  2  0

+  3  8  2  0

+  3  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  2  0

+  8 13  1  0

+ 10 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 13 17  1  0

+ 15 18  1  0

+ 18 19  1  0

+ 10 13  2  0

+ 16 18  2  0

+  4 20  1  0

+  8 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+ 15 24  1  0

+ 16 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7040-57-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    2.2201    0.2792   -0.1812 C   0  0  0

+    0.9920   -0.4170    0.4086 C   0  0  0

+    1.7809    1.5356   -0.9358 C   0  0  0

+    3.1760    0.6702    0.9477 C   0  0  0

+    2.9317   -0.6721   -1.1454 C   0  0  0

+    0.1038   -0.7908   -0.6466 O   0  0  0

+    1.4322   -1.6678    1.1718 C   0  0  0

+   -1.3822   -0.4029   -0.1634 P   0  0  0

+   -2.5532   -0.6549   -1.5377 C   0  0  0

+   -1.7695   -1.2611    0.9784 O   0  0  0

+   -1.4216    1.5921    0.4240 Cl  0  0  0

+    0.5744    0.4323    0.0000 H   0  0  0

+    2.6743    1.8479    0.0000 H   0  0  0

+    1.4686    2.4290    0.0000 H   0  0  0

+    0.8875    1.2233    0.0000 H   0  0  0

+    3.5343   -0.2058    0.0000 H   0  0  0

+    4.0520    1.0285    0.0000 H   0  0  0

+    2.8177    1.5462    0.0000 H   0  0  0

+    2.1738   -1.2390    0.0000 H   0  0  0

+    3.4986   -1.4300    0.0000 H   0  0  0

+    3.6896   -0.1052    0.0000 H   0  0  0

+    0.5394   -1.9820    0.0000 H   0  0  0

+    1.7464   -2.5606    0.0000 H   0  0  0

+    2.3250   -1.3536    0.0000 H   0  0  0

+   -2.7523    0.2703    0.0000 H   0  0  0

+   -3.4784   -0.8540    0.0000 H   0  0  0

+   -2.3541   -1.5801    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  6  8  1  0

+  8  9  1  0

+  8 10  2  0

+  8 11  1  0

+  2 12  1  0

+  3 13  1  0

+  3 14  1  0

+  3 15  1  0

+  4 16  1  0

+  4 17  1  0

+  4 18  1  0

+  5 19  1  0

+  5 20  1  0

+  5 21  1  0

+  7 22  1  0

+  7 23  1  0

+  7 24  1  0

+  9 25  1  0

+  9 26  1  0

+  9 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-77-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    1.2304   -0.9321    0.0001 C   0  0  0

+    0.0000   -1.8022    0.0000 C   0  0  0

+    1.7937   -0.5337    1.1988 C   0  0  0

+    1.7971   -0.5386   -1.1982 C   0  0  0

+   -1.2305   -0.9321   -0.0002 C   0  0  0

+    2.9211    0.2636    1.2025 C   0  0  0

+    2.9248    0.2589   -1.2017 C   0  0  0

+   -1.7935   -0.5339   -1.1986 C   0  0  0

+   -1.7972   -0.5383    1.1984 C   0  0  0

+    3.4897    0.6655    0.0002 C   0  0  0

+   -2.9213    0.2636   -1.2023 C   0  0  0

+   -2.9246    0.2589    1.2019 C   0  0  0

+    4.6298    1.4723    0.0003 N   0  0  0

+   -3.4897    0.6655   -0.0005 C   0  0  0

+   -4.6298    1.4723   -0.0006 N   0  0  0

+   -0.5187   -2.3833    0.0000 H   0  0  0

+    0.5187   -2.3833    0.0000 H   0  0  0

+    1.3439    0.1022    0.0000 H   0  0  0

+    2.2441   -1.1765    0.0000 H   0  0  0

+    2.4714    0.8996    0.0000 H   0  0  0

+    3.3772   -0.3752    0.0000 H   0  0  0

+   -1.3438    0.1020    0.0000 H   0  0  0

+   -2.2443   -1.1761    0.0000 H   0  0  0

+   -2.4716    0.8996    0.0000 H   0  0  0

+   -3.3769   -0.3752    0.0000 H   0  0  0

+    5.3374    1.1466    0.0000 H   0  0  0

+    4.5580    2.2479    0.0000 H   0  0  0

+   -4.5580    2.2479    0.0000 H   0  0  0

+   -5.3374    1.1466    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  5  9  1  0

+  6 10  1  0

+  8 11  1  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  2  0

+ 14 15  1  0

+  7 10  2  0

+ 12 14  1  0

+  2 16  1  0

+  2 17  1  0

+  3 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24096-53-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 23                          1 V2000

+   -0.4139    0.0007   -0.0034 C   0  0  0

+   -1.8159    0.0021   -0.0026 N   0  0  0

+    0.2822    1.1869   -0.1899 C   0  0  0

+    0.2803   -1.1862    0.1882 C   0  0  0

+   -2.5416   -0.9643   -0.5786 C   0  0  0

+   -2.5391    0.9669    0.5790 C   0  0  0

+    1.6649    1.1830   -0.1902 C   0  0  0

+    1.6626   -1.1851    0.1871 C   0  0  0

+   -4.0122   -0.6582   -0.3963 C   0  0  0

+   -2.0918   -1.9311   -1.1553 O   0  0  0

+   -4.0105    0.6646    0.3966 C   0  0  0

+   -2.0869    1.9300    1.1601 O   0  0  0

+    2.3545   -0.0019   -0.0049 C   0  0  0

+    2.5363    2.6662   -0.4240 Cl  0  0  0

+    2.5313   -2.6688    0.4271 Cl  0  0  0

+   -0.2291    2.0827    0.0000 H   0  0  0

+   -0.2325   -2.0811    0.0000 H   0  0  0

+   -5.0411   -0.5868    0.0000 H   0  0  0

+   -4.1533   -1.6799    0.0000 H   0  0  0

+   -4.1490    1.6867    0.0000 H   0  0  0

+   -5.0396    0.5959    0.0000 H   0  0  0

+    3.3859   -0.0030    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

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+  7 13  2  0

+  7 14  1  0

+  8 15  1  0

+  8 13  1  0

+  9 11  1  0

+  3 16  1  0

+  4 17  1  0

+  9 18  1  0

+  9 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1477-55-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -0.0002   -0.7212    0.0000 C   0  0  0

+   -1.1584   -0.0301   -0.3021 C   0  0  0

+    1.1585   -0.0299    0.3021 C   0  0  0

+   -1.1583    1.3525   -0.3022 C   0  0  0

+   -2.4211   -0.7836   -0.6319 C   0  0  0

+    1.1585    1.3522    0.3019 C   0  0  0

+    2.4212   -0.7834    0.6319 C   0  0  0

+   -0.0002    2.0435    0.0002 C   0  0  0

+   -3.1812   -1.0287    0.6011 N   0  0  0

+    3.1812   -1.0288   -0.6010 N   0  0  0

+   -0.0002   -1.7331    0.0000 H   0  0  0

+   -2.0383    1.8522    0.0000 H   0  0  0

+   -2.5586   -1.7862    0.0000 H   0  0  0

+   -1.5772   -1.3420    0.0000 H   0  0  0

+    2.0385    1.8519    0.0000 H   0  0  0

+    1.5772   -1.3417    0.0000 H   0  0  0

+    2.5584   -1.7860    0.0000 H   0  0  0

+   -0.0002    3.0554    0.0000 H   0  0  0

+   -3.9317   -0.3499    0.0000 H   0  0  0

+   -3.3938   -2.0181    0.0000 H   0  0  0

+    3.3934   -2.0182    0.0000 H   0  0  0

+    3.9320   -0.3503    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  7 10  1  0

+  6  8  1  0

+  1 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+40180-04-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -1.0253    0.4257    0.0621 C   0  0  0

+   -2.4801    0.6738    0.0877 C   0  0  0

+   -0.1312    1.5002    0.0130 C   0  0  0

+   -0.5369   -0.8838    0.0926 C   0  0  0

+   -3.4162   -0.4501    0.0128 C   0  0  0

+   -2.9021    1.8131    0.1710 O   0  0  0

+    1.2278    1.2627   -0.0108 C   0  0  0

+   -0.7301    3.1294   -0.0185 Cl  0  0  0

+    0.8205   -1.1116    0.0686 C   0  0  0

+   -4.8010   -0.4308   -0.0821 C   0  0  0

+   -3.0734   -2.2010    0.0121 S   0  0  0

+    1.7070   -0.0420    0.0140 C   0  0  0

+    2.3400    2.5942   -0.0723 Cl  0  0  0

+   -5.4397   -1.6434   -0.1381 C   0  0  0

+   -4.7018   -2.7850   -0.1013 C   0  0  0

+    3.0446   -0.2721   -0.0100 O   0  0  0

+    3.2204   -1.6898    0.0247 C   0  0  0

+    4.6919   -2.0142    0.0003 C   0  0  0

+    5.0977   -3.2934    0.0260 O   0  0  0

+    5.5064   -1.1228   -0.0425 O   0  0  0

+   -1.2005   -1.6878    0.0000 H   0  0  0

+    1.1840   -2.0886    0.0000 H   0  0  0

+   -5.3334    0.4654    0.0000 H   0  0  0

+   -6.4811   -1.6898    0.0000 H   0  0  0

+   -5.0360   -3.7724    0.0000 H   0  0  0

+    2.1780   -1.7001    0.0000 H   0  0  0

+    3.1127   -2.7267    0.0000 H   0  0  0

+    5.4129   -4.2870    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  7 12  2  0

+  7 13  1  0

+ 10 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+ 18 19  1  0

+ 18 20  2  0

+  9 12  1  0

+ 14 15  2  0

+  4 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 17 26  1  0

+ 17 27  1  0

+ 19 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59-33-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 56                          1 V2000

+   -4.3159    0.5471   -0.1069 N   0  0  0

+   -4.9193    1.6918    0.4006 C   0  0  0

+   -4.2934   -0.6831    0.6883 C   0  0  0

+   -3.7078    0.5690   -1.4396 C   0  0  0

+   -6.2368    1.9846    0.0623 C   0  0  0

+   -4.2370    2.4910    1.2060 N   0  0  0

+   -5.5900   -1.4274    0.4991 C   0  0  0

+   -2.4835    1.4866   -1.4264 C   0  0  0

+   -6.8249    3.1266    0.5748 C   0  0  0

+   -4.7726    3.5870    1.7097 C   0  0  0

+   -5.6941   -2.3934   -0.4850 C   0  0  0

+   -6.6716   -1.1474    1.3132 C   0  0  0

+   -1.8738    1.5086   -2.7627 N   0  0  0

+   -6.0730    3.9409    1.4117 C   0  0  0

+   -6.8812   -3.0773   -0.6603 C   0  0  0

+   -7.8613   -1.8288    1.1420 C   0  0  0

+   -0.7109    2.4024   -2.6814 C   0  0  0

+   -1.3516    0.1581   -3.0108 C   0  0  0

+   -7.9699   -2.7944    0.1522 C   0  0  0

+   -9.1390   -3.4660   -0.0183 O   0  0  0

+  -10.0534   -2.9567    0.9546 C   0  0  0

+   12.2808   -1.1254   -0.9359 C   0  0  0

+   11.5182   -0.0343   -0.7580 C   0  0  0

+   13.1821   -1.5792    0.1408 C   0  0  0

+   11.7463    0.8435    0.4060 C   0  0  0

+   14.3887   -2.0962   -0.1637 O   0  0  0

+   12.8365   -1.4867    1.3014 O   0  0  0

+   10.8992    1.8604    0.6593 O   0  0  0

+   12.6976    0.6495    1.1357 O   0  0  0

+   -3.9739   -1.5488    0.0000 H   0  0  0

+   -3.3865   -0.5125    0.0000 H   0  0  0

+   -3.9674   -0.3165    0.0000 H   0  0  0

+   -2.9495    0.0431    0.0000 H   0  0  0

+   -6.8004    1.2539    0.0000 H   0  0  0

+   -2.2239    2.3721    0.0000 H   0  0  0

+   -3.2418    2.0125    0.0000 H   0  0  0

+   -7.7393    3.2508    0.0000 H   0  0  0

+   -4.1845    4.2981    0.0000 H   0  0  0

+   -4.9211   -2.8974    0.0000 H   0  0  0

+   -6.7943   -0.2328    0.0000 H   0  0  0

+   -6.3278    4.8278    0.0000 H   0  0  0

+   -6.7577   -3.9918    0.0000 H   0  0  0

+   -8.6325   -1.3221    0.0000 H   0  0  0

+   -0.1485    1.6707    0.0000 H   0  0  0

+    0.0208    2.9648    0.0000 H   0  0  0

+   -1.2733    3.1341    0.0000 H   0  0  0

+   -2.2123   -0.1747    0.0000 H   0  0  0

+   -1.0188   -0.7026    0.0000 H   0  0  0

+   -0.4909    0.4909    0.0000 H   0  0  0

+   -9.6044   -2.1505    0.0000 H   0  0  0

+  -10.8596   -2.5077    0.0000 H   0  0  0

+  -10.5024   -3.7629    0.0000 H   0  0  0

+   11.6768   -1.8230    0.0000 H   0  0  0

+   10.6100   -0.1976    0.0000 H   0  0  0

+   15.2369   -2.4596    0.0000 H   0  0  0

+   10.3086    2.5694    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  4  8  1  0

+  5  9  2  0

+  6 10  1  0

+  7 11  1  0

+  7 12  2  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  2  0

+ 12 16  1  0

+ 13 17  1  0

+ 13 18  1  0

+ 15 19  1  0

+ 19 20  1  0

+ 20 21  1  0

+ 22 23  2  0

+ 22 24  1  0

+ 23 25  1  0

+ 24 26  1  0

+ 24 27  2  0

+ 25 28  1  0

+ 25 29  2  0

+ 10 14  2  0

+ 16 19  2  0

+  3 30  1  0

+  3 31  1  0

+  4 32  1  0

+  4 33  1  0

+  5 34  1  0

+  8 35  1  0

+  8 36  1  0

+  9 37  1  0

+ 10 38  1  0

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+ 21 51  1  0

+ 21 52  1  0

+ 22 53  1  0

+ 23 54  1  0

+ 26 55  1  0

+ 28 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+139953-76-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 37                          1 V2000

+   -2.5930   -0.5830   -0.0006 C   0  0  0

+   -4.0634   -0.5846   -0.0011 C   0  0  0

+   -2.2013    0.7550    0.0008 C   0  0  0

+   -1.6691   -1.5565    0.0036 N   0  0  0

+   -4.4624    0.7629    0.0001 C   0  0  0

+   -5.0246   -1.5958   -0.0023 C   0  0  0

+   -3.3292    1.5478    0.0012 N   0  0  0

+   -0.8183    1.0544    0.0015 C   0  0  0

+   -0.4109   -1.2910    0.0029 N   0  0  0

+   -5.8212    1.0697   -0.0004 C   0  0  0

+   -6.3524   -1.2728   -0.0024 C   0  0  0

+    0.0594    0.0269    0.0007 N   0  0  0

+   -0.4283    2.2104    0.0023 O   0  0  0

+   -6.7532    0.0559   -0.0020 C   0  0  0

+    1.4373    0.2805    0.0009 N   0  0  0

+    2.2804   -0.7090    0.0002 C   0  0  0

+    3.7287   -0.4424    0.0003 C   0  0  0

+    4.6376   -1.5052   -0.0004 C   0  0  0

+    4.1994    0.8741   -0.0046 C   0  0  0

+    5.9912   -1.2509   -0.0002 C   0  0  0

+    5.5552    1.1185   -0.0044 C   0  0  0

+    6.4542    0.0594    0.0007 C   0  0  0

+    7.7898    0.3053    0.0008 O   0  0  0

+   -4.7307   -2.5949    0.0000 H   0  0  0

+   -3.3256    2.5892    0.0000 H   0  0  0

+   -6.1316    2.0638    0.0000 H   0  0  0

+   -7.0685   -2.0289    0.0000 H   0  0  0

+   -7.7683    0.2885    0.0000 H   0  0  0

+    1.9316   -1.6902    0.0000 H   0  0  0

+    4.2915   -2.4874    0.0000 H   0  0  0

+    3.5262    1.6687    0.0000 H   0  0  0

+    6.6688   -2.0417    0.0000 H   0  0  0

+    5.9067    2.0988    0.0000 H   0  0  0

+    8.8140    0.4939    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  8 12  1  0

+  8 13  2  0

+ 10 14  2  0

+ 12 15  1  0

+ 15 16  2  0

+ 16 17  1  0

+ 17 18  1  0

+ 17 19  2  0

+ 18 20  2  0

+ 19 21  1  0

+ 20 22  1  0

+ 22 23  1  0

+  5  7  1  0

+  9 12  1  0

+ 11 14  1  0

+ 21 22  2  0

+  6 24  1  0

+  7 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 14 28  1  0

+ 16 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+ 20 32  1  0

+ 21 33  1  0

+ 23 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75411-83-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.7303   -0.5191    0.1443 N   0  0  0

+   -0.6213   -0.7128    0.6752 C   0  0  0

+    1.3939    0.5462    0.4423 N   0  0  0

+    1.3307   -1.5382   -0.7202 C   0  0  0

+   -1.6412   -0.1147   -0.2959 C   0  0  0

+    2.5176    0.7072    0.0009 O   0  0  0

+   -3.0527   -0.3170    0.2586 C   0  0  0

+   -1.3868    1.2827   -0.4528 O   0  0  0

+   -1.3158   -1.3482    0.0000 H   0  0  0

+   -0.2189   -1.5638    0.0000 H   0  0  0

+    0.5197   -2.0160    0.0000 H   0  0  0

+    1.8085   -2.3492    0.0000 H   0  0  0

+    2.1417   -1.0604    0.0000 H   0  0  0

+   -1.8227   -1.0384    0.0000 H   0  0  0

+   -3.1862    0.6148    0.0000 H   0  0  0

+   -3.9845   -0.4505    0.0000 H   0  0  0

+   -2.9192   -1.2488    0.0000 H   0  0  0

+   -1.2182    2.2088    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  5  7  1  0

+  5  8  1  0

+  2  9  1  0

+  2 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  5 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+526-73-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 21                          1 V2000

+   -0.0003   -0.7403   -0.0014 C   0  0  0

+   -1.1971   -0.0490   -0.0006 C   0  0  0

+    1.1972   -0.0492   -0.0010 C   0  0  0

+   -0.0006   -2.2473    0.0036 C   0  0  0

+   -1.1968    1.3336    0.0006 C   0  0  0

+   -2.5023   -0.8022   -0.0017 C   0  0  0

+    1.1975    1.3329    0.0003 C   0  0  0

+    2.5022   -0.8030   -0.0013 C   0  0  0

+    0.0003    2.0244    0.0015 C   0  0  0

+   -1.0376   -2.2471    0.0000 H   0  0  0

+   -0.0008   -3.2843    0.0000 H   0  0  0

+    1.0364   -2.2475    0.0000 H   0  0  0

+   -2.0947    1.8523    0.0000 H   0  0  0

+   -3.0206    0.0959    0.0000 H   0  0  0

+   -3.4004   -1.3205    0.0000 H   0  0  0

+   -1.9840   -1.7003    0.0000 H   0  0  0

+    2.0956    1.8512    0.0000 H   0  0  0

+    1.9835   -1.7009    0.0000 H   0  0  0

+    3.4001   -1.3217    0.0000 H   0  0  0

+    3.0209    0.0949    0.0000 H   0  0  0

+    0.0005    3.0614    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  5  9  2  0

+  7  9  1  0

+  4 10  1  0

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+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-97-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+   -0.0017    0.0042    1.4763 N   0  0  0

+    0.1814   -1.3534    0.9715 C   0  0  0

+    1.0820    0.8389    0.9664 C   0  0  0

+   -1.2669    0.5227    0.9645 C   0  0  0

+    0.1863   -1.3810   -0.4889 N   0  0  0

+    1.1025    0.8493   -0.4941 N   0  0  0

+   -1.2870    0.5276   -0.4961 N   0  0  0

+    1.2683   -0.5232   -0.9634 C   0  0  0

+   -1.0832   -0.8398   -0.9653 C   0  0  0

+   -0.1816    1.3549   -0.9704 C   0  0  0

+   -0.7779   -0.9751    0.0000 H   0  0  0

+   -0.6169   -2.0062    0.0000 H   0  0  0

+    1.0736    1.8701    0.0000 H   0  0  0

+    0.1549    1.2904    0.0000 H   0  0  0

+   -0.4836    1.1935    0.0000 H   0  0  0

+   -1.5066    1.5257    0.0000 H   0  0  0

+    1.7509   -1.4346    0.0000 H   0  0  0

+    2.2524   -0.2149    0.0000 H   0  0  0

+   -2.1138   -0.8030    0.0000 H   0  0  0

+   -1.3076   -1.8463    0.0000 H   0  0  0

+    0.3657    2.2289    0.0000 H   0  0  0

+   -0.9404    2.0532    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  6  8  1  0

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+  2 11  1  0

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+  3 13  1  0

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+  4 15  1  0

+  4 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3074-00-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 34                          1 V2000

+    0.0000   -0.7990   -0.0022 C   0  0  0

+   -1.2295   -0.1037   -0.0017 C   0  0  0

+    1.2295   -0.1036   -0.0016 C   0  0  0

+    0.0000   -2.2095    0.0026 C   0  0  0

+   -1.2652    1.3075   -0.0001 C   0  0  0

+   -2.4404   -0.8321   -0.0023 C   0  0  0

+    1.2651    1.3076    0.0000 C   0  0  0

+    2.4404   -0.8321   -0.0021 C   0  0  0

+   -1.2262   -2.9080    0.0079 C   0  0  0

+    1.2262   -2.9080    0.0025 C   0  0  0

+    0.0000    2.0632    0.0005 C   0  0  0

+   -2.4911    1.9653    0.0013 C   0  0  0

+   -2.4061   -2.2443   -0.0040 C   0  0  0

+   -3.6588   -0.1372   -0.0017 C   0  0  0

+    2.4911    1.9653    0.0015 C   0  0  0

+    2.4061   -2.2443   -0.0028 C   0  0  0

+    3.6588   -0.1372   -0.0013 C   0  0  0

+    0.0000    3.2809    0.0009 O   0  0  0

+   -3.6719    1.2397    0.0011 C   0  0  0

+    3.6719    1.2397    0.0015 C   0  0  0

+   -1.2233   -3.9661    0.0000 H   0  0  0

+    1.2233   -3.9661    0.0000 H   0  0  0

+   -2.5221    3.0230    0.0000 H   0  0  0

+   -3.3129   -2.7895    0.0000 H   0  0  0

+   -4.5712   -0.6730    0.0000 H   0  0  0

+    2.5221    3.0230    0.0000 H   0  0  0

+    3.3129   -2.7895    0.0000 H   0  0  0

+    4.5712   -0.6730    0.0000 H   0  0  0

+   -4.5979    1.7518    0.0000 H   0  0  0

+    4.5979    1.7518    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  2  0

+  7 15  1  0

+  8 16  1  0

+  8 17  2  0

+ 11 18  2  0

+ 12 19  2  0

+ 15 20  2  0

+  7 11  1  0

+  9 13  2  0

+ 10 16  2  0

+ 14 19  1  0

+ 17 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 19 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+109-08-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 13                          1 V2000

+   -0.9484   -0.0454    0.0020 C   0  0  0

+   -0.1714   -1.1906    0.0013 C   0  0  0

+   -0.3723    1.1436    0.0011 N   0  0  0

+   -2.4514   -0.1545   -0.0024 C   0  0  0

+    1.1463   -1.0949   -0.0004 N   0  0  0

+    0.9458    1.2393   -0.0005 C   0  0  0

+    1.7224    0.0945   -0.0013 C   0  0  0

+   -0.6035   -2.0826    0.0000 H   0  0  0

+   -2.5232    0.8341    0.0000 H   0  0  0

+   -3.4400   -0.2263    0.0000 H   0  0  0

+   -2.3796   -1.1431    0.0000 H   0  0  0

+    1.3779    2.1313    0.0000 H   0  0  0

+    2.7110    0.1663    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  5  7  1  0

+  6  7  2  0

+  2  8  1  0

+  4  9  1  0

+  4 10  1  0

+  4 11  1  0

+  6 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13552-21-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -0.0541    0.0525   -0.2578 C   0  0  0

+   -1.2989    0.7774    0.2581 C   0  0  0

+    1.1995    0.7580    0.2633 C   0  0  0

+   -0.0656   -1.3002    0.2026 O   0  0  0

+   -2.5525    0.0719   -0.2630 C   0  0  0

+    2.3946    0.0620   -0.2320 N   0  0  0

+   -0.0462    1.1313    0.0000 H   0  0  0

+   -0.6003    1.5996    0.0000 H   0  0  0

+   -1.9853    1.6098    0.0000 H   0  0  0

+    1.8981    1.5802    0.0000 H   0  0  0

+    0.5131    1.5904    0.0000 H   0  0  0

+   -0.0748   -2.3790    0.0000 H   0  0  0

+   -3.0816    1.0121    0.0000 H   0  0  0

+   -3.4927   -0.4572    0.0000 H   0  0  0

+   -2.0234   -0.8683    0.0000 H   0  0  0

+    2.3905   -1.0169    0.0000 H   0  0  0

+    3.3309    0.5979    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  2  1  0

+  6  3  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  6 16  1  0

+  6 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+125-46-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+    0.7254   -0.0597   -0.9435 C   0  0  0

+   -0.6358   -0.5058   -0.5335 C   0  0  0

+    0.7277    1.4120   -0.5459 C   0  0  0

+    1.8478   -0.6984   -0.1626 C   0  0  0

+    0.9266   -0.2254   -2.4511 C   0  0  0

+   -1.3431    0.6653   -0.2471 C   0  0  0

+   -1.2067   -1.7641   -0.4192 C   0  0  0

+   -0.5572    1.7490   -0.3746 O   0  0  0

+    1.8486    2.1051   -0.2843 C   0  0  0

+    3.2123   -0.0506   -0.3295 C   0  0  0

+    1.6733   -1.6595    0.5475 O   0  0  0

+   -2.6993    0.5935    0.1491 C   0  0  0

+   -2.5418   -1.8325   -0.0147 C   0  0  0

+   -0.4953   -2.8870   -0.6906 O   0  0  0

+    3.0851    1.4432   -0.1908 C   0  0  0

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+   -3.2697   -0.6931    0.2596 C   0  0  0

+   -3.4760    1.7990    0.4322 C   0  0  0

+   -3.2015   -3.1802    0.1256 C   0  0  0

+    4.0871    2.1002    0.0091 O   0  0  0

+    5.6271   -0.6703    0.4438 C   0  0  0

+    3.7179   -0.9191    1.8011 O   0  0  0

+   -4.5645   -0.8120    0.6448 O   0  0  0

+   -4.0935    2.5804   -0.6988 C   0  0  0

+   -3.6236    2.1707    1.5782 O   0  0  0

+    0.2883   -1.0004    0.0000 H   0  0  0

+    1.7016   -0.8637    0.0000 H   0  0  0

+    1.5649    0.5496    0.0000 H   0  0  0

+    1.8173    3.1086    0.0000 H   0  0  0

+    3.1788   -1.0540    0.0000 H   0  0  0

+    0.0420   -3.7351    0.0000 H   0  0  0

+   -4.1033   -2.7388    0.0000 H   0  0  0

+   -3.6429   -4.0820    0.0000 H   0  0  0

+   -2.2997   -3.6216    0.0000 H   0  0  0

+    5.5625   -1.6722    0.0000 H   0  0  0

+    6.6290   -0.7349    0.0000 H   0  0  0

+    5.6917    0.3316    0.0000 H   0  0  0

+   -5.5643   -0.9038    0.0000 H   0  0  0

+   -3.3058    3.2029    0.0000 H   0  0  0

+   -4.7160    3.3681    0.0000 H   0  0  0

+   -4.8812    1.9579    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

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+  4 11  2  0

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+  6  8  1  0

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+ 21 37  1  0

+ 23 38  1  0

+ 24 39  1  0

+ 24 40  1  0

+ 24 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+141-84-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+    1.5938   -0.5110   -0.0018 C   0  0  0

+    0.3481   -0.9549   -0.0015 N   0  0  0

+    1.7468    1.0033   -0.0009 C   0  0  0

+    2.5481   -1.2588    0.0019 O   0  0  0

+   -0.7261   -0.1439   -0.0003 C   0  0  0

+   -0.0224    1.4984    0.0005 S   0  0  0

+   -2.3808   -0.5834    0.0003 S   0  0  0

+    0.1751   -2.0832    0.0000 H   0  0  0

+    2.8741    0.8236    0.0000 H   0  0  0

+    1.9909    2.1184    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  5  7  2  0

+  5  6  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+396-31-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -3.2442    0.5632   -0.0012 F   0  0  0

+   -1.9529    0.1660   -0.0013 C   0  0  0

+   -0.9501    1.0959    0.0005 C   0  0  0

+   -1.6398   -1.1941    0.0024 C   0  0  0

+    0.3805    0.6373    0.0002 C   0  0  0

+   -0.3987   -1.6154    0.0023 N   0  0  0

+    0.6269   -0.7580   -0.0020 C   0  0  0

+    1.4620    1.5332    0.0016 C   0  0  0

+    1.9559   -1.2170   -0.0023 C   0  0  0

+    2.7351    1.0510    0.0007 C   0  0  0

+    2.9799   -0.3210   -0.0006 C   0  0  0

+   -1.1638    2.1091    0.0000 H   0  0  0

+   -2.4080   -1.8884    0.0000 H   0  0  0

+    1.2920    2.5546    0.0000 H   0  0  0

+    2.1547   -2.2332    0.0000 H   0  0  0

+    3.5320    1.7122    0.0000 H   0  0  0

+    3.9569   -0.6641    0.0000 H   0  0  0

+  2  1  1  0

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+  4 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+520-36-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -1.9843    0.5708   -0.0024 C   0  0  0

+   -1.3917   -0.7035   -0.0026 C   0  0  0

+   -1.1070    1.7537   -0.0022 C   0  0  0

+   -3.3789    0.6999    0.0036 C   0  0  0

+   -0.0466   -0.8173   -0.0024 O   0  0  0

+   -2.1992   -1.8304   -0.0027 C   0  0  0

+    0.2899    1.5284   -0.0023 C   0  0  0

+   -1.5670    2.8842   -0.0024 O   0  0  0

+   -4.1677   -0.4356    0.0092 C   0  0  0

+   -3.9517    1.9302    0.0042 O   0  0  0

+    0.7635    0.2533   -0.0018 C   0  0  0

+   -3.5787   -1.6954   -0.0025 C   0  0  0

+    2.2228    0.0386   -0.0014 C   0  0  0

+   -4.3625   -2.8038   -0.0025 O   0  0  0

+    3.0922    1.1328   -0.0007 C   0  0  0

+    2.7403   -1.2601    0.0041 C   0  0  0

+    4.4543    0.9277    0.0001 C   0  0  0

+    4.1033   -1.4560    0.0049 C   0  0  0

+    4.9643   -0.3648    0.0002 C   0  0  0

+    6.3075   -0.5624    0.0006 O   0  0  0

+   -1.7698   -2.7773    0.0000 H   0  0  0

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+   -5.2036   -0.3474    0.0000 H   0  0  0

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+    4.4889   -2.4215    0.0000 H   0  0  0

+    7.3361   -0.7137    0.0000 H   0  0  0

+  1  2  2  0

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+ 18 29  1  0

+ 20 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25212-88-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 89 88                          1 V2000

+    1.1472    1.1072   -0.6441 C   0  0  0

+   -0.2358    1.1491   -1.2971 C   0  0  0

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+   -2.6680    0.8008   -0.8439 C   0  0  0

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+ 41 87  1  0

+ 41 88  1  0

+ 41 89  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+113698-23-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 40                          1 V2000

+   -0.9905    0.4976    0.0034 C   0  0  0

+   -1.7075   -0.7194    0.0023 C   0  0  0

+    0.4080    0.4292    0.0019 C   0  0  0

+   -1.8896    1.5322    0.0003 N   0  0  0

+   -3.1336   -0.3576    0.0041 C   0  0  0

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+    2.6900    1.5598    0.0004 C   0  0  0

+    0.6926    2.7475    0.0040 O   0  0  0

+   -4.4240    1.6800   -0.0067 C   0  0  0

+   -5.5297   -0.4524    0.0060 C   0  0  0

+    3.3035    0.3540   -0.0009 C   0  0  0

+    3.0693   -1.9755   -0.0034 O   0  0  0

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+    5.4720   -1.4915    0.0000 H   0  0  0

+    6.9100   -0.7728    0.0000 H   0  0  0

+  1  2  2  0

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+ 20 32  1  0

+ 22 33  1  0

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+ 23 35  1  0

+ 23 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+79-46-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.7889   -0.0008   -0.5001 C   0  0  0

+   -0.5938    0.0000   -0.0158 N   0  3  0

+    1.5086    1.2493    0.0100 C   0  0  0

+    1.5087   -1.2491    0.0141 C   0  0  0

+   -1.5172   -0.0014   -0.8100 O   0  0  0

+   -0.8198    0.0019    1.1811 O   0  5  0

+    1.8259   -0.0004    0.0000 H   0  0  0

+    2.4073    0.7319    0.0000 H   0  0  0

+    2.0260    2.1480    0.0000 H   0  0  0

+    0.6099    1.7667    0.0000 H   0  0  0

+    0.6103   -1.7671    0.0000 H   0  0  0

+    2.0267   -2.1475    0.0000 H   0  0  0

+    2.4071   -0.7311    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  1  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+149-91-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.0322   -0.0279    0.0037 C   0  0  0

+   -0.3127   -1.2259    0.0029 C   0  0  0

+   -0.3516    1.1930    0.0026 C   0  0  0

+   -2.5068   -0.0518   -0.0004 C   0  0  0

+    1.0693   -1.2006    0.0010 C   0  0  0

+    1.0301    1.2124    0.0006 C   0  0  0

+   -3.1993    1.1041    0.0004 O   0  0  0

+   -3.0972   -1.1137   -0.0045 O   0  0  0

+    1.7446    0.0169   -0.0006 C   0  0  0

+    1.7701   -2.3662    0.0002 O   0  0  0

+    1.6929    2.4000   -0.0009 O   0  0  0

+    3.1032    0.0389   -0.0025 O   0  0  0

+   -0.8149   -2.1326    0.0000 H   0  0  0

+   -0.8829    2.0830    0.0000 H   0  0  0

+   -3.7320    1.9933    0.0000 H   0  0  0

+    2.3042   -3.2545    0.0000 H   0  0  0

+    2.1980    3.3051    0.0000 H   0  0  0

+    4.1396    0.0557    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  6 11  1  0

+  9 12  1  0

+  6  9  1  0

+  2 13  1  0

+  3 14  1  0

+  7 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+335-76-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 31                          1 V2000

+    0.3484   -0.4013    0.0546 C   0  0  0

+   -0.9224    0.4419   -0.0669 C   0  0  0

+    1.5753    0.5037   -0.0751 C   0  0  0

+    0.3683   -1.0381    1.3001 F   0  0  0

+    0.3689   -1.3630   -0.9612 F   0  0  0

+   -2.1493   -0.4631    0.0628 C   0  0  0

+   -0.9429    1.4036    0.9489 F   0  0  0

+   -0.9423    1.0787   -1.3124 F   0  0  0

+    2.8461   -0.3395    0.0464 C   0  0  0

+    1.5554    1.1405   -1.3206 F   0  0  0

+    1.5548    1.4654    0.9407 F   0  0  0

+   -3.4201    0.3801   -0.0587 C   0  0  0

+   -2.1288   -1.4248   -0.9530 F   0  0  0

+   -2.1294   -1.0999    1.3083 F   0  0  0

+    4.0730    0.5655   -0.0834 C   0  0  0

+    2.8660   -0.9763    1.2919 F   0  0  0

+    2.8666   -1.3012   -0.9695 F   0  0  0

+   -4.6470   -0.5248    0.0710 C   0  0  0

+   -3.4406    1.3419    0.9571 F   0  0  0

+   -3.4400    1.0169   -1.3042 F   0  0  0

+    5.3438   -0.2778    0.0381 C   0  0  0

+    4.0531    1.2022   -1.3289 F   0  0  0

+    4.0525    1.5272    0.9325 F   0  0  0

+   -5.8987    0.3057   -0.0486 C   0  0  0

+   -4.6265   -1.4865   -0.9448 F   0  0  0

+   -4.6271   -1.1616    1.3165 F   0  0  0

+    6.4656    0.5497   -0.0805 F   0  0  0

+    5.3637   -0.9145    1.2837 F   0  0  0

+    5.3643   -1.2395   -0.9777 F   0  0  0

+   -6.1328    1.2967    0.8260 O   0  0  0

+   -6.6916    0.0796   -0.9318 O   0  0  0

+   -6.2987    1.9988    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

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+  6 13  1  0

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+ 21 27  1  0

+ 21 28  1  0

+ 21 29  1  0

+ 24 30  1  0

+ 24 31  2  0

+ 30 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+112022-05-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+   -1.1393   -0.6390   -0.0258 C   0  0  0

+   -2.1553   -1.6908    0.0807 C   0  0  0

+    0.2711   -1.0387   -0.0799 C   0  0  0

+   -1.5121    0.6966   -0.0791 C   0  0  0

+   -3.5069   -1.3541    0.1345 C   0  0  0

+   -1.7369   -3.0375    0.1265 C   0  0  0

+    0.5786   -2.3886   -0.0282 C   0  0  0

+    1.3370   -0.0269   -0.1875 C   0  0  0

+   -2.8654    1.0358   -0.0306 C   0  0  0

+   -3.8836   -0.0125    0.0864 C   0  0  0

+   -0.4173   -3.3524    0.0728 C   0  0  0

+    2.6298   -0.3986   -0.1041 N   0  0  0

+    1.0501    1.1435   -0.3517 O   0  0  0

+   -3.2813    2.3826   -0.0829 C   0  0  0

+   -5.2426    0.3651    0.1390 C   0  0  0

+    3.6895    0.6073   -0.2110 C   0  0  0

+   -4.6060    2.6771   -0.0339 C   0  0  0

+   -5.5745    1.6806    0.0902 C   0  0  0

+    5.0537   -0.0737   -0.0843 C   0  0  0

+    6.1164    0.9349   -0.1915 N   0  0  0

+    5.9969    1.8010    0.9889 C   0  0  0

+    7.3925    0.2189   -0.0624 C   0  0  0

+   -0.7826    1.4458    0.0000 H   0  0  0

+   -4.2353   -2.1044    0.0000 H   0  0  0

+   -2.4512   -3.8013    0.0000 H   0  0  0

+    1.5810   -2.6865    0.0000 H   0  0  0

+   -0.1410   -4.3610    0.0000 H   0  0  0

+    2.8781   -1.4144    0.0000 H   0  0  0

+   -2.5723    3.1513    0.0000 H   0  0  0

+   -5.9908   -0.3655    0.0000 H   0  0  0

+    4.2618    1.4825    0.0000 H   0  0  0

+    2.8865    1.2772    0.0000 H   0  0  0

+   -4.9055    3.6790    0.0000 H   0  0  0

+   -6.5846    1.9515    0.0000 H   0  0  0

+    4.4813   -0.9489    0.0000 H   0  0  0

+    5.8567   -0.7437    0.0000 H   0  0  0

+    7.0328    1.9439    0.0000 H   0  0  0

+    5.8540    2.8369    0.0000 H   0  0  0

+    4.9610    1.6581    0.0000 H   0  0  0

+    6.8808   -0.6931    0.0000 H   0  0  0

+    8.3045   -0.2928    0.0000 H   0  0  0

+    7.9042    1.1309    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  2  5  2  0

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+  7 11  1  0

+  9 10  2  0

+ 17 18  1  0

+  4 23  1  0

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+ 21 37  1  0

+ 21 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+ 22 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2177-18-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.4870   -0.0544   -0.0011 C   0  0  0

+   -0.7335    0.5181    0.0006 O   0  0  0

+    1.6925    0.7856    0.0009 C   0  0  0

+    0.5902   -1.2655    0.0008 O   0  0  0

+   -1.8467   -0.2576   -0.0012 C   0  0  0

+    2.8975    0.2204   -0.0008 C   0  0  0

+   -3.0392    0.3017    0.0004 C   0  0  0

+    1.6072    1.7866    0.0000 H   0  0  0

+   -1.7614   -1.2586    0.0000 H   0  0  0

+    2.9828   -0.7806    0.0000 H   0  0  0

+    3.7218    0.7948    0.0000 H   0  0  0

+   -3.1245    1.3027    0.0000 H   0  0  0

+   -3.8634   -0.2727    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  5  7  2  0

+  3  8  1  0

+  5  9  1  0

+  6 10  1  0

+  6 11  1  0

+  7 12  1  0

+  7 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+31647-36-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 39                          1 V2000

+   -0.2917   -0.0121   -0.0021 C   0  0  0

+   -1.6653    0.2893   -0.0017 C   0  0  0

+    0.6529    1.0297    0.0004 C   0  0  0

+    0.1447   -1.4091    0.0011 C   0  0  0

+   -2.6199   -0.7520   -0.0032 C   0  0  0

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+   -2.1817   -2.1454   -0.0047 C   0  0  0

+   -3.9769   -0.4224   -0.0027 C   0  0  0

+   -1.1079    2.6661    0.0022 C   0  0  0

+   -3.4502    1.9291    0.0012 C   0  0  0

+    2.4590   -0.6826   -0.0030 C   0  0  0

+    3.0561    1.6779    0.0017 C   0  0  0

+   -0.4476   -3.9111    0.0073 C   0  0  0

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+   -1.4145    3.6752    0.0000 H   0  0  0

+   -3.7778    2.9317    0.0000 H   0  0  0

+    2.7777    2.6952    0.0000 H   0  0  0

+   -1.4602   -4.2062    0.0000 H   0  0  0

+   -0.1525   -4.9237    0.0000 H   0  0  0

+    0.5650   -3.6160    0.0000 H   0  0  0

+   -5.4010    1.1344    0.0000 H   0  0  0

+    4.1385   -2.0117    0.0000 H   0  0  0

+    5.1116    2.0847    0.0000 H   0  0  0

+    5.7849   -0.2536    0.0000 H   0  0  0

+  1  2  1  0

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+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+41069-00-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -2.2059   -0.8046    0.7012 C   0  0  1

+   -1.5211   -1.2756   -0.5834 C   0  0  2

+   -3.1783    0.2998    0.3761 C   0  0  0

+   -2.5960   -1.9985    0.0198 O   0  0  0

+   -0.2132   -1.9411   -0.2405 C   0  0  0

+   -4.4897   -0.0041    0.0628 C   0  0  0

+   -2.7600    1.6175    0.3969 C   0  0  0

+    1.0213   -1.1434   -0.1670 C   0  0  0

+   -0.1781   -3.1339   -0.0251 O   0  0  0

+   -5.3818    1.0092   -0.2354 C   0  0  0

+   -3.6519    2.6304    0.0988 C   0  0  0

+    2.2372   -1.7575    0.1510 C   0  0  0

+    0.9859    0.2313   -0.4203 C   0  0  0

+   -4.9622    2.3260   -0.2203 C   0  0  0

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+    3.3452    0.3579   -0.0295 C   0  0  0

+    4.5869    1.1600    0.0440 N   0  3  0

+    4.5517    2.3580   -0.1727 O   0  0  0

+    5.6439    0.6221    0.3212 O   0  5  0

+   -1.5309   -0.0438    0.0000 H   0  0  0

+   -1.0012   -0.4015    0.0000 H   0  0  0

+   -4.8005   -0.9725    0.0000 H   0  0  0

+   -1.7647    1.8268    0.0000 H   0  0  0

+   -6.3772    0.8005    0.0000 H   0  0  0

+   -3.3414    3.5989    0.0000 H   0  0  0

+    2.2940   -2.7730    0.0000 H   0  0  0

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+   -5.6520    3.0734    0.0000 H   0  0  0

+    4.2918   -1.4727    0.0000 H   0  0  0

+    2.0992    1.9877    0.0000 H   0  0  0

+  1  2  1  0

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+ 11 26  1  0

+ 12 27  1  0

+ 13 28  1  0

+ 14 29  1  0

+ 15 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13674-84-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 34                          1 V2000

+    0.1033   -0.3752    0.4053 P   0  0  0

+   -0.9802   -0.8498    1.4976 O   0  0  0

+    0.5606    1.1352    0.7242 O   0  0  0

+    1.3852   -1.3476    0.4633 O   0  0  0

+   -0.4994   -0.4335   -0.9451 O   0  0  0

+   -2.1829   -0.1269    1.2275 C   0  0  0

+    0.5710    1.8353   -0.5215 C   0  0  0

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+   -2.6621   -1.8674   -0.8150 Cl  0  0  0

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+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 13 32  1  0

+ 14 33  1  0

+ 14 34  1  0

+ 14 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+465-29-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    1.3429   -2.1205   -0.0247 C   0  0  0

+    0.6233   -0.8016    0.2644 C   0  0  0

+    1.0398    0.4282   -0.6177 C   0  0  0

+   -0.8966   -0.7989    0.0473 C   0  0  0

+    0.8188   -0.2122    1.6948 C   0  0  0

+    2.4951    0.8386   -0.3837 C   0  0  0

+    0.7463    0.1987   -2.1016 C   0  0  0

+    0.0291    1.4343    0.0380 C   0  0  0

+   -1.6299   -1.7577    0.0026 O   0  0  0

+   -1.2799    0.6440   -0.0977 C   0  0  0

+    0.4323    1.2782    1.5539 C   0  0  0

+   -2.3869    1.0906   -0.2826 O   0  0  0

+    0.4040   -2.6328    0.0000 H   0  0  0

+    1.8552   -3.0594    0.0000 H   0  0  0

+    2.2818   -1.6082    0.0000 H   0  0  0

+    1.6686   -0.8616    0.0000 H   0  0  0

+    1.7099    0.3793    0.0000 H   0  0  0

+    2.7854   -0.1908    0.0000 H   0  0  0

+    3.5245    1.1289    0.0000 H   0  0  0

+    2.2048    1.8680    0.0000 H   0  0  0

+    0.0875    1.0413    0.0000 H   0  0  0

+   -0.0963   -0.4601    0.0000 H   0  0  0

+    1.4051   -0.6439    0.0000 H   0  0  0

+   -0.0637    2.4998    0.0000 H   0  0  0

+    1.5007    1.3274    0.0000 H   0  0  0

+    0.6045    2.3338    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  1  0

+  4  2  1  0

+  5  2  1  0

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+  7  3  1  0

+  8  3  1  0

+  9  4  2  0

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+ 11  5  1  0

+ 12 10  2  0

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+  1 13  1  0

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+  6 18  1  0

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+  6 20  1  0

+  7 21  1  0

+  7 22  1  0

+  7 23  1  0

+  8 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24554-26-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.8693   -0.3980   -0.0013 C   0  0  0

+   -0.4723   -0.0129   -0.0016 C   0  0  0

+    1.9365    0.4305   -0.0014 O   0  0  0

+    1.3586   -1.7317    0.0052 C   0  0  0

+   -1.4522   -0.8959   -0.0016 N   0  0  0

+   -0.8805    1.4158    0.0043 C   0  0  0

+    3.0617   -0.2930   -0.0011 C   0  0  0

+    2.7349   -1.6433    0.0029 C   0  0  0

+   -2.7151   -0.5126   -0.0014 C   0  0  0

+   -2.6111    1.2684    0.0017 S   0  0  0

+    4.4364    0.2575   -0.0010 N   0  3  0

+   -3.8380   -1.2955   -0.0013 N   0  0  0

+    5.3939   -0.4953   -0.0007 O   0  0  0

+    4.6377    1.6591   -0.0013 O   0  5  0

+   -5.0583   -0.7234   -0.0011 C   0  0  0

+   -5.1616    0.4845   -0.0010 O   0  0  0

+    0.7939   -2.5983    0.0000 H   0  0  0

+   -0.2933    2.2673    0.0000 H   0  0  0

+    3.4003   -2.4353    0.0000 H   0  0  0

+   -3.7499   -2.3261    0.0000 H   0  0  0

+   -5.9068   -1.3150    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

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+  3  7  1  0

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+  7  8  2  0

+  9 10  1  0

+  4 17  1  0

+  6 18  1  0

+  8 19  1  0

+ 12 20  1  0

+ 15 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+484-17-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+    0.9316   -0.5307   -0.0014 C   0  0  0

+   -0.5178   -0.7520   -0.0007 C   0  0  0

+    1.4276    0.7920   -0.0009 C   0  0  0

+    1.8256   -1.6044    0.0034 C   0  0  0

+   -1.3773    0.3687    0.0003 C   0  0  0

+   -1.0610   -2.0384   -0.0016 C   0  0  0

+    0.5384    1.8902    0.0006 C   0  0  0

+    2.8159    1.0006   -0.0015 C   0  0  0

+    3.1704   -1.3678    0.0032 C   0  0  0

+   -0.8045    1.7134    0.0002 C   0  0  0

+   -2.7632    0.1710    0.0009 C   0  0  0

+   -2.4173   -2.1997   -0.0014 C   0  0  0

+    3.6627   -0.0680   -0.0025 C   0  0  0

+   -1.6259    2.7949    0.0008 O   0  0  0

+   -3.2649   -1.0983    0.0005 C   0  0  0

+    1.4653   -2.5878    0.0000 H   0  0  0

+   -0.4315   -2.8754    0.0000 H   0  0  0

+    0.9265    2.8629    0.0000 H   0  0  0

+    3.2002    1.9748    0.0000 H   0  0  0

+    3.8382   -2.1746    0.0000 H   0  0  0

+   -3.4119    0.9932    0.0000 H   0  0  0

+   -2.8235   -3.1650    0.0000 H   0  0  0

+    4.6976    0.0927    0.0000 H   0  0  0

+   -2.2593    3.6289    0.0000 H   0  0  0

+   -4.3020   -1.2442    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  9 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+540-49-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+    0.4617   -0.4663   -0.0049 C   0  0  0

+   -0.4617    0.4663    0.0049 C   0  0  0

+    2.2907    0.0141    0.0001 Br  0  0  0

+   -2.2907   -0.0141   -0.0001 Br  0  0  0

+    0.0878   -1.8344    0.0000 H   0  0  0

+   -0.0878    1.8344    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  2  6  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+115767-74-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 72 74                          1 V2000

+    0.5491    0.3765    0.2269 C   0  0  0

+    0.4187    1.6825    0.5680 C   0  0  0

+    1.8954   -0.2142    0.0625 C   0  0  0

+   -0.6550   -0.4590    0.0251 C   0  0  0

+   -0.8773    2.3584    0.4078 C   0  0  0

+    1.6021    2.4411    1.1113 C   0  0  0

+    2.4758   -0.9346    1.1076 C   0  0  0

+    2.5863   -0.0575   -1.1405 C   0  0  0

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+    3.8402   -0.6097   -1.2900 C   0  0  0

+   -2.1851   -1.5775   -1.4498 C   0  0  0

+   -2.5044   -1.6926    0.9337 C   0  0  0

+   -2.8914    3.2532    1.3664 C   0  0  0

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+   -3.3190    3.6317    0.1059 C   0  0  0

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+   -4.0159   -2.7911   -0.5381 O   0  0  0

+   -4.6472    4.3244   -0.0584 C   0  0  0

+    6.7153   -0.6966   -0.0794 P   0  0  0

+   -4.5354   -3.0871    0.7598 C   0  0  0

+   -4.4292    5.7038   -0.6835 C   0  0  0

+   -5.5490    3.4887   -0.9689 C   0  0  0

+    6.7612   -0.4297    1.5077 O   0  0  0

+    8.1745   -1.1454   -0.5906 O   0  0  0

+    6.3082    0.5438   -0.7766 O   0  0  0

+   -5.7889   -3.9535    0.6219 C   0  0  0

+   -6.8586   -3.1700   -0.0105 N   0  0  0

+   -7.2703   -3.9096   -1.2110 C   0  0  0

+   -8.0012   -3.1936    0.9125 C   0  0  0

+    1.7689    1.4736    0.0000 H   0  0  0

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+   -8.1281   -3.4321    0.0000 H   0  0  0

+   -7.7478   -4.7674    0.0000 H   0  0  0

+   -6.4125   -4.3871    0.0000 H   0  0  0

+   -8.0215   -2.2121    0.0000 H   0  0  0

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+ 35 69  1  0

+ 36 70  1  0

+ 36 71  1  0

+ 36 72  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57609-64-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+    4.8621    0.1942   -0.0009 C   0  0  0

+    3.6588    1.0451   -0.0008 C   0  0  0

+    6.1331    0.7778   -0.0012 C   0  0  0

+    4.7356   -1.1986    0.0052 C   0  0  0

+    2.4348    0.4813   -0.0004 O   0  0  0

+    3.7703    2.2552   -0.0010 O   0  0  0

+    7.2531   -0.0223   -0.0014 C   0  0  0

+    5.8510   -1.9867    0.0051 C   0  0  0

+    1.2492    1.3196   -0.0003 C   0  0  0

+    7.1175   -1.4081   -0.0012 C   0  0  0

+    0.0000    0.4362    0.0001 C   0  0  0

+    8.2489   -2.2156   -0.0018 N   0  0  0

+   -1.2492    1.3196    0.0002 C   0  0  0

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+   -3.6588    1.0451    0.0008 C   0  0  0

+   -4.8621    0.1942    0.0012 C   0  0  0

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+   -7.2531   -0.0223    0.0012 C   0  0  0

+   -5.8510   -1.9867   -0.0045 C   0  0  0

+   -7.1175   -1.4081    0.0010 C   0  0  0

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+    0.6955   -0.3428    0.0000 H   0  0  0

+    8.1485   -3.2551    0.0000 H   0  0  0

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+   -0.5537    2.0986    0.0000 H   0  0  0

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+   -8.1485   -3.2551    0.0000 H   0  0  0

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+ 18 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 21 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119525-97-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 57                          1 V2000

+   -2.8253    0.1484    0.0560 C   0  0  1

+   -2.5386   -1.2418   -0.5878 C   0  0  1

+   -1.5740    0.9411    0.4037 C   0  0  1

+   -3.1808   -0.1262   -1.4018 C   0  0  0

+   -3.8255   -0.1243    1.1432 C   0  0  0

+   -1.0948   -1.6145   -0.8217 C   0  0  0

+   -3.4079   -2.2031    0.2233 C   0  0  2

+   -0.6016    0.7659   -0.7879 C   0  0  2

+   -1.7400    2.4643    0.4407 C   0  0  0

+   -4.1218   -1.4215    1.2121 O   0  0  0

+   -4.2997    0.7230    1.8623 O   0  0  0

+   -0.1617   -0.6443   -0.8981 C   0  0  0

+   -0.7106   -3.0185   -0.9641 C   0  0  0

+   -2.5741   -3.1583    0.8826 O   0  0  0

+    0.4483    1.8419   -0.5608 C   0  0  1

+   -1.3138    1.0876   -1.9843 O   0  0  0

+   -0.2947    2.9776    0.1897 C   0  0  0

+    0.4371   -3.3095   -1.2294 O   0  0  0

+    1.5061    1.3154    0.2831 O   0  0  0

+   -0.3285    4.2417   -0.6716 C   0  0  0

+    0.3981    3.2689    1.5224 C   0  0  0

+    2.7011    0.9975   -0.2536 C   0  0  0

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+    2.8931    1.1515   -1.4438 O   0  0  0

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+    6.0494   -0.3957    0.9464 C   0  0  0

+    6.4499   -1.7876    0.4534 C   0  0  0

+    7.5646   -2.3424    1.3426 C   0  0  0

+   -1.3919    0.0103    0.0000 H   0  0  0

+   -3.7261    0.6498    0.0000 H   0  0  0

+   -3.9806   -0.6360    0.0000 H   0  0  0

+   -4.1153   -2.8348    0.0000 H   0  0  0

+   -1.9872    3.3799    0.0000 H   0  0  0

+   -2.6720    2.2888    0.0000 H   0  0  0

+    0.7614   -0.8621    0.0000 H   0  0  0

+   -1.3749   -3.6954    0.0000 H   0  0  0

+   -1.9504   -3.8728    0.0000 H   0  0  0

+    1.0784    2.5508    0.0000 H   0  0  0

+   -2.1781    1.4780    0.0000 H   0  0  0

+    0.6196    4.2671    0.0000 H   0  0  0

+   -0.3539    5.1898    0.0000 H   0  0  0

+   -1.2766    4.2164    0.0000 H   0  0  0

+    0.7657    2.3946    0.0000 H   0  0  0

+    1.2724    3.6365    0.0000 H   0  0  0

+    0.0305    4.1432    0.0000 H   0  0  0

+    3.4368   -0.4227    0.0000 H   0  0  0

+    5.2864    1.0380    0.0000 H   0  0  0

+    6.9973   -0.3646    0.0000 H   0  0  0

+    6.2512    0.5310    0.0000 H   0  0  0

+    5.5020   -1.8187    0.0000 H   0  0  0

+    6.2480   -2.7143    0.0000 H   0  0  0

+    7.1420   -3.1915    0.0000 H   0  0  0

+    8.4137   -2.7650    0.0000 H   0  0  0

+    7.9872   -1.4933    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  5 10  1  0

+  5 11  2  0

+  6 12  2  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 13 18  2  0

+ 15 19  1  0

+ 17 20  1  0

+ 17 21  1  0

+ 19 22  1  0

+ 22 23  1  0

+ 22 24  2  0

+ 23 25  2  0

+ 25 26  1  0

+ 26 27  1  0

+ 27 28  1  0

+  2  4  1  0

+  7 10  1  0

+  8 12  1  0

+ 15 17  1  0

+  3 29  1  0

+  4 30  1  0

+  4 31  1  0

+  7 32  1  0

+  9 33  1  0

+  9 34  1  0

+ 12 35  1  0

+ 13 36  1  0

+ 14 37  1  0

+ 15 38  1  0

+ 16 39  1  0

+ 20 40  1  0

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+ 21 43  1  0

+ 21 44  1  0

+ 21 45  1  0

+ 23 46  1  0

+ 25 47  1  0

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+ 26 49  1  0

+ 27 50  1  0

+ 27 51  1  0

+ 28 52  1  0

+ 28 53  1  0

+ 28 54  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97-54-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 24                          1 V2000

+    1.3729   -0.3768   -0.0029 C   0  0  0

+    0.0935   -0.9015   -0.0034 C   0  0  0

+    1.5594    1.0034   -0.0003 C   0  0  0

+    2.4490   -1.2085    0.0006 O   0  0  0

+   -1.0086   -0.0452   -0.0012 C   0  0  0

+    0.4640    1.8541    0.0014 C   0  0  0

+    2.8179    1.5179    0.0001 O   0  0  0

+    1.9392   -2.5434    0.0032 C   0  0  0

+   -0.8148    1.3369    0.0014 C   0  0  0

+   -2.3779   -0.6009   -0.0011 C   0  0  0

+   -3.4240    0.2139    0.0009 C   0  0  0

+   -4.8204   -0.3527    0.0010 C   0  0  0

+   -0.0475   -1.9343    0.0000 H   0  0  0

+    0.6074    2.8866    0.0000 H   0  0  0

+    3.7828    1.9124    0.0000 H   0  0  0

+    0.9654   -2.1715    0.0000 H   0  0  0

+    1.5673   -3.5172    0.0000 H   0  0  0

+    2.9130   -2.9153    0.0000 H   0  0  0

+   -1.6364    1.9784    0.0000 H   0  0  0

+   -2.5214   -1.6334    0.0000 H   0  0  0

+   -3.2805    1.2464    0.0000 H   0  0  0

+   -5.2123    0.6132    0.0000 H   0  0  0

+   -5.7863   -0.7446    0.0000 H   0  0  0

+   -4.4285   -1.3186    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  1  0

+ 10 11  2  0

+ 11 12  1  0

+  6  9  2  0

+  2 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2752-54-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+    0.7981    0.7211   -0.3141 O   0  0  0

+   -0.1509   -0.2183    0.1950 C   0  0  0

+    2.0311    0.1930   -0.0929 C   0  0  0

+   -1.5457    0.3101   -0.0203 C   0  0  0

+    3.1660    0.8889   -0.4860 C   0  0  0

+    2.1571   -1.0394    0.5309 C   0  0  0

+   -2.6096   -0.4121    0.3834 N   0  0  0

+   -1.7109    1.3851   -0.5568 O   0  0  0

+    3.0123    2.4352   -1.2601 Cl  0  0  0

+    4.4188    0.3497   -0.2600 C   0  0  0

+    3.4109   -1.5746    0.7548 C   0  0  0

+   -3.9656    0.1015    0.1741 C   0  0  0

+    4.5412   -0.8823    0.3573 C   0  0  0

+   -4.9325   -1.0704   -0.0071 C   0  0  0

+   -4.3839    0.9174    1.3701 C   0  0  0

+    6.1153   -1.5578    0.6395 Cl  0  0  0

+   -4.7260   -1.6927   -1.3895 C   0  0  0

+   -3.9481    0.6514    2.4652 O   0  0  0

+   -5.2404    1.9397    1.2188 O   0  0  0

+   -4.4919   -3.1975   -1.2415 C   0  0  0

+   -5.9693   -1.4521   -2.2480 C   0  0  0

+   -0.6348   -1.0937    0.0000 H   0  0  0

+    0.6468   -0.8218    0.0000 H   0  0  0

+    1.3516   -1.6324    0.0000 H   0  0  0

+   -2.4927   -1.4055    0.0000 H   0  0  0

+    5.2260    0.9404    0.0000 H   0  0  0

+    3.4839   -2.5722    0.0000 H   0  0  0

+   -3.2989    0.8472    0.0000 H   0  0  0

+   -5.5724   -0.3016    0.0000 H   0  0  0

+   -5.8068   -1.5563    0.0000 H   0  0  0

+   -3.7538   -1.4575    0.0000 H   0  0  0

+   -5.8828    2.7064    0.0000 H   0  0  0

+   -5.4803   -3.3513    0.0000 H   0  0  0

+   -4.3381   -4.1859    0.0000 H   0  0  0

+   -3.5035   -3.0437    0.0000 H   0  0  0

+   -5.7793   -0.4701    0.0000 H   0  0  0

+   -6.9513   -1.2621    0.0000 H   0  0  0

+   -6.1593   -2.4341    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  3  2  0

+  6  3  1  0

+  7  4  1  0

+  8  4  2  0

+  9  5  1  0

+ 10  5  1  0

+ 11  6  2  0

+ 12  7  1  0

+ 13 10  2  0

+ 14 12  1  0

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+ 16 13  1  0

+ 17 14  1  0

+ 18 15  2  0

+ 19 15  1  0

+ 20 17  1  0

+ 21 17  1  0

+ 11 13  1  0

+  2 22  1  0

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+  7 25  1  0

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+ 14 30  1  0

+ 17 31  1  0

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+ 20 33  1  0

+ 20 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71721-78-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+   -1.6265    0.2523   -0.0066 C   0  0  0

+   -1.4661   -1.1299   -0.0048 C   0  0  0

+   -0.5351    1.0640   -0.0057 O   0  0  0

+   -2.8989    0.7992   -0.0035 C   0  0  0

+   -0.2178   -1.6700   -0.0021 O   0  0  0

+   -2.5793   -1.9538   -0.0051 C   0  0  0

+    0.7135    0.5239   -0.0031 C   0  0  0

+   -4.0069   -0.0288    0.0014 C   0  0  0

+    0.8739   -0.8582   -0.0013 C   0  0  0

+   -3.8476   -1.4017   -0.0074 C   0  0  0

+    1.8263    1.3483   -0.0027 C   0  0  0

+   -5.3664    0.5568    0.0052 N   0  3  0

+    2.1459   -1.4059    0.0014 C   0  0  0

+    3.0957    0.7967   -0.0005 C   0  0  0

+   -6.3430   -0.1710    0.0095 O   0  0  0

+   -5.5085    1.7665    0.0040 O   0  5  0

+    3.2552   -0.5783    0.0022 C   0  0  0

+    4.4900    1.8309    0.0000 Cl  0  0  0

+    4.8493   -1.2657    0.0055 Cl  0  0  0

+   -3.0210    1.8300    0.0000 H   0  0  0

+   -2.4620   -2.9852    0.0000 H   0  0  0

+   -4.6815   -2.0198    0.0000 H   0  0  0

+    1.7084    2.3796    0.0000 H   0  0  0

+    2.2673   -2.4368    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  1  0

+  8 12  1  0

+  9 13  1  0

+ 11 14  2  0

+ 12 15  2  0

+ 12 16  1  0

+ 13 17  2  0

+ 14 18  1  0

+ 17 19  1  0

+  7  9  2  0

+  8 10  1  0

+ 14 17  1  0

+  4 20  1  0

+  6 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+136587-13-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 43                          1 V2000

+    2.2650    0.1565   -0.0749 N   0  0  0

+    1.0331    0.7353    0.4777 C   0  0  0

+    3.3648    1.0449    0.3240 C   0  0  0

+    2.4652   -1.0304    0.5709 N   0  0  0

+   -0.1803    0.0774   -0.1823 C   0  0  0

+    4.6136    0.7093   -0.4937 C   0  0  0

+    2.5773   -2.1224   -0.1065 N   0  0  0

+    2.5495   -1.0620    1.9840 O   0  0  0

+   -1.4633    0.6802    0.3933 C   0  0  0

+    5.7591    1.6346   -0.0782 C   0  0  0

+    2.4163   -2.1094   -1.3138 O   0  0  0

+   -2.6767    0.0223   -0.2667 C   0  0  0

+    6.9582    1.3124   -0.8632 N   0  0  0

+   -3.9086    0.6011    0.2860 N   0  0  0

+   -5.0290   -0.0704   -0.3861 C   0  0  0

+   -6.3508    0.4877    0.1452 C   0  0  0

+   -7.5178   -0.2116   -0.5549 C   0  0  0

+   -8.7869    0.3243   -0.0448 N   0  0  0

+    1.6515    1.5475    0.0000 H   0  0  0

+    0.3689    1.5105    0.0000 H   0  0  0

+    3.8291    1.9540    0.0000 H   0  0  0

+    2.5721    1.6882    0.0000 H   0  0  0

+   -0.7987   -0.7348    0.0000 H   0  0  0

+    0.4839   -0.6978    0.0000 H   0  0  0

+    4.1493   -0.1998    0.0000 H   0  0  0

+    5.4062    0.0660    0.0000 H   0  0  0

+    3.5054   -1.4203    0.0000 H   0  0  0

+   -0.8449    1.4924    0.0000 H   0  0  0

+   -2.1275    1.4554    0.0000 H   0  0  0

+    6.2233    2.5438    0.0000 H   0  0  0

+    4.9664    2.2779    0.0000 H   0  0  0

+   -3.2951   -0.7899    0.0000 H   0  0  0

+   -2.0125   -0.7529    0.0000 H   0  0  0

+    7.2217    0.3262    0.0000 H   0  0  0

+    7.6805    2.0337    0.0000 H   0  0  0

+   -3.9600    1.6206    0.0000 H   0  0  0

+   -5.6138   -0.9071    0.0000 H   0  0  0

+   -4.3329   -0.8171    0.0000 H   0  0  0

+   -5.7660    1.3244    0.0000 H   0  0  0

+   -7.0469    1.2344    0.0000 H   0  0  0

+   -8.1026   -1.0483    0.0000 H   0  0  0

+   -6.8217   -0.9583    0.0000 H   0  0  0

+   -8.9132    1.3373    0.0000 H   0  0  0

+   -9.6010   -0.2916    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 12 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+ 17 18  1  0

+  2 19  1  0

+  2 20  1  0

+  3 21  1  0

+  3 22  1  0

+  5 23  1  0

+  5 24  1  0

+  6 25  1  0

+  6 26  1  0

+  8 27  1  0

+  9 28  1  0

+  9 29  1  0

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+ 12 32  1  0

+ 12 33  1  0

+ 13 34  1  0

+ 13 35  1  0

+ 14 36  1  0

+ 15 37  1  0

+ 15 38  1  0

+ 16 39  1  0

+ 16 40  1  0

+ 17 41  1  0

+ 17 42  1  0

+ 18 43  1  0

+ 18 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+51-36-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.1950   -0.0944    0.0037 C   0  0  0

+   -0.4104   -1.2494    0.0026 C   0  0  0

+   -0.5812    1.1594    0.0027 C   0  0  0

+   -2.6687   -0.1987   -0.0002 C   0  0  0

+    0.9661   -1.1452    0.0005 C   0  0  0

+    0.7967    1.2503    0.0006 C   0  0  0

+   -3.4230    0.9174    0.0009 O   0  0  0

+   -3.2002   -1.2910   -0.0044 O   0  0  0

+    1.5691    0.1014   -0.0005 C   0  0  0

+    1.9434   -2.5800   -0.0003 Cl  0  0  0

+    1.5620    2.8085   -0.0013 Cl  0  0  0

+   -0.8615   -2.1849    0.0000 H   0  0  0

+   -1.1596    2.0220    0.0000 H   0  0  0

+   -4.0046    1.7779    0.0000 H   0  0  0

+    2.6051    0.1747    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  1  0

+  4  8  2  0

+  5  9  1  0

+  5 10  1  0

+  6 11  1  0

+  6  9  2  0

+  2 12  1  0

+  3 13  1  0

+  7 14  1  0

+  9 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+123-86-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+    0.7560   -0.5271    0.0000 O   0  0  0

+   -0.3805    0.3767    0.0000 C   0  0  0

+    2.0048   -0.0351    0.0000 C   0  0  0

+   -1.6775   -0.4349    0.0000 C   0  0  0

+    3.1843   -0.9731    0.0000 C   0  0  0

+    2.1833    1.1599    0.0000 O   0  0  0

+   -2.8750    0.5174    0.0000 C   0  0  0

+   -4.1720   -0.2941    0.0000 C   0  0  0

+    0.4185    1.1761    0.0000 H   0  0  0

+   -1.0845    1.2609    0.0000 H   0  0  0

+   -2.4765   -1.2343    0.0000 H   0  0  0

+   -0.9735   -1.3191    0.0000 H   0  0  0

+    2.4808   -1.8577    0.0000 H   0  0  0

+    4.0689   -1.6766    0.0000 H   0  0  0

+    3.8878   -0.0885    0.0000 H   0  0  0

+   -2.0760    1.3168    0.0000 H   0  0  0

+   -3.5790    1.4016    0.0000 H   0  0  0

+   -4.7715    0.6641    0.0000 H   0  0  0

+   -5.1302   -0.8936    0.0000 H   0  0  0

+   -3.5725   -1.2523    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  3  6  2  0

+  4  7  1  0

+  7  8  1  0

+  2  9  1  0

+  2 10  1  0

+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  5 14  1  0

+  5 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+39834-38-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 41                          1 V2000

+   -0.1243   -1.1641    0.1549 C   0  0  0

+    0.8898   -2.2814    0.2483 C   0  0  0

+    0.3072    0.1684    0.0711 C   0  0  0

+   -1.4476   -1.4748    0.1483 C   0  0  0

+    2.3786   -1.9065    0.2465 C   0  0  0

+    1.6836   -2.2962   -0.9398 O   0  0  0

+    1.7486    0.5223    0.0704 C   0  0  0

+   -0.6223    1.1940   -0.0145 C   0  0  0

+   -2.4119   -0.4559    0.0621 C   0  0  0

+   -1.8819   -2.9153    0.2331 C   0  0  0

+    2.7438   -0.4444    0.1536 C   0  0  0

+    2.1098    1.8701   -0.0154 C   0  0  0

+   -1.9921    0.8960   -0.0170 C   0  0  0

+   -0.1609    2.6258   -0.1041 C   0  0  0

+   -3.7852   -0.7520    0.0533 C   0  0  0

+    4.0742   -0.0749    0.1505 C   0  0  0

+    3.4405    2.2299   -0.0184 C   0  0  0

+   -2.9594    1.9136   -0.1028 C   0  0  0

+   -4.6927    0.2591   -0.0310 C   0  0  0

+    4.4238    1.2604    0.0659 C   0  0  0

+   -4.2808    1.5887   -0.1029 C   0  0  0

+    0.4571   -3.2343    0.0000 H   0  0  0

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+   -2.8839   -2.6132    0.0000 H   0  0  0

+   -2.1840   -3.9173    0.0000 H   0  0  0

+   -0.8799   -3.2174    0.0000 H   0  0  0

+    1.3690    2.6093    0.0000 H   0  0  0

+    0.8352    2.3048    0.0000 H   0  0  0

+    0.1601    3.6219    0.0000 H   0  0  0

+   -1.1570    2.9468    0.0000 H   0  0  0

+   -4.1079   -1.7475    0.0000 H   0  0  0

+    4.8197   -0.8094    0.0000 H   0  0  0

+    3.7066    3.2420    0.0000 H   0  0  0

+   -2.6653    2.9180    0.0000 H   0  0  0

+   -5.7150    0.0353    0.0000 H   0  0  0

+    5.4329    1.5377    0.0000 H   0  0  0

+   -4.9985    2.3503    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+91-17-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.0000    0.7121    0.2794 C   0  0  0

+    0.0000   -0.7122   -0.2794 C   0  0  0

+    1.2492    1.4503   -0.2058 C   0  0  0

+   -1.2492    1.4503   -0.2058 C   0  0  0

+    1.2492   -1.4503    0.2058 C   0  0  0

+   -1.2492   -1.4503    0.2058 C   0  0  0

+    2.4985    0.7121    0.2794 C   0  0  0

+   -2.4985    0.7122    0.2794 C   0  0  0

+    2.4985   -0.7122   -0.2794 C   0  0  0

+   -2.4985   -0.7121   -0.2794 C   0  0  0

+    0.9452    0.1728    0.0000 H   0  0  0

+   -0.9452   -0.1728    0.0000 H   0  0  0

+    1.9515    2.2816    0.0000 H   0  0  0

+    0.5469    2.2816    0.0000 H   0  0  0

+   -0.5468    2.2816    0.0000 H   0  0  0

+   -1.9515    2.2816    0.0000 H   0  0  0

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+    1.9515   -2.2816    0.0000 H   0  0  0

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+   -0.5469   -2.2816    0.0000 H   0  0  0

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+   -3.5696    0.5196    0.0000 H   0  0  0

+    2.8775   -1.7323    0.0000 H   0  0  0

+    3.5696   -0.5196    0.0000 H   0  0  0

+   -3.5696   -0.5195    0.0000 H   0  0  0

+   -2.8776   -1.7322    0.0000 H   0  0  0

+  1  2  1  0

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+  8 24  1  0

+  9 25  1  0

+  9 26  1  0

+ 10 27  1  0

+ 10 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+100-12-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    2.3317    0.0000   -0.0869 N   0  3  0

+    2.9382   -1.0549   -0.1410 O   0  5  0

+    2.9377    1.0547   -0.1475 O   0  0  0

+    0.8575    0.0001    0.0464 C   0  0  0

+    0.1693    1.1971    0.1078 C   0  0  0

+    0.1685   -1.1972    0.1038 C   0  0  0

+   -1.2077    1.1972    0.2323 C   0  0  0

+   -1.2080   -1.1971    0.2283 C   0  0  0

+   -1.8960    0.0003    0.2955 C   0  0  0

+   -3.3968    0.0004    0.4312 C   0  0  0

+   -4.0347   -0.0006   -0.9595 C   0  0  0

+    0.6879    2.0934    0.0000 H   0  0  0

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+  2  1  1  0

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+ 10 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+87-83-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -0.0001   -1.8525   -0.0005 C   0  0  0

+   -1.1978   -1.1613    0.0001 C   0  0  0

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+   -0.0002    0.9150    0.0000 C   0  0  0

+   -2.8362    1.1680   -0.0003 Br  0  0  0

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+   -1.0842   -3.3595    0.0000 H   0  0  0

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+  7  9  1  0

+  4 13  1  0

+  4 14  1  0

+  4 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+114899-77-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 97105                          1 V2000

+    0.2127   -2.5149    0.0000 C   0  0  2

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+ 54 97  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+16311-38-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+   -0.6688    0.4049    0.0505 C   0  0  0

+   -1.4778   -0.6748   -0.0764 C   0  0  0

+    0.8146    0.3870    0.0470 C   0  0  0

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+    2.9045    1.3685   -0.6105 C   0  0  0

+    2.8836   -0.6404    0.7004 C   0  0  0

+   -4.3979    1.6445    0.1835 S   0  0  0

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+ 13 24  1  0

+ 14 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+56-93-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+   -2.7365   -0.6858    0.2970 C   0  0  0

+   -3.8065    0.3517    0.5199 C   0  0  0

+   -1.7937   -0.9285    1.2786 C   0  0  0

+   -2.7011   -1.3987   -0.8866 C   0  0  0

+   -3.3834    1.6269   -0.0742 N   0  3  0

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+   -1.7194   -2.3506   -1.0912 C   0  0  0

+   -3.3383    1.4947   -1.5365 C   0  0  0

+   -4.3400    2.6795    0.2931 C   0  0  0

+   -2.0488    1.9816    0.4269 C   0  0  0

+   -0.7735   -2.5891   -0.1121 C   0  0  0

+    9.4917    0.4836   -0.0598 Cl  0  0  0

+   -4.7048    0.8083    0.0000 H   0  0  0

+   -4.3921   -0.4684    0.0000 H   0  0  0

+   -1.3009   -0.0495    0.0000 H   0  0  0

+   -3.6190   -1.8144    0.0000 H   0  0  0

+    0.1046   -1.4621    0.0000 H   0  0  0

+   -2.2100   -3.2308    0.0000 H   0  0  0

+   -4.2920    1.1693    0.0000 H   0  0  0

+   -3.0129    0.5410    0.0000 H   0  0  0

+   -2.3846    1.8201    0.0000 H   0  0  0

+   -3.5943    3.3572    0.0000 H   0  0  0

+   -5.0177    3.4252    0.0000 H   0  0  0

+   -5.0857    2.0018    0.0000 H   0  0  0

+   -1.7900    1.0077    0.0000 H   0  0  0

+   -1.0749    2.2404    0.0000 H   0  0  0

+   -2.3076    2.9555    0.0000 H   0  0  0

+   -0.1327   -3.3667    0.0000 H   0  0  0

+   10.4994    0.4836    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  5 10  1  0

+  6 11  1  0

+  7 11  2  0

+  2 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  6 17  1  0

+  7 18  1  0

+  8 19  1  0

+  8 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+ 11 28  1  0

+ 12 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7239-21-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -1.2284   -0.4249    0.0052 C   0  0  0

+   -0.3813   -1.5339    0.0055 C   0  0  0

+   -0.6857    0.8605    0.0026 C   0  0  0

+   -2.5896   -0.5979    0.0017 N   0  0  0

+    0.9862   -1.3538    0.0033 C   0  0  0

+    0.6838    1.0281    0.0004 C   0  0  0

+   -3.3702    0.4291    0.0014 N   0  0  0

+    1.5189   -0.0757    0.0008 C   0  0  0

+   -4.7601    0.2525   -0.0021 N   0  0  0

+    3.3948    0.1626   -0.0016 Br  0  0  0

+   -5.3268   -1.0985   -0.0056 C   0  0  0

+   -5.6467    1.4187   -0.0025 C   0  0  0

+   -0.7813   -2.4966    0.0000 H   0  0  0

+   -1.3137    1.6926    0.0000 H   0  0  0

+    1.6199   -2.1815    0.0000 H   0  0  0

+    1.0904    1.9880    0.0000 H   0  0  0

+   -6.2881   -0.6953    0.0000 H   0  0  0

+   -5.7300   -2.0598    0.0000 H   0  0  0

+   -4.3655   -1.5017    0.0000 H   0  0  0

+   -4.8168    2.0496    0.0000 H   0  0  0

+   -6.2776    2.2486    0.0000 H   0  0  0

+   -6.4766    0.7878    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  5  8  1  0

+  7  9  1  0

+  8 10  1  0

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+  6  8  2  0

+  2 13  1  0

+  3 14  1  0

+  5 15  1  0

+  6 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+ 11 19  1  0

+ 12 20  1  0

+ 12 21  1  0

+ 12 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5397-37-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 27                          1 V2000

+   -0.2762    0.1024   -0.0026 C   0  0  0

+   -1.6819   -0.3730   -0.0014 C   0  0  0

+   -0.2577    1.4947    0.0000 C   0  0  0

+    0.9308   -0.5985   -0.0005 C   0  0  0

+   -2.5416    0.7217    0.0020 C   0  0  0

+   -2.2156   -1.6632   -0.0034 C   0  0  0

+   -1.6906    1.9680    0.0030 C   0  0  0

+    0.9420    2.1736   -0.0006 C   0  0  0

+    2.1268    0.0893   -0.0018 C   0  0  0

+   -3.9076    0.5328    0.0033 C   0  0  0

+   -3.5831   -1.8427   -0.0021 C   0  0  0

+    2.1350    1.4722   -0.0037 C   0  0  0

+    3.4058   -0.6557    0.0009 N   0  3  0

+   -4.4296   -0.7485    0.0012 C   0  0  0

+    4.4629   -0.0508   -0.0002 O   0  0  0

+    3.4011   -1.8737    0.0043 O   0  5  0

+    0.9286   -1.6363    0.0000 H   0  0  0

+   -1.5838   -2.4865    0.0000 H   0  0  0

+   -1.2747    2.9188    0.0000 H   0  0  0

+   -2.5985    2.4708    0.0000 H   0  0  0

+    0.9506    3.2114    0.0000 H   0  0  0

+   -4.5444    1.3522    0.0000 H   0  0  0

+   -3.9785   -2.8022    0.0000 H   0  0  0

+    3.0373    1.9849    0.0000 H   0  0  0

+   -5.4578   -0.8890    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

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+  5  7  1  0

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+ 11 14  1  0

+  4 17  1  0

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+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 14 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+772-43-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.9565    0.5407   -0.0110 C   0  0  0

+    0.0702   -0.2859    0.2713 O   0  0  0

+   -0.4423    1.6956   -0.5182 C   0  0  0

+   -2.3847    0.2444    0.1882 C   0  0  0

+    1.2268    0.3161   -0.0445 C   0  0  0

+    0.9562    1.5428   -0.5360 C   0  0  0

+   -2.8978   -0.8503   -0.3004 N   0  0  0

+   -3.1842    1.1293    0.8954 N   0  0  0

+    2.5768   -0.2691    0.1193 N   0  3  0

+   -2.0640   -1.9604   -0.5783 O   0  0  0

+    3.5615    0.3715   -0.2026 O   0  0  0

+    2.7029   -1.3913    0.5759 O   0  5  0

+   -0.9221    2.5306    0.0000 H   0  0  0

+    1.5993    2.2596    0.0000 H   0  0  0

+   -2.8882    2.0457    0.0000 H   0  0  0

+   -4.1258    0.9275    0.0000 H   0  0  0

+   -1.4856   -2.7304    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

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+  9 11  2  0

+  9 12  1  0

+  5  6  2  0

+  3 13  1  0

+  6 14  1  0

+  8 15  1  0

+  8 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+85-02-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 25                          1 V2000

+    0.7640   -0.3890   -0.0013 C   0  0  0

+   -0.7003   -0.4107   -0.0006 C   0  0  0

+    1.4233    0.8615   -0.0008 C   0  0  0

+    1.5144   -1.5663    0.0033 C   0  0  0

+   -1.4025    0.8155    0.0006 C   0  0  0

+   -1.4173   -1.6113   -0.0016 C   0  0  0

+    0.6655    2.0550    0.0009 C   0  0  0

+    2.8249    0.8955   -0.0015 C   0  0  0

+    2.8785   -1.4996    0.0029 C   0  0  0

+   -0.6828    2.0332    0.0011 C   0  0  0

+   -2.7372    0.8116    0.0009 N   0  0  0

+   -2.7864   -1.5479   -0.0013 C   0  0  0

+    3.5303   -0.2720   -0.0026 C   0  0  0

+   -3.4186   -0.3106    0.0000 C   0  0  0

+    1.0345   -2.4943    0.0000 H   0  0  0

+   -0.9228   -2.5316    0.0000 H   0  0  0

+    1.1613    2.9746    0.0000 H   0  0  0

+    3.3272    1.8116    0.0000 H   0  0  0

+    3.4386   -2.3816    0.0000 H   0  0  0

+   -1.2079    2.9364    0.0000 H   0  0  0

+   -3.3523   -2.4262    0.0000 H   0  0  0

+    4.5747   -0.2431    0.0000 H   0  0  0

+   -4.4627   -0.2723    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  3  7  2  0

+  3  8  1  0

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+  4 15  1  0

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+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 12 21  1  0

+ 13 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+31438-22-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 26                          1 V2000

+    0.4013    1.0875   -0.0024 C   0  0  0

+   -0.4843   -0.0001   -0.0012 C   0  0  0

+    1.7618    0.5192   -0.0015 C   0  0  0

+   -0.0929    2.3899    0.0009 C   0  0  0

+    0.2583   -1.1673    0.0004 N   0  0  0

+   -1.8555    0.2381   -0.0014 C   0  0  0

+    1.6106   -0.8753    0.0003 C   0  0  0

+    3.0356    1.0830   -0.0015 C   0  0  0

+   -1.4540    2.6055    0.0053 C   0  0  0

+   -2.3311    1.5315   -0.0022 C   0  0  0

+   -2.8037   -0.8985   -0.0001 N   0  3  0

+    2.7438   -1.6832    0.0015 C   0  0  0

+    4.1456    0.2663    0.0001 C   0  0  0

+   -4.0038   -0.6905   -0.0003 O   0  0  0

+   -2.3839   -2.0419    0.0010 O   0  5  0

+    3.9981   -1.1124    0.0010 C   0  0  0

+    0.5631    3.1968    0.0000 H   0  0  0

+   -0.1426   -2.1269    0.0000 H   0  0  0

+    3.1485    2.1168    0.0000 H   0  0  0

+   -1.8247    3.5772    0.0000 H   0  0  0

+   -3.3567    1.7036    0.0000 H   0  0  0

+    2.6440   -2.7184    0.0000 H   0  0  0

+    5.0973    0.6855    0.0000 H   0  0  0

+    4.8414   -1.7210    0.0000 H   0  0  0

+  1  2  2  0

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+  8 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 16 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+578-66-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.3880    0.9495   -0.0027 C   0  0  0

+   -0.0220   -0.4186   -0.0015 C   0  0  0

+    0.6100    1.9378   -0.0015 C   0  0  0

+   -1.7540    1.2896    0.0009 C   0  0  0

+    1.3484   -0.7620    0.0003 C   0  0  0

+   -0.9681   -1.3608   -0.0017 N   0  0  0

+    1.9229    1.5771    0.0007 C   0  0  0

+   -2.6705    0.2767    0.0054 C   0  0  0

+    2.2976    0.2365    0.0010 C   0  0  0

+    1.7372   -2.1009    0.0019 N   0  0  0

+   -2.2416   -1.0485   -0.0029 C   0  0  0

+    0.3454    2.9480    0.0000 H   0  0  0

+   -2.0583    2.2886    0.0000 H   0  0  0

+    2.6597    2.3172    0.0000 H   0  0  0

+   -3.6916    0.4957    0.0000 H   0  0  0

+    3.3110   -0.0156    0.0000 H   0  0  0

+    1.0143   -2.8546    0.0000 H   0  0  0

+    2.7513   -2.3501    0.0000 H   0  0  0

+   -2.9528   -1.8132    0.0000 H   0  0  0

+  1  2  1  0

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+  8 15  1  0

+  9 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 11 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+75-05-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  6  5                          1 V2000

+    0.0464    0.0000    0.0000 C   0  0  0

+   -1.4256    0.0000    0.0000 C   0  0  0

+    1.1824    0.0000    0.0000 N   0  0  0

+   -1.4256    0.9780    0.0000 H   0  0  0

+   -2.4036    0.0000    0.0000 H   0  0  0

+   -1.4256   -0.9780    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  3  0

+  2  4  1  0

+  2  5  1  0

+  2  6  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1064-48-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 58                          1 V2000

+   -0.4716   -1.8431   -0.0387 N   0  0  0

+   -0.3478   -0.4662   -0.0932 C   0  0  0

+    0.9217    0.1397   -0.0003 C   0  0  0

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+ 37 55  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+121-54-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 72 73                          1 V2000

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+ 30 72  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+122-19-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 78 78                          1 V2000

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+ 28 78  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1239-45-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 47                          1 V2000

+   -0.6309    0.3544   -0.0682 C   0  0  0

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+ 24 44  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+124-64-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.1579    0.4368   -0.0635 P   0  0  0

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+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+126-92-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 30                          1 V2000

+    1.1545    0.6758   -0.0337 C   0  0  0

+   -0.1121   -0.1303   -0.3284 C   0  0  0

+    2.3492    0.0212   -0.7302 C   0  0  0

+    0.9818    2.1047   -0.5527 C   0  0  0

+   -1.2279    0.4811    0.3221 O   0  0  0

+    3.3757   -0.4127    0.3182 C   0  0  0

+    1.1607    3.0920    0.6024 C   0  0  0

+   -2.4485   -0.3653   -0.0097 S   0  0  0

+    4.6218   -0.9571   -0.3830 C   0  0  0

+   -2.5709   -1.4305    1.0705 O   0  0  0

+   -3.5700    0.4901    0.1628 O   0  0  0

+   -2.1218   -1.0625   -1.2041 O   0  0  0

+    5.6483   -1.3910    0.6653 C   0  0  0

+    1.9720    1.2290    0.0000 H   0  0  0

+   -0.7242   -0.9047    0.0000 H   0  0  0

+    0.5493   -0.8630    0.0000 H   0  0  0

+    1.5234   -0.5195    0.0000 H   0  0  0

+    2.4378   -0.9619    0.0000 H   0  0  0

+    0.1688    2.6645    0.0000 H   0  0  0

+    0.1372    1.5938    0.0000 H   0  0  0

+    4.1678    0.1762    0.0000 H   0  0  0

+    3.2578    0.5673    0.0000 H   0  0  0

+    2.1319    2.9160    0.0000 H   0  0  0

+    1.3367    4.0632    0.0000 H   0  0  0

+    0.1895    3.2680    0.0000 H   0  0  0

+    3.8297   -1.5460    0.0000 H   0  0  0

+    4.7397   -1.9371    0.0000 H   0  0  0

+   -2.6836   -2.4111    0.0000 H   0  0  0

+    5.2640   -2.3002    0.0000 H   0  0  0

+    6.5575   -1.7753    0.0000 H   0  0  0

+    6.0326   -0.4818    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  1  0

+  5  8  1  0

+  6  9  1  0

+  8 10  1  0

+  8 11  2  0

+  8 12  2  0

+  9 13  1  0

+  1 14  1  0

+  2 15  1  0

+  2 16  1  0

+  3 17  1  0

+  3 18  1  0

+  4 19  1  0

+  4 20  1  0

+  6 21  1  0

+  6 22  1  0

+  7 23  1  0

+  7 24  1  0

+  7 25  1  0

+  9 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 13 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+135-20-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+    0.2684    0.0757   -0.0013 C   0  0  0

+   -1.1189    0.2325   -0.0003 N   0  0  0

+    1.0955    1.1922   -0.0001 C   0  0  0

+    0.8255   -1.1977    0.0024 C   0  0  0

+   -1.8853   -0.8051   -0.0014 N   0  0  0

+   -1.6846    1.5306    0.0019 O   0  0  0

+    2.4674    1.0332   -0.0005 C   0  0  0

+    2.1978   -1.3490    0.0020 C   0  0  0

+   -3.0956   -0.6682   -0.0006 O   0  0  0

+    3.0181   -0.2352   -0.0022 C   0  0  0

+    0.6831    2.1440    0.0000 H   0  0  0

+    0.2110   -2.0333    0.0000 H   0  0  0

+   -2.0990    2.4815    0.0000 H   0  0  0

+    3.0854    1.8663    0.0000 H   0  0  0

+    2.6142   -2.2990    0.0000 H   0  0  0

+    4.0488   -0.3517    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  7 10  2  0

+  8 10  1  0

+  3 11  1  0

+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  8 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+135-49-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -1.1969    0.7865   -0.0044 C   0  0  0

+   -1.1603   -0.6794   -0.0017 C   0  0  0

+    0.0001    1.5066   -0.0047 C   0  0  0

+   -2.4440    1.4451   -0.0008 C   0  0  0

+    0.0001   -1.3301    0.0004 N   0  0  0

+   -2.3806   -1.3822   -0.0010 C   0  0  0

+    1.1968    0.7867   -0.0024 C   0  0  0

+   -3.5888    0.7182    0.0050 C   0  0  0

+    1.1602   -0.6794    0.0002 C   0  0  0

+   -3.5655   -0.6836   -0.0029 C   0  0  0

+    2.4441    1.4452   -0.0020 C   0  0  0

+   -4.9155    1.4330    0.0089 C   0  0  0

+    2.3805   -1.3823    0.0021 C   0  0  0

+   -4.7691   -1.3846   -0.0026 N   0  0  0

+    3.5888    0.7182    0.0007 C   0  0  0

+    3.5654   -0.6837    0.0014 C   0  0  0

+    4.9155    1.4329    0.0006 C   0  0  0

+    4.7690   -1.3846    0.0032 N   0  0  0

+    0.0001    2.5562    0.0000 H   0  0  0

+   -2.4859    2.4939    0.0000 H   0  0  0

+   -2.3860   -2.4318    0.0000 H   0  0  0

+    2.4861    2.4939    0.0000 H   0  0  0

+   -4.4177    2.3570    0.0000 H   0  0  0

+   -5.8395    1.9308    0.0000 H   0  0  0

+   -5.4133    0.5090    0.0000 H   0  0  0

+    2.3858   -2.4319    0.0000 H   0  0  0

+   -5.6801   -0.8633    0.0000 H   0  0  0

+   -4.7651   -2.4342    0.0000 H   0  0  0

+    5.4133    0.5089    0.0000 H   0  0  0

+    5.8395    1.9307    0.0000 H   0  0  0

+    4.4177    2.3569    0.0000 H   0  0  0

+    4.7651   -2.4342    0.0000 H   0  0  0

+    5.6799   -0.8632    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

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+ 13 16  2  0

+ 15 17  1  0

+ 16 18  1  0

+  7  9  1  0

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+ 14 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+ 18 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+137-09-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -0.6601    0.7939    0.0019 C   0  0  0

+   -1.0898   -0.5312    0.0007 C   0  0  0

+    0.6967    1.0806    0.0016 C   0  0  0

+   -1.5963    1.8342   -0.0024 N   0  0  0

+   -0.1624   -1.5595   -0.0009 C   0  0  0

+   -2.4210   -0.8152    0.0005 O   0  0  0

+    1.6226    0.0465    0.0001 C   0  0  0

+    1.1901   -1.2731   -0.0012 C   0  0  0

+    2.9920    0.3338   -0.0002 N   0  0  0

+    1.0204    2.0700    0.0000 H   0  0  0

+   -1.2743    2.8242    0.0000 H   0  0  0

+   -2.6146    1.6180    0.0000 H   0  0  0

+   -0.4841   -2.5496    0.0000 H   0  0  0

+   -3.4391   -1.0324    0.0000 H   0  0  0

+    1.8854   -2.0479    0.0000 H   0  0  0

+    3.6865   -0.4417    0.0000 H   0  0  0

+    3.3163    1.3230    0.0000 H   0  0  0

+  1  2  2  0

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+  3 10  1  0

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+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+146-56-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 59                          1 V2000

+   -2.1979    0.1332   -0.0210 C   0  0  0

+   -1.7020   -0.9999    0.6235 N   0  0  0

+   -2.9470    0.0393   -1.1879 C   0  0  0

+   -1.9344    1.3818    0.5307 C   0  0  0

+   -2.3109   -2.2512    0.5312 C   0  0  0

+   -0.4876   -0.8700    1.4326 C   0  0  0

+   -3.3175   -1.5135   -1.9233 S   0  0  0

+   -3.4194    1.1991   -1.7941 C   0  0  0

+   -2.4099    2.5283   -0.0780 C   0  0  0

+   -3.0723   -2.6121   -0.5734 C   0  0  0

+   -2.1446   -3.1514    1.5781 C   0  0  0

+    0.7388   -1.1401    0.5587 C   0  0  0

+   -3.1485    2.4365   -1.2420 C   0  0  0

+   -2.1222    3.8779    0.5276 C   0  0  0

+   -3.6596   -3.8731   -0.6189 C   0  0  0

+   -2.7323   -4.4010    1.5241 C   0  0  0

+    2.0070   -1.0045    1.4038 C   0  0  0

+   -2.7025    4.8766   -0.2618 F   0  0  0

+   -2.6582    3.9336    1.8186 F   0  0  0

+   -0.7386    4.0765    0.5881 F   0  0  0

+   -3.4893   -4.7612    0.4254 C   0  0  0

+    3.1846   -1.2639    0.5647 N   0  0  0

+    4.3605   -1.1184    1.4314 C   0  0  0

+    3.2461   -0.1793   -0.4228 C   0  0  0

+    5.6345   -1.2546    0.5967 C   0  0  0

+    4.5201   -0.3155   -1.2575 C   0  0  0

+    5.6960   -0.1700   -0.3907 N   0  0  0

+    6.8736   -0.4294   -1.2298 C   0  0  0

+    7.7420    0.8287   -1.2926 C   0  0  0

+    8.3204    1.0728   -0.0089 O   0  0  0

+   -1.0223    1.4665    0.0000 H   0  0  0

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+   -0.9446   -0.0762    0.0000 H   0  0  0

+   -4.3320    1.1208    0.0000 H   0  0  0

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+   -2.0831   -5.0472    0.0000 H   0  0  0

+    2.5486   -0.2658    0.0000 H   0  0  0

+    1.5500   -0.2106    0.0000 H   0  0  0

+   -3.9030   -5.5784    0.0000 H   0  0  0

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+    3.8661   -0.3473    0.0000 H   0  0  0

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+    2.3326   -0.1123    0.0000 H   0  0  0

+    5.5523   -2.1669    0.0000 H   0  0  0

+    6.5480   -1.3216    0.0000 H   0  0  0

+    4.0385   -1.0947    0.0000 H   0  0  0

+    5.0145   -1.0866    0.0000 H   0  0  0

+    6.5630   -1.2911    0.0000 H   0  0  0

+    7.6882   -0.8484    0.0000 H   0  0  0

+    7.6826    1.7428    0.0000 H   0  0  0

+    6.8591    1.0727    0.0000 H   0  0  0

+    9.1643    1.4290    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

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+ 27 28  1  0

+ 28 29  1  0

+ 29 30  1  0

+  7 10  1  0

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+ 16 21  1  0

+ 26 27  1  0

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+ 11 35  1  0

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+ 26 51  1  0

+ 28 52  1  0

+ 28 53  1  0

+ 29 54  1  0

+ 29 55  1  0

+ 30 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15826-37-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 53                          1 V2000

+   -4.7822    0.2259    0.1887 C   0  0  0

+   -5.8963    1.0738    0.2980 C   0  0  0

+   -3.4843    0.7459    0.1381 C   0  0  0

+   -5.0231   -1.2290    0.1083 C   0  0  0

+   -7.1487    0.6146    0.4086 O   0  0  0

+   -5.6775    2.4532    0.3062 C   0  0  0

+   -2.4153   -0.0870    0.0709 O   0  0  0

+   -3.3006    2.1180    0.1568 C   0  0  0

+   -6.4292   -1.5898   -0.1718 C   0  0  0

+   -4.1422   -2.0574    0.2587 O   0  0  0

+   -7.3558   -0.6201   -0.0158 C   0  0  0

+   -4.3989    2.9590    0.2341 C   0  0  0

+   -1.2498    0.7390    0.0327 C   0  0  0

+   -8.7521   -0.9777   -0.3562 C   0  0  0

+   -0.0019   -0.1429   -0.0439 C   0  0  0

+   -9.0418   -2.2176   -0.7957 O   0  0  0

+   -9.6357   -0.1533   -0.2392 O   0  0  0

+    1.2459    0.7415   -0.0848 C   0  0  0

+    0.0530   -0.9913    1.1047 O   0  0  0

+    2.4114   -0.0823   -0.1563 O   0  0  0

+    3.4803    0.7528   -0.1898 C   0  0  0

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+    5.6734    2.4657   -0.2904 C   0  0  0

+    6.4256   -1.5930    0.0267 C   0  0  0

+    4.1387   -2.0435   -0.4221 O   0  0  0

+    7.3521   -0.6178   -0.0909 C   0  0  0

+    8.7484   -0.9884    0.2350 C   0  0  0

+    9.0383   -2.2447    0.6251 O   0  0  0

+    9.6319   -0.1599    0.1506 O   0  0  0

+   -6.4875    3.1025    0.0000 H   0  0  0

+   -2.3412    2.5147    0.0000 H   0  0  0

+   -6.7146   -2.5880    0.0000 H   0  0  0

+   -4.2557    3.9872    0.0000 H   0  0  0

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+   -1.9418    1.5129    0.0000 H   0  0  0

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+    0.5539    1.5154    0.0000 H   0  0  0

+    0.1200   -2.0273    0.0000 H   0  0  0

+    2.3365    2.5206    0.0000 H   0  0  0

+    4.2492    3.9960    0.0000 H   0  0  0

+    6.4826    3.1160    0.0000 H   0  0  0

+    6.7089   -2.5917    0.0000 H   0  0  0

+    9.2717   -3.2563    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  3  7  1  0

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+ 31 32  1  0

+ 32 33  1  0

+ 32 34  2  0

+  8 12  1  0

+  9 11  2  0

+ 26 28  2  0

+ 29 31  2  0

+  6 35  1  0

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+ 19 45  1  0

+ 23 46  1  0

+ 26 47  1  0

+ 28 48  1  0

+ 29 49  1  0

+ 33 50  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1684-40-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+   -1.1851    0.8892   -0.0160 C   0  0  0

+   -1.2237   -0.5255    0.0114 C   0  0  0

+   -0.0091    1.5189   -0.0309 N   0  0  0

+   -2.3951    1.6037   -0.0329 C   0  0  0

+   -0.0019   -1.2350    0.0258 C   0  0  0

+   -2.4584   -1.1874    0.0241 C   0  0  0

+    1.1445    0.8730   -0.0199 C   0  0  0

+   -3.5782    0.9298   -0.0238 C   0  0  0

+    1.1857   -0.5101    0.0113 C   0  0  0

+    0.0133   -2.6211    0.0533 N   0  0  0

+   -3.6119   -0.4616    0.0114 C   0  0  0

+    2.3986    1.7117   -0.0476 C   0  0  0

+    2.4754   -1.2870    0.0348 C   0  0  0

+    3.6039    0.8913    0.4054 C   0  0  0

+    3.6414   -0.4063   -0.4099 C   0  0  0

+   -2.3869    2.6475    0.0000 H   0  0  0

+   -2.4947   -2.2306    0.0000 H   0  0  0

+   -4.4743    1.4652    0.0000 H   0  0  0

+   -0.8849   -3.1529    0.0000 H   0  0  0

+    0.9230   -3.1331    0.0000 H   0  0  0

+   -4.5317   -0.9551    0.0000 H   0  0  0

+    3.0912    2.4927    0.0000 H   0  0  0

+    1.7124    2.4983    0.0000 H   0  0  0

+    1.8277   -2.1056    0.0000 H   0  0  0

+    3.2052   -2.0334    0.0000 H   0  0  0

+    4.6309    0.7045    0.0000 H   0  0  0

+    3.9996    1.8573    0.0000 H   0  0  0

+    4.0869   -1.3503    0.0000 H   0  0  0

+    4.6566   -0.1634    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

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+  7 12  1  0

+  9 13  1  0

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+  7  9  1  0

+  8 11  2  0

+ 14 15  1  0

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+  8 18  1  0

+ 10 19  1  0

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+ 13 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+ 15 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1934-20-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+   -2.0816    0.2463   -0.3915 N   0  0  0

+   -3.1070    0.3535    0.3838 N   0  0  0

+   -1.0274    1.0909   -0.2443 C   0  0  0

+   -4.1673   -0.4959    0.2357 C   0  0  0

+    0.3398    0.5756   -0.1783 C   0  0  0

+   -1.2249    2.4718   -0.1583 C   0  0  0

+   -5.2800   -0.3829    1.0738 C   0  0  0

+   -4.1467   -1.4785   -0.7585 C   0  0  0

+    1.4096    1.4905   -0.0243 C   0  0  0

+    0.6083   -0.7951   -0.2643 C   0  0  0

+   -2.4817    2.9785   -0.2222 O   0  0  0

+   -0.1381    3.3315   -0.0068 C   0  0  0

+   -6.3463   -1.2438    0.9183 C   0  0  0

+   -5.2201   -2.3319   -0.9018 C   0  0  0

+    2.7255    1.0021    0.0398 C   0  0  0

+    1.1378    2.8678    0.0610 C   0  0  0

+    1.8975   -1.2350   -0.1989 C   0  0  0

+   -6.3162   -2.2176   -0.0643 C   0  0  0

+    2.9517   -0.3382   -0.0467 C   0  0  0

+    4.6035   -0.9465    0.0341 S   0  0  0

+    4.6159   -2.1347   -0.7450 O   0  0  0

+    5.4412    0.1823   -0.1740 O   0  0  0

+    4.8555   -1.3896    1.4682 O   0  0  0

+   -5.5712    0.5964    0.0000 H   0  0  0

+   -3.2220   -1.9128    0.0000 H   0  0  0

+   -0.1613   -1.4670    0.0000 H   0  0  0

+   -3.4292    3.3605    0.0000 H   0  0  0

+   -0.3012    4.3400    0.0000 H   0  0  0

+   -7.2748   -0.8176    0.0000 H   0  0  0

+   -4.9339   -3.3126    0.0000 H   0  0  0

+    3.5126    1.6534    0.0000 H   0  0  0

+    1.9136    3.5326    0.0000 H   0  0  0

+    2.0885   -2.2386    0.0000 H   0  0  0

+   -7.0645   -2.9132    0.0000 H   0  0  0

+    5.3606   -2.2777    0.0000 H   0  0  0

+  2  1  2  0

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+ 15 31  1  0

+ 16 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1936-15-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+    0.4915   -1.6085    0.0220 S   0  0  0

+    1.1785   -1.3904    1.2467 O   0  0  0

+    1.0796   -1.5613   -1.2707 O   0  0  0

+   -0.1363   -2.9899    0.1405 O   0  0  0

+   -0.8215   -0.4338   -0.0061 C   0  0  0

+   -0.5394    0.9364   -0.0133 C   0  0  0

+   -2.1186   -0.8554   -0.0266 C   0  0  0

+    0.8368    1.4324    0.0025 C   0  0  0

+   -1.6034    1.8704   -0.0359 C   0  0  0

+   -3.1670    0.0600   -0.0489 C   0  0  0

+    1.8860    0.5692    0.0239 N   0  0  0

+    1.0483    2.8135   -0.0054 C   0  0  0

+   -2.9273    1.4011   -0.0511 C   0  0  0

+   -1.3176    3.2480   -0.0432 C   0  0  0

+   -4.8290   -0.5246   -0.0749 S   0  0  0

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+    2.3139    3.3019    0.0089 O   0  0  0

+   -0.0337    3.6928   -0.0283 C   0  0  0

+   -5.5741    0.4615   -0.7761 O   0  0  0

+   -4.7493   -1.8992   -0.4258 O   0  0  0

+   -5.3451   -0.4925    1.3566 O   0  0  0

+    4.1506    0.1636    0.0606 C   0  0  0

+    5.4565    0.6602    0.0940 C   0  0  0

+    3.9364   -1.2124   -0.0610 C   0  0  0

+    6.5236   -0.2087    0.0017 C   0  0  0

+    5.0132   -2.0688   -0.1523 C   0  0  0

+    6.3037   -1.5691   -0.1238 C   0  0  0

+   -0.5639   -3.9308    0.0000 H   0  0  0

+   -2.3257   -1.8680    0.0000 H   0  0  0

+   -3.7155    2.0697    0.0000 H   0  0  0

+   -2.0940    3.9302    0.0000 H   0  0  0

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+    0.1457    4.7107    0.0000 H   0  0  0

+   -6.3767   -0.4283    0.0000 H   0  0  0

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+ 21 34  1  0

+ 23 35  1  0

+ 24 36  1  0

+ 25 37  1  0

+ 26 38  1  0

+ 27 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1937-37-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 79 84                          1 V2000

+    2.4288   -1.2601   -0.7157 N   0  0  0

+    2.8831    0.0186   -0.4454 C   0  0  0

+    4.2613    0.2662   -0.2840 C   0  0  0

+    1.9797    1.0822   -0.3348 C   0  0  0

+    4.7070    1.5831   -0.0075 C   0  0  0

+    5.2000   -0.7757   -0.3932 C   0  0  0

+    0.6473    0.8591   -0.4938 N   0  0  0

+    2.4451    2.3808   -0.0594 C   0  0  0

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+    6.0823    1.8334    0.1542 C   0  0  0

+    4.7915   -2.0404   -0.6576 O   0  0  0

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+   -0.1768    1.1791    0.4457 N   0  0  0

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+    7.4763   -1.4929   -0.3296 N   0  0  0

+   -1.5140    0.9553    0.2862 C   0  0  0

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+ 52 78  1  0

+ 52 79  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2045-52-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+    0.3377    0.1883   -0.4044 N   0  0  0

+    0.4011   -1.1823   -0.1434 C   0  0  0

+   -0.6534    0.7089   -1.3494 C   0  0  0

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+ 18 40  1  0

+ 19 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2216-51-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -0.6689    0.1080    0.4353 C   0  0  0

+    0.0693   -1.0700   -0.2037 C   0  0  0

+   -0.0873    1.4211   -0.0924 C   0  0  0

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+   -2.3307    0.2040   -1.4280 C   0  0  0

+    2.1376    0.3207   -0.3781 C   0  0  0

+    3.6242    0.3984   -0.0248 C   0  0  0

+    0.4055    0.1849    0.0000 H   0  0  0

+   -1.0051   -1.1468    0.0000 H   0  0  0

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+  1  2  1  0

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+ 11 29  1  0

+ 11 30  1  0

+ 11 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2390-59-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 78                          1 V2000

+   -0.0153    0.0076    0.0067 C   0  0  0

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+ 34 76  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2429-73-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 76 81                          1 V2000

+    5.3538   -1.9135    0.2485 O   0  0  0

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+ 52 76  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2429-82-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 63 67                          1 V2000

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+ 42 63  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2465-27-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 42                          1 V2000

+    0.0177   -1.6949   -0.2134 C   0  0  0

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+ 20 41  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2586-60-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 72 77                          1 V2000

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+ 48 72  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2610-05-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 88 93                          1 V2000

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+ 60 88  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2610-11-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 65 69                          1 V2000

+    2.1355   -2.3504   -0.6036 O   0  0  0

+    2.8048   -1.1769   -0.4930 C   0  0  0

+    4.2118   -1.1546   -0.5296 C   0  0  0

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+  -12.8001   -2.1190    0.0000 H   0  0  0

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+ 39 64  1  0

+ 44 65  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2611-82-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 52                          1 V2000

+    0.0745    0.8612   -0.6557 N   0  0  0

+   -0.9156    1.2920    0.0502 N   0  0  0

+    1.2361    1.5638   -0.6961 C   0  0  0

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+   -4.3307    3.8013    0.0000 H   0  0  0

+    1.8066   -3.8010    0.0000 H   0  0  0

+   -6.3309    2.7186    0.0000 H   0  0  0

+   -5.7460   -3.6717    0.0000 H   0  0  0

+    8.0083   -1.8968    0.0000 H   0  0  0

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+ 32 48  1  0

+ 35 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+298-59-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+    0.0204   -0.3965   -0.5479 C   0  0  0

+   -1.1965    0.4323   -0.2264 C   0  0  0

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+   -0.8751   -4.0769   -0.1215 C   0  0  0

+   -3.4289    1.9528    0.3635 C   0  0  0

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+ 17 35  1  0

+ 17 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3087-16-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 65 68                          1 V2000

+    1.3813   -0.0888    0.0362 C   0  0  0

+    0.1254    0.2581   -0.5148 C   0  0  0

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+    1.1654    1.1293   -2.4803 O   0  0  0

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+ 35 64  1  0

+ 38 65  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+314-13-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 86 91                          1 V2000

+   -9.7364   -2.6794   -1.0719 N   0  0  0

+  -10.1645   -1.4226   -0.6563 C   0  0  0

+   -9.2271   -0.4503   -0.2479 C   0  0  0

+  -11.5103   -1.1134   -0.6452 C   0  0  0

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+ 58 86  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+32780-64-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 49                          1 V2000

+    2.1392    0.2379   -0.7086 C   0  0  0

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+ 24 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3567-66-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+   -0.7745   -2.3106   -0.4579 O   0  0  0

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+ 28 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3717-88-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 57                          1 V2000

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+ 28 53  1  0

+ 29 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3761-53-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 47                          1 V2000

+   -1.6368   -0.6580   -0.4269 N   0  0  0

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+ 29 45  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4080-31-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 32                          1 V2000

+   -0.7543   -1.4578    0.0374 C   0  0  0

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+ 14 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4213-45-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 60                          1 V2000

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+ 28 58  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4335-09-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 78 83                          1 V2000

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+ 54 78  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+477-73-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 46                          1 V2000

+   -4.7936    0.2971   -0.0039 N   0  0  0

+   -3.5756   -0.3634   -0.0032 C   0  0  0

+   -2.4020    0.3732   -0.0022 C   0  0  0

+   -3.5527   -1.7660    0.0022 C   0  0  0

+   -1.1796   -0.2840   -0.0015 C   0  0  0

+   -4.8545   -2.5251    0.0071 C   0  0  0

+   -2.3843   -2.4527    0.0026 C   0  0  0

+   -0.0003    0.4168   -0.0010 N   0  3  0

+   -1.1556   -1.7494   -0.0020 C   0  0  0

+    1.1783   -0.2858   -0.0009 C   0  0  0

+    0.0006    1.8129    0.0000 C   0  0  0

+   -0.0023   -2.4039   -0.0019 N   0  0  0

+    1.1522   -1.7508   -0.0014 C   0  0  0

+    2.4015    0.3698    0.0000 C   0  0  0

+    0.0035    2.5087    1.2031 C   0  0  0

+    0.0045    2.5106   -1.2025 C   0  0  0

+    2.3798   -2.4558   -0.0008 C   0  0  0

+    3.5741   -0.3682    0.0005 C   0  0  0

+    0.0049    3.8896    1.2001 C   0  0  0

+    0.0060    3.8911   -1.1975 C   0  0  0

+    3.5492   -1.7707    0.0001 C   0  0  0

+    4.7930    0.2907    0.0009 N   0  0  0

+    0.0035    4.5802    0.0020 C   0  0  0

+    4.8500   -2.5317    0.0012 C   0  0  0

+   -4.8213    1.3359    0.0000 H   0  0  0

+   -5.6794   -0.2463    0.0000 H   0  0  0

+   -2.4369    1.4118    0.0000 H   0  0  0

+   -5.3780   -1.6274    0.0000 H   0  0  0

+   -5.7522   -3.0486    0.0000 H   0  0  0

+   -4.3310   -3.4228    0.0000 H   0  0  0

+   -2.3903   -3.4919    0.0000 H   0  0  0

+    2.4377    1.4083    0.0000 H   0  0  0

+    1.0427    2.5060    0.0000 H   0  0  0

+    1.0437    2.5071    0.0000 H   0  0  0

+    2.3843   -3.4950    0.0000 H   0  0  0

+    1.0441    3.8901    0.0000 H   0  0  0

+    1.0452    3.8924    0.0000 H   0  0  0

+    5.6780   -0.2539    0.0000 H   0  0  0

+    4.8221    1.3295    0.0000 H   0  0  0

+    0.0006    5.6194    0.0000 H   0  0  0

+    4.3253   -3.4287    0.0000 H   0  0  0

+    5.7470   -3.0564    0.0000 H   0  0  0

+    5.3747   -1.6347    0.0000 H   0  0  0

+  2  1  1  0

+  3  2  2  0

+  4  2  1  0

+  5  3  1  0

+  6  4  1  0

+  7  4  2  0

+  8  5  2  0

+  9  5  1  0

+ 10  8  1  0

+ 11  8  1  0

+ 12  9  2  0

+ 13 10  2  0

+ 14 10  1  0

+ 15 11  2  0

+ 16 11  1  0

+ 17 13  1  0

+ 18 14  2  0

+ 19 15  1  0

+ 20 16  2  0

+ 21 17  2  0

+ 22 18  1  0

+ 23 19  2  0

+ 24 21  1  0

+  7  9  1  0

+ 12 13  1  0

+ 18 21  1  0

+ 20 23  1  0

+  1 25  1  0

+  1 26  1  0

+  3 27  1  0

+  6 28  1  0

+  6 29  1  0

+  6 30  1  0

+  7 31  1  0

+ 14 32  1  0

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+ 17 35  1  0

+ 19 36  1  0

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+ 22 38  1  0

+ 22 39  1  0

+ 23 40  1  0

+ 24 41  1  0

+ 24 42  1  0

+ 24 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5407-04-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+   -1.1802   -0.6521    0.1615 C   0  0  0

+   -2.3254    0.0868   -0.3867 N   0  0  0

+    0.1167    0.0723   -0.2048 C   0  0  0

+   -3.5318   -0.6576   -0.0012 C   0  0  0

+   -2.3776    1.3719    0.3232 C   0  0  0

+    1.3094   -0.6973    0.3661 C   0  0  0

+    2.8377    0.1564   -0.0656 Cl  0  0  0

+   -1.8943   -1.4407    0.0000 H   0  0  0

+   -0.5177   -1.4845    0.0000 H   0  0  0

+    0.8308    0.8609    0.0000 H   0  0  0

+   -0.5458    0.9048    0.0000 H   0  0  0

+   -4.0905    0.2478    0.0000 H   0  0  0

+   -4.4372   -1.2163    0.0000 H   0  0  0

+   -2.9731   -1.5630    0.0000 H   0  0  0

+   -1.3146    1.4151    0.0000 H   0  0  0

+   -2.4208    2.4349    0.0000 H   0  0  0

+   -3.4406    1.3287    0.0000 H   0  0  0

+    0.5953   -1.4859    0.0000 H   0  0  0

+    1.9719   -1.5297    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  2  1  0

+  5  2  1  0

+  6  3  1  0

+  7  6  1  0

+  1  8  1  0

+  1  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  6 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+569-61-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+    0.0000   -0.0241   -0.0048 C   0  0  0

+   -1.2723    0.7110    0.0012 C   0  0  0

+    1.2729    0.7102   -0.0068 C   0  0  0

+   -0.0004   -1.4320   -0.0029 C   0  0  0

+   -1.9006    1.0183    1.2157 C   0  0  0

+   -1.8582    1.1121   -1.2075 C   0  0  0

+    1.9081    1.0122   -1.2190 C   0  0  0

+    1.8523    1.1157    1.2035 C   0  0  0

+    1.2154   -2.1376    0.1387 C   0  0  0

+   -1.2174   -2.1372   -0.1368 C   0  0  0

+   -3.0827    1.7020    1.2166 C   0  0  0

+   -3.0401    1.7953   -1.1971 C   0  0  0

+    3.0906    1.6952   -1.2161 C   0  0  0

+    3.0347    1.7982    1.1970 C   0  0  0

+    1.2173   -3.4911    0.1408 C   0  0  0

+   -1.2202   -3.4907   -0.1353 C   0  0  0

+   -3.6641    2.0941    0.0127 C   0  0  0

+    3.6656    2.0917   -0.0106 C   0  0  0

+   -0.0013   -4.2004    0.0008 C   0  0  0

+   -4.8673    2.7893    0.0185 N   0  0  0

+    4.8692    2.7861   -0.0124 N   0  0  0

+   -0.0017   -5.5263    0.0022 N   0  0  0

+   -2.3821    0.1147    0.0000 H   0  0  0

+   -1.3124    1.9784    0.0000 H   0  0  0

+    2.3844    0.1058    0.0000 H   0  0  0

+    1.3023    1.9793    0.0000 H   0  0  0

+    2.1023   -1.6260    0.0000 H   0  0  0

+   -2.1040   -1.6250    0.0000 H   0  0  0

+   -3.6256    0.8339    0.0000 H   0  0  0

+   -2.5624    2.7009    0.0000 H   0  0  0

+    3.6377    0.8297    0.0000 H   0  0  0

+    2.5624    2.7066    0.0000 H   0  0  0

+    2.1053   -4.0009    0.0000 H   0  0  0

+   -2.1084   -4.0001    0.0000 H   0  0  0

+   -4.8670    3.8132    0.0000 H   0  0  0

+   -5.7542    2.2776    0.0000 H   0  0  0

+    5.7558    2.2739    0.0000 H   0  0  0

+    4.8695    3.8100    0.0000 H   0  0  0

+   -0.0020   -6.5502    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  2  0

+  5  2  2  0

+  6  2  1  0

+  7  3  2  0

+  8  3  1  0

+  9  4  1  0

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+ 11  5  1  0

+ 12  6  2  0

+ 13  7  1  0

+ 14  8  2  0

+ 15  9  2  0

+ 16 10  2  0

+ 17 11  2  0

+ 18 13  2  0

+ 19 15  1  0

+ 20 17  1  0

+ 21 18  1  0

+ 22 19  2  0

+ 12 17  1  0

+ 14 18  1  0

+ 16 19  1  0

+  5 23  1  0

+  6 24  1  0

+  7 25  1  0

+  8 26  1  0

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+ 16 34  1  0

+ 20 35  1  0

+ 20 36  1  0

+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+573-58-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 75                          1 V2000

+    9.7081   -2.0036    0.6882 S   0  0  0

+   10.5068   -1.6452    1.8075 O   0  0  0

+   10.1848   -2.6263   -0.4968 O   0  0  0

+    8.6240   -2.9235    1.2315 O   0  0  0

+    8.9226   -0.5158    0.1646 C   0  0  0

+    9.7035    0.5807   -0.2510 C   0  0  0

+    7.5692   -0.4331    0.1581 C   0  0  0

+    9.0702    1.7762   -0.6718 C   0  0  0

+   11.1058    0.5084   -0.2559 C   0  0  0

+    6.9180    0.7444   -0.2559 C   0  0  0

+    7.6617    1.8538   -0.6683 C   0  0  0

+    9.8551    2.8645   -1.0850 C   0  0  0

+   11.8363    1.5836   -0.6631 C   0  0  0

+    5.5585    0.8031   -0.2541 N   0  0  0

+    7.0228    3.0135   -1.0754 N   0  0  0

+   11.2131    2.7585   -1.0766 C   0  0  0

+    4.8693   -0.2189    0.1264 N   0  0  0

+    3.5054   -0.1601    0.1283 C   0  0  0

+    2.7573   -1.2680    0.5408 C   0  0  0

+    2.8544    1.0102   -0.2769 C   0  0  0

+    1.3825   -1.2043    0.5415 C   0  0  0

+    1.4902    1.0705   -0.2751 C   0  0  0

+    0.7396   -0.0348    0.1308 C   0  0  0

+   -0.7397    0.0352    0.1306 C   0  0  0

+   -1.3827    1.2044    0.5419 C   0  0  0

+   -1.4899   -1.0662   -0.2863 C   0  0  0

+   -2.7575    1.2682    0.5408 C   0  0  0

+   -2.8542   -1.0059   -0.2885 C   0  0  0

+   -3.5055    0.1605    0.1273 C   0  0  0

+   -4.8694    0.2193    0.1251 N   0  0  0

+   -5.5584   -0.8024   -0.2562 N   0  0  0

+   -6.9180   -0.7438   -0.2584 C   0  0  0

+   -7.6613   -1.8525   -0.6722 C   0  0  0

+   -7.5694    0.4318    0.1618 C   0  0  0

+   -7.0222   -3.0117   -1.0804 N   0  0  0

+   -9.0703   -1.7776   -0.6688 C   0  0  0

+   -8.9226    0.5141    0.1689 C   0  0  0

+   -9.7035   -0.5827   -0.2471 C   0  0  0

+   -9.8551   -2.8677   -1.0771 C   0  0  0

+   -9.7084    1.9989    0.7003 S   0  0  0

+  -11.1059   -0.5126   -0.2458 C   0  0  0

+  -11.2133   -2.7640   -1.0629 C   0  0  0

+  -10.4587    2.4592   -0.4152 O   0  0  0

+  -10.2387    1.7157    1.9878 O   0  0  0

+   -8.6175    3.0370    0.9216 O   0  0  0

+  -11.8366   -1.5895   -0.6484 C   0  0  0

+    7.8545   -3.5764    0.0000 H   0  0  0

+    7.0303   -1.2863    0.0000 H   0  0  0

+   11.5550   -0.3953    0.0000 H   0  0  0

+    9.4307    3.7801    0.0000 H   0  0  0

+   12.8440    1.5286    0.0000 H   0  0  0

+    7.5448    3.8772    0.0000 H   0  0  0

+    6.0138    3.0337    0.0000 H   0  0  0

+   11.7666    3.6024    0.0000 H   0  0  0

+    3.2101   -2.1699    0.0000 H   0  0  0

+    3.3850    1.8686    0.0000 H   0  0  0

+    0.8488   -2.0608    0.0000 H   0  0  0

+    1.0376    1.9725    0.0000 H   0  0  0

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+   -1.0380   -1.9685    0.0000 H   0  0  0

+   -3.2103    2.1701    0.0000 H   0  0  0

+   -3.3841   -1.8647    0.0000 H   0  0  0

+   -7.0310    1.2853    0.0000 H   0  0  0

+   -7.5439   -3.8755    0.0000 H   0  0  0

+   -6.0132   -3.0316    0.0000 H   0  0  0

+   -9.4295   -3.7828    0.0000 H   0  0  0

+  -11.5560    0.3906    0.0000 H   0  0  0

+  -11.7660   -3.6084    0.0000 H   0  0  0

+   -7.8864    3.7327    0.0000 H   0  0  0

+  -12.8443   -1.5349    0.0000 H   0  0  0

+  2  1  2  0

+  3  1  2  0

+  4  1  1  0

+  5  1  1  0

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+ 10 11  1  0

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+ 22 23  1  0

+ 28 29  1  0

+ 37 38  1  0

+ 42 46  1  0

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+ 34 63  1  0

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+ 35 65  1  0

+ 39 66  1  0

+ 41 67  1  0

+ 42 68  1  0

+ 45 69  1  0

+ 46 70  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 42                          1 V2000

+   -0.1366   -0.1580   -0.5736 N   0  0  0

+    0.9899   -0.9744   -0.4765 C   0  0  0

+   -0.0824    1.2291   -0.4388 C   0  0  0

+   -1.4345   -0.7851   -0.8349 C   0  0  0

+    2.1021   -0.5982    0.2669 C   0  0  0

+    0.9878   -2.1932   -1.1457 C   0  0  0

+    0.9090    1.8515    0.3095 C   0  0  0

+   -1.0518    1.9977   -1.0744 C   0  0  0

+   -2.2089   -0.9205    0.4777 C   0  0  0

+    2.1596    0.9305    1.1323 S   0  0  0

+    3.2017   -1.4483    0.3329 C   0  0  0

+    2.0852   -3.0308   -1.0740 C   0  0  0

+    0.9188    3.2394    0.4144 C   0  0  0

+   -1.0328    3.3751   -0.9650 C   0  0  0

+   -3.5615   -1.4211    0.1988 N   0  0  0

+   -1.4821   -1.9016    1.3997 C   0  0  0

+    3.1916   -2.6577   -0.3353 C   0  0  0

+   -0.0479    3.9953   -0.2197 C   0  0  0

+   -4.2978   -1.3781    1.4692 C   0  0  0

+   -4.1987   -0.4418   -0.6917 C   0  0  0

+   -1.6704   -1.6786    0.0000 H   0  0  0

+   -0.7215   -1.3729    0.0000 H   0  0  0

+    0.1592   -2.6023    0.0000 H   0  0  0

+   -1.8866    1.6013    0.0000 H   0  0  0

+   -2.4498   -0.0284    0.0000 H   0  0  0

+    4.0329   -1.0445    0.0000 H   0  0  0

+    1.9349   -3.9426    0.0000 H   0  0  0

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+   -2.2246   -2.4517    0.0000 H   0  0  0

+   -0.9320   -2.6441    0.0000 H   0  0  0

+   -0.7396   -1.3515    0.0000 H   0  0  0

+    3.9400   -3.1999    0.0000 H   0  0  0

+   -0.0010    4.9182    0.0000 H   0  0  0

+   -4.2439   -0.4556    0.0000 H   0  0  0

+   -5.2203   -1.3242    0.0000 H   0  0  0

+   -4.3517   -2.3006    0.0000 H   0  0  0

+   -3.4241    0.0622    0.0000 H   0  0  0

+   -4.7027    0.3328    0.0000 H   0  0  0

+   -4.9733   -0.9458    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

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+  5 10  1  0

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+  4 21  1  0

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+ 17 33  1  0

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+ 19 35  1  0

+ 19 36  1  0

+ 19 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+ 20 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59-02-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 81 82                          1 V2000

+   -4.8146   -0.1211    0.3213 C   0  0  0

+   -5.8899    0.6508   -0.0735 C   0  0  0

+   -3.6017    0.3837    0.6521 O   0  0  0

+   -4.9641   -1.5076    0.3975 C   0  0  0

+   -5.7923    2.1532   -0.1931 C   0  0  0

+   -7.1026    0.0529   -0.3782 C   0  0  0

+   -3.3882    1.6331    0.0128 C   0  0  0

+   -6.1679   -2.1024    0.0909 C   0  0  0

+   -3.7962   -2.3616    0.8190 C   0  0  0

+   -4.4819    2.6142    0.4557 C   0  0  0

+   -7.2470   -1.3219   -0.2975 C   0  0  0

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+ 31 80  1  0

+ 31 81  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+590-46-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -0.0242   -0.6129    0.7369 C   0  0  0

+   -1.1747   -0.0833   -0.0073 N   0  3  0

+    1.2473   -0.0251    0.1812 C   0  0  0

+   -0.8771   -0.1002   -1.4458 C   0  0  0

+   -2.3552   -0.9163    0.2583 C   0  0  0

+   -1.4422    1.2961    0.4212 C   0  0  0

+    1.3170    1.1599   -0.0441 O   0  0  0

+    2.3023   -0.8180   -0.0635 O   0  0  0

+   -0.6364   -1.3907    0.0000 H   0  0  0

+    0.5893   -1.3897    0.0000 H   0  0  0

+   -0.9332   -1.0884    0.0000 H   0  0  0

+    0.1111   -0.1563    0.0000 H   0  0  0

+   -0.8210    0.8880    0.0000 H   0  0  0

+   -2.9259   -0.1076    0.0000 H   0  0  0

+   -3.1639   -1.4870    0.0000 H   0  0  0

+   -1.7845   -1.7250    0.0000 H   0  0  0

+   -0.4705    1.4845    0.0000 H   0  0  0

+   -1.6306    2.2678    0.0000 H   0  0  0

+   -2.4139    1.1077    0.0000 H   0  0  0

+    3.0935   -1.4127    0.0000 H   0  0  0

+  2  1  1  0

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+  5 15  1  0

+  5 16  1  0

+  6 17  1  0

+  6 18  1  0

+  6 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+593-56-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+   -0.0865   -0.5311    0.0000 O   0  0  0

+   -1.1962    0.3692    0.0000 C   0  0  0

+    1.1243    0.2901    0.0000 N   0  0  0

+   -0.5129    1.2114    0.0000 H   0  0  0

+   -2.0384    1.0525    0.0000 H   0  0  0

+   -1.8795   -0.4730    0.0000 H   0  0  0

+    2.1002   -0.1828    0.0000 H   0  0  0

+    1.0459    1.3718    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61-73-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+   -5.1068    0.5051   -0.0015 N   0  0  0

+   -6.2426   -0.4202   -0.0014 C   0  0  0

+   -5.3403    1.9514    0.0049 C   0  0  0

+   -3.8111    0.0122   -0.0017 C   0  0  0

+   -2.7367    0.8949   -0.0018 C   0  0  0

+   -3.5932   -1.3738    0.0039 C   0  0  0

+   -1.4647    0.3842   -0.0016 C   0  0  0

+   -2.3524   -1.9141    0.0043 C   0  0  0

+   -1.2099   -1.0692   -0.0014 C   0  0  0

+    0.0000    1.3956   -0.0011 S   0  3  0

+    0.0001   -1.5723   -0.0013 N   0  0  0

+    1.4647    0.3844   -0.0004 C   0  0  0

+    1.2099   -1.0693   -0.0009 C   0  0  0

+    2.7367    0.8950    0.0000 C   0  0  0

+    2.3525   -1.9143   -0.0009 C   0  0  0

+    3.8111    0.0121    0.0005 C   0  0  0

+    3.5932   -1.3739   -0.0007 C   0  0  0

+    5.1067    0.5050    0.0010 N   0  0  0

+    6.2425   -0.4204    0.0015 C   0  0  0

+    5.3403    1.9513    0.0009 C   0  0  0

+   -6.9072    0.3956    0.0000 H   0  0  0

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+   -4.4258   -2.0173    0.0000 H   0  0  0

+   -2.2337   -2.9597    0.0000 H   0  0  0

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+    2.2339   -2.9599    0.0000 H   0  0  0

+    4.4258   -2.0174    0.0000 H   0  0  0

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+ 19 35  1  0

+ 20 36  1  0

+ 20 37  1  0

+ 20 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63-92-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+    0.8934   -1.3909    0.4666 C   0  0  0

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+    0.1967    2.7019    0.9664 C   0  0  0

+    3.6150    0.5746   -0.5735 C   0  0  0

+   -1.7767    0.9752    0.5299 O   0  0  0

+    5.2202    1.3230   -0.2358 Cl  0  0  0

+   -3.0614    0.6495    0.2291 C   0  0  0

+   -4.0755    1.5782    0.4146 C   0  0  0

+   -3.3603   -0.6100   -0.2693 C   0  0  0

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+   -4.9135   -1.9123    0.0000 H   0  0  0

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+  1  2  1  0

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+ 17 39  1  0

+ 18 40  1  0

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+ 20 42  1  0

+ 21 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+632-99-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 44                          1 V2000

+    0.1949   -0.0537   -0.0978 C   0  0  0

+   -1.2444    0.2244   -0.1990 C   0  0  0

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+ 21 38  1  0

+ 21 39  1  0

+ 22 40  1  0

+ 22 41  1  0

+ 23 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+633-96-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+    1.3955    0.2087   -0.3181 N   0  0  0

+    0.5397    0.8481    0.4049 N   0  0  0

+    2.7193    0.4992   -0.2202 C   0  0  0

+   -0.7917    0.5560    0.3065 C   0  0  0

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+    2.2730    2.8294   -0.4428 O   0  0  0

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+   -3.0638    0.9462    0.9833 C   0  0  0

+   -2.5753   -0.7204   -0.6746 C   0  0  0

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+    2.3382   -2.1663    0.0000 H   0  0  0

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+    4.0057   -3.8581    0.0000 H   0  0  0

+    6.3309   -3.2794    0.0000 H   0  0  0

+   -6.3476    1.1780    0.0000 H   0  0  0

+  2  1  2  0

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+ 19 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+65-61-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+   -1.1602    0.1976   -0.0063 C   0  0  0

+   -1.1968   -1.2686   -0.0031 C   0  0  0

+   -0.0001    0.8483   -0.0061 N   0  0  0

+   -2.3806    0.9004   -0.0036 C   0  0  0

+   -0.0002   -1.9885    0.0001 C   0  0  0

+   -2.4440   -1.9271   -0.0029 C   0  0  0

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+   -3.5888   -1.2001   -0.0056 C   0  0  0

+    2.3803    0.9003   -0.0025 C   0  0  0

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+    2.4438   -1.9269    0.0037 C   0  0  0

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+   -6.0404    0.1749    0.0104 C   0  0  0

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+    3.5889   -1.1998    0.0041 C   0  0  0

+    4.7691    0.9025    0.0017 N   0  0  0

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+    4.7636    2.3675   -0.0015 C   0  0  0

+   -2.3860    1.9518    0.0000 H   0  0  0

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+  1  2  1  0

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+ 20 37  1  0

+ 20 38  1  0

+ 20 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67-03-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+    0.6718    0.3022    1.4892 C   0  0  0

+   -0.4481    0.4812    0.5618 N   0  3  0

+    1.9059   -0.0877    0.7173 C   0  0  0

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+   -3.7925   -0.9436   -0.4207 C   0  0  0

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+ 17 34  1  0

+ 18 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+69-05-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 60                          1 V2000

+   -0.2892   -1.4835    0.2564 N   0  0  0

+    0.3398   -1.6216   -1.0639 C   0  0  0

+   -1.0928   -0.3638    0.1975 C   0  0  0

+    1.5844   -2.5037   -0.9461 C   0  0  0

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+   -3.1123   -1.7378    0.2677 C   0  0  0

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+ 28 56  1  0

+ 28 57  1  0

+ 28 58  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6959-47-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.2911    0.0083   -0.9960 C   0  0  0

+   -2.4370   -0.0217    0.3957 Cl  0  0  0

+    0.1251   -0.0064   -0.4810 C   0  0  0

+    0.7645   -1.2140   -0.2754 C   0  0  0

+    0.7417    1.1336   -0.2369 N   0  0  0

+    2.0678   -1.2166    0.1983 C   0  0  0

+    1.9803    1.1692    0.2139 C   0  0  0

+    2.6813    0.0012    0.4484 C   0  0  0

+   -0.7929    0.8749    0.0000 H   0  0  0

+   -1.8029    0.8669    0.0000 H   0  0  0

+    0.2481   -2.0698    0.0000 H   0  0  0

+    2.5912   -2.0682    0.0000 H   0  0  0

+    2.4602    2.0460    0.0000 H   0  0  0

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+  1 10  1  0

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+  6 12  1  0

+  7 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6959-48-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+    0.0886   -0.0400   -0.4907 C   0  0  0

+    0.7240   -1.2462   -0.2397 C   0  0  0

+    0.7737    1.1405   -0.2718 C   0  0  0

+   -1.3289   -0.0161   -1.0016 C   0  0  0

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+    2.0159    1.1274    0.1700 N   0  0  0

+   -2.4701    0.0229    0.3937 Cl  0  0  0

+    2.6514   -0.0010    0.4194 C   0  0  0

+    0.2153   -2.1087    0.0000 H   0  0  0

+    0.2786    2.0109    0.0000 H   0  0  0

+   -1.8540   -0.8687    0.0000 H   0  0  0

+   -0.8480   -0.8944    0.0000 H   0  0  0

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+  1  2  2  0

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+  3 10  1  0

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+  4 12  1  0

+  5 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+72-57-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 86 91                          1 V2000

+    6.7016   -1.8041    0.1564 O   0  0  0

+    7.4958   -0.7228   -0.0369 C   0  0  0

+    8.8949   -0.8549   -0.0080 C   0  0  0

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+    7.0269    3.2310   -0.7704 S   0  0  0

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+    3.4926    0.2164    0.5442 C   0  0  0

+    7.9492    3.9369   -1.5891 O   0  0  0

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+   -6.9211   -0.5236    0.1908 C   0  0  0

+   -7.5688   -1.6298   -0.3916 C   0  0  0

+   -7.6601    0.5831    0.6142 C   0  0  0

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+   -7.0379    1.6465    1.1796 O   0  0  0

+   -9.0557    0.5830    0.4475 C   0  0  0

+   -7.3245   -3.5814   -2.0089 O   0  0  0

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+   -6.6847   -4.0576    0.1990 O   0  0  0

+   -9.6888   -0.5373   -0.1458 C   0  0  0

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+  -11.0829   -0.5342   -0.3103 C   0  0  0

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+  -11.2070    1.6449    0.6821 C   0  0  0

+  -11.8156    0.5418    0.0940 C   0  0  0

+  -13.5644    0.5290   -0.1205 S   0  0  0

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+ 53 85  1  0

+ 58 86  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+81-88-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 67                          1 V2000

+   -0.1218    2.7856    1.6564 C   0  0  0

+   -0.0974    1.5964    1.9024 O   0  0  0

+   -0.1540    3.6810    2.6624 O   0  0  0

+   -0.1101    3.2503    0.2537 C   0  0  0

+   -0.0706    2.3170   -0.8028 C   0  0  0

+   -0.1439    4.6120   -0.0335 C   0  0  0

+   -0.0397    0.8717   -0.5155 C   0  0  0

+   -0.0605    2.7715   -2.1224 C   0  0  0

+   -0.1333    5.0422   -1.3475 C   0  0  0

+    1.1904    0.1870   -0.3544 C   0  0  0

+   -1.2396    0.1284   -0.3867 C   0  0  0

+   -0.0892    4.1270   -2.3854 C   0  0  0

+    1.1828   -1.1983   -0.0792 C   0  0  0

+    2.4104    0.8751   -0.4667 C   0  0  0

+   -1.1729   -1.2549   -0.1107 C   0  0  0

+   -2.4877    0.7572   -0.5320 C   0  0  0

+    0.0188   -1.8706    0.0301 O   0  3  0

+    2.3886   -1.8644    0.0777 C   0  0  0

+    3.5839    0.2043   -0.3099 C   0  0  0

+   -2.3490   -1.9783    0.0145 C   0  0  0

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+    5.7351   -1.4095    1.1536 C   0  0  0

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+   -5.3103   -3.1786    0.0000 H   0  0  0

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+    5.2713   -1.6322    0.0000 H   0  0  0

+   -6.0242   -4.4361    0.0000 H   0  0  0

+   -4.8259   -5.2372    0.0000 H   0  0  0

+   -4.0248   -4.0389    0.0000 H   0  0  0

+   -4.4105   -0.7757    0.0000 H   0  0  0

+   -5.4421    0.2309    0.0000 H   0  0  0

+   -6.4487   -0.8007    0.0000 H   0  0  0

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+ 33 62  1  0

+ 33 63  1  0

+ 33 64  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86-40-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -1.1928    0.3444   -0.0038 C   0  0  0

+   -1.2082   -1.0721   -0.0024 C   0  0  0

+    0.0001    1.0246   -0.0027 N   0  3  0

+   -2.3959    1.0388   -0.0004 C   0  0  0

+    0.0002   -1.7823    0.0001 C   0  0  0

+   -2.4402   -1.7581   -0.0030 C   0  0  0

+    1.1927    0.3445   -0.0012 C   0  0  0

+    0.0001    2.4896   -0.0037 C   0  0  0

+   -3.5940    0.3425    0.0042 C   0  0  0

+    1.2081   -1.0722    0.0011 C   0  0  0

+   -3.6046   -1.0586   -0.0050 C   0  0  0

+    2.3958    1.0389   -0.0006 C   0  0  0

+   -4.7938    1.0389    0.0081 N   0  0  0

+    2.4403   -1.7582    0.0031 C   0  0  0

+    3.5939    0.3425    0.0005 C   0  0  0

+    3.6046   -1.0586    0.0035 C   0  0  0

+    4.7937    1.0389    0.0011 N   0  0  0

+   -2.3975    2.0806    0.0000 H   0  0  0

+    0.0003   -2.8241    0.0000 H   0  0  0

+   -2.4573   -2.7998    0.0000 H   0  0  0

+    1.0419    2.4896    0.0000 H   0  0  0

+    0.0001    3.5314    0.0000 H   0  0  0

+   -1.0417    2.4896    0.0000 H   0  0  0

+   -4.5133   -1.5682    0.0000 H   0  0  0

+    2.3974    2.0807    0.0000 H   0  0  0

+   -4.7914    2.0807    0.0000 H   0  0  0

+   -5.6973    0.5201    0.0000 H   0  0  0

+    2.4575   -2.7999    0.0000 H   0  0  0

+    4.5133   -1.5682    0.0000 H   0  0  0

+    5.6972    0.5201    0.0000 H   0  0  0

+    4.7913    2.0807    0.0000 H   0  0  0

+  1  2  2  0

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+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+92-31-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 37                          1 V2000

+    4.8296    0.2213    0.0017 N   0  0  0

+    5.8708   -0.8093    0.0019 C   0  0  0

+    5.2014    1.6383   -0.0049 C   0  0  0

+    3.4924   -0.1445    0.0019 C   0  0  0

+    2.5081    0.8378    0.0017 C   0  0  0

+    3.1419   -1.5030   -0.0035 C   0  0  0

+    1.1928    0.4521    0.0015 C   0  0  0

+    1.8547   -1.9211   -0.0040 C   0  0  0

+    0.7990   -0.9700    0.0015 C   0  0  0

+   -0.1676    1.5999    0.0007 S   0  3  0

+   -0.4539   -1.3541    0.0013 N   0  0  0

+   -1.7230    0.7347    0.0001 C   0  0  0

+   -1.6095   -0.7368    0.0008 C   0  0  0

+   -2.9399    1.3656   -0.0006 C   0  0  0

+   -2.8283   -1.4677    0.0008 C   0  0  0

+   -4.0943    0.5904   -0.0011 C   0  0  0

+   -4.0111   -0.8102    0.0004 C   0  0  0

+   -5.3364    1.2059   -0.0017 N   0  0  0

+   -5.2868   -1.6125   -0.0001 C   0  0  0

+    5.1306   -1.5571    0.0000 H   0  0  0

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+    5.4685    2.6561    0.0000 H   0  0  0

+    4.1836    1.9054    0.0000 H   0  0  0

+    2.7680    1.8574    0.0000 H   0  0  0

+    3.9085   -2.2238    0.0000 H   0  0  0

+    1.6357   -2.9503    0.0000 H   0  0  0

+   -2.9993    2.4162    0.0000 H   0  0  0

+   -2.8110   -2.5198    0.0000 H   0  0  0

+   -5.4032    2.2560    0.0000 H   0  0  0

+   -6.2124    0.6230    0.0000 H   0  0  0

+   -5.8470   -0.7218    0.0000 H   0  0  0

+   -6.1775   -2.1727    0.0000 H   0  0  0

+   -4.7266   -2.5032    0.0000 H   0  0  0

+  2  1  1  0

+  3  1  1  0

+  4  1  1  0

+  5  4  2  0

+  6  4  1  0

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+ 15 30  1  0

+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+108-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.6579   -1.1763   -0.0019 C   0  0  0

+   -0.6897   -1.1579   -0.0012 N   0  0  0

+    1.3476   -0.0183   -0.0012 N   0  0  0

+    1.2511   -2.2368    0.0020 O   0  0  0

+   -1.3476    0.0183    0.0001 C   0  0  0

+    0.6897    1.1579    0.0001 C   0  0  0

+   -0.6579    1.1763    0.0008 N   0  0  0

+   -2.5627    0.0349    0.0003 O   0  0  0

+    1.3115    2.2019    0.0003 O   0  0  0

+   -1.2070   -2.0263    0.0000 H   0  0  0

+    2.3583   -0.0320    0.0000 H   0  0  0

+   -1.1513    2.0585    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  5  8  2  0

+  6  9  2  0

+  6  7  1  0

+  2 10  1  0

+  3 11  1  0

+  7 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1127-45-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 20                          1 V2000

+   -0.0116    0.1118   -0.0021 C   0  0  0

+    0.0089   -1.3045   -0.0011 C   0  0  0

+    1.2116    0.8145   -0.0011 C   0  0  0

+   -1.1801    0.7607    0.0014 N   0  3  0

+    1.2396   -1.9814    0.0014 C   0  0  0

+   -1.2121   -2.0044   -0.0021 C   0  0  0

+    2.3886    0.1216    0.0009 C   0  0  0

+    1.2188    2.1728   -0.0026 O   0  0  0

+   -2.3204    0.1114    0.0060 C   0  0  0

+   -1.1877    2.1767    0.0008 O   0  5  0

+    2.4012   -1.2707    0.0028 C   0  0  0

+   -2.3706   -1.2803   -0.0040 C   0  0  0

+    1.2637   -3.0254    0.0000 H   0  0  0

+   -1.2320   -3.0485    0.0000 H   0  0  0

+    3.2928    0.6440    0.0000 H   0  0  0

+    1.2243    3.2171    0.0000 H   0  0  0

+   -3.2136    0.6524    0.0000 H   0  0  0

+    3.3144   -1.7771    0.0000 H   0  0  0

+   -3.2929   -1.7700    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  2  0

+  3  8  1  0

+  4  9  1  0

+  4 10  1  0

+  5 11  2  0

+  6 12  1  0

+  7 11  1  0

+  9 12  2  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+115-02-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    0.4887   -0.6993    0.4485 O   0  0  0

+   -0.6043    0.1297    0.0484 C   0  0  0

+    1.6214   -0.0523    0.0910 C   0  0  0

+   -1.9231   -0.5480    0.4259 C   0  0  1

+    2.8699   -0.6273    0.3574 C   0  0  0

+    1.5552    1.0304   -0.4625 O   0  0  0

+   -3.0759    0.3262    0.0040 C   0  0  0

+   -2.0187   -1.8464   -0.2545 N   0  0  0

+    3.9167   -0.0293    0.0270 N   0  3  0

+   -3.5657    1.2458    0.8503 O   0  0  0

+   -3.5592    0.1995   -1.0961 O   0  0  0

+    4.8579    0.5084   -0.2701 N   0  5  0

+    0.0948    0.8114    0.0000 H   0  0  0

+   -1.1746    0.9223    0.0000 H   0  0  0

+   -2.8130   -0.9499    0.0000 H   0  0  0

+    2.9126   -1.6028    0.0000 H   0  0  0

+   -2.8979   -2.2712    0.0000 H   0  0  0

+   -1.2112   -2.3954    0.0000 H   0  0  0

+   -4.0247    2.1076    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  1  0

+  5  9  2  0

+  7 10  1  0

+  7 11  2  0

+  9 12  2  0

+  2 13  1  0

+  2 14  1  0

+  4 15  1  0

+  5 16  1  0

+  8 17  1  0

+  8 18  1  0

+ 10 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+115-28-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -0.2573   -1.1416    0.0120 C   0  0  1

+    0.6773   -0.8220   -1.1974 C   0  0  0

+    0.1008    0.0505    0.9726 C   0  0  0

+   -1.6400   -0.6858   -0.4686 C   0  0  0

+   -0.1348   -2.8028    0.7021 Cl  0  0  0

+    0.6698    0.7245   -1.2690 C   0  0  0

+    2.0728   -1.3041   -0.8950 C   0  0  0

+   -0.2684    1.1453   -0.0938 C   0  0  1

+   -0.9677    0.1125    2.4235 Cl  0  0  0

+    1.8486    0.0794    1.4145 Cl  0  0  0

+   -1.6465    0.6336   -0.5297 C   0  0  0

+   -2.9710   -1.7271   -0.8660 Cl  0  0  0

+    2.0604    1.2459   -1.0130 C   0  0  0

+    2.4606   -2.5271   -1.2894 O   0  0  0

+    2.8425   -0.5897   -0.2974 O   0  0  0

+   -0.1846    2.8633    0.4467 Cl  0  0  0

+   -2.9875    1.6209   -1.0201 Cl  0  0  0

+    2.9750    1.2288   -1.9953 O   0  0  0

+    2.3520    1.6794    0.0765 O   0  0  0

+    0.6757   -1.8627    0.0000 H   0  0  0

+    0.7025    1.7647    0.0000 H   0  0  0

+    2.7752   -3.5192    0.0000 H   0  0  0

+    4.0156    1.2093    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  2  0

+  4 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  2  0

+  8 16  1  0

+ 11 17  1  0

+ 13 18  1  0

+ 13 19  2  0

+  6  8  1  0

+  8 11  1  0

+  2 20  1  0

+  6 21  1  0

+ 14 22  1  0

+ 18 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+119-39-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.4758    0.9103   -0.0027 C   0  0  0

+   -0.1299   -0.4603   -0.0016 C   0  0  0

+    0.5991    1.9027   -0.0017 C   0  0  0

+   -1.8217    1.2816    0.0011 C   0  0  0

+    1.2940   -0.8177    0.0004 C   0  0  0

+   -1.1345   -1.4272   -0.0020 C   0  0  0

+    1.8403    1.5168    0.0001 N   0  0  0

+   -2.7898    0.3166    0.0059 C   0  0  0

+    2.2114    0.1720    0.0012 N   0  0  0

+    1.6409   -1.9854    0.0018 O   0  0  0

+   -2.4540   -1.0312   -0.0035 C   0  0  0

+    0.3692    2.9208    0.0000 H   0  0  0

+   -2.0873    2.2910    0.0000 H   0  0  0

+   -0.8891   -2.4417    0.0000 H   0  0  0

+   -3.7953    0.5964    0.0000 H   0  0  0

+    3.2254   -0.0752    0.0000 H   0  0  0

+   -3.2093   -1.7515    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  2  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  7  9  1  0

+  8 11  1  0

+  3 12  1  0

+  4 13  1  0

+  6 14  1  0

+  8 15  1  0

+  9 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+121-66-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+    0.5655    0.1969   -0.0027 C   0  0  0

+   -0.7502   -1.0120   -0.0021 S   0  0  0

+   -0.1492    1.3474   -0.0005 C   0  0  0

+    2.0325   -0.0037    0.0002 N   0  3  0

+   -2.0818    0.1026    0.0009 C   0  0  0

+   -1.4668    1.2698    0.0013 N   0  0  0

+    2.7788    0.9589   -0.0007 O   0  0  0

+    2.4930   -1.1313    0.0035 O   0  5  0

+   -3.4418   -0.1653    0.0021 N   0  0  0

+    0.3181    2.2493    0.0000 H   0  0  0

+   -4.1102    0.5997    0.0000 H   0  0  0

+   -3.7701   -1.1266    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  5  6  2  0

+  3 10  1  0

+  9 11  1  0

+  9 12  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1214-39-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    2.0312   -0.4907    0.0010 C   0  0  0

+    1.0172    0.4693    0.0008 C   0  0  0

+    3.3673   -0.0583    0.0007 C   0  0  0

+    2.0753   -1.8689   -0.0039 N   0  0  0

+   -0.3158    0.0916    0.0007 N   0  0  0

+    1.3598    1.7548    0.0003 N   0  0  0

+    4.1354   -1.1640    0.0005 N   0  0  0

+    3.6160    1.2554    0.0002 N   0  0  0

+    3.3793   -2.2265   -0.0010 C   0  0  0

+   -1.3664    1.1125    0.0005 C   0  0  0

+    2.6284    2.1228    0.0000 C   0  0  0

+   -2.7168    0.4436    0.0003 C   0  0  0

+   -3.3362    0.1370    1.1972 C   0  0  0

+   -3.3387    0.1418   -1.1971 C   0  0  0

+   -4.5751   -0.4767    1.1971 C   0  0  0

+   -4.5772   -0.4716   -1.1972 C   0  0  0

+   -5.1942   -0.7836    0.0001 C   0  0  0

+    1.2823   -2.4940    0.0000 H   0  0  0

+   -0.5631   -0.8874    0.0000 H   0  0  0

+    3.7182   -3.1776    0.0000 H   0  0  0

+   -0.5854    1.7525    0.0000 H   0  0  0

+   -1.9140    1.9609    0.0000 H   0  0  0

+    2.8479    3.1084    0.0000 H   0  0  0

+   -3.7843    1.0419    0.0000 H   0  0  0

+   -3.7832    1.0484    0.0000 H   0  0  0

+   -5.0234    0.4280    0.0000 H   0  0  0

+   -5.0291    0.4314    0.0000 H   0  0  0

+   -6.0971   -1.2357    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  6 11  1  0

+ 10 12  1  0

+ 12 13  2  0

+ 12 14  1  0

+ 13 15  1  0

+ 14 16  2  0

+ 15 17  2  0

+  7  9  2  0

+  8 11  2  0

+ 16 17  1  0

+  4 18  1  0

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+  9 20  1  0

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+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 15 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1250-95-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 75 79                          1 V2000

+   -4.0971    0.5806   -0.5314 C   0  0  2

+   -3.2859   -0.5094    0.1436 C   0  0  1

+   -3.5130    1.9211   -0.8849 C   0  0  1

+   -4.4165    1.7589    0.2212 O   0  0  0

+   -5.2758    0.0233   -1.3580 C   0  0  0

+   -2.0382   -0.0021    0.8383 C   0  0  2

+   -4.1969   -1.2993    1.0836 C   0  0  0

+   -2.8346   -1.4801   -0.9496 C   0  0  0

+   -2.1417    2.2141   -0.3086 C   0  0  0

+   -6.1524   -0.8094   -0.4156 C   0  0  2

+   -1.2986    0.9590   -0.1053 C   0  0  1

+   -1.1738   -1.1954    1.2393 C   0  0  0

+   -5.3274   -1.9123    0.2457 C   0  0  0

+   -7.2246   -1.3957   -1.1563 O   0  0  0

+    0.0108    1.3502    0.5587 C   0  0  1

+    0.1931   -0.7682    1.7909 C   0  0  0

+    0.8622    0.0628    0.7108 C   0  0  2

+    0.9358    2.2389   -0.2804 C   0  0  0

+    2.2514    0.5999    1.0431 C   0  0  2

+    0.8985   -0.7027   -0.6133 C   0  0  0

+    2.3301    1.9857    0.3555 C   0  0  0

+    3.3126   -0.3266    0.4460 C   0  0  1

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+    3.3823   -1.6169    1.2653 C   0  0  0

+    5.7351   -0.5556   -0.1208 C   0  0  0

+    7.0965    0.1420   -0.0905 C   0  0  0

+    8.1576   -0.7845   -0.6876 C   0  0  0

+    7.7876   -1.1181   -2.1342 C   0  0  0

+    9.5190   -0.0869   -0.6573 C   0  0  0

+   -3.7107    2.9268    0.0000 H   0  0  0

+   -5.3005    1.0479    0.0000 H   0  0  0

+   -6.2224    0.4163    0.0000 H   0  0  0

+   -2.6589    0.8135    0.0000 H   0  0  0

+   -4.1500   -2.3232    0.0000 H   0  0  0

+   -3.2550   -1.7035    0.0000 H   0  0  0

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+    9.9864   -0.9991    0.0000 H   0  0  0

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+  1  2  1  0

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+ 28 72  1  0

+ 29 73  1  0

+ 29 74  1  0

+ 29 75  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+130-01-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 51                          1 V2000

+    2.6484   -0.4249   -0.5917 C   0  0  2

+    1.6678   -0.9442    0.4232 C   0  0  1

+    4.0021   -0.6137    0.0667 N   0  0  0

+    2.4850    1.0613   -0.7669 C   0  0  0

+    2.4299   -1.3747    1.6630 C   0  0  0

+    0.3041   -0.9677    0.3203 O   0  0  0

+    3.6994   -0.4690    1.5373 C   0  0  0

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+    3.6220    1.6740   -0.5501 C   0  0  0

+    1.2138    1.7654   -1.1712 C   0  0  0

+   -0.4926   -1.9739   -0.0774 C   0  0  0

+    0.1274    1.4168   -0.2756 O   0  0  0

+   -1.9328   -1.9218    0.2086 C   0  0  0

+   -0.0233   -2.9241   -0.6723 O   0  0  0

+   -1.0693    2.0172   -0.4147 C   0  0  0

+   -2.5155   -0.7694    0.9850 C   0  0  0

+   -2.7278   -2.8987   -0.2212 C   0  0  0

+   -2.2068    1.6666    0.5086 C   0  0  2

+   -1.2316    2.8411   -1.2835 O   0  0  0

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+ 24 48  1  0

+ 24 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13010-08-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    0.5960   -0.9513   -0.2248 N   0  0  0

+   -0.7320   -0.6792    0.0641 C   0  0  0

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+    2.2506   -2.3588   -0.2315 O   0  0  0

+   -2.6430    0.7725   -0.0724 N   0  3  0

+    3.1107    1.8836   -0.2967 C   0  0  0

+   -3.3240   -0.0589    0.5009 O   0  0  0

+   -3.1395    1.8264   -0.4276 O   0  5  0

+    3.8846    2.5900    0.8183 C   0  0  0

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+ 13 23  1  0

+ 13 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+134-58-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+   -0.4922    0.9423   -0.0025 C   0  0  0

+   -0.7420   -0.4364   -0.0019 C   0  0  0

+    0.7696    1.3894   -0.0014 N   0  0  0

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+    0.3668   -1.3230   -0.0001 C   0  0  0

+   -2.0728   -0.6159   -0.0029 N   0  0  0

+    1.7862    0.5566    0.0003 C   0  0  0

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+    1.6105   -0.7953    0.0010 N   0  0  0

+    0.2008   -2.5302    0.0009 O   0  0  0

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+  4 12  1  0

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+ 11 14  1  0

+ 11 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+137-66-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 67                          1 V2000

+    7.4122    0.1660    0.7942 C   0  0  1

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+ 29 67  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+137-89-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 66 66                          1 V2000

+    1.1612    0.3220    0.0143 C   0  0  0

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+ 28 64  1  0

+ 28 65  1  0

+ 28 66  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1397-89-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+138140                          1 V2000

+    5.7509    0.3438    1.6976 C   0  0  2

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+ 65138  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1445-69-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.3582    0.7046   -0.0023 C   0  0  0

+   -0.3582   -0.7044   -0.0016 C   0  0  0

+    0.9412    1.4112   -0.0011 C   0  0  0

+   -1.5619    1.3952    0.0016 C   0  0  0

+    0.9410   -1.4113    0.0003 C   0  0  0

+   -1.5620   -1.3950   -0.0023 C   0  0  0

+    2.0839    0.6976    0.0007 N   0  0  0

+    0.9777    2.6261   -0.0012 O   0  0  0

+   -2.7540    0.6919    0.0062 C   0  0  0

+    2.0839   -0.6979    0.0014 N   0  0  0

+    0.9772   -2.6262    0.0014 O   0  0  0

+   -2.7540   -0.6917   -0.0036 C   0  0  0

+   -1.5682    2.4333    0.0000 H   0  0  0

+   -1.5683   -2.4331    0.0000 H   0  0  0

+    2.9918    1.2010    0.0000 H   0  0  0

+   -3.6554    1.2067    0.0000 H   0  0  0

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+   -3.6554   -1.2065    0.0000 H   0  0  0

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+ 10 17  1  0

+ 12 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+148-82-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 37                          1 V2000

+   -0.7989    0.0948   -0.2399 C   0  0  0

+   -2.1755   -0.0582   -0.0601 N   0  0  0

+   -0.1872    1.3038    0.0651 C   0  0  0

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+   -2.8298   -1.3111   -0.4452 C   0  0  0

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+ 15 34  1  0

+ 17 35  1  0

+ 17 36  1  0

+ 18 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+149-30-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 16                          1 V2000

+   -0.7544    0.7135   -0.0029 C   0  0  0

+   -1.0234   -0.6740   -0.0011 C   0  0  0

+    0.5522    1.0567   -0.0023 N   0  0  0

+   -1.8811    1.5679    0.0006 C   0  0  0

+    0.6085   -1.3765    0.0013 S   0  0  0

+   -2.2984   -1.1813   -0.0010 C   0  0  0

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+   -3.1510    1.0523    0.0053 C   0  0  0

+   -3.3776   -0.3163   -0.0028 C   0  0  0

+    3.2596    0.4182    0.0004 S   0  0  0

+   -1.7446    2.5993    0.0000 H   0  0  0

+   -2.4523   -2.2103    0.0000 H   0  0  0

+   -3.9635    1.7021    0.0000 H   0  0  0

+   -4.3493   -0.6882    0.0000 H   0  0  0

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+  1  2  2  0

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+  8  9  1  0

+  4 11  1  0

+  6 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 10 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+149-32-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    0.6823   -0.2285   -0.2599 C   0  0  1

+   -0.6823    0.2285    0.2599 C   0  0  2

+    1.7788    0.6507    0.3447 C   0  0  0

+    0.9029   -1.5899    0.1141 O   0  0  0

+   -1.7788   -0.6507   -0.3447 C   0  0  0

+   -0.9029    1.5899   -0.1141 O   0  0  0

+    3.0532    0.2239   -0.1409 O   0  0  0

+   -3.0532   -0.2239    0.1409 O   0  0  0

+    0.5008    0.7898    0.0000 H   0  0  0

+   -0.5008   -0.7898    0.0000 H   0  0  0

+    2.2871    1.5515    0.0000 H   0  0  0

+    0.9906    1.3205    0.0000 H   0  0  0

+    1.0683   -2.6109    0.0000 H   0  0  0

+   -2.2871   -1.5515    0.0000 H   0  0  0

+   -0.9906   -1.3205    0.0000 H   0  0  0

+   -1.0683    2.6109    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1686-14-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.1529   -1.0762    0.0941 C   0  0  2

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+   -0.1476    0.6021    0.0000 H   0  0  0

+    2.1695   -1.6389    0.0000 H   0  0  0

+    3.5685   -1.1235    0.0000 H   0  0  0

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+    0.7482    2.0926    0.0000 H   0  0  0

+   -0.6033    2.3164    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1747-60-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.4240    0.8185    0.0023 C   0  0  0

+    0.1747   -0.5722    0.0002 C   0  0  0

+    1.7276    1.1798    0.0025 N   0  0  0

+   -0.7131    1.6585   -0.0016 C   0  0  0

+   -1.0928   -1.0987   -0.0002 C   0  0  0

+    1.8164   -1.2516   -0.0014 S   0  0  0

+    2.7025    0.3004    0.0008 C   0  0  0

+   -1.9769    1.1289   -0.0070 C   0  0  0

+   -2.1874   -0.2466    0.0015 C   0  0  0

+    4.0659    0.5191    0.0007 N   0  0  0

+   -3.4509   -0.7494    0.0007 O   0  0  0

+   -4.3405    0.3689    0.0029 C   0  0  0

+   -0.5889    2.6914    0.0000 H   0  0  0

+   -1.2317   -2.1298    0.0000 H   0  0  0

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+    4.7222   -0.2881    0.0000 H   0  0  0

+    4.4368    1.4911    0.0000 H   0  0  0

+   -3.5263    1.0166    0.0000 H   0  0  0

+   -4.9882    1.1831    0.0000 H   0  0  0

+   -5.1547   -0.2788    0.0000 H   0  0  0

+  1  2  2  0

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+ 10 16  1  0

+ 10 17  1  0

+ 12 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+18172-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 49                          1 V2000

+    0.3412   -0.0166   -0.7458 C   0  0  1

+   -0.6888    0.0327    0.3845 C   0  0  2

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+ 25 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18883-66-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 32                          1 V2000

+    0.1498   -0.6205    0.1196 C   0  0  1

+   -1.0080    0.3797    0.1338 C   0  0  2

+    1.4190    0.0999    0.2474 N   0  0  0

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+ 16 32  1  0

+ 17 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21259-20-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 67                          1 V2000

+   -1.9369   -0.1915    0.8919 C   0  0  2

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+ 32 64  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21794-01-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 70                          1 V2000

+    0.2064   -1.8488    0.4524 C   0  0  0

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+ 35 66  1  0

+ 36 67  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2270-40-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 55                          1 V2000

+    0.1728    2.3110    0.1960 C   0  0  2

+   -0.1664    0.9289    0.7997 C   0  0  2

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+   -2.1424   -3.3449    0.0000 H   0  0  0

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+ 25 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23255-69-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 50                          1 V2000

+   -0.5477   -0.5933   -0.7067 C   0  0  2

+   -0.5311   -1.8903    0.1161 C   0  0  2

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+ 25 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23282-20-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 45                          1 V2000

+    2.1775    0.0569   -0.1957 C   0  0  1

+    0.8058    0.3010   -0.8869 C   0  0  2

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+  1  2  1  0

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+ 22 40  1  0

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+ 22 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2349-67-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+    1.8145    0.0809   -0.0015 C   0  0  0

+    0.4330   -1.0514   -0.0008 S   0  0  0

+    1.1959    1.2454   -0.0010 N   0  0  0

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+   -2.6188   -0.0658    0.0006 S   0  0  0

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+  5  7  1  0

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+  4  8  1  0

+  4  9  1  0

+  7 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+24815-24-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 88 93                          1 V2000

+   -3.8693    0.2045   -0.2797 C   0  0  0

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+ 46 87  1  0

+ 46 88  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2550-75-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+    1.1423    0.4426    0.1576 C   0  0  1

+    0.0021    1.5251    0.1367 C   0  0  0

+    0.7387   -0.3701    1.4284 C   0  0  0

+    0.6814   -0.4473   -1.0028 C   0  0  0

+    2.8384    1.0516    0.1013 Cl  0  0  0

+   -1.1464    0.4518    0.1042 C   0  0  2

+   -0.0288    2.5237    1.6376 Cl  0  0  0

+    0.0410    2.5395   -1.3534 Cl  0  0  0

+   -0.8090   -0.3639    1.3923 C   0  0  0

+    1.2461   -1.8075    1.2969 C   0  0  0

+   -0.6391   -0.4420   -1.0336 C   0  0  0

+    1.7189   -1.3141   -2.0917 Cl  0  0  0

+   -2.8315    1.0733   -0.0542 Cl  0  0  0

+   -1.3213   -1.7972    1.2371 C   0  0  0

+    3.0491   -1.8117    1.3077 Cl  0  0  0

+   -1.6317   -1.3011   -2.1695 Cl  0  0  0

+   -3.1198   -1.8096    1.3630 Cl  0  0  0

+    1.8145   -0.4356    0.0000 H   0  0  0

+   -1.8864   -0.3903    0.0000 H   0  0  0

+    0.1956   -2.0484    0.0000 H   0  0  0

+    1.3661   -2.8786    0.0000 H   0  0  0

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+ 14 22  1  0

+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+29975-16-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 35                          1 V2000

+    1.4234   -0.7693   -0.0018 C   0  0  0

+    0.1398   -0.2061   -0.0009 C   0  0  0

+    2.6576   -0.0830   -0.0013 N   0  0  0

+    1.5759   -2.1381    0.0029 C   0  0  0

+   -0.2156    1.2340   -0.0004 C   0  0  0

+   -0.9778   -1.0294   -0.0011 C   0  0  0

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+    0.4535   -2.9575    0.0080 C   0  0  0

+   -1.6568    1.5469    0.0000 C   0  0  0

+    0.6025    2.2677   -0.0005 N   0  0  0

+   -0.8134   -2.4070   -0.0016 C   0  0  0

+    1.9372    2.3020    0.0009 C   0  0  0

+    4.2155    1.4748    0.0005 N   0  0  0

+    4.8132    0.2070   -0.0006 N   0  0  0

+   -2.3444    1.6937   -1.2087 C   0  0  0

+   -2.3441    1.6926    1.2094 C   0  0  0

+   -2.2060   -3.4435   -0.0018 Cl  0  0  0

+   -3.6920    1.9857   -1.2002 C   0  0  0

+   -3.6913    1.9846    1.2016 C   0  0  0

+   -4.3641    2.1336    0.0007 C   0  0  0

+    2.5223   -2.5546    0.0000 H   0  0  0

+   -1.9267   -0.6186    0.0000 H   0  0  0

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+   -5.3738    2.3565    0.0000 H   0  0  0

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+ 20 31  1  0

+ 21 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3048-64-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.1822   -0.9814    0.3810 C   0  0  1

+    0.7514   -0.0544   -0.4601 C   0  0  0

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+   -2.0654   -0.0758   -0.6192 C   0  0  0

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+  7 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+30516-87-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+    0.2872   -0.2119   -0.9857 C   0  0  1

+   -1.0802   -0.0327   -0.4915 N   0  0  0

+    1.1619    0.9664   -0.5155 C   0  0  0

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+    2.2847    0.2978    0.3146 C   0  0  1

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+   -3.3640    0.2259   -0.9396 N   0  0  0

+   -1.8712   -0.0039   -2.5590 O   0  0  0

+   -2.5711    0.1974    1.3112 C   0  0  0

+    3.5721    0.9102   -0.0229 N   0  0  0

+    2.7808   -2.1038    0.8716 C   0  0  0

+   -3.6323    0.3001    0.3797 C   0  0  0

+   -2.8445    0.2715    2.7913 C   0  0  0

+    3.7415    2.0046    0.1696 N   0  3  0

+    2.6343   -3.4570    0.4365 O   0  0  0

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+    3.9110    3.0989    0.3622 N   0  5  0

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+   -3.0825   -0.6065    0.0000 H   0  0  0

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+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+309-00-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 29                          1 V2000

+    0.3785   -1.1453   -0.1763 C   0  0  1

+   -0.3129   -0.8030   -1.5323 C   0  0  2

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+   -0.6203   -0.6514    0.8768 C   0  0  0

+    0.9916   -2.8312    0.0046 Cl  0  0  0

+   -0.3184    0.7592   -1.5539 C   0  0  2

+   -1.8206   -1.1688   -1.3675 C   0  0  1

+    0.3689    1.1431   -0.2070 C   0  0  1

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+   -0.6259    0.6692    0.8588 C   0  0  0

+   -1.5810   -1.6570    1.9157 Cl  0  0  0

+   -1.8287    1.1191   -1.4009 C   0  0  2

+   -2.2972   -0.0124   -0.4156 C   0  0  0

+   -2.4539   -0.7051   -2.6844 C   0  0  0

+    0.9648    2.8374   -0.0481 Cl  0  0  0

+   -1.5958    1.6943    1.8698 Cl  0  0  0

+   -2.4584    0.6125   -2.7036 C   0  0  0

+   -0.4222   -1.7851    0.0000 H   0  0  0

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+  1  2  1  0

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+ 13 22  1  0

+ 14 23  1  0

+ 14 24  1  0

+ 15 25  1  0

+ 18 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+315-22-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 48                          1 V2000

+    2.4753    0.6260   -0.7741 C   0  0  2

+    1.8523   -0.7604   -1.1135 C   0  0  1

+    3.8798    0.2059   -0.3510 N   0  0  0

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+    0.4360   -0.7757   -0.8866 O   0  0  0

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+   -4.3016   -1.5548    0.0000 H   0  0  0

+   -3.1210   -2.0374    0.0000 H   0  0  0

+   -0.3290   -0.6177    0.0000 H   0  0  0

+   -3.8303    1.7023    0.0000 H   0  0  0

+   -4.7881    0.8601    0.0000 H   0  0  0

+   -3.9459   -0.0977    0.0000 H   0  0  0

+   -2.3408    2.4702    0.0000 H   0  0  0

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+ 18 23  1  0

+  5  7  1  0

+  8  9  1  0

+ 16 18  1  0

+  1 24  1  0

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+  5 26  1  0

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+ 21 42  1  0

+ 22 43  1  0

+ 22 44  1  0

+ 22 45  1  0

+ 23 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+320-67-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    0.4519   -0.3609    0.4467 C   0  0  2

+   -0.9455   -0.0606    0.1254 N   0  0  0

+    1.2164    0.8643    0.4617 O   0  0  0

+    1.0732   -1.1998   -0.6920 C   0  0  1

+   -1.9285   -0.4071    0.9819 C   0  0  0

+   -1.2575    0.5701   -1.0280 C   0  0  0

+    2.5867    0.4604    0.2495 C   0  0  1

+    2.5099   -0.6471   -0.8247 C   0  0  1

+    1.1254   -2.5725   -0.2983 O   0  0  0

+   -3.1985   -0.1271    0.6761 N   0  0  0

+   -1.6596   -0.9725    2.0281 O   0  0  0

+   -2.5080    0.8366   -1.3112 N   0  0  0

+    3.3888    1.6441   -0.2949 C   0  0  0

+    3.4479   -1.6790   -0.5128 O   0  0  0

+   -3.4857    0.4874   -0.4629 C   0  0  0

+    3.3842    2.7038    0.6638 O   0  0  0

+   -4.7919    0.7732   -0.7731 N   0  0  0

+   -0.0720   -1.1738    0.0000 H   0  0  0

+    0.1607   -1.5203    0.0000 H   0  0  0

+   -0.6640    1.3337    0.0000 H   0  0  0

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+    1.1622   -3.5390    0.0000 H   0  0  0

+    3.9754    0.8751    0.0000 H   0  0  0

+    4.3044    1.9556    0.0000 H   0  0  0

+    4.0984   -2.3947    0.0000 H   0  0  0

+    3.3800    3.6709    0.0000 H   0  0  0

+   -5.0853    1.6948    0.0000 H   0  0  0

+   -5.4433    0.0583    0.0000 H   0  0  0

+  1  2  1  0

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+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+327-97-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 44                          1 V2000

+    2.0978    0.7870    0.1547 C   0  0  2

+    2.7029   -0.5263    0.6547 C   0  0  0

+    3.0260    1.9474    0.5186 C   0  0  1

+    0.8222    0.9873    0.7669 O   0  0  0

+    4.0686   -0.7408   -0.0008 C   0  0  1

+    4.3918    1.7330   -0.1369 C   0  0  1

+    2.4609    3.1740    0.0516 O   0  0  0

+   -0.0925    0.4101   -0.0398 C   0  0  0

+    4.9969    0.4197    0.3632 C   0  0  0

+    4.6647   -2.0343    0.4917 C   0  0  0

+    3.9120   -0.7983   -1.4200 O   0  0  0

+    4.2351    1.6753   -1.5561 O   0  0  0

+   -1.4666    0.4452    0.3076 C   0  0  0

+    0.2618   -0.1404   -1.0651 O   0  0  0

+    4.9027   -2.2079    1.8013 O   0  0  0

+    4.9283   -2.9151   -0.2922 O   0  0  0

+   -2.3825   -0.1327   -0.5001 C   0  0  0

+   -3.8068   -0.0963   -0.1400 C   0  0  0

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+   -6.4948   -0.0244    0.5448 C   0  0  0

+   -7.0209   -1.2365   -1.4411 O   0  0  0

+   -7.8104    0.0111    0.8805 O   0  0  0

+    1.5081    0.0071    0.0000 H   0  0  0

+    1.7522   -0.7548    0.0000 H   0  0  0

+    2.7421   -1.5033    0.0000 H   0  0  0

+    3.6157    2.7273    0.0000 H   0  0  0

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+    5.6571   -0.3015    0.0000 H   0  0  0

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+    2.9942   -1.1353    0.0000 H   0  0  0

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+   -1.7261    1.3879    0.0000 H   0  0  0

+    5.6926   -2.7841    0.0000 H   0  0  0

+   -2.1230   -1.0754    0.0000 H   0  0  0

+   -4.4999   -1.6376    0.0000 H   0  0  0

+   -3.7400    1.3855    0.0000 H   0  0  0

+   -5.8096    1.5074    0.0000 H   0  0  0

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+  6  9  1  0

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+ 19 39  1  0

+ 20 40  1  0

+ 22 41  1  0

+ 24 42  1  0

+ 25 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+32795-84-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+   -1.6721   -0.3370   -0.0022 C   0  0  0

+   -3.1372   -0.2153   -0.0016 C   0  0  0

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+   -3.9515   -1.3490   -0.0030 C   0  0  0

+    0.5212    0.8073   -0.0003 C   0  0  0

+   -1.5399    2.1835    0.0024 C   0  0  0

+    0.3341   -1.6648    0.0007 C   0  0  0

+   -2.8839    2.2627    0.0025 C   0  0  0

+   -5.1197    1.1821    0.0017 C   0  0  0

+   -5.3205   -1.2043   -0.0019 C   0  0  0

+    1.1426   -0.4436   -0.0024 C   0  0  0

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+    2.3473   -2.9571    0.0046 C   0  0  0

+    3.1178   -1.7958   -0.0036 C   0  0  0

+    3.6332    0.9878   -0.0001 Br  0  0  0

+   -1.6425   -2.4524    0.0000 H   0  0  0

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+  1  2  1  0

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+ 14 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33089-61-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 46                          1 V2000

+    3.4621    0.3434   -0.1748 C   0  0  0

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+    4.1034    0.1108   -1.3851 C   0  0  0

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+ 22 43  1  0

+ 22 44  1  0

+ 22 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33419-42-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 74 80                          1 V2000

+    2.2506    0.3320   -1.3629 C   0  0  2

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+34807-41-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 86 93                          1 V2000

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+ 48 86  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3682-19-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

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+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3868-31-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

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+ 21 34  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+38966-21-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 61                          1 V2000

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+ 20 54  1  0

+ 21 55  1  0

+ 22 56  1  0

+ 23 57  1  0

+ 24 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4245-76-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 13                          1 V2000

+    0.8755    0.0731   -0.0325 C   0  0  0

+   -0.2912    0.7532    0.2256 N   0  0  0

+    2.0885    0.6663    0.2260 N   0  0  0

+    0.8314   -1.1360   -0.5172 N   0  0  0

+   -1.5255    0.1056    0.0840 N   0  3  0

+    3.3317   -0.0584   -0.0490 C   0  0  0

+   -1.6636   -1.0362    0.4847 O   0  0  0

+   -2.4604    0.6846   -0.4397 O   0  5  0

+   -0.2686    1.7657    0.0000 H   0  0  0

+    2.1254    1.6783    0.0000 H   0  0  0

+    0.7945   -2.1480    0.0000 H   0  0  0

+    2.8217   -0.9333    0.0000 H   0  0  0

+    4.2066   -0.5684    0.0000 H   0  0  0

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+  3 10  1  0

+  4 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4245-77-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+    1.2973    0.0288    0.1782 N   0  0  0

+   -0.0296    0.4104    0.0555 C   0  0  0

+    1.6378   -1.3809    0.3861 C   0  0  0

+    2.2326    0.9141    0.1041 N   0  0  0

+   -1.0314   -0.5007    0.2913 N   0  0  0

+   -0.3266    1.6304   -0.2829 N   0  0  0

+    1.9423   -2.0362   -0.9625 C   0  0  0

+    3.3985    0.5787    0.2119 O   0  0  0

+   -2.3664   -0.1527    0.0475 N   0  3  0

+   -3.2615   -0.9189    0.3560 O   0  0  0

+   -2.6318    0.9160   -0.4731 O   0  5  0

+    0.7071   -1.1722    0.0000 H   0  0  0

+    1.0394   -2.1236    0.0000 H   0  0  0

+   -0.8033   -1.4268    0.0000 H   0  0  0

+   -0.5522    2.5571    0.0000 H   0  0  0

+    1.0773   -2.4381    0.0000 H   0  0  0

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+    2.8073   -1.6343    0.0000 H   0  0  0

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+  6 15  1  0

+  7 16  1  0

+  7 17  1  0

+  7 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+427-51-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 62                          1 V2000

+   -2.3494   -0.7917   -0.5501 C   0  0  2

+   -2.8984   -2.1660   -0.3110 C   0  0  2

+   -0.9341   -0.6320   -0.0007 C   0  0  2

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+   -2.2495   -0.6138   -2.0664 C   0  0  0

+   -4.3176   -2.3187    0.1819 C   0  0  1

+   -3.1517   -2.5078    1.1571 C   0  0  0

+   -0.3530    0.6907   -0.5199 C   0  0  2

+   -0.0543   -1.8144   -0.3835 C   0  0  0

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+   -1.2587    1.8336   -0.1887 C   0  0  0

+    1.3894   -1.6043    0.1106 C   0  0  0

+   -3.5481    3.0663    0.3774 Cl  0  0  0

+   -6.2615   -1.1154    0.6894 O   0  0  0

+    1.8914   -0.3050   -0.4837 C   0  0  2

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+ 28 56  1  0

+ 28 57  1  0

+ 28 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4342-03-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -0.3188   -0.6526   -0.0021 C   0  0  0

+   -1.6213   -0.1601   -0.0016 C   0  0  0

+    0.8301    0.0757   -0.0007 N   0  0  0

+   -0.4275   -2.0182    0.0016 N   0  0  0

+   -2.4529   -1.2250   -0.0027 N   0  0  0

+   -2.0173    1.2535   -0.0001 C   0  0  0

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+   -3.3230    1.5875    0.0003 N   0  0  0

+   -1.1666    2.1237    0.0008 O   0  0  0

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+    3.0957    1.6912    0.0024 C   0  0  0

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+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4345-03-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 92 93                          1 V2000

+   -2.5166    1.4043    0.6703 C   0  0  0

+   -3.5327    2.0364   -0.0208 C   0  0  0

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+ 38 92  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+461-89-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -0.0318   -1.0067   -0.0001 N   0  0  0

+   -1.1952   -0.3236   -0.0002 C   0  0  0

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+  4 10  1  0

+  6 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+470-82-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    1.1879    0.3562    0.0077 C   0  0  1

+    0.0414    1.1904    0.0130 O   0  0  0

+    1.2163   -0.5351    1.2502 C   0  0  0

+    1.2228   -0.5101   -1.2522 C   0  0  0

+    2.4375    1.2390    0.0081 C   0  0  0

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+   -0.0188   -1.4114   -1.2616 C   0  0  0

+   -0.8476   -1.0841   -0.0120 C   0  0  2

+   -1.9695    0.7472    1.2482 C   0  0  0

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+ 11 28  1  0

+ 11 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+471-80-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 53 56                          1 V2000

+   -0.8652    0.6386   -0.7778 C   0  0  2

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+ 21 52  1  0

+ 22 53  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+477-30-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 54                          1 V2000

+    0.6886   -0.0179   -0.3473 C   0  0  0

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+ 27 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+481-49-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 83 90                          1 V2000

+   -2.7814    0.0367   -0.1138 C   0  0  0

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+ 45 83  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+488-41-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    0.5564   -0.5250   -0.0056 C   0  0  1

+   -0.5564    0.5250    0.0056 C   0  0  1

+    1.9173    0.1741    0.0019 C   0  0  1

+    0.4405   -1.3542    1.1524 O   0  0  0

+   -1.9173   -0.1741   -0.0019 C   0  0  1

+   -0.4405    1.3293    1.1811 O   0  0  0

+    3.0301   -0.8758   -0.0093 C   0  0  0

+    2.0332    1.0033   -1.1562 O   0  0  0

+   -3.0301    0.8758    0.0093 C   0  0  0

+   -2.0332   -0.9784   -1.1773 O   0  0  0

+    4.7788    0.0225    0.0002 Br  0  0  0

+   -4.7788   -0.0225   -0.0002 Br  0  0  0

+   -0.5262   -0.9052    0.0000 H   0  0  0

+   -1.4905    1.1914    0.0000 H   0  0  0

+    2.9999    0.5544    0.0000 H   0  0  0

+    0.2817   -2.4906    0.0000 H   0  0  0

+   -0.9832   -0.8405    0.0000 H   0  0  0

+   -0.2768    2.4650    0.0000 H   0  0  0

+    2.1534   -1.6160    0.0000 H   0  0  0

+    3.6664   -1.8306    0.0000 H   0  0  0

+    2.1920    2.1397    0.0000 H   0  0  0

+   -2.1534    1.6160    0.0000 H   0  0  0

+   -3.6664    1.8306    0.0000 H   0  0  0

+   -2.1969   -2.1141    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  5  9  1  0

+  5 10  1  0

+  7 11  1  0

+  9 12  1  0

+  1 13  1  0

+  2 14  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  7 19  1  0

+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+  9 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50-07-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 45                          1 V2000

+    0.8873   -1.6157   -0.6928 C   0  0  2

+    0.0288   -1.7207    0.5082 N   0  0  0

+    2.2875   -2.0669   -0.3044 C   0  0  2

+    0.8214   -0.0890   -0.9330 C   0  0  1

+    0.3708   -2.3705   -1.7908 O   0  0  0

+   -1.0089   -0.8339    0.3055 C   0  0  0

+    0.6580   -2.6432    1.4479 C   0  0  0

+    2.1345   -2.7855    1.0466 C   0  0  2

+    2.7723   -1.4629    0.9396 N   0  0  0

+   -0.6178    0.1829   -0.5114 C   0  0  0

+    1.7771    0.6203    0.0284 C   0  0  0

+    1.3566   -2.3236   -2.8243 C   0  0  0

+   -2.4048   -0.8455    0.8298 C   0  0  0

+   -1.5042    1.2375   -0.8234 C   0  0  0

+    1.7153    2.0533   -0.1970 O   0  0  0

+   -3.2977    0.2054    0.5081 C   0  0  0

+   -2.7778   -1.7610    1.5370 O   0  0  0

+   -2.8927    1.2266   -0.2859 C   0  0  0

+   -1.1333    2.1541   -1.5304 O   0  0  0

+    2.4767    2.8842    0.5396 C   0  0  0

+   -4.7042    0.1874    1.0490 C   0  0  0

+   -3.7592    2.2484   -0.5920 N   0  0  0

+    2.4192    4.2144    0.3303 N   0  0  0

+    3.2157    2.4348    1.3931 O   0  0  0

+    3.1897   -2.4950    0.0000 H   0  0  0

+    0.5978    0.8842    0.0000 H   0  0  0

+   -0.2741   -3.0015    0.0000 H   0  0  0

+    0.7929   -3.6326    0.0000 H   0  0  0

+    2.6243   -3.6557    0.0000 H   0  0  0

+    3.3051   -0.6184    0.0000 H   0  0  0

+    2.2025   -0.2832    0.0000 H   0  0  0

+    2.7467    0.8592    0.0000 H   0  0  0

+    1.4041   -3.3211    0.0000 H   0  0  0

+    2.3541   -2.2761    0.0000 H   0  0  0

+    1.3091   -1.3261    0.0000 H   0  0  0

+   -4.7170    1.1859    0.0000 H   0  0  0

+   -5.7027    0.1746    0.0000 H   0  0  0

+   -4.6914   -0.8111    0.0000 H   0  0  0

+   -3.4226    3.1885    0.0000 H   0  0  0

+   -4.7417    2.0699    0.0000 H   0  0  0

+    3.2616    4.7506    0.0000 H   0  0  0

+    1.5336    4.6759    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  1  0

+  2  7  1  0

+  3  8  1  0

+  3  9  1  0

+  4 10  1  0

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+ 10 14  1  0

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+ 16 21  1  0

+ 18 22  1  0

+ 20 23  1  0

+ 20 24  2  0

+  6 10  2  0

+  7  8  1  0

+  8  9  1  0

+ 16 18  2  0

+  3 25  1  0

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+  7 27  1  0

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+ 21 37  1  0

+ 21 38  1  0

+ 22 39  1  0

+ 22 40  1  0

+ 23 41  1  0

+ 23 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50-24-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 57                          1 V2000

+    0.8009   -1.3432   -0.4306 C   0  0  1

+   -0.4940   -1.0740    0.3136 C   0  0  1

+    1.7040   -0.0956   -0.2358 C   0  0  1

+    1.6806   -2.4561    0.1494 C   0  0  0

+   -1.1821    0.1151   -0.3757 C   0  0  1

+   -1.4011   -2.3039    0.2408 C   0  0  0

+    3.0755   -0.5818   -0.6932 C   0  0  2

+    1.0857    1.0289   -1.0440 C   0  0  0

+    1.7534    0.2864    1.2449 C   0  0  0

+    3.0919   -2.1017   -0.3939 C   0  0  0

+   -2.4690    0.4536    0.3825 C   0  0  2

+   -0.2793    1.3446   -0.4121 C   0  0  2

+   -2.6882   -2.0413    1.0290 C   0  0  0

+    4.1624    0.1152    0.0839 C   0  0  0

+    3.2418   -0.3491   -2.0933 O   0  0  0

+   -3.3237   -0.7745    0.4875 C   0  0  0

+   -3.1590    1.6159   -0.2456 C   0  0  0

+   -2.0776    0.8740    1.8006 C   0  0  0

+   -0.0873    1.8340    0.9167 O   0  0  0

+    4.6790    1.4535   -0.3777 C   0  0  0

+    4.6195   -0.3987    1.0765 O   0  0  0

+   -4.5971   -0.8032    0.1189 C   0  0  0

+   -4.4267    1.6083   -0.6262 C   0  0  0

+    5.6977    1.9052    0.5168 O   0  0  0

+   -5.2403    0.3945   -0.4431 C   0  0  0

+   -6.4177    0.3823   -0.7501 O   0  0  0

+    0.2681   -2.2056    0.0000 H   0  0  0

+    0.0996   -0.2522    0.0000 H   0  0  0

+    0.8049   -2.9668    0.0000 H   0  0  0

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+   -1.7970   -0.6909    0.0000 H   0  0  0

+   -1.7449   -3.2576    0.0000 H   0  0  0

+   -0.5070   -2.7817    0.0000 H   0  0  0

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+    3.2610   -3.1013    0.0000 H   0  0  0

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+   -1.1672    1.8338    0.0000 H   0  0  0

+   -3.6722   -2.2851    0.0000 H   0  0  0

+   -2.6671   -3.0548    0.0000 H   0  0  0

+    3.8312    0.4757    0.0000 H   0  0  0

+   -2.6601    2.4984    0.0000 H   0  0  0

+   -1.3356    0.1832    0.0000 H   0  0  0

+   -1.3868    1.6160    0.0000 H   0  0  0

+   -2.8196    1.5648    0.0000 H   0  0  0

+    0.2829    2.7777    0.0000 H   0  0  0

+    4.5221    2.4550    0.0000 H   0  0  0

+    3.6710    1.5612    0.0000 H   0  0  0

+   -5.1076   -1.6790    0.0000 H   0  0  0

+   -4.9066    2.5013    0.0000 H   0  0  0

+    6.6244    2.3161    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

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+ 25 26  2  0

+  7 10  1  0

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+ 13 16  1  0

+ 23 25  1  0

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+  4 29  1  0

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+ 19 49  1  0

+ 20 50  1  0

+ 20 51  1  0

+ 22 52  1  0

+ 23 53  1  0

+ 24 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-27-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 48                          1 V2000

+    1.7257   -0.5993   -0.3424 C   0  0  1

+    0.2852   -0.6935    0.1153 C   0  0  1

+    2.2355    0.7980    0.1090 C   0  0  1

+    2.7159   -1.5306    0.3648 C   0  0  0

+   -0.5029    0.3607   -0.6729 C   0  0  1

+   -0.3214   -2.0622   -0.1934 C   0  0  0

+    3.7470    0.6896   -0.0581 C   0  0  2

+    1.5319    1.8432   -0.7302 C   0  0  0

+    1.8940    1.0197    1.5838 C   0  0  0

+    4.0763   -0.8081    0.1634 C   0  0  2

+   -1.9682    0.2486   -0.3682 C   0  0  0

+    0.0266    1.7632   -0.4112 C   0  0  0

+   -1.7009   -2.1315    0.4608 C   0  0  0

+    4.3946    1.4733    0.9461 O   0  0  0

+    4.7254   -1.3299   -0.9979 O   0  0  0

+   -2.5197   -0.9083    0.1420 C   0  0  0

+   -2.7773    1.3496   -0.6153 C   0  0  0

+   -3.8844   -0.9637    0.3915 C   0  0  0

+   -4.1314    1.2969   -0.3635 C   0  0  0

+   -4.6917    0.1322    0.1415 C   0  0  0

+   -6.0265    0.0678    0.3889 O   0  0  0

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+   -0.4294   -3.0810    0.0000 H   0  0  0

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+    2.4704    2.2541    0.0000 H   0  0  0

+    1.2954    2.8401    0.0000 H   0  0  0

+    2.4519    1.8790    0.0000 H   0  0  0

+    1.0347    1.5776    0.0000 H   0  0  0

+    1.3361    0.1604    0.0000 H   0  0  0

+    4.9470   -0.2682    0.0000 H   0  0  0

+    0.1135    2.7841    0.0000 H   0  0  0

+   -0.9726    1.9898    0.0000 H   0  0  0

+   -2.6405   -2.5399    0.0000 H   0  0  0

+   -1.4672   -3.1291    0.0000 H   0  0  0

+    5.0472    2.2631    0.0000 H   0  0  0

+    5.5239   -1.9718    0.0000 H   0  0  0

+   -2.3325    2.2726    0.0000 H   0  0  0

+   -4.3279   -1.8873    0.0000 H   0  0  0

+   -4.6934    2.1535    0.0000 H   0  0  0

+   -7.0499    0.0184    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+ 14 40  1  0

+ 15 41  1  0

+ 17 42  1  0

+ 18 43  1  0

+ 19 44  1  0

+ 21 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-28-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 47                          1 V2000

+    1.9733   -0.7369   -0.5489 C   0  0  1

+    0.5460   -0.8065   -0.0465 C   0  0  1

+    2.5697    0.5828    0.0153 C   0  0  2

+    2.9378   -1.7796    0.0260 C   0  0  0

+   -0.2129    0.3567   -0.6981 C   0  0  1

+   -0.1404   -2.1076   -0.4621 C   0  0  0

+    1.8924    1.7384   -0.6911 C   0  0  0

+    4.0668    0.4194   -0.2203 C   0  0  2

+    2.3012    0.6685    1.5192 C   0  0  0

+    4.3258   -1.1070   -0.1576 C   0  0  0

+   -1.6706    0.2857   -0.3488 C   0  0  0

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+   -1.4986   -2.1748    0.2355 C   0  0  0

+    4.7878    1.0684    0.8290 O   0  0  0

+   -2.2634   -0.8881    0.0684 C   0  0  0

+   -2.4299    1.4435   -0.4567 C   0  0  0

+   -3.6201   -0.9023    0.3643 C   0  0  0

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+    1.6917    2.7605    0.0000 H   0  0  0

+    3.7470    1.4107    0.0000 H   0  0  0

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+    1.3089    0.9852    0.0000 H   0  0  0

+    1.9845   -0.3238    0.0000 H   0  0  0

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+   -0.6058    1.9831    0.0000 H   0  0  0

+   -2.4682   -2.5554    0.0000 H   0  0  0

+   -1.2797   -3.1932    0.0000 H   0  0  0

+    5.5620    1.7653    0.0000 H   0  0  0

+   -1.9391    2.3623    0.0000 H   0  0  0

+   -4.1098   -1.8217    0.0000 H   0  0  0

+   -4.3238    2.3171    0.0000 H   0  0  0

+   -6.7464    0.2076    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 14 40  1  0

+ 16 41  1  0

+ 17 42  1  0

+ 18 43  1  0

+ 20 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-44-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 15                          1 V2000

+   -0.2505   -0.4154    0.0020 C   0  0  0

+   -1.3930    0.4008    0.0012 C   0  0  0

+    1.0069    0.1934    0.0002 C   0  0  0

+   -0.7091   -1.7155   -0.0010 N   0  0  0

+   -1.2328    1.7285   -0.0001 N   0  0  0

+   -2.4596   -0.4209    0.0024 N   0  0  0

+    1.0688    1.5231   -0.0021 N   0  0  0

+    2.4776   -0.7770    0.0005 S   0  0  0

+   -2.0602   -1.6622   -0.0034 C   0  0  0

+   -0.0292    2.2569   -0.0007 C   0  0  0

+   -0.1422   -2.5511    0.0000 H   0  0  0

+    3.3205   -1.3331    0.0000 H   0  0  0

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+ 10 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+50-55-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 84 89                          1 V2000

+   -1.8473   -1.0555   -0.4086 C   0  0  2

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+ 44 84  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-76-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+176182                          1 V2000

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-89-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    0.7278   -0.6460    0.4759 C   0  0  2

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51-21-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 12 12                          1 V2000

+   -0.5926    0.8264    0.0017 C   0  0  0

+   -1.0817   -0.5040    0.0003 C   0  0  0

+    0.7383    1.0422    0.0016 N   0  0  0

+   -1.3675    1.7659   -0.0022 O   0  0  0

+   -0.2005   -1.5275   -0.0010 C   0  0  0

+   -2.4110   -0.7449    0.0007 F   0  0  0

+    1.5946    0.0038    0.0003 C   0  0  0

+    1.1448   -1.2642   -0.0010 N   0  0  0

+    2.7921    0.2148   -0.0001 O   0  0  0

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+  8 12  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51-98-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 53 56                          1 V2000

+   -1.2645   -0.1198   -0.2286 C   0  0  2

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+ 23 53  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+512-04-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 72 77                          1 V2000

+   -3.8282   -0.3112    0.2837 C   0  0  2

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+ 30 72  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+51481-10-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 44                          1 V2000

+    2.0279   -0.6121   -0.7306 C   0  0  0

+    1.2131   -0.9400    0.5410 C   0  0  2

+    2.2608    0.9014   -0.6077 C   0  0  1

+    3.0664   -1.5613   -1.2921 C   0  0  0

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+   -1.3842   -2.0307    1.3275 O   0  0  0

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+   -3.5795   -0.8789    0.3381 O   0  0  0

+   -3.7483    1.2831   -1.5183 C   0  0  0

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+ 21 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+517-28-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+   -0.0905   -0.7767    1.1186 C   0  0  2

+   -1.3469   -0.1709    0.5571 C   0  0  0

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+ 21 35  1  0

+ 22 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+518-28-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 56                          1 V2000

+   -0.2562   -0.9018   -1.1981 C   0  0  2

+   -1.6080   -0.3630   -0.7629 C   0  0  0

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+ 30 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+518-34-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 88 94                          1 V2000

+    1.0085   -1.2880    0.5037 C   0  0  0

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+ 46 88  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+518-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -1.1161    0.5727    0.0902 C   0  0  0

+   -0.7059   -0.7831    0.1393 C   0  0  0

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+   -2.9608   -1.4841    0.2241 O   0  0  0

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+   -3.1303   -0.3545   -1.9306 C   0  0  0

+    3.0545   -0.4278   -0.0261 C   0  0  0

+    3.9602    0.5459   -0.2502 O   0  0  0

+    3.4236   -1.5735    0.1463 O   0  0  0

+   -2.2155    1.8864    0.0000 H   0  0  0

+   -1.3578   -2.7964    0.0000 H   0  0  0

+    0.3136    3.3262    0.0000 H   0  0  0

+   -1.0022    3.9922    0.0000 H   0  0  0

+   -1.6682    2.6764    0.0000 H   0  0  0

+   -4.4260   -0.1159    0.0000 H   0  0  0

+   -2.4926    2.0494    0.0000 H   0  0  0

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+   -3.4948    0.2204    0.0000 H   0  0  0

+    1.3542   -3.4114    0.0000 H   0  0  0

+   -3.5016   -1.3290    0.0000 H   0  0  0

+   -2.1558   -0.7258    0.0000 H   0  0  0

+   -2.7590    0.6200    0.0000 H   0  0  0

+    4.6704    1.3094    0.0000 H   0  0  0

+  1  2  1  0

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+ 12 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+520-26-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 77 81                          1 V2000

+    0.5629   -2.6988   -1.2899 C   0  0  0

+    0.6034   -2.0221   -0.0593 C   0  0  0

+    1.7530   -2.6973   -2.1526 C   0  0  0

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+    2.8831   -1.8696   -0.1536 C   0  0  1

+   -1.6508   -2.7591    0.3702 C   0  0  0

+    4.0567   -1.0961    0.3900 C   0  0  0

+   -2.7299   -2.7983    1.1916 O   0  0  0

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+   -3.5752   -1.7094    0.8153 C   0  0  2

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+ 43 77  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+521-31-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.5087   -0.8155    0.0021 C   0  0  0

+   -0.4974    0.1732    0.0013 C   0  0  0

+    1.9231   -0.3829    0.0010 C   0  0  0

+    0.1592   -2.1567   -0.0018 C   0  0  0

+   -0.0940    1.5911   -0.0006 C   0  0  0

+   -1.8408   -0.2060    0.0019 C   0  0  0

+    2.2129    0.9330   -0.0008 N   0  0  0

+    2.8163   -1.2072    0.0021 O   0  0  0

+   -1.1784   -2.5206   -0.0064 C   0  0  0

+    1.2152    1.9089   -0.0016 N   0  0  0

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+   -2.1695   -1.5605    0.0032 C   0  0  0

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+    0.8989   -2.8885    0.0000 H   0  0  0

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+   -1.4378   -3.5283    0.0000 H   0  0  0

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+  1  2  2  0

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+ 10 17  1  0

+ 12 18  1  0

+ 13 19  1  0

+ 13 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+53-43-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 49 52                          1 V2000

+    0.6216    0.8191   -0.0914 C   0  0  2

+   -0.1095   -0.4177    0.4484 C   0  0  1

+    2.0424    0.7824    0.4432 C   0  0  1

+   -0.0924    2.0666    0.4413 C   0  0  0

+   -1.5379   -0.4598   -0.0687 C   0  0  2

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+ 18 47  1  0

+ 20 48  1  0

+ 21 49  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+54-11-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.9711    0.1148   -0.8513 C   0  0  1

+   -0.4744    0.0061   -0.4393 C   0  0  0

+    1.6757    1.0305    0.0646 N   0  0  0

+    1.6470   -1.2669   -0.7260 C   0  0  0

+   -1.4236    0.8620   -0.9762 C   0  0  0

+   -0.8715   -0.9521    0.4744 C   0  0  0

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+    3.0539   -0.9188   -0.1726 C   0  0  0

+   -2.7418    0.7250   -0.5682 C   0  0  0

+   -2.1345   -1.0535    0.8394 N   0  0  0

+   -3.0632   -0.2531    0.3535 C   0  0  0

+    0.5197    0.9510    0.0000 H   0  0  0

+    0.7660   -1.6230    0.0000 H   0  0  0

+    1.9399   -2.1709    0.0000 H   0  0  0

+   -1.1291    1.7655    0.0000 H   0  0  0

+   -0.3124   -1.7205    0.0000 H   0  0  0

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+    3.9735   -0.6793    0.0000 H   0  0  0

+   -3.3382    1.4649    0.0000 H   0  0  0

+   -3.9788   -0.5075    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+54-42-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    2.3835   -0.8135    0.4178 C   0  0  2

+    0.9645   -1.1623    0.3123 N   0  0  0

+    2.5133    0.6005    0.6816 O   0  0  0

+    3.0687   -1.0242   -0.9506 C   0  0  0

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+   -2.7235    1.0040   -0.1613 I   0  0  0

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+  5  9  1  0

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+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 14 17  2  0

+  7  8  1  0

+ 11 14  1  0

+  1 18  1  0

+  4 19  1  0

+  4 20  1  0

+  6 21  1  0

+  7 22  1  0

+  8 23  1  0

+  9 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+546-80-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.8024   -0.0629   -0.4400 C   0  0  1

+   -0.1478   -1.2629   -0.4960 C   0  0  2

+    0.4298   -0.6824   -1.7884 C   0  0  0

+   -0.0412    1.1752   -0.1269 C   0  0  0

+    2.2280   -0.1495    0.1089 C   0  0  0

+   -1.5598   -0.7424   -0.2164 C   0  0  2

+   -1.4778    0.7445    0.0063 C   0  0  0

+    2.8942    1.2248    0.0169 C   0  0  0

+    2.1852   -0.5986    1.5708 C   0  0  0

+   -2.1122   -1.4167    1.0409 C   0  0  0

+   -2.4103    1.4714    0.2519 O   0  0  0

+    0.0881   -2.3312    0.0000 H   0  0  0

+    0.7996   -1.7120    0.0000 H   0  0  0

+    1.5185   -0.7898    0.0000 H   0  0  0

+    0.9211    1.6957    0.0000 H   0  0  0

+   -0.4607    2.1856    0.0000 H   0  0  0

+    3.2814   -0.4447    0.0000 H   0  0  0

+   -2.5795   -0.3460    0.0000 H   0  0  0

+    3.8787    0.7476    0.0000 H   0  0  0

+    3.3714    2.2093    0.0000 H   0  0  0

+    1.9097    1.7020    0.0000 H   0  0  0

+    1.0961   -0.4948    0.0000 H   0  0  0

+    2.0814   -1.6877    0.0000 H   0  0  0

+    3.2743   -0.7024    0.0000 H   0  0  0

+   -2.9585   -0.7234    0.0000 H   0  0  0

+   -2.8055   -2.2630    0.0000 H   0  0  0

+   -1.2659   -2.1100    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  4  7  1  0

+  5  8  1  0

+  5  9  1  0

+  6 10  1  0

+  7 11  2  0

+  2  3  1  0

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+  2 12  1  0

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+  9 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+ 10 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+555-30-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -2.2677   -0.5745    0.0600 C   0  0  1

+   -2.1157    0.9017   -0.2020 C   0  0  0

+   -1.2779   -1.0047    1.1445 C   0  0  0

+   -3.6951   -0.8651    0.5280 C   0  0  0

+   -1.9958   -1.3217   -1.1752 N   0  0  0

+   -2.3767    1.3972   -1.4218 O   0  0  0

+   -1.7588    1.6392    0.6860 O   0  0  0

+    0.1301   -0.7730    0.6600 C   0  0  0

+    0.6755    0.4965    0.7067 C   0  0  0

+    0.8756   -1.8315    0.1750 C   0  0  0

+    1.9701    0.7111    0.2620 C   0  0  0

+    2.1678   -1.6242   -0.2702 C   0  0  0

+    2.7186   -0.3533   -0.2310 C   0  0  0

+    2.5080    1.9594    0.3069 O   0  0  0

+    3.9897   -0.1477   -0.6687 O   0  0  0

+   -1.9416   -1.7278    0.0000 H   0  0  0

+   -0.8111   -1.8681    0.0000 H   0  0  0

+   -3.8909    0.0967    0.0000 H   0  0  0

+   -4.6569   -1.0609    0.0000 H   0  0  0

+   -3.4993   -1.8269    0.0000 H   0  0  0

+   -2.6268   -2.0736    0.0000 H   0  0  0

+   -1.0292   -1.4922    0.0000 H   0  0  0

+   -2.8341    2.2656    0.0000 H   0  0  0

+    0.0701    1.2691    0.0000 H   0  0  0

+    0.4942   -2.7359    0.0000 H   0  0  0

+    2.7700   -2.3993    0.0000 H   0  0  0

+    2.8964    2.8608    0.0000 H   0  0  0

+    4.9586    0.0090    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

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+  2  7  2  0

+  3  8  1  0

+  8  9  2  0

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+  6 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 12 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56-04-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.1164    1.2655    0.0020 C   0  0  0

+   -1.8383    0.1241    0.0011 C   0  0  0

+    0.2500    1.2028    0.0017 N   0  0  0

+   -1.8129    2.6018   -0.0029 C   0  0  0

+   -1.1610   -1.1193   -0.0002 C   0  0  0

+    0.8817    0.0149    0.0005 C   0  0  0

+    0.1872   -1.1381   -0.0004 N   0  0  0

+   -1.7903   -2.1619   -0.0006 O   0  0  0

+    2.5931   -0.0308   -0.0005 S   0  0  0

+   -2.8507    0.1571    0.0000 H   0  0  0

+    0.7914    2.0588    0.0000 H   0  0  0

+   -0.9147    3.0700    0.0000 H   0  0  0

+   -2.2811    3.5000    0.0000 H   0  0  0

+   -2.7111    2.1336    0.0000 H   0  0  0

+    0.6793   -2.0234    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  5  7  1  0

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+  6  9  2  0

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+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+56-86-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+    1.1329   -0.5366   -0.4636 C   0  0  1

+   -0.1221    0.2067   -0.0017 C   0  0  0

+    2.3573    0.2315   -0.0369 C   0  0  0

+    1.1594   -1.8753    0.1408 N   0  0  0

+   -1.3651   -0.5731   -0.4349 C   0  0  0

+    2.8824    1.1623   -0.8490 O   0  0  0

+    2.8662    0.0094    1.0362 O   0  0  0

+   -2.6012    0.1591    0.0201 C   0  0  0

+   -3.8164   -0.3429   -0.2505 O   0  0  0

+   -2.4985    1.1980    0.6284 O   0  0  0

+    0.2654   -1.0425    0.0000 H   0  0  0

+    0.5197    0.9791    0.0000 H   0  0  0

+   -0.7834    0.9624    0.0000 H   0  0  0

+    0.2998   -2.3945    0.0000 H   0  0  0

+    2.0388   -2.3601    0.0000 H   0  0  0

+   -2.0069   -1.3455    0.0000 H   0  0  0

+   -0.7038   -1.3288    0.0000 H   0  0  0

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+   -4.7445   -0.7263    0.0000 H   0  0  0

+  1  2  1  0

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+  4 14  1  0

+  4 15  1  0

+  5 16  1  0

+  5 17  1  0

+  6 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57-63-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 49                          1 V2000

+   -1.5538    0.8496   -0.4181 C   0  0  2

+   -2.1677   -0.2956    0.4347 C   0  0  1

+   -0.0895    0.9234   -0.0376 C   0  0  1

+   -2.4162    2.0435    0.0048 C   0  0  0

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+   -1.6065   -1.6063   -0.0751 C   0  0  0

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+   -4.5651   -1.4269   -1.8221 C   0  0  0

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+  1  2  1  0

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+ 16 42  1  0

+ 18 43  1  0

+ 19 44  1  0

+ 20 45  1  0

+ 22 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57-83-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 53 56                          1 V2000

+    0.7339    0.3410    0.3033 C   0  0  1

+   -0.0542   -0.9153   -0.1051 C   0  0  2

+    2.0141    0.4089   -0.5302 C   0  0  2

+   -0.0843    1.6105    0.0872 C   0  0  0

+   -1.3360   -0.9276    0.7070 C   0  0  1

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+   -2.1629    0.3105    0.2671 C   0  0  2

+   -2.3061   -2.0734    0.3996 C   0  0  0

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+   -4.9440   -0.0162   -1.0468 O   0  0  0

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+   -1.6020    1.2242    0.0000 H   0  0  0

+   -3.0964    1.0088    0.0000 H   0  0  0

+   -2.8810   -0.4856    0.0000 H   0  0  0

+   -4.7203   -1.3163    0.0000 H   0  0  0

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+ 18 50  1  0

+ 22 51  1  0

+ 22 52  1  0

+ 22 53  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+574-25-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.0344   -0.2402   -0.0748 N   0  0  0

+   -1.2187    0.3848   -0.3730 C   0  0  0

+    1.3089    0.2504   -0.3930 C   0  0  2

+   -0.3367   -1.3986    0.5772 C   0  0  0

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+   -1.5547    1.5184   -0.9810 N   0  0  0

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+    1.8670    1.0408    0.8112 C   0  0  1

+   -1.6273   -1.5185    0.6947 N   0  0  0

+   -3.5690   -0.0464   -0.0489 C   0  0  0

+   -2.8193    1.8569   -1.1188 C   0  0  0

+    3.5284   -0.3325   -0.3234 C   0  0  1

+    3.3607    0.6485    0.8580 C   0  0  1

+    1.7503    2.4421    0.5566 O   0  0  0

+   -3.8075    1.1048   -0.6701 N   0  0  0

+   -4.8958   -1.0421    0.5452 S   0  0  0

+    4.4768   -1.4624    0.0826 C   0  0  0

+    4.1650    1.8079    0.6322 O   0  0  0

+    4.5619   -2.4169   -0.9775 O   0  0  0

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+    4.3230    0.4347    0.0000 H   0  0  0

+    1.6685    3.4245    0.0000 H   0  0  0

+   -5.6843   -1.6338    0.0000 H   0  0  0

+    5.4363   -1.6886    0.0000 H   0  0  0

+    4.9938   -0.6230    0.0000 H   0  0  0

+    4.7269    2.6179    0.0000 H   0  0  0

+    4.6494   -3.3988    0.0000 H   0  0  0

+  1  2  1  0

+  3  1  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  7 12  1  0

+  8 13  1  0

+  8 14  1  0

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+ 12 17  1  0

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+ 17 19  1  0

+  5  9  1  0

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+  3 20  1  0

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+  8 22  1  0

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+ 14 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+ 17 29  1  0

+ 18 30  1  0

+ 19 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+58-61-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -0.3758   -0.3523    0.0006 N   0  0  0

+   -1.6076    0.1772   -0.2900 C   0  0  0

+    0.9216    0.2078   -0.3860 C   0  0  2

+   -0.5802   -1.4919    0.7200 C   0  0  0

+   -2.5489   -0.6961    0.2803 C   0  0  0

+   -2.0367    1.2524   -0.9432 N   0  0  0

+    1.8878   -0.8582   -0.5122 O   0  0  0

+    1.4604    1.0956    0.7576 C   0  0  1

+   -1.8557   -1.6900    0.8859 N   0  0  0

+   -3.9127   -0.3901    0.1324 C   0  0  0

+   -3.3246    1.4991   -1.0563 C   0  0  0

+    3.1763   -0.2238   -0.3598 C   0  0  1

+    2.9779    0.8052    0.7752 C   0  0  1

+    1.2425    2.4708    0.4361 O   0  0  0

+   -4.2462    0.7076   -0.5382 N   0  0  0

+   -4.8855   -1.2127    0.6728 N   0  0  0

+    4.2100   -1.2660    0.0717 C   0  0  0

+    3.6955    2.0012    0.4646 O   0  0  0

+    4.3278   -2.2675   -0.9408 O   0  0  0

+    0.2859    0.9379    0.0000 H   0  0  0

+    0.0963   -2.1844    0.0000 H   0  0  0

+    0.5105    1.2824    0.0000 H   0  0  0

+   -3.5736    2.4346    0.0000 H   0  0  0

+    4.0323    0.2283    0.0000 H   0  0  0

+    3.9312    0.6367    0.0000 H   0  0  0

+    1.0910    3.4270    0.0000 H   0  0  0

+   -5.7965   -0.8851    0.0000 H   0  0  0

+   -4.7138   -2.1654    0.0000 H   0  0  0

+    5.1616   -1.4442    0.0000 H   0  0  0

+    4.6633   -0.4106    0.0000 H   0  0  0

+    4.1936    2.8313    0.0000 H   0  0  0

+    4.4409   -3.2290    0.0000 H   0  0  0

+  1  2  1  0

+  3  1  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

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+  5  9  1  0

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+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58-85-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -2.2943    0.0889   -1.1500 C   0  0  1

+   -3.4939    0.5455   -0.3214 C   0  0  1

+   -1.0167    0.9102   -0.9206 C   0  0  1

+   -2.0584   -1.2951   -0.7082 N   0  0  0

+   -3.8226   -0.6239    0.5097 N   0  0  0

+   -3.2107    1.7450    0.5953 C   0  0  0

+   -1.3743    1.7990    0.6478 S   0  0  0

+    0.1673   -0.0361   -0.7120 C   0  0  0

+   -2.9643   -1.6138    0.2269 C   0  0  0

+    1.4399    0.7820   -0.4835 C   0  0  0

+   -3.0038   -2.7013    0.7691 O   0  0  0

+    2.6239   -0.1643   -0.2749 C   0  0  0

+    3.8965    0.6538   -0.0464 C   0  0  0

+    5.0627   -0.2783    0.1591 C   0  0  0

+    6.2895    0.2200    0.3787 O   0  0  0

+    4.8933   -1.4742    0.1262 O   0  0  0

+   -2.3972    1.0767    0.0000 H   0  0  0

+   -4.4554    0.7940    0.0000 H   0  0  0

+   -0.2199    1.5029    0.0000 H   0  0  0

+   -1.2025   -1.7987    0.0000 H   0  0  0

+   -4.7917   -0.8408    0.0000 H   0  0  0

+   -3.1534    2.7365    0.0000 H   0  0  0

+   -4.1934    1.8883    0.0000 H   0  0  0

+   -0.5330   -0.7402    0.0000 H   0  0  0

+    0.7915   -0.8085    0.0000 H   0  0  0

+    2.1402    1.4861    0.0000 H   0  0  0

+    0.8157    1.5544    0.0000 H   0  0  0

+    1.9236   -0.8684    0.0000 H   0  0  0

+    3.2481   -0.9367    0.0000 H   0  0  0

+    4.5968    1.3579    0.0000 H   0  0  0

+    3.2723    1.4262    0.0000 H   0  0  0

+    7.2096    0.5937    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  5  9  1  0

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+ 10 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 13 31  1  0

+ 15 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58-94-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 24                          1 V2000

+   -1.2661    0.0525    0.0298 C   0  0  0

+   -1.2129   -1.3424    0.0626 C   0  0  0

+   -0.1073    0.7949   -0.0117 C   0  0  0

+   -2.8395    0.8515    0.0497 S   0  0  0

+    0.0328   -1.9762    0.0582 C   0  0  0

+   -2.3553   -2.0899    0.0931 N   0  0  0

+    1.1221    0.1590   -0.0175 C   0  0  0

+   -3.7409   -0.3630   -0.6387 N   0  0  0

+   -3.2406    0.9497    1.4093 O   0  0  0

+   -2.7804    1.9131   -0.8930 O   0  0  0

+    1.1887   -1.2238    0.0184 C   0  0  0

+   -3.5232   -1.6513   -0.2384 C   0  0  0

+    2.6044    1.1102   -0.0712 S   0  0  0

+    2.7342   -2.0144    0.0137 Cl  0  0  0

+    3.4735    0.7499    1.2915 N   0  0  0

+    3.3576    0.5902   -1.1583 O   0  0  0

+    2.1997    2.4644    0.0758 O   0  0  0

+   -0.1552    1.8300    0.0000 H   0  0  0

+    0.0879   -3.0110    0.0000 H   0  0  0

+   -4.7485   -0.1212    0.0000 H   0  0  0

+   -4.3227   -2.3105    0.0000 H   0  0  0

+    3.6084   -0.2775    0.0000 H   0  0  0

+    4.2958    1.3805    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  7 11  1  0

+  8 12  1  0

+  3 18  1  0

+  5 19  1  0

+  8 20  1  0

+ 12 21  1  0

+ 15 22  1  0

+ 15 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+583-39-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -0.6975    0.7160   -0.0029 C   0  0  0

+   -0.6696   -0.6882   -0.0009 C   0  0  0

+    0.6252    1.1281   -0.0025 N   0  0  0

+   -1.9124    1.3844    0.0002 C   0  0  0

+    0.6365   -1.0628    0.0007 N   0  0  0

+   -1.8720   -1.4000   -0.0004 C   0  0  0

+    1.3998    0.0025   -0.0003 C   0  0  0

+   -3.0909    0.6669    0.0053 C   0  0  0

+   -3.0692   -0.7199   -0.0019 C   0  0  0

+    3.1617   -0.0142    0.0011 S   0  0  0

+    0.9649    2.1101    0.0000 H   0  0  0

+   -1.9352    2.4232    0.0000 H   0  0  0

+   -1.8627   -2.4390    0.0000 H   0  0  0

+   -4.0007    1.1688    0.0000 H   0  0  0

+   -3.9631   -1.2496    0.0000 H   0  0  0

+    4.2007   -0.0240    0.0000 H   0  0  0

+  1  2  2  0

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+  5  7  2  0

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+  3 11  1  0

+  4 12  1  0

+  6 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59-14-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    1.8061   -0.8596    0.4318 C   0  0  2

+    0.3544   -1.0147    0.3104 N   0  0  0

+    2.1238    0.5296    0.6665 O   0  0  0

+    2.4745   -1.1945   -0.9200 C   0  0  0

+   -0.1936   -2.2409    0.3886 C   0  0  0

+   -0.4324    0.0902    0.1241 C   0  0  0

+    3.4982    0.6813    0.2493 C   0  0  1

+    3.6133   -0.1575   -1.0428 C   0  0  1

+   -1.5242   -2.4125    0.2800 N   0  0  0

+    0.5233   -3.2079    0.5594 O   0  0  0

+   -1.7706   -0.0532    0.0122 C   0  0  0

+    3.7747    2.1516   -0.0709 C   0  0  0

+    4.8725   -0.8329   -1.0616 O   0  0  0

+   -2.3334   -1.3507    0.0904 C   0  0  0

+   -2.8782    1.4577   -0.2452 Br  0  0  0

+    3.5806    2.9399    1.1052 O   0  0  0

+   -3.5373   -1.5054   -0.0083 O   0  0  0

+    1.6257   -1.8568    0.0000 H   0  0  0

+    1.9132   -2.0382    0.0000 H   0  0  0

+    3.2433   -1.8547    0.0000 H   0  0  0

+   -0.0168    1.0144    0.0000 H   0  0  0

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+   -1.9148   -3.3476    0.0000 H   0  0  0

+    4.6295    1.6073    0.0000 H   0  0  0

+    4.5979    2.7425    0.0000 H   0  0  0

+    5.7655   -1.3119    0.0000 H   0  0  0

+    3.3383    3.9239    0.0000 H   0  0  0

+  1  2  1  0

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+  8 23  1  0

+  9 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 16 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59-30-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 51 53                          1 V2000

+   -6.5004   -0.5672   -1.0205 C   0  0  0

+   -5.7897   -0.2147    0.1404 C   0  0  0

+   -5.8395   -0.8912   -2.1227 N   0  0  0

+   -7.8788   -0.5591   -0.9761 N   0  0  0

+   -4.4641   -0.2065    0.1322 N   0  0  0

+   -6.5644    0.1403    1.3479 C   0  0  0

+   -4.5191   -0.8796   -2.1194 C   0  0  0

+   -8.5288   -0.2170    0.1671 C   0  0  0

+   -3.8187   -0.5309   -0.9712 C   0  0  0

+   -7.9023    0.1092    1.2780 N   0  0  0

+   -6.0001    0.4535    2.3823 O   0  0  0

+   -9.8952   -0.2222    0.1668 N   0  0  0

+   -2.3118   -0.5230   -0.9868 C   0  0  0

+   -1.8190    0.4839   -0.0437 N   0  0  0

+   -0.4512    0.6759    0.1165 C   0  0  0

+    0.0155    1.6330    1.0130 C   0  0  0

+    0.4489   -0.0936   -0.6159 C   0  0  0

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+    7.0106   -2.9505    0.5341 C   0  0  0

+    6.7440   -4.0288    1.2877 O   0  0  0

+    7.8301   -3.0197   -0.3510 O   0  0  0

+   -8.0895   -1.4012    0.0000 H   0  0  0

+   -4.3167   -1.7237    0.0000 H   0  0  0

+  -10.3321    0.5279    0.0000 H   0  0  0

+  -10.3264   -0.9756    0.0000 H   0  0  0

+   -2.4400   -1.3815    0.0000 H   0  0  0

+   -1.4830   -0.7809    0.0000 H   0  0  0

+   -2.3287    1.1866    0.0000 H   0  0  0

+   -0.4952    2.3349    0.0000 H   0  0  0

+    0.2049   -0.9266    0.0000 H   0  0  0

+    1.6094    2.6591    0.0000 H   0  0  0

+    2.3119   -0.6096    0.0000 H   0  0  0

+    4.3566   -0.3127    0.0000 H   0  0  0

+    6.9069    0.7576    0.0000 H   0  0  0

+    7.4694   -1.1121    0.0000 H   0  0  0

+    7.4263   -0.0214    0.0000 H   0  0  0

+    5.5917   -1.1349    0.0000 H   0  0  0

+    5.6348   -2.2256    0.0000 H   0  0  0

+    8.2595    3.0679    0.0000 H   0  0  0

+    6.5357   -4.8715    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

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+  4  8  1  0

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+ 22 44  1  0

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+ 25 47  1  0

+ 27 48  1  0

+ 27 49  1  0

+ 28 50  1  0

+ 31 51  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59-92-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 25                          1 V2000

+   -2.4681    0.7063   -0.1731 C   0  0  0

+   -2.9349   -0.5626    0.1558 C   0  0  0

+   -1.1345    0.8864   -0.5036 C   0  0  0

+   -3.3199    1.7664   -0.1755 O   0  0  0

+   -2.0642   -1.6405    0.1512 C   0  0  0

+   -4.2427   -0.7444    0.4813 O   0  0  0

+   -0.2711   -0.1932   -0.5062 C   0  0  0

+   -0.7350   -1.4540   -0.1795 C   0  0  0

+    1.1787    0.0044   -0.8665 C   0  0  0

+    2.0183    0.0633    0.4113 C   0  0  1

+    3.4742   -0.1125    0.0642 C   0  0  0

+    1.8244    1.3644    1.0650 N   0  0  0

+    4.0134   -1.3413    0.0344 O   0  0  0

+    4.1561    0.8527   -0.1871 O   0  0  0

+   -0.7595    1.8225    0.0000 H   0  0  0

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+    1.9930   -0.9448    0.0000 H   0  0  0

+    2.6139    1.9918    0.0000 H   0  0  0

+    0.8863    1.7344    0.0000 H   0  0  0

+    4.4186   -2.2647    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  5  8  2  0

+  7  9  1  0

+  9 10  1  0

+ 10 11  1  0

+ 10 12  1  0

+ 11 13  1  0

+ 11 14  2  0

+  7  8  1  0

+  3 15  1  0

+  4 16  1  0

+  5 17  1  0

+  6 18  1  0

+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+613-92-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+    0.2863    0.0968   -0.0013 C   0  0  0

+   -1.1820    0.2863   -0.0003 C   0  0  0

+    1.1352    1.2037    0.0000 C   0  0  0

+    0.8264   -1.1889    0.0023 C   0  0  0

+   -1.9711   -0.7477   -0.0015 N   0  0  0

+   -1.7152    1.5641    0.0019 N   0  0  0

+    2.5027    1.0207   -0.0005 C   0  0  0

+    2.1959   -1.3590    0.0019 C   0  0  0

+   -3.3754   -0.5665   -0.0005 O   0  0  0

+    3.0325   -0.2575   -0.0022 C   0  0  0

+    0.7388    2.1631    0.0000 H   0  0  0

+    0.1995   -2.0163    0.0000 H   0  0  0

+   -1.0854    2.3893    0.0000 H   0  0  0

+   -2.7448    1.6969    0.0000 H   0  0  0

+    3.1354    1.8437    0.0000 H   0  0  0

+    2.5990   -2.3156    0.0000 H   0  0  0

+   -4.4050   -0.4337    0.0000 H   0  0  0

+    4.0621   -0.3903    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  1  0

+  7 10  1  0

+  8 10  2  0

+  3 11  1  0

+  4 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+  9 17  1  0

+ 10 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+616-91-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 19 18                          1 V2000

+   -0.2042    0.4440   -0.2003 C   0  0  2

+    0.3526   -0.7056    0.5171 N   0  0  0

+    0.6457    1.6602    0.0633 C   0  0  0

+   -1.6318    0.7048    0.2842 C   0  0  0

+    1.2678   -1.4941   -0.0805 C   0  0  0

+    0.3239    2.8377   -0.4950 O   0  0  0

+    1.6169    1.5754    0.7771 O   0  0  0

+   -2.6549   -0.7592   -0.0330 S   0  0  0

+    1.8405   -2.6766    0.6574 C   0  0  0

+    1.6305   -1.2518   -1.2122 O   0  0  0

+   -0.7841   -0.3185    0.0000 H   0  0  0

+   -0.4069   -1.2894    0.0000 H   0  0  0

+   -1.3270    1.6130    0.0000 H   0  0  0

+   -2.4873    1.1360    0.0000 H   0  0  0

+    0.0713    3.7618    0.0000 H   0  0  0

+   -3.2037   -1.5445    0.0000 H   0  0  0

+    0.9783   -3.0942    0.0000 H   0  0  0

+    2.2581   -3.5388    0.0000 H   0  0  0

+    2.7027   -2.2590    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

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+  3  6  1  0

+  3  7  2  0

+  4  8  1  0

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+  1 11  1  0

+  2 12  1  0

+  4 13  1  0

+  4 14  1  0

+  6 15  1  0

+  8 16  1  0

+  9 17  1  0

+  9 18  1  0

+  9 19  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6219-89-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.7391    0.1501   -0.0008 C   0  0  0

+   -0.7441    0.1730   -0.0011 C   0  0  0

+    1.4378    0.1402   -1.2072 C   0  0  0

+    1.4371    0.1442    1.2055 C   0  0  0

+   -1.4608   -1.0230    0.0015 C   0  0  0

+   -1.4233    1.3901    0.0017 C   0  0  0

+    2.8166    0.1188   -1.2036 C   0  0  0

+    2.8163    0.1228    1.2025 C   0  0  0

+   -2.8390   -0.9994    0.0011 C   0  0  0

+   -0.7291   -2.3405    0.0041 C   0  0  0

+   -2.8020    1.4091    0.0014 C   0  0  0

+    3.5090    0.1072   -0.0002 C   0  0  0

+   -3.5145    0.2158   -0.0018 C   0  0  0

+    4.8678    0.0862    0.0001 O   0  0  0

+   -4.9104    0.2373   -0.0026 N   0  0  0

+    1.4532    1.1745    0.0000 H   0  0  0

+    1.4495    1.1785    0.0000 H   0  0  0

+   -0.8935    2.2785    0.0000 H   0  0  0

+    2.8333    1.1530    0.0000 H   0  0  0

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+   -3.3711   -1.8864    0.0000 H   0  0  0

+   -1.6334   -2.8427    0.0000 H   0  0  0

+   -0.2269   -3.2448    0.0000 H   0  0  0

+    0.1752   -1.8383    0.0000 H   0  0  0

+   -3.3064    2.3122    0.0000 H   0  0  0

+    5.9021    0.0702    0.0000 H   0  0  0

+   -5.4137    1.1410    0.0000 H   0  0  0

+   -5.4413   -0.6504    0.0000 H   0  0  0

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+ 10 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6285-57-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 19                          1 V2000

+   -0.5191    0.4438   -0.0041 C   0  0  0

+   -0.9267   -0.9094   -0.0034 C   0  0  0

+    0.8006    0.8199   -0.0026 C   0  0  0

+   -2.0719    1.3071   -0.0001 S   0  0  0

+    0.1078   -1.8731   -0.0004 C   0  0  0

+   -2.2616   -1.1188   -0.0051 N   0  0  0

+    1.7869   -0.1497   -0.0002 C   0  0  0

+   -3.1300   -0.1332    0.0023 C   0  0  0

+    1.4233   -1.4884    0.0015 C   0  0  0

+    3.2157    0.2372    0.0011 N   0  3  0

+   -4.5087   -0.1944    0.0063 N   0  0  0

+    4.0792   -0.6219    0.0033 O   0  0  0

+    3.5279    1.4145    0.0001 O   0  5  0

+    1.0566    1.8240    0.0000 H   0  0  0

+   -0.1312   -2.8813    0.0000 H   0  0  0

+    2.1630   -2.2140    0.0000 H   0  0  0

+   -5.0661    0.6791    0.0000 H   0  0  0

+   -4.9865   -1.1138    0.0000 H   0  0  0

+  1  2  2  0

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+  7  9  1  0

+  3 14  1  0

+  5 15  1  0

+  9 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+636-26-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.1359    0.7625    0.0017 C   0  0  0

+   -1.6440   -0.5591    0.0004 C   0  0  0

+    0.1983    0.9582    0.0017 N   0  0  0

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+    2.7287    0.1764   -0.0002 S   0  0  0

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+   -1.1247   -2.5477    0.0000 H   0  0  0

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+   -4.1299   -0.9713    0.0000 H   0  0  0

+   -2.9650   -1.8048    0.0000 H   0  0  0

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+  1  2  1  0

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+  3 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  8 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6379-69-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 51                          1 V2000

+    0.1576    2.1768    0.1634 C   0  0  0

+    0.0462    0.7406    0.7186 C   0  0  2

+    0.3272    1.9463   -1.3467 C   0  0  2

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+ 24 47  1  0

+ 24 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+67-97-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 72 74                          1 V2000

+    1.0055   -1.6946   -0.1049 C   0  0  1

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+ 26 69  1  0

+ 27 70  1  0

+ 27 71  1  0

+ 28 72  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+673-06-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    1.0738    0.0511    0.4384 C   0  0  0

+   -0.3747   -0.0110    0.8495 C   0  0  0

+    1.6176    1.2445    0.0006 C   0  0  0

+    1.8602   -1.0836    0.5044 C   0  0  0

+   -1.2549   -0.1126   -0.3978 C   0  0  2

+    2.9460    1.3015   -0.3765 C   0  0  0

+    3.1891   -1.0266    0.1272 C   0  0  0

+   -2.6846    0.1902   -0.0297 C   0  0  0

+   -1.1685   -1.4716   -0.9487 N   0  0  0

+    3.7312    0.1651   -0.3160 C   0  0  0

+   -3.1393    1.4519   -0.0860 O   0  0  0

+   -3.4215   -0.7027    0.3161 O   0  0  0

+    0.0671    0.8880    0.0000 H   0  0  0

+   -0.9522    0.8075    0.0000 H   0  0  0

+    1.0577    2.0752    0.0000 H   0  0  0

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+   -2.0025   -2.0265    0.0000 H   0  0  0

+   -0.2710   -1.9164    0.0000 H   0  0  0

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+   -3.4789    2.3943    0.0000 H   0  0  0

+  1  2  1  0

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+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 11 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+68-22-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 51                          1 V2000

+   -1.4056    0.9065   -0.4364 C   0  0  2

+   -2.1926   -0.3450    0.0370 C   0  0  1

+   -0.0678    0.8879    0.2804 C   0  0  1

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+   -4.5895   -0.6641    0.4874 C   0  0  0

+   -3.8061   -0.5758   -1.7583 O   0  0  0

+   -0.1017   -1.6356    0.0441 C   0  0  0

+    2.0334   -0.4504    0.5443 C   0  0  2

+    2.0534    2.1389    0.6870 C   0  0  0

+   -5.3670   -1.1428    1.2253 C   0  0  0

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+ 20 47  1  0

+ 20 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+68-23-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 51                          1 V2000

+   -1.5635    0.8775   -0.3935 C   0  0  2

+   -2.1305   -0.3065    0.4389 C   0  0  1

+   -0.0933    0.9762   -0.0407 C   0  0  1

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+   -4.1461   -0.8533   -0.8587 C   0  0  0

+   -4.2893   -0.5937    1.5029 O   0  0  0

+   -0.0246   -1.5445    0.1015 C   0  0  0

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+    2.0162    2.2266   -0.2492 C   0  0  0

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+ 20 47  1  0

+ 20 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+70-00-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 32                          1 V2000

+    1.4539   -0.5400    0.5974 C   0  0  2

+    0.1818    0.1186    0.2905 N   0  0  0

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+  1  2  1  0

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+ 10 27  1  0

+ 12 28  1  0

+ 12 29  1  0

+ 13 30  1  0

+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+70-25-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+   -0.1514   -0.2119    0.0905 C   0  0  0

+   -1.4482    0.2631   -0.0279 N   0  0  0

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+    2.2206    0.1463   -0.0621 N   0  3  0

+   -3.5852   -0.1242    0.0146 O   0  0  0

+    2.4817   -0.8827   -0.6591 O   0  0  0

+    3.0975    0.7414    0.5382 O   0  5  0

+    0.7610    1.5949    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 10  1  0

+  3 11  1  0

+  4 12  1  0

+  6 13  1  0

+  6 14  1  0

+  6 15  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+700-02-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 17                          1 V2000

+   -0.6048    0.5284   -0.0021 C   0  0  0

+   -1.0618   -0.8084   -0.0016 C   0  0  0

+    0.7809    0.7607   -0.0009 C   0  0  0

+   -1.7014    1.3042    0.0016 N   0  0  0

+   -0.1291   -1.8186    0.0000 N   0  0  0

+   -2.3857   -0.7534   -0.0025 N   0  0  0

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+   -2.7592    0.5209    0.0041 C   0  0  0

+    1.1821   -1.5170    0.0011 C   0  0  0

+    3.0122   -0.0454    0.0014 O   0  5  0

+   -0.4267   -2.7820    0.0000 H   0  0  0

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+  5 12  1  0

+  8 13  1  0

+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+7059-24-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+165172                          1 V2000

+    0.2227    3.1504    0.6314 C   0  0  0

+   -0.1231    2.7865   -0.6857 C   0  0  0

+    1.5031    3.8176    0.8978 C   0  0  0

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71-58-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 62 65                          1 V2000

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+73-03-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

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+    4.0980    1.2995    0.0000 H   0  0  0

+    3.1044    2.1160    0.0000 H   0  0  0

+    1.0506    3.6336    0.0000 H   0  0  0

+   -5.4932   -1.2356    0.0000 H   0  0  0

+   -4.2817   -2.4239    0.0000 H   0  0  0

+    5.5074   -0.8943    0.0000 H   0  0  0

+    4.9345    0.1128    0.0000 H   0  0  0

+    4.9017   -2.6903    0.0000 H   0  0  0

+  1  2  1  0

+  3  1  1  0

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+  5  9  1  0

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+ 14 26  1  0

+ 16 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+77-06-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 51                          1 V2000

+    0.7181   -0.9171    0.7656 C   0  0  2

+   -0.6826   -0.5610    1.1628 C   0  0  1

+    1.2888    0.4902    0.3361 C   0  0  2

+    0.7859   -1.7018   -0.4576 O   0  0  0

+    1.6720   -1.4620    1.7706 C   0  0  0

+   -1.1305    0.3813    0.0308 C   0  0  1

+   -1.6496   -1.6133    1.5481 C   0  0  0

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+   -0.2359    3.4551   -1.1163 O   0  0  0

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+ 23 44  1  0

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+ 25 46  1  0

+ 25 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+77-73-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 24                          1 V2000

+   -0.3167    0.8072   -0.7105 C   0  0  0

+   -0.3704   -0.7462   -0.7063 C   0  0  0

+    0.8187    1.1392    0.3075 C   0  0  1

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+   -1.6973   -1.1116   -0.0984 C   0  0  0

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+   -2.3834   -0.0648    0.2446 C   0  0  0

+    2.0422   -0.7031   -0.3806 C   0  0  0

+   -0.3114    1.8150    0.0000 H   0  0  0

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+  8 20  1  0

+  9 21  1  0

+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80-56-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.0804    0.7836    0.6312 C   0  0  1

+   -1.0765    0.3597   -0.2894 C   0  0  0

+   -0.4338   -0.3061    1.6006 C   0  0  0

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+   -0.9358   -1.0366    0.3460 C   0  0  2

+   -2.4034    1.0513    0.0300 C   0  0  0

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+    0.0846    1.8076    0.0000 H   0  0  0

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+    0.5898   -0.2764    0.0000 H   0  0  0

+   -1.8139   -1.5635    0.0000 H   0  0  0

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+  1  2  1  0

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+ 10 25  1  0

+ 10 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80-78-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 72 77                          1 V2000

+   -2.1750    1.1869    0.8675 C   0  0  1

+   -2.6031   -0.2981    1.1050 C   0  0  1

+   -0.7533    1.1056    0.3231 C   0  0  2

+   -3.1177    1.6948   -0.2566 C   0  0  1

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+ 27 70  1  0

+ 28 71  1  0

+ 29 72  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+81-25-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 69 72                          1 V2000

+    1.2861   -0.8865   -0.6183 C   0  0  1

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+    4.6675    0.1839    0.0000 H   0  0  0

+    4.2742    2.7745    0.0000 H   0  0  0

+    3.1060    2.1365    0.0000 H   0  0  0

+    2.8507    1.5227    0.0000 H   0  0  0

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+    2.8075   -0.5473    0.0000 H   0  0  0

+   -3.3040   -0.5145    0.0000 H   0  0  0

+    1.2456    1.1370    0.0000 H   0  0  0

+    4.4399   -1.7613    0.0000 H   0  0  0

+    5.6084   -1.1227    0.0000 H   0  0  0

+    5.4699    2.1681    0.0000 H   0  0  0

+    4.3213    2.7640    0.0000 H   0  0  0

+   -5.2544   -0.8507    0.0000 H   0  0  0

+   -3.9804   -0.8672    0.0000 H   0  0  0

+   -2.2832    2.0670    0.0000 H   0  0  0

+   -3.3371    3.0833    0.0000 H   0  0  0

+   -4.3534    2.0294    0.0000 H   0  0  0

+    5.8996    1.4541    0.0000 H   0  0  0

+   -5.1236    1.2996    0.0000 H   0  0  0

+   -6.3976    1.3161    0.0000 H   0  0  0

+    6.8796    0.4986    0.0000 H   0  0  0

+   -9.2245    0.5587    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  6 14  1  0

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+ 11 18  1  0

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+ 18 22  1  0

+ 18 23  1  0

+ 20 24  1  0

+ 22 25  1  0

+ 24 26  1  0

+ 25 27  1  0

+ 27 28  1  0

+ 27 29  2  0

+  8 12  1  0

+  9 15  1  0

+ 11 14  1  0

+ 21 24  1  0

+  1 30  1  0

+  2 31  1  0

+  3 32  1  0

+  4 33  1  0

+  6 34  1  0

+  6 35  1  0

+  8 36  1  0

+  8 37  1  0

+  9 38  1  0

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+ 10 40  1  0

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+ 23 64  1  0

+ 24 65  1  0

+ 25 66  1  0

+ 25 67  1  0

+ 26 68  1  0

+ 28 69  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+87-33-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+    0.6061   -0.4280   -0.5765 C   0  0  0

+   -0.6367    0.5047   -0.5485 C   0  0  0

+    1.7452    0.5267   -0.1313 C   0  0  1

+    0.3849   -1.3687    0.4947 O   0  0  0

+   -1.7192   -0.3350    0.1620 C   0  0  2

+   -0.3133    1.6292    0.2735 O   0  0  0

+    0.9920    1.4607    0.8478 C   0  0  0

+    2.7355   -0.2146    0.5842 O   0  0  0

+   -1.0231   -1.6826    0.4522 C   0  0  0

+   -2.8170   -0.5478   -0.7277 O   0  0  0

+    3.9498   -0.0704   -0.1297 N   0  3  0

+   -3.9588    0.0199   -0.1119 N   0  3  0

+    3.9816    0.5956   -1.1489 O   0  0  0

+    4.9625   -0.6124    0.2756 O   0  5  0

+   -5.0395   -0.0278   -0.6715 O   0  0  0

+   -3.8601    0.5558    0.9774 O   0  5  0

+    1.3870   -0.9090    0.0000 H   0  0  0

+   -1.3959    1.0192    0.0000 H   0  0  0

+    2.3819    1.1868    0.0000 H   0  0  0

+   -2.0979    0.5003    0.0000 H   0  0  0

+    1.8332    1.8260    0.0000 H   0  0  0

+    0.8635    2.3688    0.0000 H   0  0  0

+   -1.8710   -2.0321    0.0000 H   0  0  0

+   -0.7475   -2.5573    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  8 11  1  0

+ 10 12  1  0

+ 11 13  2  0

+ 11 14  1  0

+ 12 15  2  0

+ 12 16  1  0

+  5  9  1  0

+  6  7  1  0

+  1 17  1  0

+  2 18  1  0

+  3 19  1  0

+  5 20  1  0

+  7 21  1  0

+  7 22  1  0

+  9 23  1  0

+  9 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+87-44-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+   -0.6922    1.2762    0.0000 C   0  0  2

+   -0.6922   -0.4398    0.0000 C   0  0  2

+   -2.4154    1.2762    0.0000 C   0  0  0

+    0.2019    2.3361    0.0000 C   0  0  0

+   -2.4154   -0.4398    0.0000 C   0  0  0

+    0.2343   -1.6259    0.0000 C   0  0  0

+   -3.1941    2.8768    0.0000 C   0  0  0

+   -3.9980    1.3086    0.0000 C   0  0  0

+    1.6727    2.6822    0.0000 C   0  0  0

+    1.8314   -1.6259    0.0000 C   0  0  0

+   -0.4254   -2.8768    0.0000 C   0  0  0

+    2.7471    1.8133    0.0000 C   0  0  0

+    2.4947   -0.4867    0.0000 C   0  0  0

+    1.9251    0.7571    0.0000 C   0  0  0

+    3.9980    1.8133    0.0000 C   0  0  0

+    0.3701    0.8880    0.0000 H   0  0  0

+    0.3772   -0.0716    0.0000 H   0  0  0

+    0.2917    3.4635    0.0000 H   0  0  0

+   -0.8441    2.7662    0.0000 H   0  0  0

+   -3.5464   -0.4398    0.0000 H   0  0  0

+   -2.4154   -1.5708    0.0000 H   0  0  0

+   -2.1771    3.3716    0.0000 H   0  0  0

+   -3.6889    3.8938    0.0000 H   0  0  0

+   -4.2111    2.3820    0.0000 H   0  0  0

+   -3.9748    2.4394    0.0000 H   0  0  0

+   -5.1288    1.3317    0.0000 H   0  0  0

+   -4.0211    0.1778    0.0000 H   0  0  0

+    2.5586    3.3853    0.0000 H   0  0  0

+    1.1797    3.7001    0.0000 H   0  0  0

+    1.6336   -2.7395    0.0000 H   0  0  0

+    2.8933   -2.0153    0.0000 H   0  0  0

+   -1.5556   -2.9201    0.0000 H   0  0  0

+    0.1772   -3.8339    0.0000 H   0  0  0

+    3.3360   -1.2426    0.0000 H   0  0  0

+    3.4058    0.1834    0.0000 H   0  0  0

+    0.8017    0.8879    0.0000 H   0  0  0

+    3.9980    0.6823    0.0000 H   0  0  0

+    5.1290    1.8133    0.0000 H   0  0  0

+    3.9980    2.9443    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  1  0

+  6 10  1  0

+  6 11  2  0

+  9 12  1  0

+ 10 13  1  0

+ 12 14  2  0

+ 12 15  1  0

+  3  5  1  0

+ 13 14  1  0

+  1 16  1  0

+  2 17  1  0

+  4 18  1  0

+  4 19  1  0

+  5 20  1  0

+  5 21  1  0

+  7 22  1  0

+  7 23  1  0

+  7 24  1  0

+  8 25  1  0

+  8 26  1  0

+  8 27  1  0

+  9 28  1  0

+  9 29  1  0

+ 10 30  1  0

+ 10 31  1  0

+ 11 32  1  0

+ 11 33  1  0

+ 13 34  1  0

+ 13 35  1  0

+ 14 36  1  0

+ 15 37  1  0

+ 15 38  1  0

+ 15 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89-65-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 20                          1 V2000

+    0.3097   -0.0460    0.7086 C   0  0  2

+   -0.7457   -1.0146    0.2282 C   0  0  0

+   -0.2542    1.2623    0.5734 O   0  0  0

+    1.5499   -0.1612   -0.1800 C   0  0  1

+   -1.8082   -0.2731   -0.1413 C   0  0  0

+   -0.6438   -2.3606    0.1784 O   0  0  0

+   -1.4984    1.1355    0.0745 C   0  0  0

+    2.5550    0.9267    0.2038 C   0  0  0

+    2.1473   -1.4467    0.0003 O   0  0  0

+   -2.9812   -0.7600   -0.6355 O   0  0  0

+   -2.2532    2.0601   -0.1614 O   0  0  0

+    3.7133    0.8191   -0.6261 O   0  0  0

+    0.6264   -0.9861    0.0000 H   0  0  0

+    1.1947    0.7651    0.0000 H   0  0  0

+   -0.5689   -3.3498    0.0000 H   0  0  0

+    2.8580    1.8714    0.0000 H   0  0  0

+    1.6981    1.4266    0.0000 H   0  0  0

+    2.5654   -2.3464    0.0000 H   0  0  0

+   -3.8975   -1.1403    0.0000 H   0  0  0

+    4.7011    0.7273    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  4  9  1  0

+  5 10  1  0

+  7 11  2  0

+  8 12  1  0

+  5  7  1  0

+  1 13  1  0

+  4 14  1  0

+  6 15  1  0

+  8 16  1  0

+  8 17  1  0

+  9 18  1  0

+ 10 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+932-53-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -0.7372    0.7950    0.0017 C   0  0  0

+   -1.1807   -0.6021    0.0004 C   0  0  0

+    0.5846    1.0652    0.0016 N   0  0  0

+   -1.5512    1.6998   -0.0022 O   0  0  0

+   -0.2859   -1.5507   -0.0009 N   0  0  0

+   -2.6499   -0.9374    0.0010 C   0  0  0

+    1.4781    0.0583    0.0003 C   0  0  0

+    1.0756   -1.2249   -0.0009 N   0  0  0

+    2.6671    0.3129   -0.0002 O   0  0  0

+    0.9038    2.0230    0.0000 H   0  0  0

+   -2.8745    0.0469    0.0000 H   0  0  0

+   -3.6342   -1.1620    0.0000 H   0  0  0

+   -2.4253   -1.9217    0.0000 H   0  0  0

+    1.7644   -1.9630    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  5  8  1  0

+  7  9  2  0

+  7  8  1  0

+  3 10  1  0

+  6 11  1  0

+  6 12  1  0

+  6 13  1  0

+  8 14  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+951-78-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+    0.5284   -0.5009    0.4894 C   0  0  2

+   -0.8509   -0.0901    0.2153 N   0  0  0

+    1.3861    0.6611    0.4874 O   0  0  0

+    1.0460   -1.3755   -0.6740 C   0  0  0

+   -1.8616   -0.9439    0.4599 C   0  0  0

+   -1.0996    1.1602   -0.2818 C   0  0  0

+    2.7133    0.1538    0.2286 C   0  0  1

+    2.5165   -0.9349   -0.8495 C   0  0  1

+   -3.1380   -0.5925    0.2174 N   0  0  0

+   -1.6184   -2.0485    0.9059 O   0  0  0

+   -2.3708    1.5387   -0.5343 C   0  0  0

+    3.5876    1.2763   -0.3340 C   0  0  0

+    3.3807   -2.0393   -0.5746 O   0  0  0

+   -3.4245    0.6286   -0.2777 C   0  0  0

+    3.6960    2.3247    0.6310 O   0  0  0

+   -4.5791    0.9473   -0.4974 O   0  0  0

+   -0.0827   -1.2835    0.0000 H   0  0  0

+    0.1534   -1.8103    0.0000 H   0  0  0

+    1.4071   -2.3004    0.0000 H   0  0  0

+   -0.3656    1.8289    0.0000 H   0  0  0

+    3.6198   -0.2513    0.0000 H   0  0  0

+    3.4803   -0.6964    0.0000 H   0  0  0

+   -3.8534   -1.2811    0.0000 H   0  0  0

+   -2.5792    2.5095    0.0000 H   0  0  0

+    4.1248    0.4413    0.0000 H   0  0  0

+    4.5534    1.5069    0.0000 H   0  0  0

+    3.9926   -2.8213    0.0000 H   0  0  0

+    3.7981    3.3124    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

+  5 10  2  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+  9 14  1  0

+ 12 15  1  0

+ 14 16  2  0

+  7  8  1  0

+ 11 14  1  0

+  1 17  1  0

+  4 18  1  0

+  4 19  1  0

+  6 20  1  0

+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+958-09-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 33                          1 V2000

+   -0.2875   -0.1863    0.0308 N   0  0  0

+   -1.5326    0.3204   -0.2437 C   0  0  0

+    0.9952    0.4357   -0.3069 C   0  0  2

+   -0.4629   -1.3717    0.6805 C   0  0  0

+   -2.4513   -0.6136    0.2637 C   0  0  0

+   -1.9890    1.4179   -0.8387 N   0  0  0

+    1.9862   -0.5921   -0.5242 O   0  0  0

+    1.5155    1.2351    0.9083 C   0  0  0

+   -1.7331   -1.6190    0.8191 N   0  0  0

+   -3.8226   -0.3424    0.1171 C   0  0  0

+   -3.2829    1.6303   -0.9530 C   0  0  0

+    3.2596    0.0575   -0.3186 C   0  0  1

+    3.0395    0.9805    0.9004 C   0  0  1

+   -4.1841    0.7815   -0.4928 N   0  0  0

+   -4.7742   -1.2251    0.5971 N   0  0  0

+    4.3188   -0.9928    0.0217 C   0  0  0

+    3.7276    2.2156    0.6931 O   0  0  0

+    4.4580   -1.9009   -1.0728 O   0  0  0

+    0.3484    1.1693    0.0000 H   0  0  0

+    0.2442   -2.0474    0.0000 H   0  0  0

+    1.8070    2.1687    0.0000 H   0  0  0

+    0.6306    1.6515    0.0000 H   0  0  0

+   -3.5685    2.5657    0.0000 H   0  0  0

+    4.1123    0.5365    0.0000 H   0  0  0

+    4.0083    0.8468    0.0000 H   0  0  0

+   -5.7087   -0.9367    0.0000 H   0  0  0

+   -4.5567   -2.1786    0.0000 H   0  0  0

+    5.2845   -1.1476    0.0000 H   0  0  0

+    4.7618   -0.1209    0.0000 H   0  0  0

+    4.2036    3.0700    0.0000 H   0  0  0

+    4.6062   -2.8676    0.0000 H   0  0  0

+  1  2  1  0

+  3  1  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  8 13  1  0

+ 10 14  2  0

+ 10 15  1  0

+ 12 16  1  0

+ 13 17  1  0

+ 16 18  1  0

+  5  9  1  0

+ 11 14  1  0

+ 12 13  1  0

+  3 19  1  0

+  4 20  1  0

+  8 21  1  0

+  8 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96-50-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -0.8965   -0.1610    0.0017 C   0  0  0

+   -0.1713   -1.2632    0.0009 N   0  0  0

+    0.3208    1.0774    0.0003 S   0  0  0

+   -2.2760   -0.0262   -0.0016 N   0  0  0

+    1.1477   -1.2126   -0.0005 C   0  0  0

+    1.7475    0.0017   -0.0012 C   0  0  0

+   -2.7008    0.9095    0.0000 H   0  0  0

+   -2.8739   -0.8620    0.0000 H   0  0  0

+    1.7067   -2.0749    0.0000 H   0  0  0

+    2.7474    0.2390    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  6  2  0

+  4  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+100-11-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -2.2857    0.0002    0.1074 C   0  0  0

+   -1.6190   -1.1969    0.2918 C   0  0  0

+   -1.6191    1.1974    0.2882 C   0  0  0

+   -3.7116   -0.0004   -0.2896 N   0  3  0

+   -0.2860   -1.1964    0.6569 C   0  0  0

+   -0.2857    1.1979    0.6534 C   0  0  0

+   -4.2990    1.0542   -0.4520 O   0  0  0

+   -4.2977   -1.0554   -0.4538 O   0  5  0

+    0.3808    0.0011    0.8377 C   0  0  0

+    1.8344    0.0017    1.2353 C   0  0  0

+    2.9555   -0.0004   -0.3797 Br  0  0  0

+   -2.1394   -2.0828    0.0000 H   0  0  0

+   -2.1399    2.0830    0.0000 H   0  0  0

+    0.2348   -2.0820    0.0000 H   0  0  0

+    0.2347    2.0838    0.0000 H   0  0  0

+    2.3491    0.8909    0.0000 H   0  0  0

+    1.3210    0.8916    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  3  6  1  0

+  4  7  2  0

+  4  8  1  0

+  5  9  1  0

+  9 10  1  0

+ 10 11  1  0

+  6  9  2  0

+  2 12  1  0

+  3 13  1  0

+  5 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+105-54-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 19                          1 V2000

+   -0.0051   -0.1391   -0.0011 C   0  0  0

+   -1.2717    0.6775    0.0007 C   0  0  0

+    1.1889    0.4742    0.0003 O   0  0  0

+   -0.0644   -1.3459    0.0013 O   0  0  0

+   -2.4820   -0.2585   -0.0014 C   0  0  0

+    2.4092   -0.3126   -0.0014 C   0  0  0

+   -3.7679    0.5706    0.0004 C   0  0  0

+    3.6195    0.6233    0.0006 C   0  0  0

+   -0.5558    1.5521    0.0000 H   0  0  0

+   -2.0598    1.4877    0.0000 H   0  0  0

+   -3.1979   -1.1331    0.0000 H   0  0  0

+   -1.6939   -1.0687    0.0000 H   0  0  0

+    1.6933   -1.1872    0.0000 H   0  0  0

+    3.1973   -1.1228    0.0000 H   0  0  0

+   -3.1554    1.5205    0.0000 H   0  0  0

+   -4.7178    1.1831    0.0000 H   0  0  0

+   -4.3804   -0.3793    0.0000 H   0  0  0

+    4.3109   -0.2708    0.0000 H   0  0  0

+    4.5136    1.3147    0.0000 H   0  0  0

+    2.9281    1.5174    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  5  7  1  0

+  6  8  1  0

+  2  9  1  0

+  2 10  1  0

+  5 11  1  0

+  5 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  7 17  1  0

+  8 18  1  0

+  8 19  1  0

+  8 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+107-13-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  6                          1 V2000

+    0.7917   -0.5149    0.0000 C   0  0  0

+   -0.5848   -0.1199    0.0000 C   0  0  0

+    1.7490    0.4092    0.0000 C   0  0  0

+   -1.6767    0.1934    0.0000 N   0  0  0

+    1.0329   -1.4832    0.0000 H   0  0  0

+    2.7082    0.1340    0.0000 H   0  0  0

+    1.5078    1.3775    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  2  4  3  0

+  1  5  1  0

+  3  6  1  0

+  3  7  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1122-54-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.2486    0.0094    0.0033 C   0  0  0

+    0.4708   -1.1920    0.0029 C   0  0  0

+    0.4725    1.2103    0.0009 C   0  0  0

+   -1.7241    0.0103    0.0001 C   0  0  0

+    1.8515   -1.1451    0.0003 C   0  0  0

+    1.8526    1.1618   -0.0017 C   0  0  0

+   -2.4768    1.3159    0.0005 C   0  0  0

+   -2.3288   -1.0357   -0.0029 O   0  0  0

+    2.4899    0.0079   -0.0020 N   0  0  0

+   -0.0247   -2.1020    0.0000 H   0  0  0

+   -0.0219    2.1208    0.0000 H   0  0  0

+    2.3927   -2.0287    0.0000 H   0  0  0

+    2.3947    2.0448    0.0000 H   0  0  0

+   -1.5792    1.8334    0.0000 H   0  0  0

+   -2.9943    2.2135    0.0000 H   0  0  0

+   -3.3744    0.7984    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  4  8  2  0

+  5  9  2  0

+  6  9  1  0

+  2 10  1  0

+  3 11  1  0

+  5 12  1  0

+  6 13  1  0

+  7 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1837-57-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 47                          1 V2000

+   -4.1624    0.3804   -0.2207 C   0  0  0

+   -4.8963   -0.6736    0.3814 C   0  0  0

+   -2.8491    0.1519   -0.6814 C   0  0  0

+   -4.7497    1.6518   -0.3491 C   0  0  0

+   -4.3690   -1.8906    0.5246 N   0  0  0

+   -6.2080   -0.4191    0.8344 C   0  0  0

+   -2.3136   -1.1378   -0.5202 C   0  0  0

+   -2.1147    1.1601   -1.2708 N   0  0  0

+   -6.0190    1.8601    0.1061 C   0  0  0

+   -3.1357   -2.1734    0.1113 C   0  0  0

+   -6.7479    0.8190    0.6906 C   0  0  0

+   -1.0136   -1.4551   -0.9497 C   0  0  0

+   -6.5849    3.0901   -0.0185 O   0  0  0

+   -2.5910   -3.4605    0.2685 C   0  0  0

+   -0.5356   -2.7145   -0.7744 C   0  0  0

+   -7.8971    2.9996    0.5401 C   0  0  0

+   -1.3110   -3.7127   -0.1719 C   0  0  0

+   -8.5926    4.3580    0.4311 C   0  0  0

+   -0.7752   -4.9891   -0.0137 N   0  0  0

+   11.9248    1.6224   -0.0014 C   0  0  0

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+   13.3088    1.1127   -0.4084 C   0  0  0

+   11.2285    2.0865   -1.1597 O   0  0  0

+   11.6114   -0.0913    1.7481 O   0  0  0

+   10.1005    0.1392    0.1521 O   0  0  0

+   -4.1459    2.4455    0.0000 H   0  0  0

+   -6.8317   -1.1973    0.0000 H   0  0  0

+   -1.1230    1.0546    0.0000 H   0  0  0

+   -2.5192    2.0716    0.0000 H   0  0  0

+   -7.7402    0.9184    0.0000 H   0  0  0

+   -0.3532   -0.7078    0.0000 H   0  0  0

+   -3.2200   -4.2344    0.0000 H   0  0  0

+    0.4506   -2.8624    0.0000 H   0  0  0

+   -8.8378    2.6685    0.0000 H   0  0  0

+   -7.6954    2.0229    0.0000 H   0  0  0

+   -7.7049    4.8125    0.0000 H   0  0  0

+   -9.0471    5.2457    0.0000 H   0  0  0

+   -9.4803    3.9035    0.0000 H   0  0  0

+   -1.3785   -5.7831    0.0000 H   0  0  0

+    0.2141   -5.1146    0.0000 H   0  0  0

+   12.3768    2.5113    0.0000 H   0  0  0

+   12.9642    0.1769    0.0000 H   0  0  0

+   14.2446    0.7681    0.0000 H   0  0  0

+   13.6534    2.0485    0.0000 H   0  0  0

+   10.3987    2.6396    0.0000 H   0  0  0

+   12.2272   -0.8757    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

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+  7 12  2  0

+  9 13  1  0

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+ 12 15  1  0

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+ 16 18  1  0

+ 17 19  1  0

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+ 20 23  1  0

+ 21 24  1  0

+ 21 25  2  0

+  7 10  1  0

+  9 11  1  0

+ 15 17  2  0

+  4 26  1  0

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+  8 28  1  0

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+ 22 42  1  0

+ 22 43  1  0

+ 22 44  1  0

+ 23 45  1  0

+ 24 46  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2402-78-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -0.0001   -0.5433    0.0000 N   0  0  0

+   -1.1526    0.0997    0.0001 C   0  0  0

+    1.1526    0.0998    0.0001 C   0  0  0

+   -1.1910    1.4828   -0.0001 C   0  0  0

+   -2.6372   -0.8000    0.0000 Cl  0  0  0

+    1.1911    1.4824   -0.0001 C   0  0  0

+    2.6372   -0.8000    0.0000 Cl  0  0  0

+   -0.0001    2.1919    0.0000 C   0  0  0

+   -2.1010    1.9835    0.0000 H   0  0  0

+    2.1011    1.9830    0.0000 H   0  0  0

+    0.0000    3.2305    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  2  4  1  0

+  2  5  1  0

+  3  6  2  0

+  3  7  1  0

+  4  8  2  0

+  6  8  1  0

+  4  9  1  0

+  6 10  1  0

+  8 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+311-45-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+   -1.9618   -0.2707   -0.1109 P   0  0  0

+   -1.0203   -1.1878   -1.0408 O   0  0  0

+   -1.7557    1.2778   -0.5003 O   0  0  0

+   -3.5022   -0.6805   -0.3371 O   0  0  0

+   -1.6006   -0.4744    1.3098 O   0  0  0

+    0.2647   -0.8851   -0.7184 C   0  0  0

+   -1.0186    1.8775    0.5670 C   0  0  0

+   -4.2696    0.0530    0.6195 C   0  0  0

+    0.8392   -1.4218    0.4244 C   0  0  0

+    1.0061   -0.0431   -1.5349 C   0  0  0

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+   -5.7513   -0.2923    0.4576 C   0  0  0

+    2.1460   -1.1128    0.7497 C   0  0  0

+    2.3121    0.2627   -1.2053 C   0  0  0

+    2.8809   -0.2695   -0.0627 C   0  0  0

+    4.2805    0.0598    0.2881 N   0  3  0

+    4.9289    0.8027   -0.4269 O   0  0  0

+    4.7840   -0.4121    1.2918 O   0  5  0

+   -0.6598    1.0373    0.0000 H   0  0  0

+   -0.1121    1.9908    0.0000 H   0  0  0

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+   -5.9586    0.5974    0.0000 H   0  0  0

+   -6.6410   -0.4996    0.0000 H   0  0  0

+   -5.5440   -1.1820    0.0000 H   0  0  0

+    2.6181   -1.8949    0.0000 H   0  0  0

+    2.5479    1.1453    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  2  0

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+  3  7  1  0

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+  6  9  2  0

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+ 12 28  1  0

+ 12 29  1  0

+ 12 30  1  0

+ 13 31  1  0

+ 14 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+32795-47-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 48 49                          1 V2000

+   -4.9054   -0.3518   -0.3750 C   0  0  0

+   -5.9345    0.7074   -0.6804 C   0  0  0

+   -3.7583   -0.0449    0.3252 C   0  0  0

+   -5.1301   -1.6494   -0.8046 C   0  0  0

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+   -5.6817    1.9319    0.2011 C   0  0  0

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+   -8.3179    0.3175   -1.3385 C   0  0  0

+   -4.2736    2.3301    0.0630 N   0  0  0

+   -3.0509   -2.3420    0.1531 C   0  0  0

+   -1.6603   -0.7401    1.2984 N   0  0  0

+   -8.8362   -0.9813    1.0464 C   0  0  0

+   -9.5816   -0.1808   -1.0835 C   0  0  0

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+   -6.8885   -1.1709    0.0000 H   0  0  0

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+   -2.3373   -2.9991    0.0000 H   0  0  0

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+   -4.0190    4.5792    0.0000 H   0  0  0

+   -5.0920    3.7244    0.0000 H   0  0  0

+  -10.6802   -1.3177    0.0000 H   0  0  0

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+    9.3916   -0.7130    0.0000 H   0  0  0

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+  1  2  1  0

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+ 23 47  1  0

+ 25 48  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+562-10-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 56                          1 V2000

+   -5.0666   -0.3082    0.5837 C   0  0  0

+   -5.5855   -1.6760    0.2218 C   0  0  0

+   -3.6695   -0.1419    0.0439 C   0  0  0

+   -5.9182    0.6896    0.0169 O   0  0  0

+   -5.0465   -0.1567    2.1061 C   0  0  0

+   -6.9284   -1.8557   -0.0514 C   0  0  0

+   -4.7172   -2.7500    0.1576 C   0  0  0

+   -2.5863   -0.3371    0.8800 C   0  0  0

+   -3.4944    0.1829   -1.2220 N   0  0  0

+   -5.0951    1.8230   -0.2657 C   0  0  0

+   -7.4044   -3.1106   -0.3834 C   0  0  0

+   -5.1931   -4.0045   -0.1743 C   0  0  0

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+   -5.9502    2.9342   -0.8781 C   0  0  0

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+   -7.7848    4.3831   -0.5765 C   0  0  0

+   11.4908    0.6077    0.2241 C   0  0  0

+   10.5454   -0.5801    0.0336 C   0  0  0

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+    9.3024   -0.3703    0.8595 C   0  0  0

+   13.7102    1.3189   -0.5909 O   0  0  0

+   12.8513   -0.5993   -1.2738 O   0  0  0

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+    9.1848    0.6269    1.5315 O   0  0  0

+   -4.0684   -0.2865    0.0000 H   0  0  0

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+   -6.0246   -0.0269    0.0000 H   0  0  0

+   -7.5416   -1.0827    0.0000 H   0  0  0

+   -3.7429   -2.5941    0.0000 H   0  0  0

+   -2.6147   -1.3234    0.0000 H   0  0  0

+   -4.3557    1.1696    0.0000 H   0  0  0

+   -4.3742    2.4966    0.0000 H   0  0  0

+   -8.3788   -3.2660    0.0000 H   0  0  0

+   -4.5796   -4.7773    0.0000 H   0  0  0

+   -0.7089   -0.9678    0.0000 H   0  0  0

+   -2.2793    1.3257    0.0000 H   0  0  0

+   -5.0138    3.2452    0.0000 H   0  0  0

+   -5.9358    3.9208    0.0000 H   0  0  0

+   -6.9026   -5.1019    0.0000 H   0  0  0

+   -0.3011    0.6498    0.0000 H   0  0  0

+   -5.6691    3.1994    0.0000 H   0  0  0

+   -5.6023    4.5932    0.0000 H   0  0  0

+   -6.9961    4.6600    0.0000 H   0  0  0

+   -6.9890    4.9664    0.0000 H   0  0  0

+   -8.3681    5.1789    0.0000 H   0  0  0

+   -8.5806    3.7998    0.0000 H   0  0  0

+   11.8157    1.5394    0.0000 H   0  0  0

+   10.6268    1.0841    0.0000 H   0  0  0

+   10.2205   -1.5118    0.0000 H   0  0  0

+   11.4094   -1.0565    0.0000 H   0  0  0

+   14.4280    1.9959    0.0000 H   0  0  0

+    7.6082   -1.9683    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

+  3  8  1  0

+  3  9  2  0

+  4 10  1  0

+  6 11  1  0

+  7 12  2  0

+  8 13  2  0

+  9 14  1  0

+ 10 15  1  0

+ 11 16  2  0

+ 13 17  1  0

+ 15 18  1  0

+ 18 19  1  0

+ 18 20  1  0

+ 21 22  1  0

+ 21 23  1  0

+ 22 24  1  0

+ 23 25  1  0

+ 23 26  2  0

+ 24 27  1  0

+ 24 28  2  0

+ 12 16  1  0

+ 14 17  2  0

+  5 29  1  0

+  5 30  1  0

+  5 31  1  0

+  6 32  1  0

+  7 33  1  0

+  8 34  1  0

+ 10 35  1  0

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+ 11 37  1  0

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+ 21 51  1  0

+ 21 52  1  0

+ 22 53  1  0

+ 22 54  1  0

+ 25 55  1  0

+ 27 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+57-55-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 12                          1 V2000

+    0.5329    0.0807   -0.3535 C   0  0  0

+   -0.6995    0.7345    0.2747 C   0  0  0

+    1.7834    0.8728    0.0334 C   0  0  0

+    0.6538   -1.2618    0.1208 O   0  0  0

+   -1.8675   -0.0053   -0.0867 O   0  0  0

+   -0.3347   -0.4957    0.0000 H   0  0  0

+   -0.0604    1.5570    0.0000 H   0  0  0

+   -1.3999    1.5055    0.0000 H   0  0  0

+    2.3408   -0.0071    0.0000 H   0  0  0

+    2.6633    1.4302    0.0000 H   0  0  0

+    1.2260    1.7527    0.0000 H   0  0  0

+    0.7472   -2.2992    0.0000 H   0  0  0

+   -2.7475   -0.5627    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+615-50-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+   -6.9241    0.0052   -0.0962 S   0  0  0

+   -7.7561   -0.9622    0.7334 O   0  0  0

+   -5.6801   -0.7421   -0.5549 O   0  0  0

+   -7.6808    0.2543   -1.2729 O   0  0  0

+   -6.4655    0.9972    0.8121 O   0  0  0

+    5.5758    1.0716   -0.0915 C   0  0  0

+    4.8166    0.1888    0.6655 C   0  0  0

+    6.7726    0.6570   -0.6413 C   0  0  0

+    5.0904    2.4802   -0.3180 C   0  0  0

+    5.2611   -1.1106    0.8695 C   0  0  0

+    3.6034    0.6093    1.2234 N   0  0  0

+    7.2171   -0.6428   -0.4373 C   0  0  0

+    6.4582   -1.5253    0.3195 C   0  0  0

+    8.4304   -1.0633   -0.9951 N   0  0  0

+   -8.3801   -1.6877    0.0000 H   0  0  0

+   -4.8598   -1.2349    0.0000 H   0  0  0

+    7.4506    1.3323    0.0000 H   0  0  0

+    5.9952    2.7920    0.0000 H   0  0  0

+    4.7786    3.3850    0.0000 H   0  0  0

+    4.1856    2.1684    0.0000 H   0  0  0

+    4.5831   -1.7860    0.0000 H   0  0  0

+    3.4227    1.5491    0.0000 H   0  0  0

+    2.8799   -0.0171    0.0000 H   0  0  0

+    6.7075   -2.4492    0.0000 H   0  0  0

+    8.6111   -2.0031    0.0000 H   0  0  0

+    9.1539   -0.4369    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  1  5  2  0

+  6  7  1  0

+  6  8  2  0

+  6  9  1  0

+  7 10  2  0

+  7 11  1  0

+  8 12  1  0

+ 10 13  1  0

+ 12 14  1  0

+ 12 13  2  0

+  2 15  1  0

+  3 16  1  0

+  8 17  1  0

+  9 18  1  0

+  9 19  1  0

+  9 20  1  0

+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+78-83-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 14                          1 V2000

+    0.5725    0.0000   -0.3520 C   0  0  0

+   -0.6358   -0.6965    0.2771 C   0  0  0

+    0.6499    1.4422    0.1529 C   0  0  0

+    1.8506   -0.7457    0.0369 C   0  0  0

+   -1.8295    0.0000   -0.0862 O   0  0  0

+   -0.3347    0.5571    0.0000 H   0  0  0

+   -1.3228   -1.5098    0.0000 H   0  0  0

+    0.0469   -1.5134    0.0000 H   0  0  0

+    1.7130    1.3851    0.0000 H   0  0  0

+    0.7070    2.5053    0.0000 H   0  0  0

+   -0.4132    1.4993    0.0000 H   0  0  0

+    1.3141   -1.6652    0.0000 H   0  0  0

+    2.7701   -1.2822    0.0000 H   0  0  0

+    2.3871    0.1738    0.0000 H   0  0  0

+   -2.7490    0.5365    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  4 13  1  0

+  4 14  1  0

+  5 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+80-71-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 16                          1 V2000

+   -0.1457   -0.5605   -0.0016 C   0  0  0

+   -1.1693    0.2866   -0.0006 C   0  0  0

+    1.1430    0.1322   -0.0006 C   0  0  0

+   -0.2802   -1.9140    0.0021 O   0  0  0

+   -0.6758    1.7115    0.0012 C   0  0  0

+   -2.6205   -0.1198   -0.0012 C   0  0  0

+    0.8600    1.6192    0.0012 C   0  0  0

+    2.2381   -0.3898   -0.0009 O   0  0  0

+   -0.3903   -3.0223    0.0000 H   0  0  0

+   -0.5081    2.8126    0.0000 H   0  0  0

+   -1.7571    1.9787    0.0000 H   0  0  0

+   -2.9209    0.9527    0.0000 H   0  0  0

+   -3.6930   -0.4202    0.0000 H   0  0  0

+   -2.3201   -1.1923    0.0000 H   0  0  0

+    1.9676    1.7363    0.0000 H   0  0  0

+    0.8348    2.7327    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

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+  5  7  1  0

+  4  9  1  0

+  5 10  1  0

+  5 11  1  0

+  6 12  1  0

+  6 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90-33-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+   -0.1630    0.6110   -0.0040 C   0  0  0

+   -0.0309   -0.7900   -0.0021 C   0  0  0

+    0.9399    1.3900   -0.0026 O   0  0  0

+   -1.4296    1.1756   -0.0017 C   0  0  0

+    1.3110   -1.3761    0.0010 C   0  0  0

+   -1.1716   -1.6013   -0.0026 C   0  0  0

+    2.1727    0.8592    0.0007 C   0  0  0

+   -2.5475    0.3577    0.0026 C   0  0  0

+    2.3784   -0.5358    0.0018 C   0  0  0

+    1.5028   -2.8709    0.0037 C   0  0  0

+   -2.4105   -1.0292   -0.0051 C   0  0  0

+    3.1383    1.6014    0.0015 O   0  0  0

+   -3.7868    0.9117    0.0054 O   0  0  0

+   -1.5397    2.2092    0.0000 H   0  0  0

+   -1.0753   -2.6363    0.0000 H   0  0  0

+    3.3442   -0.9201    0.0000 H   0  0  0

+    0.4718   -3.0032    0.0000 H   0  0  0

+    1.6351   -3.9019    0.0000 H   0  0  0

+    2.5338   -2.7386    0.0000 H   0  0  0

+   -3.2575   -1.6317    0.0000 H   0  0  0

+   -4.7358    1.3359    0.0000 H   0  0  0

+  1  2  2  0

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+  4 14  1  0

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+  9 16  1  0

+ 10 17  1  0

+ 10 18  1  0

+ 10 19  1  0

+ 11 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+91-66-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -0.1675    0.0015   -0.0010 C   0  0  0

+    1.2292   -0.0005   -0.0008 N   0  0  0

+   -0.8642   -0.5642   -1.0611 C   0  0  0

+   -0.8632    0.5641    1.0619 C   0  0  0

+    1.9603   -0.9491    0.8429 C   0  0  0

+    1.9631    0.9461   -0.8443 C   0  0  0

+   -2.2454   -0.5610   -1.0579 C   0  0  0

+   -2.2440    0.5639    1.0587 C   0  0  0

+    1.9739   -2.3237    0.1711 C   0  0  0

+    1.9876    2.3186   -0.1685 C   0  0  0

+   -2.9346    0.0044   -0.0010 C   0  0  0

+   -0.5648   -1.4112    0.0000 H   0  0  0

+   -0.5637    1.4110    0.0000 H   0  0  0

+    2.8190   -1.2130    0.0000 H   0  0  0

+    2.4721   -0.2108    0.0000 H   0  0  0

+    2.4715    0.2055    0.0000 H   0  0  0

+    2.8234    1.2046    0.0000 H   0  0  0

+   -2.5489   -1.4065    0.0000 H   0  0  0

+   -2.5440    1.4106    0.0000 H   0  0  0

+    1.0756   -2.3326    0.0000 H   0  0  0

+    1.9828   -3.2220    0.0000 H   0  0  0

+    2.8722   -2.3148    0.0000 H   0  0  0

+    2.8858    2.3026    0.0000 H   0  0  0

+    2.0036    3.2168    0.0000 H   0  0  0

+    1.0894    2.3346    0.0000 H   0  0  0

+   -3.8329    0.0072    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

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+  3  7  1  0

+  4  8  2  0

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+  9 20  1  0

+  9 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+96-12-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 10                          1 V2000

+   -0.4994    0.7407   -0.0509 C   0  0  0

+   -1.7184    1.4129    0.5840 C   0  0  0

+    0.7666    1.1763    0.6896 C   0  0  0

+   -0.6905   -1.2122    0.0706 Br  0  0  0

+   -3.2103    0.8995   -0.2886 Cl  0  0  0

+    2.3330    0.3126   -0.1263 Br  0  0  0

+   -0.3974    1.9196    0.0000 H   0  0  0

+   -0.9126    2.2795    0.0000 H   0  0  0

+   -2.3635    2.4049    0.0000 H   0  0  0

+    1.5724    2.0429    0.0000 H   0  0  0

+    0.1215    2.1683    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  1  7  1  0

+  2  8  1  0

+  2  9  1  0

+  3 10  1  0

+  3 11  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97-88-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    1.2895   -0.3784   -0.0013 C   0  0  0

+    0.0970    0.2500   -0.0003 O   0  0  0

+    2.5328    0.4050   -0.0004 C   0  0  0

+    1.3365   -1.5928    0.0022 O   0  0  0

+   -1.1315   -0.5241   -0.0012 C   0  0  0

+    2.4746    1.9109    0.0015 C   0  0  0

+    3.7102   -0.2154   -0.0014 C   0  0  0

+   -2.3320    0.4245    0.0002 C   0  0  0

+   -3.6264   -0.3911   -0.0007 C   0  0  0

+   -4.8269    0.5574    0.0007 C   0  0  0

+   -1.9082   -1.3061    0.0000 H   0  0  0

+   -0.4423   -1.3842    0.0000 H   0  0  0

+    3.5759    1.9535    0.0000 H   0  0  0

+    2.4320    3.0122    0.0000 H   0  0  0

+    1.3733    1.8683    0.0000 H   0  0  0

+    3.7528   -1.3167    0.0000 H   0  0  0

+    4.6427    0.3721    0.0000 H   0  0  0

+   -1.5553    1.2065    0.0000 H   0  0  0

+   -3.0212    1.2846    0.0000 H   0  0  0

+   -4.4030   -1.1731    0.0000 H   0  0  0

+   -2.9372   -1.2512    0.0000 H   0  0  0

+   -4.1436    1.4222    0.0000 H   0  0  0

+   -5.6917    1.2407    0.0000 H   0  0  0

+   -5.5102   -0.3074    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  3  6  1  0

+  3  7  2  0

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+  8 19  1  0

+  9 20  1  0

+  9 21  1  0

+ 10 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+101-26-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 27                          1 V2000

+   -4.2575   -0.9586    0.0337 C   0  0  0

+   -5.1690    0.0167    0.2905 O   0  0  0

+   -3.1502   -1.1199    0.8532 C   0  0  0

+   -4.4250   -1.8129   -1.0516 C   0  0  0

+   -4.9774    1.2606   -0.1889 C   0  0  0

+   -2.2639   -2.0647    0.6084 N   0  3  0

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+   -5.8206    2.2534    0.1570 N   0  0  0

+   -4.0442    1.4878   -0.9334 O   0  0  0

+   -2.3903   -2.8873   -0.4142 C   0  0  0

+   -1.1069   -2.2039    1.4963 C   0  0  0

+   -6.9457    1.9796    1.0545 C   0  0  0

+   -5.6122    3.6065   -0.3645 C   0  0  0

+    8.7241    0.4063   -0.0274 Br  0  0  0

+   -2.7458   -0.3451    0.0000 H   0  0  0

+   -5.2626   -2.0626    0.0000 H   0  0  0

+   -3.8444   -3.5815    0.0000 H   0  0  0

+   -1.8510   -3.5750    0.0000 H   0  0  0

+   -1.2113   -3.0717    0.0000 H   0  0  0

+   -0.2391   -2.3083    0.0000 H   0  0  0

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+  1  2  1  0

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+ 12 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 13 27  1  0

+ 14 28  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+10510-77-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 43                          1 V2000

+   -5.6631   -1.2499   -0.1584 C   0  0  0

+   -6.5624   -0.3189   -0.4571 N   0  3  0

+   -4.3922   -0.8742    0.4733 C   0  0  0

+   -5.9013   -2.6119   -0.4432 C   0  0  0

+   -6.3038    0.9548   -0.1803 C   0  0  0

+   -7.8304   -0.6939   -1.0878 C   0  0  0

+   -4.1337    0.3990    0.7505 N   0  0  0

+   -3.4593   -1.8896    0.7759 C   0  0  0

+   -4.9609   -3.5375   -0.1258 C   0  0  0

+   -5.0330    1.3303    0.4513 C   0  0  0

+   -7.2355    1.9703   -0.4839 C   0  0  0

+   -8.8713   -0.9870   -0.0055 C   0  0  0

+   -3.7543   -3.1807    0.4792 C   0  0  0

+   -4.7915    2.6924    0.7307 C   0  0  0

+   -6.9394    3.2619   -0.1882 C   0  0  0

+   -5.7313    3.6188    0.4122 C   0  0  0

+    9.8018   -0.7162    0.1019 O   0  0  0

+    8.8201    0.3584   -0.3429 S   0  0  0

+   10.9247   -0.0398    0.6708 C   0  0  0

+    8.3469    0.9671    0.8508 O   0  0  0

+    9.4533    1.0387   -1.4179 O   0  0  0

+    7.6173   -0.3480   -0.9518 O   0  0  0

+   11.9552   -1.0685    1.1409 C   0  0  0

+   -6.8448   -2.9142    0.0000 H   0  0  0

+   -8.0705   -1.6551    0.0000 H   0  0  0

+   -7.1150   -1.3793    0.0000 H   0  0  0

+   -2.5017   -1.6356    0.0000 H   0  0  0

+   -5.2012   -4.4986    0.0000 H   0  0  0

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+   -9.1398   -0.0334    0.0000 H   0  0  0

+   -9.8249   -1.2555    0.0000 H   0  0  0

+   -8.6028   -1.9406    0.0000 H   0  0  0

+   -3.0321   -3.8589    0.0000 H   0  0  0

+   -3.8476    2.9933    0.0000 H   0  0  0

+   -7.6613    3.9404    0.0000 H   0  0  0

+   -5.4905    4.5798    0.0000 H   0  0  0

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+   11.2553   -1.7697    0.0000 H   0  0  0

+   12.6564   -1.7684    0.0000 H   0  0  0

+   12.6551   -0.3673    0.0000 H   0  0  0

+    6.7630   -0.8497    0.0000 H   0  0  0

+  1  2  2  0

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+  7 10  1  0

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+ 19 37  1  0

+ 19 38  1  0

+ 23 39  1  0

+ 23 40  1  0

+ 23 41  1  0

+ 22 42  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+107-06-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  8  7                          1 V2000

+    0.4913    0.5864    0.0000 C   0  0  0

+   -0.4913   -0.5864    0.0000 C   0  0  0

+    2.1803   -0.0447    0.0000 Cl  0  0  0

+   -2.1803    0.0447    0.0000 Cl  0  0  0

+    1.1048    1.7915    0.0000 H   0  0  0

+   -0.6368    1.3321    0.0000 H   0  0  0

+   -1.1048   -1.7915    0.0000 H   0  0  0

+    0.6368   -1.3321    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1070-11-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 42 39                          1 V2000

+   -3.7064   -2.8122   -0.1449 C   0  0  2

+   -4.0511   -1.5426    0.5089 N   0  0  0

+   -4.1406   -3.9785    0.7452 C   0  0  0

+   -2.1942   -2.8767   -0.3684 C   0  0  0

+   -4.9818   -0.8448   -0.3882 C   0  0  0

+   -5.5350   -4.4483    0.3261 C   0  0  0

+   -1.8590   -4.1116   -1.0044 O   0  0  0

+   -5.3840    0.4934    0.2350 C   0  0  0

+   -6.3147    1.1912   -0.6621 N   0  0  0

+   -6.6593    2.4607   -0.0083 C   0  0  2

+   -8.1675    2.6958   -0.1140 C   0  0  0

+   -5.9151    3.6070   -0.6961 C   0  0  0

+   -8.8439    2.2603    1.1874 C   0  0  0

+   -6.2503    4.8420   -0.0601 O   0  0  0

+    9.0005   -0.0557    0.4606 Cl  0  0  0

+   17.5682    1.0315   -0.1817 Cl  0  0  0

+   -4.6920   -2.7672    0.0000 H   0  0  0

+   -3.2348   -0.9886    0.0000 H   0  0  0

+   -4.0442   -4.9604    0.0000 H   0  0  0

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+   -5.6846    2.3080    0.0000 H   0  0  0

+   -7.7508    3.5901    0.0000 H   0  0  0

+   -8.9109    3.3444    0.0000 H   0  0  0

+   -5.2414    2.8862    0.0000 H   0  0  0

+   -5.0533    4.0872    0.0000 H   0  0  0

+   -9.3780    3.0898    0.0000 H   0  0  0

+   -9.6734    1.7262    0.0000 H   0  0  0

+   -8.3098    1.4308    0.0000 H   0  0  0

+   -6.5087    5.7941    0.0000 H   0  0  0

+    9.9871   -0.0557    0.0000 H   0  0  0

+   18.5548    1.0315    0.0000 H   0  0  0

+  1  2  1  0

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+ 13 38  1  0

+ 13 39  1  0

+ 14 40  1  0

+ 15 41  1  0

+ 16 42  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1146-04-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 40                          1 V2000

+    1.7937   -0.7885   -0.1962 C   0  0  0

+    0.4122   -1.4053   -0.1895 C   0  0  0

+    1.9311    0.5791    0.4820 C   0  0  1

+    2.9846   -1.7439   -0.0978 C   0  0  0

+    2.6672   -1.0519   -1.4249 C   0  0  0

+   -0.6383   -0.5974   -0.1741 C   0  0  0

+    0.2350   -2.9018   -0.1996 C   0  0  0

+    0.8453    1.5010   -0.0539 C   0  0  0

+    1.7686    0.4202    1.9951 C   0  0  0

+    3.2162    1.1319    0.1904 O   0  0  0

+   -0.5043    0.8848   -0.1343 C   0  0  0

+   -2.1045   -0.9194   -0.2049 C   0  0  2

+    1.0639    2.6461   -0.3881 O   0  0  0

+   -1.6921    1.4820   -0.1635 C   0  0  0

+   -2.7990    0.4559   -0.2110 C   0  0  0

+   -2.4616   -1.6281    0.9834 O   0  0  0

+   -3.6204    0.6257   -1.4906 C   0  0  0

+   -3.7018    0.5956    1.0164 C   0  0  0

+    2.6699   -2.7352    0.0000 H   0  0  0

+    4.0227   -1.6802    0.0000 H   0  0  0

+    3.6887   -0.8564    0.0000 H   0  0  0

+    2.7212   -0.0133    0.0000 H   0  0  0

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+   -1.4667   -1.7409    0.0000 H   0  0  0

+   -1.8381    2.5117    0.0000 H   0  0  0

+   -2.9296   -2.5569    0.0000 H   0  0  0

+   -3.4099    1.6442    0.0000 H   0  0  0

+   -4.6389    0.8362    0.0000 H   0  0  0

+   -3.8309   -0.3928    0.0000 H   0  0  0

+   -3.5428    1.6234    0.0000 H   0  0  0

+   -4.7296    0.7546    0.0000 H   0  0  0

+   -3.8608   -0.4322    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  1  5  1  0

+  2  6  2  0

+  2  7  1  0

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+ 17 33  1  0

+ 17 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1149-99-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+    2.2009   -0.6076   -0.0230 C   0  0  0

+    0.9240   -1.3796   -0.2730 C   0  0  0

+    3.0898   -1.0869    1.1270 C   0  0  0

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+    2.0321    1.1411   -1.6886 O   0  0  0

+   -0.3153    0.6846    0.2663 C   0  0  0

+   -1.6366   -1.2662   -0.2524 C   0  0  2

+    0.9773    2.4981    1.0827 O   0  0  0

+   -1.5775    1.0810    0.3998 C   0  0  0

+   -2.5238   -0.0574    0.1016 C   0  0  1

+   -1.8549   -2.3116    0.6971 O   0  0  0

+   -3.4227    0.3014   -1.0834 C   0  0  0

+   -3.3763   -0.3721    1.3325 C   0  0  0

+   -4.2386    1.4231   -0.7398 O   0  0  0

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+   -2.0675   -3.3299    0.0000 H   0  0  0

+   -4.4188    0.0013    0.0000 H   0  0  0

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+   -4.3522   -0.7324    0.0000 H   0  0  0

+   -3.0160   -1.3480    0.0000 H   0  0  0

+   -4.8505    2.2644    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+ 17 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+ 19 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1195-92-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 25                          1 V2000

+   -1.6517    0.1768   -0.0255 C   0  0  0

+   -1.0119   -1.0746    0.4873 C   0  0  0

+   -1.3352   -0.9180   -0.8927 O   0  0  0

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+   -3.1382    0.4048    0.2558 C   0  0  0

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+    1.1917    0.0421   -0.0472 C   0  0  0

+    2.6454    0.0664    0.3492 C   0  0  0

+    3.5743   -0.1161   -0.5562 C   0  0  0

+   -1.2458   -2.1024    0.0000 H   0  0  0

+   -0.6206    2.4476    0.0000 H   0  0  0

+   -1.8160    1.8230    0.0000 H   0  0  0

+   -2.9784    1.4467    0.0000 H   0  0  0

+   -4.1801    0.5646    0.0000 H   0  0  0

+   -3.2980   -0.6371    0.0000 H   0  0  0

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+    3.9155   -1.1135    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 20  1  0

+  8 21  1  0

+  9 22  1  0

+ 10 23  1  0

+ 10 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1198-27-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -2.4745    0.4679   -0.1544 C   0  0  0

+   -3.3199   -0.4905    0.4590 C   0  0  0

+   -1.1947    0.0780   -0.5975 C   0  0  0

+   -2.9254    1.7896   -0.3043 C   0  0  0

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+   -4.5963   -0.0996    0.9004 C   0  0  0

+   -0.7872   -1.2320   -0.4256 C   0  0  0

+   -0.3456    1.0067   -1.2052 N   0  0  0

+   -4.1653    2.1331    0.1402 C   0  0  0

+   -1.6287   -2.1648    0.1804 C   0  0  0

+   -5.0015    1.1888    0.7333 C   0  0  0

+    0.4469   -1.6149   -0.8515 O   0  0  0

+    9.7472    0.3790    0.3363 Cl  0  0  0

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+   -3.5372   -2.5144    0.0000 H   0  0  0

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+  1  2  1  0

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+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

+  4  9  2  0

+  5 10  1  0

+  6 11  2  0

+  7 12  1  0

+  7 10  2  0

+  9 11  1  0

+  4 14  1  0

+  5 15  1  0

+  6 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1229-35-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 45                          1 V2000

+   -2.0789   -0.3095   -0.5369 N   0  0  0

+   -2.4849   -0.9087    0.6553 C   0  0  0

+   -1.2046   -0.9226   -1.4340 C   0  0  0

+   -2.5985    1.0206   -0.8641 C   0  0  0

+   -1.6927   -1.8452    1.3077 C   0  0  0

+   -3.7165   -0.5519    1.1938 C   0  0  0

+   -0.2688   -1.8602   -1.0152 C   0  0  0

+   -1.2822   -0.5788   -2.7794 C   0  0  0

+   -1.5531    2.0788   -0.5060 C   0  0  0

+   -0.1292   -2.3346    0.6713 S   0  0  0

+   -2.1422   -2.4147    2.4954 C   0  0  0

+   -4.1542   -1.1234    2.3736 C   0  0  0

+    0.5823   -2.4435   -1.9493 C   0  0  0

+   -0.4331   -1.1641   -3.6993 C   0  0  0

+   -2.0077    3.4503   -1.0387 C   0  0  0

+   -1.4910    2.2427    1.0300 C   0  0  0

+   -3.3666   -2.0545    3.0238 C   0  0  0

+    0.4990   -2.0961   -3.2836 C   0  0  0

+   -2.2187    4.3238    0.1360 N   0  0  0

+   -1.3511    3.7752    1.2096 C   0  0  0

+   -1.6737    5.6421   -0.2148 C   0  0  0

+   12.0940    0.4415    0.7355 Cl  0  0  0

+   -3.1188    1.7025    0.0000 H   0  0  0

+   -3.3462    0.6003    0.0000 H   0  0  0

+   -3.9844    0.2630    0.0000 H   0  0  0

+   -1.7627    0.1317    0.0000 H   0  0  0

+   -0.8313    1.6154    0.0000 H   0  0  0

+   -1.8820   -3.2320    0.0000 H   0  0  0

+   -5.0117   -1.1442    0.0000 H   0  0  0

+    1.0685   -3.1502    0.0000 H   0  0  0

+    0.1158   -0.5050    0.0000 H   0  0  0

+   -2.8369    3.6699    0.0000 H   0  0  0

+   -2.5954    2.8255    0.0000 H   0  0  0

+   -0.8906    1.6301    0.0000 H   0  0  0

+   -0.6830    2.5305    0.0000 H   0  0  0

+   -3.8348   -2.7732    0.0000 H   0  0  0

+    1.2474   -1.6771    0.0000 H   0  0  0

+   -0.5197    3.5641    0.0000 H   0  0  0

+   -1.0121    4.5632    0.0000 H   0  0  0

+   -0.8810    5.3144    0.0000 H   0  0  0

+   -1.3460    6.4348    0.0000 H   0  0  0

+   -2.4664    5.9698    0.0000 H   0  0  0

+   12.9518    0.4415    0.0000 H   0  0  0

+  1  2  1  0

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+ 19 21  1  0

+  7 10  1  0

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+  4 23  1  0

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+ 21 40  1  0

+ 21 41  1  0

+ 21 42  1  0

+ 22 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1253-28-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 71                          1 V2000

+    1.5352    1.2173   -0.0328 C   0  0  1

+    0.0670    1.0320   -0.4023 C   0  0  2

+    1.5293    1.6848    1.4441 C   0  0  0

+    2.2487   -0.0409   -0.1595 O   0  0  0

+    2.1661    2.2674   -0.9104 C   0  0  0

+   -0.5957    0.6527    0.9493 C   0  0  1

+   -0.2449   -0.0876   -1.3766 C   0  0  0

+   -0.5122    2.3520   -0.9150 C   0  0  0

+    0.0458    1.6659    1.9037 C   0  0  0

+    3.5586   -0.1014    0.1271 C   0  0  0

+    2.8492    1.8668   -2.1926 C   0  0  0

+    2.1243    3.4300   -0.5863 O   0  0  0

+   -2.0957    0.7867    0.7607 C   0  0  1

+   -1.7661   -0.0882   -1.5951 C   0  0  0

+    4.3284   -1.3711   -0.1304 C   0  0  0

+    4.1206    0.8621    0.5916 O   0  0  0

+   -2.5255   -0.2554   -0.2821 C   0  0  2

+   -2.8115    0.4972    2.0830 C   0  0  0

+    5.7890   -1.1742    0.2805 C   0  0  0

+   -4.0292   -0.1178   -0.5495 C   0  0  2

+   -4.3166    0.7009    1.8949 C   0  0  0

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+   -4.7851   -0.1689    0.7425 C   0  0  0

+   -4.4567   -1.1693   -1.5581 C   0  0  0

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+   -5.9726   -1.3627   -1.5625 C   0  0  0

+    8.8127   -3.5555    0.1685 C   0  0  0

+   -6.3839   -1.7566   -0.1574 C   0  0  0

+   -7.1043   -2.7098    0.0533 O   0  0  0

+    2.4480    1.6964    0.0000 H   0  0  0

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+   -4.0183    0.8009    0.0000 H   0  0  0

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+  6  9  1  0

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+ 27 64  1  0

+ 27 65  1  0

+ 28 66  1  0

+ 28 67  1  0

+ 28 68  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+128-44-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.3691    0.7472   -0.1980 C   0  0  0

+   -2.1840   -0.1814    0.4727 C   0  0  0

+   -0.0211   -0.2412   -0.7865 S   0  0  0

+   -1.6913    2.0705   -0.2761 C   0  0  0

+   -1.6405   -1.5349    0.4325 C   0  0  0

+   -3.3658    0.3057    1.0668 C   0  0  0

+   -0.4847   -1.7402   -0.2045 N   0  0  0

+   -0.1388   -0.2956   -2.2015 O   0  0  0

+    1.1278    0.1491   -0.0469 O   0  0  0

+   -2.8572    2.5313    0.3202 C   0  0  0

+   -2.2867   -2.5498    1.0224 O   0  0  0

+   -3.6864    1.6400    0.9799 C   0  0  0

+   10.0013    0.3590    0.6130 Na  0  3  0

+   -0.9823    2.6881    0.0000 H   0  0  0

+   -4.0802   -0.3056    0.0000 H   0  0  0

+   -3.0647    3.4484    0.0000 H   0  0  0

+   -4.5958    1.8788    0.0000 H   0  0  0

+   -2.7917   -3.3429    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

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+  4 10  2  0

+  5 11  1  0

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+  5  7  2  0

+ 10 12  1  0

+  4 14  1  0

+  6 15  1  0

+ 10 16  1  0

+ 12 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13010-07-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 20                          1 V2000

+    0.7165    0.2082    0.3457 N   0  0  0

+   -0.5461   -0.2486    0.6399 C   0  0  0

+    1.8656   -0.6940    0.4545 C   0  0  0

+    0.9037    1.5348   -0.0638 N   0  3  0

+   -1.5537   -0.1593   -0.3076 N   0  0  0

+   -0.7953   -0.7645    1.8074 N   0  0  0

+    1.8644   -1.6662   -0.7270 C   0  0  0

+    2.0295    1.9637   -0.2433 O   0  0  0

+   -0.0593    2.2593   -0.2404 O   0  5  0

+   -2.7387   -0.5879   -0.0315 N   0  0  0

+    3.0645   -2.6083   -0.6134 C   0  0  0

+   -3.6241   -0.5095   -0.8642 O   0  0  0

+    2.7471   -0.8936    0.0000 H   0  0  0

+    2.2540    0.1221    0.0000 H   0  0  0

+   -1.6703    0.7370    0.0000 H   0  0  0

+   -1.1884   -1.5784    0.0000 H   0  0  0

+    0.9829   -1.4666    0.0000 H   0  0  0

+    1.4761   -2.4824    0.0000 H   0  0  0

+    2.5064   -3.3192    0.0000 H   0  0  0

+    3.7754   -3.1664    0.0000 H   0  0  0

+    3.6226   -1.8974    0.0000 H   0  0  0

+  1  2  1  0

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+  5 15  1  0

+  6 16  1  0

+  7 17  1  0

+  7 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+ 11 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+13010-10-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+    0.0256    0.9686    0.0439 N   0  0  0

+   -1.0508    0.1604   -0.2872 C   0  0  0

+    1.1645    0.4083    0.7755 C   0  0  0

+    0.0268    2.2128   -0.2967 N   0  0  0

+   -2.0496   -0.0639    0.6301 N   0  0  0

+   -1.1156   -0.3856   -1.4657 N   0  0  0

+    2.2144   -0.0901   -0.2196 C   0  0  0

+    0.9726    2.9229   -0.0057 O   0  0  0

+   -3.1804   -0.8069    0.2668 N   0  3  0

+    3.4039   -0.6752    0.5444 C   0  0  0

+   -4.2944   -0.3794    0.5113 O   0  0  0

+   -3.0495   -1.8804   -0.2935 O   0  5  0

+    4.4538   -1.1736   -0.4507 C   0  0  0

+    5.6433   -1.7587    0.3133 C   0  0  0

+    0.4232   -0.0931    0.0000 H   0  0  0

+    1.2322   -0.4840    0.0000 H   0  0  0

+   -2.3990    0.7600    0.0000 H   0  0  0

+   -1.2211   -1.2743    0.0000 H   0  0  0

+    2.9557    0.4113    0.0000 H   0  0  0

+    2.1467    0.8022    0.0000 H   0  0  0

+    2.6626   -1.1766    0.0000 H   0  0  0

+    3.4716   -1.5675    0.0000 H   0  0  0

+    5.1951   -0.6722    0.0000 H   0  0  0

+    4.3861   -0.2813    0.0000 H   0  0  0

+    5.2483   -2.5617    0.0000 H   0  0  0

+    6.4463   -2.1537    0.0000 H   0  0  0

+    6.0383   -0.9557    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 14 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+132-20-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 50                          1 V2000

+   -5.8057   -0.1717   -0.5461 C   0  0  0

+   -7.1338    0.4831   -0.8261 C   0  0  0

+   -5.0037    0.6982    0.3872 C   0  0  0

+   -6.0373   -1.5378    0.1026 C   0  0  0

+   -7.4805    0.8165   -2.1218 C   0  0  0

+   -8.0079    0.7452    0.2125 C   0  0  0

+   -3.8662    1.3314   -0.0773 C   0  0  0

+   -5.3981    0.8507    1.6361 N   0  0  0

+   -4.7484   -2.3595    0.0351 C   0  0  0

+   -8.6989    1.4172   -2.3787 C   0  0  0

+   -9.2260    1.3457   -0.0442 C   0  0  0

+   -3.1355    2.1293    0.7895 C   0  0  0

+   -4.7280    1.6019    2.4882 C   0  0  0

+   -4.9708   -3.6712    0.6580 N   0  0  0

+   -9.5704    1.6844   -1.3397 C   0  0  0

+   -3.5783    2.2611    2.0970 C   0  0  0

+   -5.9368   -4.3827   -0.1896 C   0  0  0

+   -3.7022   -4.4054    0.5603 C   0  0  0

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+   12.7526   -0.7457    0.0115 C   0  0  0

+   10.5446    1.0634   -0.4408 C   0  0  0

+   13.9785   -1.3013   -0.0530 O   0  0  0

+   12.4290   -0.1004    0.9882 O   0  0  0

+    9.3515    1.6811   -0.3375 O   0  0  0

+   11.5408    1.5864    0.0163 O   0  0  0

+   -4.9636   -0.5851    0.0000 H   0  0  0

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+   -3.8525   -2.6378    0.0000 H   0  0  0

+   -4.3536   -1.5085    0.0000 H   0  0  0

+   -8.3529    2.2892    0.0000 H   0  0  0

+   -9.7692    0.5809    0.0000 H   0  0  0

+   -2.2314    2.3795    0.0000 H   0  0  0

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+  -10.3763    2.1645    0.0000 H   0  0  0

+   -3.6866    3.1929    0.0000 H   0  0  0

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+   -4.1721   -5.2173    0.0000 H   0  0  0

+   -2.8903   -4.8753    0.0000 H   0  0  0

+   -3.2323   -3.5935    0.0000 H   0  0  0

+   11.6437   -1.8456    0.0000 H   0  0  0

+    9.8459   -0.7468    0.0000 H   0  0  0

+   14.8329   -1.6885    0.0000 H   0  0  0

+    8.5184    2.1124    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  5 10  1  0

+  6 11  2  0

+  7 12  2  0

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+ 10 15  2  0

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+ 14 18  1  0

+ 19 20  2  0

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+ 20 22  1  0

+ 21 23  1  0

+ 21 24  2  0

+ 22 25  1  0

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+ 11 15  1  0

+ 13 16  2  0

+  1 27  1  0

+  4 28  1  0

+  4 29  1  0

+  5 30  1  0

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+  7 32  1  0

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+ 18 45  1  0

+ 18 46  1  0

+ 19 47  1  0

+ 20 48  1  0

+ 23 49  1  0

+ 25 50  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+135-51-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 28                          1 V2000

+   -2.6028   -0.2217    0.0749 C   0  0  0

+   -3.2902   -1.1038    0.9462 C   0  0  0

+   -1.3480   -0.5946   -0.4368 C   0  0  0

+   -3.1871    1.0128   -0.2566 C   0  0  0

+   -2.7052   -2.3351    1.2830 C   0  0  0

+   -4.5450   -0.7286    1.4573 C   0  0  0

+   -0.8082   -1.7943   -0.0915 C   0  0  0

+   -4.4011    1.3443    0.2615 C   0  0  0

+   -1.4841   -2.6659    0.7676 C   0  0  0

+   -5.0817    0.4727    1.1099 C   0  0  0

+    0.7650   -2.2568   -0.7365 S   0  0  0

+   -5.1295    2.8931   -0.1571 S   0  0  0

+   -0.9189   -3.8576    1.0946 O   0  0  0

+    1.7219   -1.7736    0.1963 O   0  0  0

+    0.6300   -3.6096   -1.1502 O   0  0  0

+    0.9879   -1.4549   -2.0107 O   0  0  0

+   -5.9058    2.6523   -1.3227 O   0  0  0

+   -5.6221    3.4303    1.0627 O   0  0  0

+   -4.0052    3.8215   -0.5936 O   0  0  0

+   11.0876    0.5899   -0.0348 Na  0  3  0

+   19.5107    2.5289    0.5042 Na  0  3  0

+   -0.7016    0.1447    0.0000 H   0  0  0

+   -2.5562    1.7654    0.0000 H   0  0  0

+   -3.3348   -3.0888    0.0000 H   0  0  0

+   -5.1930   -1.4665    0.0000 H   0  0  0

+   -6.0565    0.5916    0.0000 H   0  0  0

+   -0.4981   -4.7449    0.0000 H   0  0  0

+    1.2509   -0.5087    0.0000 H   0  0  0

+   -3.2480    4.4468    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

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+ 11 14  2  0

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+  7  9  2  0

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+  3 22  1  0

+  4 23  1  0

+  5 24  1  0

+  6 25  1  0

+ 10 26  1  0

+ 13 27  1  0

+ 16 28  1  0

+ 19 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+13849-08-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 34                          1 V2000

+   -0.5817    0.8717    0.0986 C   0  0  0

+   -0.5484   -0.5240    0.1211 C   0  0  0

+    0.5639    1.6037    0.0382 C   0  0  0

+   -2.0413    1.2804    0.1634 C   0  0  0

+    0.6779   -1.1798    0.0927 C   0  0  0

+   -1.8063   -1.0421    0.1598 O   0  0  0

+    1.8030    0.9531    0.0058 C   0  0  0

+   -2.7215   -0.0326    0.6173 C   0  0  2

+    1.8556   -0.4528    0.0354 C   0  0  0

+    3.0537    1.7109   -0.0592 C   0  0  0

+   -4.0595   -0.1909   -0.1076 C   0  0  0

+    3.0521   -1.0792    0.0073 O   0  0  0

+    4.2225    1.0187   -0.0866 C   0  0  0

+   -3.8235   -0.1918   -1.6193 C   0  0  0

+   -4.7114   -1.5113    0.3077 C   0  0  0

+   -4.9207    0.8954    0.2394 O   0  0  0

+    4.2026   -0.3908   -0.0507 C   0  0  0

+    5.2573   -0.9994   -0.0738 O   0  0  0

+    0.5197    2.6416    0.0000 H   0  0  0

+   -1.6935    2.2593    0.0000 H   0  0  0

+   -2.9942    1.6942    0.0000 H   0  0  0

+    0.7101   -2.2182    0.0000 H   0  0  0

+   -3.0858   -1.0055    0.0000 H   0  0  0

+    3.0485    2.7497    0.0000 H   0  0  0

+    5.1286    1.5267    0.0000 H   0  0  0

+   -3.8275   -1.2306    0.0000 H   0  0  0

+   -2.7847   -0.1958    0.0000 H   0  0  0

+   -3.8195    0.8470    0.0000 H   0  0  0

+   -5.6429   -1.0514    0.0000 H   0  0  0

+   -5.1713   -2.4428    0.0000 H   0  0  0

+   -3.7799   -1.9712    0.0000 H   0  0  0

+   -5.5661    1.7095    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

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+  6  8  1  0

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+ 14 27  1  0

+ 14 28  1  0

+ 15 29  1  0

+ 15 30  1  0

+ 15 31  1  0

+ 16 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+139-33-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 35                          1 V2000

+   -1.4981   -1.6341    0.2261 N   0  0  0

+   -2.0051   -0.2769    0.4686 C   0  0  0

+   -0.2103   -1.7350    0.9255 C   0  0  0

+   -2.4197   -2.5562    0.9032 C   0  0  0

+   -3.3520   -0.1021   -0.2358 C   0  0  0

+    0.8971   -1.2890    0.0059 C   0  0  0

+   -2.3692   -3.9026    0.2281 C   0  0  0

+   -3.8589    1.2552    0.0068 N   0  0  0

+    2.1523   -1.1820    0.4694 O   0  0  0

+    0.6552   -1.0277   -1.1487 O   0  0  0

+   -1.7215   -4.0477   -0.7996 O   0  0  0

+   -2.9760   -4.8506    0.7077 O   0  0  0

+   -5.1468    1.3560   -0.6927 C   0  0  0

+   -4.1507    1.3463    1.4436 C   0  0  0

+   -4.9199    1.8698   -2.0912 C   0  0  0

+   -4.0685    2.7856    1.8826 C   0  0  0

+   -5.9330    1.8897   -2.9714 O   0  0  0

+   -3.8261    2.2637   -2.4200 O   0  0  0

+   -3.6652    3.6401    1.1054 O   0  0  0

+   -4.4050    3.0996    3.0162 O   0  0  0

+   11.4397    0.3741    0.0595 Na  0  3  0

+   20.0426    1.3145   -0.2636 Na  0  3  0

+   -1.1267   -0.1031    0.0000 H   0  0  0

+   -2.0348    0.6180    0.0000 H   0  0  0

+   -0.5982   -2.5420    0.0000 H   0  0  0

+    0.4018   -2.3884    0.0000 H   0  0  0

+   -2.8772   -1.7865    0.0000 H   0  0  0

+   -3.2785   -2.8096    0.0000 H   0  0  0

+   -4.2304   -0.2758    0.0000 H   0  0  0

+   -3.3224   -0.9970    0.0000 H   0  0  0

+    3.0444   -1.1059    0.0000 H   0  0  0

+   -6.0013    1.6234    0.0000 H   0  0  0

+   -5.3165    0.4769    0.0000 H   0  0  0

+   -5.0375    1.4703    0.0000 H   0  0  0

+   -4.3468    0.4727    0.0000 H   0  0  0

+   -6.8282    1.9073    0.0000 H   0  0  0

+   -3.4587   -5.6047    0.0000 H   0  0  0

+   -5.0596    3.7105    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 18  2  0

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+ 16 20  1  0

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+ 13 33  1  0

+ 14 34  1  0

+ 14 35  1  0

+ 17 36  1  0

+ 12 37  1  0

+ 20 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+140-64-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 75 74                          1 V2000

+  -14.9473    3.3729   -0.5768 C   0  0  0

+  -15.9649    4.2934   -0.7926 C   0  0  0

+  -13.7504    3.7782    0.0009 C   0  0  0

+  -15.1247    2.0728   -0.9259 O   0  0  0

+  -15.7904    5.6125   -0.4342 C   0  0  0

+  -13.5690    5.0954    0.3616 C   0  0  0

+  -13.9194    1.3853   -0.5844 C   0  0  0

+  -14.5895    6.0232    0.1461 C   0  0  0

+  -14.0536   -0.0933   -0.9541 C   0  0  0

+  -14.3983    7.4385    0.5317 C   0  0  0

+  -12.7631   -0.8295   -0.5885 C   0  0  0

+  -13.2118    7.8423    1.1047 N   0  0  0

+  -15.3519    8.3035    0.3295 N   0  0  0

+  -12.8972   -2.3081   -0.9582 C   0  0  0

+  -11.6068   -3.0443   -0.5925 C   0  0  0

+  -11.7320   -4.4252   -0.9378 O   0  0  0

+  -10.5634   -5.0237   -0.5922 C   0  0  0

+  -10.3900   -6.3847   -0.8122 C   0  0  0

+   -9.5417   -4.2730   -0.0246 C   0  0  0

+   -9.2053   -6.9951   -0.4631 C   0  0  0

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+   -8.1785   -6.2448    0.1123 C   0  0  0

+   -6.9052   -6.8968    0.4889 C   0  0  0

+   -5.8925   -6.1545    1.0569 N   0  0  0

+   -6.7412   -8.1733    0.2836 N   0  0  0

+    9.3718   -0.9087    1.4408 C   0  0  0

+    8.0428    0.2934    1.1590 S   0  0  0

+   10.5685   -0.2046    2.0834 C   0  0  0

+    6.9431   -0.5474    0.5264 O   0  0  0

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+    8.3751    1.2081    0.1235 O   0  0  0

+   11.6154   -1.1516    2.3054 O   0  0  0

+   23.4526    0.1957   -0.8396 C   0  0  0

+   22.1237    1.3978   -1.1215 S   0  0  0

+   24.6494    0.8998   -0.1971 C   0  0  0

+   21.0240    0.5570   -1.7541 O   0  0  0

+   21.5333    1.8215    0.0996 O   0  0  0

+   22.4560    2.3125   -2.1569 O   0  0  0

+   25.6963   -0.0472    0.0249 O   0  0  0

+  -16.9309    3.9386    0.0000 H   0  0  0

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+  -13.8984   -2.0704    0.0000 H   0  0  0

+  -13.2749   -3.2654    0.0000 H   0  0  0

+  -10.6056   -3.2820    0.0000 H   0  0  0

+  -11.2291   -2.0870    0.0000 H   0  0  0

+  -11.2330   -6.9750    0.0000 H   0  0  0

+   -9.6255   -3.2474    0.0000 H   0  0  0

+   -9.1255   -8.0211    0.0000 H   0  0  0

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+   -4.9507   -6.5691    0.0000 H   0  0  0

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+   -6.6101   -9.1940    0.0000 H   0  0  0

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+   20.2065   -0.0680    0.0000 H   0  0  0

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+  1  2  2  0

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+ 21 22  2  0

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+ 33 70  1  0

+ 33 71  1  0

+ 35 72  1  0

+ 35 73  1  0

+ 36 74  1  0

+ 39 75  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+142-04-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+   -3.2650    0.8671    0.0192 C   0  0  0

+   -4.0820   -0.1182    0.5596 C   0  0  0

+   -2.0726    0.5140   -0.5993 C   0  0  0

+   -3.6448    2.2092    0.0927 N   0  0  0

+   -3.7063   -1.4446    0.4802 C   0  0  0

+   -1.7029   -0.8147   -0.6753 C   0  0  0

+   -2.5183   -1.7927   -0.1365 C   0  0  0

+    7.3174    0.0718    0.0826 Cl  0  0  0

+   -5.0213    0.0802    0.0000 H   0  0  0

+   -1.3882    1.1872    0.0000 H   0  0  0

+   -2.9756    2.8974    0.0000 H   0  0  0

+   -4.5754    2.4447    0.0000 H   0  0  0

+   -4.3882   -2.1203    0.0000 H   0  0  0

+   -0.7644   -1.0165    0.0000 H   0  0  0

+   -2.2388   -2.7111    0.0000 H   0  0  0

+    8.2774    0.0718    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

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+  2  5  2  0

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+  4 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  8 16  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+142-47-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 18                          1 V2000

+   -0.7273   -0.8747   -0.5894 C   0  0  1

+   -1.7242    0.0304    0.1372 C   0  0  0

+    0.4774   -1.1008    0.2874 C   0  0  0

+   -1.3643   -2.1642   -0.8882 N   0  0  0

+   -2.9472    0.2600   -0.7530 C   0  0  0

+    1.5260   -0.2660    0.2154 O   0  0  0

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+   -3.9292    1.1514   -0.0374 C   0  0  0

+   -3.6735    1.5663    1.0848 O   0  0  0

+   -4.9820    1.4603   -0.5786 O   0  0  0

+   10.0693    1.0915   -0.1963 Na  0  3  0

+   -0.3118   -0.0390    0.0000 H   0  0  0

+   -0.9025    0.4728    0.0000 H   0  0  0

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+   -2.2956   -2.2246    0.0000 H   0  0  0

+   -0.8463   -2.9405    0.0000 H   0  0  0

+   -3.7689   -0.1825    0.0000 H   0  0  0

+   -2.8039   -0.6622    0.0000 H   0  0  0

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+   -5.8775    1.7231    0.0000 H   0  0  0

+  1  2  1  0

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+  6 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+143-67-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+124131                          1 V2000

+   -2.3879   -1.8217   -0.5737 C   0  0  2

+   -3.1946   -2.5594    0.4864 C   0  0  2

+   -1.1142   -2.4539   -1.0803 C   0  0  2

+   -1.9276   -0.4896   -0.0383 C   0  0  0

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+   -3.0603   -4.0692    0.3869 C   0  0  2

+   -4.5922   -2.1306    0.3169 N   0  0  0

+   -0.9997   -3.9517   -0.9664 C   0  0  2

+   -0.0444   -1.7849   -0.3005 N   0  0  0

+   -0.5328   -0.5423    0.0872 C   0  0  0

+   -2.6544    0.6337    0.2979 C   0  0  0

+   -4.6949   -1.2856   -0.8915 C   0  0  0

+   -1.5812   -4.4575    0.3517 C   0  0  2

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+ 62124  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+144-55-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  7  5                          1 V2000

+   -2.7015    0.0000   -0.0306 C   0  0  0

+   -3.4770   -0.9896    0.4192 O   0  0  0

+   -1.5767   -0.2815   -0.6925 O   0  0  0

+   -3.0538    1.2712    0.1767 O   0  0  0

+    7.0537   -0.0001    0.0832 Na  0  3  0

+   -4.0586   -1.7318    0.0000 H   0  0  0

+   -3.3056    2.1799    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  6  1  0

+  4  7  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14448-67-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+   -2.3088    1.0556   -0.2960 C   0  0  0

+   -3.0136    0.0008    0.2986 C   0  0  0

+   -0.7569    0.3220   -0.7536 S   0  0  0

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+   -4.3045    0.2945    0.7680 C   0  0  0

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+   -4.8323    1.5585    0.6414 C   0  0  0

+   -0.2983   -2.3753   -0.1981 N   0  0  0

+    0.9775   -2.2792   -0.7691 N   0  0  0

+    9.9812    0.6411    0.2941 Cl  0  0  0

+   -2.2019    3.0856    0.0000 H   0  0  0

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+ 13 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1456-55-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 54                          1 V2000

+   -1.9074    0.8082   -0.3197 C   0  0  1

+   -1.7569   -0.2871    0.6658 N   0  0  0

+   -0.5324    1.4299   -0.5206 C   0  0  1

+   -2.4650    0.1757   -1.5747 C   0  0  0

+   -3.1036    2.0061    0.3236 S   0  0  0

+   -0.4055   -0.2824    1.1999 C   0  0  2

+   -2.8079   -1.1141    0.8963 C   0  0  0

+    0.2031    1.1058    0.8058 C   0  0  1

+    0.1314    0.7776   -1.6050 O   0  0  0

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+   -2.7882   -2.0074    1.7164 O   0  0  0

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+ 30 49  1  0

+ 30 50  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+14919-77-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 34                          1 V2000

+   -1.2739   -1.5643    0.3524 C   0  0  0

+   -2.0532   -2.6943    0.5475 C   0  0  0

+   -0.0169   -1.6782   -0.2118 C   0  0  0

+   -1.8003   -0.2094    0.7500 C   0  0  0

+   -1.5691   -3.9429    0.1751 C   0  0  0

+   -3.2894   -2.5813    1.1029 O   0  0  0

+    0.4681   -2.9179   -0.5835 C   0  0  0

+   -2.5174    0.3893   -0.3837 N   0  0  0

+   -0.3051   -4.0531   -0.3916 C   0  0  0

+   -2.3307   -5.0546    0.3654 O   0  0  0

+   -2.9679    1.6085    0.0366 N   0  0  0

+    0.1733   -5.2726   -0.7572 O   0  0  0

+   -2.5706    2.7291   -0.5981 C   0  0  0

+   -3.0677    4.0742   -0.1345 C   0  0  0

+   -1.8131    2.6551   -1.5424 O   0  0  0

+   -2.1097    4.6370    0.9174 C   0  0  0

+   -3.1331    4.9930   -1.2788 N   0  0  0

+   -2.5810    5.9124    1.3570 O   0  0  0

+   12.6918    1.1004    0.1266 Cl  0  0  0

+    0.5708   -0.8956    0.0000 H   0  0  0

+   -0.8218   -0.1946    0.0000 H   0  0  0

+   -1.4737    0.7132    0.0000 H   0  0  0

+   -4.2640   -2.4922    0.0000 H   0  0  0

+    1.4406   -3.0278    0.0000 H   0  0  0

+   -3.3170   -0.1750    0.0000 H   0  0  0

+   -2.8838   -5.8620    0.0000 H   0  0  0

+   -3.9465    1.6020    0.0000 H   0  0  0

+    0.5307   -6.1837    0.0000 H   0  0  0

+   -4.0243    3.8678    0.0000 H   0  0  0

+   -1.6647    3.7654    0.0000 H   0  0  0

+   -1.2133    5.0298    0.0000 H   0  0  0

+   -2.3224    5.5413    0.0000 H   0  0  0

+   -4.0132    5.4209    0.0000 H   0  0  0

+   -2.9202    6.8304    0.0000 H   0  0  0

+   13.6705    1.1004    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  4  8  1  0

+  5  9  2  0

+  5 10  1  0

+  8 11  1  0

+  9 12  1  0

+ 11 13  1  0

+ 13 14  1  0

+ 13 15  2  0

+ 14 16  1  0

+ 14 17  1  0

+ 16 18  1  0

+  7  9  1  0

+  3 20  1  0

+  4 21  1  0

+  4 22  1  0

+  6 23  1  0

+  7 24  1  0

+  8 25  1  0

+ 10 26  1  0

+ 11 27  1  0

+ 12 28  1  0

+ 14 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+ 19 35  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+151-21-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 42                          1 V2000

+    0.5662   -0.7742   -0.7268 C   0  0  0

+   -0.6097   -0.4613    0.2007 C   0  0  0

+    1.8487   -0.8953    0.0987 C   0  0  0

+   -1.8922   -0.3402   -0.6248 C   0  0  0

+    2.9469   -1.1876   -0.7676 O   0  0  0

+   -3.0680   -0.0273    0.3027 C   0  0  0

+    4.1845   -1.2945    0.1118 S   0  0  0

+   -4.3505    0.0938   -0.5227 C   0  0  0

+    3.7985   -2.0859    1.2271 O   0  0  0

+    5.2606   -1.5848   -0.7697 O   0  0  0

+    4.4687    0.0934    0.6681 O   0  0  0

+   -5.5264    0.4067    0.4048 C   0  0  0

+   -6.8089    0.5278   -0.4207 C   0  0  0

+   -7.9848    0.8408    0.5068 C   0  0  0

+   -9.2673    0.9618   -0.3187 C   0  0  0

+  -10.4431    1.2748    0.6088 C   0  0  0

+  -11.7256    1.3958   -0.2167 C   0  0  0

+   13.6572    3.5524   -0.0352 Na  0  3  0

+   -0.0476   -1.4624    0.0000 H   0  0  0

+    0.9032   -1.6326    0.0000 H   0  0  0

+    0.0041    0.2269    0.0000 H   0  0  0

+   -0.9467    0.3971    0.0000 H   0  0  0

+    2.4626   -0.2072    0.0000 H   0  0  0

+    1.5117   -0.0369    0.0000 H   0  0  0

+   -2.5060   -1.0284    0.0000 H   0  0  0

+   -1.5552   -1.1986    0.0000 H   0  0  0

+   -2.4542    0.6609    0.0000 H   0  0  0

+   -3.4050    0.8311    0.0000 H   0  0  0

+   -4.9643   -0.5944    0.0000 H   0  0  0

+   -4.0135   -0.7646    0.0000 H   0  0  0

+   -4.9126    1.0949    0.0000 H   0  0  0

+   -5.8634    1.2651    0.0000 H   0  0  0

+   -7.4228   -0.1603    0.0000 H   0  0  0

+   -6.4719   -0.3306    0.0000 H   0  0  0

+   -7.3710    1.5290    0.0000 H   0  0  0

+   -8.3218    1.6991    0.0000 H   0  0  0

+   -9.8812    0.2737    0.0000 H   0  0  0

+   -8.9303    0.1035    0.0000 H   0  0  0

+   -9.8292    1.9629    0.0000 H   0  0  0

+  -10.7801    2.1331    0.0000 H   0  0  0

+  -11.6390    2.3139    0.0000 H   0  0  0

+  -12.6437    1.4824    0.0000 H   0  0  0

+  -11.8122    0.4777    0.0000 H   0  0  0

+    4.6537    0.9968    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  2  4  1  0

+  3  5  1  0

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+  5  7  1  0

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+  7  9  2  0

+  7 10  2  0

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+ 12 13  1  0

+ 13 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+ 16 17  1  0

+  1 19  1  0

+  1 20  1  0

+  2 21  1  0

+  2 22  1  0

+  3 23  1  0

+  3 24  1  0

+  4 25  1  0

+  4 26  1  0

+  6 27  1  0

+  6 28  1  0

+  8 29  1  0

+  8 30  1  0

+ 12 31  1  0

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+ 16 39  1  0

+ 16 40  1  0

+ 17 41  1  0

+ 17 42  1  0

+ 17 43  1  0

+ 11 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+15307-79-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -1.7418    0.5208   -0.6037 C   0  0  0

+   -2.7508    1.3952   -0.2189 C   0  0  0

+   -0.7073    0.2119    0.2828 N   0  0  0

+   -1.7672   -0.0499   -1.8700 C   0  0  0

+   -3.7720    1.6980   -1.0975 C   0  0  0

+   -2.7308    2.0120    1.1560 C   0  0  0

+    0.3074   -0.6684   -0.1062 C   0  0  0

+   -2.7946    0.2534   -2.7418 C   0  0  0

+   -3.7914    1.1320   -2.3594 C   0  0  0

+   -3.4804    1.1242    2.1157 C   0  0  0

+    1.4531   -0.1814   -0.7245 C   0  0  0

+    0.1754   -2.0314    0.1296 C   0  0  0

+   -3.5834    1.4444    3.2920 O   0  0  0

+   -3.9859    0.0832    1.7185 O   0  0  0

+    2.4539   -1.0542   -1.1071 C   0  0  0

+    1.6264    1.5211   -1.0163 Cl  0  0  0

+    1.1807   -2.8984   -0.2559 C   0  0  0

+   -1.2501   -2.6447    0.9078 Cl  0  0  0

+    2.3166   -2.4108   -0.8754 C   0  0  0

+   12.9244    1.1455    0.9793 Na  0  3  0

+   -0.2593    1.0273    0.0000 H   0  0  0

+   -1.2269   -0.8073    0.0000 H   0  0  0

+   -4.3157    2.4530    0.0000 H   0  0  0

+   -1.8337    2.2586    0.0000 H   0  0  0

+   -3.2320    2.7958    0.0000 H   0  0  0

+   -3.2445   -0.5610    0.0000 H   0  0  0

+   -4.6458    0.7637    0.0000 H   0  0  0

+    3.3192   -0.7122    0.0000 H   0  0  0

+    1.0388   -3.8179    0.0000 H   0  0  0

+    3.0667   -2.9613    0.0000 H   0  0  0

+   -4.3923   -0.7537    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

+  5  9  1  0

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+ 10 13  2  0

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+ 15 19  1  0

+  8  9  2  0

+ 17 19  2  0

+  3 21  1  0

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+  8 26  1  0

+  9 27  1  0

+ 15 28  1  0

+ 17 29  1  0

+ 19 30  1  0

+ 14 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1605-06-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 30                          1 V2000

+    0.7647   -2.0775   -0.5048 C   0  0  1

+   -0.7653   -2.0772   -0.5051 C   0  0  1

+    1.2672   -0.6835   -0.2306 C   0  0  0

+   -0.0006   -2.5587    0.6531 N   0  0  0

+   -1.2674   -0.6830   -0.2310 C   0  0  0

+    1.5174   -0.2819    1.0685 C   0  0  0

+    1.4834    0.1918   -1.2782 C   0  0  0

+   -1.4818    0.1927   -1.2786 C   0  0  0

+   -1.5189   -0.2817    1.0679 C   0  0  0

+    1.9783    0.9966    1.3201 C   0  0  0

+    1.9444    1.4707   -1.0266 C   0  0  0

+   -1.9424    1.4719   -1.0272 C   0  0  0

+   -1.9794    0.9970    1.3193 C   0  0  0

+    2.1891    1.8740    0.2726 C   0  0  0

+   -2.1884    1.8749    0.2718 C   0  0  0

+    1.2927   -2.5025    0.0000 H   0  0  0

+   -1.2935   -2.5019    0.0000 H   0  0  0

+   -0.0008   -3.2364    0.0000 H   0  0  0

+    2.1272   -0.5777    0.0000 H   0  0  0

+    0.8347    0.3882    0.0000 H   0  0  0

+   -0.8329    0.3884    0.0000 H   0  0  0

+   -2.1284   -0.5782    0.0000 H   0  0  0

+    2.6276    0.8022    0.0000 H   0  0  0

+    1.3329    1.7628    0.0000 H   0  0  0

+   -1.3312    1.7648    0.0000 H   0  0  0

+   -2.6289    0.8034    0.0000 H   0  0  0

+    2.4471    2.5007    0.0000 H   0  0  0

+   -2.4466    2.5015    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

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+ 10 14  1  0

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+  2  4  1  0

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+ 10 23  1  0

+ 11 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 15 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+17372-87-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 40                          1 V2000

+   -1.4469   -1.2436   -0.3625 C   0  0  0

+   -2.4378   -0.2489   -0.5536 C   0  0  0

+   -0.2040   -0.8495    0.1931 C   0  0  0

+   -1.7037   -2.6495   -0.7255 C   0  0  0

+   -2.1596    1.0872   -0.1892 C   0  0  0

+   -3.6882   -0.5820   -1.1008 C   0  0  0

+    0.0055    0.5047    0.5345 C   0  0  0

+    0.8151   -1.7931    0.4045 C   0  0  0

+   -2.2572   -3.5404    0.2230 C   0  0  0

+   -1.4081   -3.1086   -2.0078 C   0  0  0

+   -0.9639    1.4208    0.3371 O   0  0  0

+   -3.1336    2.0583   -0.3783 C   0  0  0

+   -4.6300    0.3859   -1.2787 C   0  0  0

+    1.2250    0.8859    1.0786 C   0  0  0

+    2.0043   -1.3986    0.9389 C   0  0  0

+   -2.4939   -4.8686   -0.1376 C   0  0  0

+   -2.5798   -3.0730    1.5759 C   0  0  0

+   -1.6508   -4.4284   -2.3433 C   0  0  0

+   -4.3609    1.7098   -0.9191 C   0  0  0

+   -2.7857    3.8542    0.1008 Br  0  0  0

+   -6.3124   -0.0642   -2.0154 Br  0  0  0

+    2.2174   -0.0595    1.2798 C   0  0  0

+    1.5307    2.6931    1.5436 Br  0  0  0

+    3.3747   -2.6702    1.2232 Br  0  0  0

+   -2.1872   -5.3028   -1.4138 C   0  0  0

+   -3.1030   -3.9199    2.4691 O   0  0  0

+   -2.3505   -1.7998    1.9160 O   0  0  0

+   -5.3095    2.6618   -1.1016 O   0  0  0

+    3.4071    0.3175    1.8110 O   0  0  0

+   13.8543    0.3246   -0.9817 Na  0  3  0

+   22.2180    1.1937   -3.0537 Na  0  3  0

+   -3.9562   -1.5529    0.0000 H   0  0  0

+    0.6019   -2.7775    0.0000 H   0  0  0

+   -0.4200   -2.9133    0.0000 H   0  0  0

+   -3.4770   -5.0877    0.0000 H   0  0  0

+   -0.7103   -4.7889    0.0000 H   0  0  0

+   -2.1546   -6.3095    0.0000 H   0  0  0

+   -2.1720   -0.8086    0.0000 H   0  0  0

+    4.3672    0.6218    0.0000 H   0  0  0

+  1  2  2  0

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+ 19 28  2  0

+ 22 29  1  0

+  7 11  1  0

+ 13 19  1  0

+ 15 22  1  0

+ 18 25  1  0

+  6 32  1  0

+  8 33  1  0

+ 10 34  1  0

+ 16 35  1  0

+ 18 36  1  0

+ 25 37  1  0

+ 27 38  1  0

+ 29 39  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+1818-71-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+    0.5521   -0.5601    0.0600 C   0  0  0

+   -0.5171    0.2575    0.2565 N   0  0  0

+    1.5750   -0.0726    0.8689 C   0  0  0

+    0.7851   -1.6704   -0.7081 N   0  0  0

+   -1.8286    0.1370   -0.3851 C   0  0  2

+   -0.1457    1.2105    1.1595 C   0  0  0

+    1.0894    1.0136    1.5195 N   0  0  0

+    2.8215   -0.7439    0.8621 C   0  0  0

+    1.9922   -2.2676   -0.6765 C   0  0  0

+   -2.4413    1.4416   -0.4768 O   0  0  0

+   -2.7735   -0.6798    0.5241 C   0  0  1

+    2.9797   -1.8114    0.0907 N   0  0  0

+    3.8568   -0.2940    1.6461 N   0  0  0

+    2.1839   -3.2555   -1.3657 O   0  0  0

+   -3.8578    1.1889   -0.6012 C   0  0  1

+   -4.1391    0.0282    0.3786 C   0  0  1

+   -2.8744   -2.0161    0.0280 O   0  0  0

+   -4.6377    2.4290   -0.1601 C   0  0  0

+   -5.0821   -0.8717   -0.2071 O   0  0  0

+   -4.3086    3.5271   -1.0132 O   0  0  0

+   13.1854    2.8653   -0.9450 O   0  0  0

+    0.0441   -2.2445    0.0000 H   0  0  0

+   -1.4617   -0.7256    0.0000 H   0  0  0

+   -0.6119    2.0237    0.0000 H   0  0  0

+   -1.9363   -1.1015    0.0000 H   0  0  0

+    4.6102   -0.8517    0.0000 H   0  0  0

+    3.9631    0.6373    0.0000 H   0  0  0

+   -4.7829    1.0379    0.0000 H   0  0  0

+   -4.9511    0.4966    0.0000 H   0  0  0

+   -2.9450   -2.9508    0.0000 H   0  0  0

+   -5.4462    2.9034    0.0000 H   0  0  0

+   -5.2902    1.7560    0.0000 H   0  0  0

+   -5.7602   -1.5189    0.0000 H   0  0  0

+   -4.0395    4.4250    0.0000 H   0  0  0

+   12.2480    2.8653    0.0000 H   0  0  0

+   14.1228    2.8653    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  5  2  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+  6  7  2  0

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+ 18 31  1  0

+ 18 32  1  0

+ 19 33  1  0

+ 20 34  1  0

+ 21 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+18296-45-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 62 64                          1 V2000

+    2.3143    1.3981   -0.6015 C   0  0  2

+    1.1609    0.4461   -0.9531 C   0  0  2

+    1.7438    2.4953    0.3052 C   0  0  2

+    3.4224    1.6969   -1.6054 C   0  0  0

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+ 30 61  1  0

+ 30 62  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+18559-59-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 50 51                          1 V2000

+    0.5451   -1.6454    0.4156 C   0  0  0

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+ 26 50  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1934-21-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 46 45                          1 V2000

+   -5.6636   -0.8854    0.4908 N   0  0  0

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+ 31 46  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+1947-37-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 94 97                          1 V2000

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+ 52 94  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+19622-55-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 21 22                          1 V2000

+    0.1496   -0.3941   -0.2982 C   0  0  0

+   -1.2001   -0.0430   -0.2298 C   0  0  0

+    1.2074    0.3871    0.1181 N   0  0  0

+    0.6351   -1.5501   -0.7743 N   0  0  0

+   -2.5677   -0.9149    0.5226 S   0  0  0

+   -1.8401    1.0691   -0.7164 N   0  0  0

+    2.3313   -0.3086   -0.1181 C   0  0  0

+    1.1209    1.7257    0.7071 C   0  0  0

+    1.9427   -1.5371   -0.6856 C   0  0  0

+   -3.8043    0.2391    0.1221 C   0  0  0

+   -3.0848    1.1950   -0.5448 N   0  0  0

+    3.7279    0.1352    0.1693 N   0  3  0

+   -5.1190    0.2045    0.3975 N   0  0  0

+    4.4875   -0.5988    0.7758 O   0  0  0

+    4.1691    1.4093   -0.2631 O   0  5  0

+    2.1052    1.7893    0.0000 H   0  0  0

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+ 13 20  1  0

+ 13 21  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+203-33-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 36                          1 V2000

+    0.2132    0.9845   -0.0019 C   0  0  0

+   -0.0826   -0.3725   -0.0015 C   0  0  0

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+    1.0644    3.5741   -0.0066 C   0  0  0

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+   -4.1540   -1.3691   -0.0002 C   0  0  0

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+   -2.8644    2.4274    0.0000 H   0  0  0

+   -0.9464    4.1791    0.0000 H   0  0  0

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+   -3.4776   -3.3703    0.0000 H   0  0  0

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+ 20 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+20325-40-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 37                          1 V2000

+   -4.1454   -0.8783   -0.0381 C   0  0  0

+   -5.1507    0.1749    0.2450 C   0  0  0

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+   -1.3224   -3.8444   -0.8415 N   0  0  0

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+   -6.8140    1.9174   -2.7752 C   0  0  0

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+   -6.2011    2.5026    0.0000 H   0  0  0

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+ 20 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2058-46-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 59 61                          1 V2000

+   -1.6912    1.1186    0.1268 C   0  0  0

+   -2.4925   -0.1725   -0.0851 C   0  0  1

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+   -2.5836    2.3116   -0.2014 C   0  0  2

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+   -3.5979   -0.1818    0.9477 C   0  0  0

+   -3.0660   -0.1673   -1.3939 O   0  0  0

+    0.4756   -0.0125   -0.2727 C   0  0  0

+   -0.8745    0.7651   -2.1190 O   0  0  0

+   -3.8547    2.2460    0.5999 C   0  0  0

+   -2.9071    2.3016   -1.6343 N   0  0  0

+   -0.2658   -1.3008   -0.0499 C   0  0  0

+   -2.1652   -2.5575    0.3221 O   0  0  0

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+ 34 59  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2068-78-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+123130                          1 V2000

+   -2.2823   -1.8218   -0.8011 C   0  0  2

+   -3.0499   -2.5600    0.2890 C   0  0  2

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+ 63123  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+20830-81-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 67 71                          1 V2000

+   -0.0844    2.1425    0.4367 C   0  0  0

+   -0.5484    0.9307   -0.0093 C   0  0  0

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+ 38 67  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21313-86-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 29                          1 V2000

+    0.6963   -0.1730   -0.0019 C   0  0  0

+   -0.7850   -0.1033   -0.0016 C   0  0  0

+    1.5047    0.8750   -0.0014 N   0  0  0

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+   -1.5404   -1.2745   -0.0022 C   0  0  0

+   -1.4272    1.1341    0.0052 C   0  0  0

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+    4.0315    1.0374   -0.0014 C   0  0  0

+    3.8425   -1.7031    0.0036 N   0  0  0

+   -3.5505    0.0269   -0.0010 C   0  0  0

+    5.1325    0.2372   -0.0019 N   0  0  0

+    4.1539    2.3986   -0.0009 N   0  0  0

+    5.0034   -1.1146    0.0004 C   0  0  0

+   -5.0291    0.0965   -0.0007 N   0  3  0

+   -5.5879    1.1788    0.0001 O   0  0  0

+   -5.6871   -0.9285   -0.0013 O   0  5  0

+   -1.0732   -2.1869    0.0000 H   0  0  0

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+ 16 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2163-68-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 29                          1 V2000

+   -1.0383    0.5131    0.0167 C   0  0  0

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+    1.0992   -0.3491    0.0042 C   0  0  0

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+   -2.9437   -1.0307   -0.0138 C   0  0  0

+    1.6166    0.8736   -0.0028 N   0  0  0

+    1.9334   -1.4408    0.0012 N   0  0  0

+    1.2960    3.0644   -0.0060 O   0  0  0

+   -3.7974   -1.2658    1.2340 C   0  0  0

+   -3.8106   -1.1969   -1.2635 C   0  0  0

+    3.3862   -1.2525   -0.0092 C   0  0  0

+    4.0774   -2.6174   -0.0105 C   0  0  0

+   -1.1322    2.5757    0.0000 H   0  0  0

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+  1  2  2  0

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+ 14 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+21794-55-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 50                          1 V2000

+    0.8072    0.4483    0.1429 C   0  0  0

+    0.5592   -0.9362    0.0506 C   0  0  0

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+    5.6867   -0.4241   -0.1278 C   0  0  0

+    4.8833    1.8085    0.0709 O   0  0  0

+   -3.9942    1.1984    0.8046 C   0  0  0

+   -2.8795    2.5006   -0.8954 O   0  0  0

+   -4.2531   -0.0016   -0.0933 C   0  0  2

+    5.4381   -1.7787   -0.2178 C   0  0  0

+    6.3027    1.9664    0.0227 C   0  0  0

+   -5.6369   -0.5426    0.1583 C   0  0  0

+   -4.1357    0.4044   -1.4584 O   0  0  0

+   -6.8046   -0.0277   -0.6434 C   0  0  0

+   -5.8102   -1.3887    1.0023 O   0  0  0

+    0.1403    3.6911    0.0000 H   0  0  0

+   -1.1917   -3.7554    0.0000 H   0  0  0

+   -1.8059    2.4183    0.0000 H   0  0  0

+   -4.0511   -1.7042    0.0000 H   0  0  0

+   -2.6986   -1.9854    0.0000 H   0  0  0

+    3.9633   -3.2873    0.0000 H   0  0  0

+    6.6704   -0.0758    0.0000 H   0  0  0

+   -4.2468    2.2109    0.0000 H   0  0  0

+   -5.0376    1.1817    0.0000 H   0  0  0

+   -3.1765    3.5010    0.0000 H   0  0  0

+    6.2368   -2.4504    0.0000 H   0  0  0

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+   -6.3836    0.9271    0.0000 H   0  0  0

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+   -7.2256   -0.9825    0.0000 H   0  0  0

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+ 28 46  1  0

+ 28 47  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+21884-44-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 77                          1 V2000

+   -2.1861   -0.0907    0.8789 C   0  0  2

+   -3.3970    0.3398    0.1635 C   0  0  0

+   -1.4395    1.2709    1.1764 C   0  0  0

+   -1.2391   -1.2566    0.2795 C   0  0  0

+   -2.2118   -1.4801    1.6081 C   0  0  0

+   -2.7400   -0.5381   -0.8128 C   0  0  0

+   -3.5415    1.6141   -0.6616 C   0  0  0

+    0.0780    1.3802    1.6194 C   0  0  0

+   -1.7699    2.3757    0.5880 C   0  0  0

+    0.3487   -1.2996    0.7682 C   0  0  0

+   -1.6708   -1.9373   -1.1358 O   0  0  0

+   -1.6755   -2.4710    0.5360 C   0  0  1

+   -1.2302   -0.1716   -1.1595 C   0  0  2

+   -3.1282   -1.9677   -0.0903 C   0  0  0

+   -2.1370    2.1801   -0.9005 C   0  0  1

+   -4.1466    1.3088   -1.9198 O   0  0  0

+    1.0252    0.0484    1.4090 C   0  0  0

+    0.4959    2.3421    2.1376 O   0  0  0

+   -1.7128    3.6324    1.0639 O   0  0  0

+    1.3791   -2.1236    0.7629 C   0  0  0

+   -0.3629   -2.6610   -0.4222 C   0  0  0

+   -0.0914   -1.3227   -1.2233 C   0  0  0

+   -0.3232    0.3304    0.0213 C   0  0  0

+   -1.2488    1.2124   -1.7131 C   0  0  0

+   -3.9365   -1.6621    1.0270 O   0  0  0

+    2.2460    0.0658    1.9117 C   0  0  0

+    2.4453   -2.2585    1.6567 C   0  0  0

+    1.9452   -2.7290   -0.3592 O   0  0  0

+    0.1434   -3.7994   -0.6680 O   0  0  0

+    1.0861   -1.0925   -1.8225 C   0  0  0

+    0.8130    1.0337   -0.4974 C   0  0  0

+   -0.6185   -0.1551    1.4965 O   0  0  0

+    2.9840   -1.0947    2.1705 C   0  0  0

+    2.8755    1.2498    2.2192 O   0  0  0

+    3.1158   -3.5673    1.9156 C   0  0  0

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+    3.6524   -0.1549   -2.6112 O   0  0  0

+    2.9837    4.1518   -0.4598 C   0  0  0

+   -4.3127   -0.0235    0.0000 H   0  0  0

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+   -3.4637   -2.8940    0.0000 H   0  0  0

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+  1  2  1  0

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+ 43 67  1  0

+ 44 68  1  0

+ 44 69  1  0

+ 44 70  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2244-21-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -2.0706    1.2595   -0.6225 N   0  0  0

+   -2.9022    0.6755    0.4365 C   0  0  0

+   -0.9735    0.3173   -0.8735 C   0  0  0

+   -1.3644    2.6733    0.0305 Cl  0  0  0

+   -3.4787   -0.5917   -0.0282 N   0  0  0

+   -1.5159   -0.9562   -1.3614 N   0  0  0

+   -2.3571   -1.5016   -0.2895 C   0  0  0

+   -4.3478   -1.2488    1.2898 Cl  0  0  0

+   -0.3808   -1.8673   -1.5098 O   0  0  0

+    9.7808   -0.2678    0.3649 K   0  3  0

+   -3.1765    1.6830    0.0000 H   0  0  0

+   -3.9429    0.7595    0.0000 H   0  0  0

+   -0.0597   -0.1878    0.0000 H   0  0  0

+   -0.3777    1.1747    0.0000 H   0  0  0

+   -3.0960   -2.2393    0.0000 H   0  0  0

+   -1.7006   -2.3136    0.0000 H   0  0  0

+    0.4335   -2.5209    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

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+  3 13  1  0

+  3 14  1  0

+  7 15  1  0

+  7 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+22897-08-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 44                          1 V2000

+    1.7019    0.2487    0.1182 C   0  0  0

+    0.3545    0.0051   -0.1300 C   0  0  0

+    2.4735    1.5473    0.2328 C   0  0  1

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+   -1.5265   -1.5865   -0.3078 C   0  0  0

+   -1.7567    0.8676   -0.1467 C   0  0  0

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+    4.2623    2.0607   -1.0981 C   0  0  0

+    0.3881   -3.6678   -0.0209 O   0  0  0

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+   -3.7516   -0.5145    0.0923 C   0  0  0

+   -3.9129    1.8668    0.2901 C   0  0  0

+   -1.9900    3.2351    0.0671 O   0  0  0

+   -4.5172    0.6208    0.2977 C   0  0  0

+   -4.3341   -1.7409    0.0930 O   0  0  0

+   -3.0414    4.1711    0.3131 C   0  0  0

+    1.6862    2.2088    0.0000 H   0  0  0

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+    4.4668    3.0685    0.0000 H   0  0  0

+    0.9273   -5.3305    0.0000 H   0  0  0

+    2.3636   -5.1030    0.0000 H   0  0  0

+    2.1361   -3.6667    0.0000 H   0  0  0

+   -4.5001    2.7110    0.0000 H   0  0  0

+   -5.5429    0.5480    0.0000 H   0  0  0

+   -4.7753   -2.6697    0.0000 H   0  0  0

+   -2.3577    4.9391    0.0000 H   0  0  0

+   -3.8094    4.8548    0.0000 H   0  0  0

+   -3.7251    3.4031    0.0000 H   0  0  0

+  1  2  1  0

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+ 25 37  1  0

+ 26 38  1  0

+ 26 39  1  0

+ 26 40  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2298-13-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 34                          1 V2000

+    0.1449   -1.1917    0.2862 C   0  0  0

+   -0.9557   -0.3831    0.3481 N   0  0  0

+    1.3465   -0.7887    0.8755 C   0  0  0

+    0.0724   -2.4277   -0.3616 C   0  0  0

+   -2.0631   -0.7581   -0.1969 N   0  0  0

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+   -3.0904    1.2809    0.5239 C   0  0  0

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+   -4.2009    2.0921    0.5845 C   0  0  0

+   -5.3933    1.6880   -0.0087 C   0  0  0

+   -6.7646    0.0254   -1.2969 C   0  0  0

+   -6.5144    2.5114    0.0548 N   0  0  0

+   11.7064    1.5952   -0.4923 Cl  0  0  0

+   -0.8089   -2.8445    0.0000 H   0  0  0

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+    0.4601    0.6027    0.0000 H   0  0  0

+    1.0424   -4.2023    0.0000 H   0  0  0

+    3.1498   -3.4213    0.0000 H   0  0  0

+   -4.5148   -1.3193    0.0000 H   0  0  0

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+   -7.6887   -0.2850    0.0000 H   0  0  0

+   -6.4542   -0.8987    0.0000 H   0  0  0

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+   -7.4070    2.1195    0.0000 H   0  0  0

+   12.6813    1.5952    0.0000 H   0  0  0

+  1  2  1  0

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+ 16 29  1  0

+ 16 30  1  0

+ 16 31  1  0

+ 17 32  1  0

+ 17 33  1  0

+ 18 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23165-19-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+   -2.6751    0.9665   -0.0155 N   0  3  0

+   -3.4726    0.3432    1.0489 C   0  0  0

+   -1.6320   -0.0006   -0.3818 C   0  0  0

+   -3.5255    1.2532   -1.1785 C   0  0  0

+   -2.0604    2.2063    0.4774 C   0  0  0

+   -4.0782   -0.9638    0.5353 C   0  0  0

+   -2.2836   -1.2990   -0.8596 C   0  0  0

+   -3.0355   -1.8810    0.2051 O   0  0  0

+    8.2043   -0.0545    0.0350 Cl  0  0  0

+   -3.7775    1.3372    0.0000 H   0  0  0

+   -4.5099    0.4140    0.0000 H   0  0  0

+   -0.7507   -0.5522    0.0000 H   0  0  0

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+  1  2  1  0

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+  7 22  1  0

+  7 23  1  0

+  9 24  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23537-16-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 62 69                          1 V2000

+   -1.3784   -1.1659    0.1341 C   0  0  2

+   -0.5679   -2.3751    0.6132 C   0  0  0

+   -1.0565   -0.9794   -1.3728 C   0  0  2

+   -1.0227    0.1193    0.8252 C   0  0  0

+   -2.8541   -1.4498    0.2780 C   0  0  0

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+   -3.7931   -0.3277    0.0914 C   0  0  0

+   -3.2546   -2.5642    0.5383 O   0  0  0

+    1.4484   -1.2185   -0.0674 C   0  0  2

+    1.1348   -0.8789    1.4125 C   0  0  2

+   -0.7114   -1.5058    2.8749 O   0  0  0

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+ 40 61  1  0

+ 40 62  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+23541-50-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 69 72                          1 V2000

+   -0.2215    1.0454   -1.6250 C   0  0  0

+   -1.1967    0.4860   -0.8382 C   0  0  0

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+ 38 68  1  0

+ 39 69  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+23815-63-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 28                          1 V2000

+   -0.3523   -0.2609   -0.0561 C   0  0  0

+   -1.5265   -1.0040   -0.0501 C   0  0  0

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+   -2.8038    1.0200    0.0282 C   0  0  0

+   -2.4977   -3.1331   -0.0840 O   0  0  0

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+   -4.1151    1.7051    0.0732 N   0  3  0

+    4.6889    1.0787   -0.1211 C   0  0  0

+    4.0413   -0.9509    1.0477 N   0  0  0

+   -4.1658    2.9217    0.1051 O   0  0  0

+   -5.1434    1.0524    0.0784 O   0  5  0

+    5.0768    1.6351   -1.2794 O   0  0  0

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+ 12 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 18 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+24169-02-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 44 45                          1 V2000

+   -1.2024   -0.6538   -0.0381 C   0  0  0

+   -1.7302    0.7570    0.0087 C   0  0  0

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+ 21 42  1  0

+ 22 43  1  0

+ 26 44  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25013-15-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+   -7.9170   -0.9551   -0.0911 C   0  0  0

+   -8.8728    0.0083   -0.4147 C   0  0  0

+   -6.6563   -0.5563    0.3552 C   0  0  0

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+    9.0936    0.9048    0.4999 C   0  0  0

+    8.1263   -3.1868    0.1197 C   0  0  0

+    8.1412    1.8553    0.1774 C   0  0  0

+    5.8588    2.5087   -0.6151 C   0  0  0

+   -9.8514   -0.2714    0.0000 H   0  0  0

+   -5.9045   -1.2425    0.0000 H   0  0  0

+   -9.2181   -2.6746    0.0000 H   0  0  0

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+    6.5823    3.2245    0.0000 H   0  0  0

+    5.1430    3.2322    0.0000 H   0  0  0

+    5.1353    1.7929    0.0000 H   0  0  0

+  1  2  2  0

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+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+25316-40-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 70 73                          1 V2000

+   -0.4298    1.1108   -1.5359 C   0  0  0

+   -1.2198    0.4159   -0.6551 C   0  0  0

+    0.8256    0.6073   -1.9009 C   0  0  0

+   -0.8510    2.4257   -2.1402 C   0  0  0

+   -2.5831    0.9003   -0.2325 C   0  0  2

+   -0.7700   -0.7957   -0.1135 C   0  0  0

+    1.2860   -0.5976   -1.3732 C   0  0  0

+    1.5989    1.2978   -2.7752 O   0  0  0

+   -2.3591    2.6224   -2.0045 C   0  0  2

+   -2.7458    2.3872   -0.5394 C   0  0  0

+   -2.7526    0.6820    1.1695 O   0  0  0

+    0.4766   -1.3091   -0.4648 C   0  0  0

+   -1.5547   -1.4741    0.7602 O   0  0  0

+    2.6059   -1.1270   -1.7569 C   0  0  0

+   -3.0813    1.6355   -2.8851 C   0  0  0

+   -2.7075    3.9543   -2.3874 O   0  0  0

+   -4.0771    0.1772    1.3517 C   0  0  1

+    0.9498   -2.5836    0.1037 C   0  0  0

+    3.0797   -2.4054   -1.1868 C   0  0  0

+    3.3038   -0.5138   -2.5412 O   0  0  0

+   -4.4224    1.9911   -3.4734 C   0  0  0

+   -2.5854    0.5596   -3.1194 O   0  0  0

+   -4.1337   -0.6550    2.6348 C   0  0  0

+   -4.9929    1.2669    1.4418 O   0  0  0

+    2.2708   -3.1140   -0.2792 C   0  0  0

+    0.2515   -3.1969    0.8883 O   0  0  0

+    4.3250   -2.9129   -1.5426 C   0  0  0

+   -4.8996    0.9011   -4.2647 O   0  0  0

+   -3.7257    0.2268    3.8204 C   0  0  1

+   -4.5088    2.1556    2.4468 C   0  0  2

+    2.7277   -4.3230    0.2546 C   0  0  0

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+   -3.9314   -0.5118    5.0735 N   0  0  0

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+ 38 66  1  0

+ 39 67  1  0

+ 39 68  1  0

+ 39 69  1  0

+ 40 70  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2592-95-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -1.0046    0.2616   -0.2338 C   0  0  0

+   -1.8835   -0.6673    0.3498 C   0  0  0

+    0.1260   -0.4435   -0.5713 N   0  0  0

+   -1.3880    1.5924   -0.3623 C   0  0  0

+   -3.1373   -0.2321    0.7995 C   0  0  0

+   -1.2716   -1.8683    0.3453 N   0  0  0

+   -0.1026   -1.7721   -0.1832 N   0  0  0

+    1.2922    0.0701   -1.1888 O   0  0  0

+   -2.6184    1.9906    0.0797 C   0  0  0

+   -3.4875    1.0796    0.6663 C   0  0  0

+    9.9486    0.4849    0.5721 O   0  0  0

+   -0.6728    2.2847    0.0000 H   0  0  0

+   -3.8664   -0.9097    0.0000 H   0  0  0

+    2.2032    0.4713    0.0000 H   0  0  0

+   -2.8627    2.9555    0.0000 H   0  0  0

+   -4.4518    1.3263    0.0000 H   0  0  0

+    8.9532    0.4849    0.0000 H   0  0  0

+   10.9440    0.4849    0.0000 H   0  0  0

+  1  2  2  0

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+  8 14  1  0

+  9 15  1  0

+ 10 16  1  0

+ 11 17  1  0

+ 11 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+27046-19-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+    0.4303    0.6436    0.2813 P   0  0  0

+   -0.8439   -0.4503    0.3914 N   0  0  0

+    1.7374    0.1267    1.0578 O   0  0  0

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+    0.0264    1.9997    0.7152 O   0  0  0

+   -1.9677    0.1345   -0.3523 C   0  0  0

+   -0.4319   -1.6536   -0.3435 C   0  0  0

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+   -3.0158    0.6549    0.6333 C   0  0  0

+   -0.0549   -2.7541    0.6503 C   0  0  0

+    3.0326    1.6654   -0.2266 C   0  0  0

+   -4.3951    1.3726   -0.2795 Cl  0  0  0

+    0.4508   -4.2311   -0.2517 Cl  0  0  0

+    4.1857    1.8919   -0.5045 O   0  0  0

+   -1.1665    0.6522    0.0000 H   0  0  0

+   -2.0215    1.0869    0.0000 H   0  0  0

+   -1.3680   -1.4700    0.0000 H   0  0  0

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+    1.6946    1.4048    0.0000 H   0  0  0

+    2.2116    2.7158    0.0000 H   0  0  0

+    1.0821    2.2272    0.0000 H   0  0  0

+   -3.8170    0.1372    0.0000 H   0  0  0

+   -2.9620   -0.2975    0.0000 H   0  0  0

+    0.8812   -2.9377    0.0000 H   0  0  0

+    0.5721   -2.0352    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 24  1  0

+ 10 25  1  0

+ 11 26  1  0

+ 11 27  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+27833-64-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 57                          1 V2000

+   -4.1591   -0.3922    0.3187 C   0  0  0

+   -5.2526    0.5799    0.1520 C   0  0  0

+   -2.9389    0.0750    0.7516 N   0  0  0

+   -4.2771   -1.6560    0.0885 N   0  0  0

+   -6.5626    0.2494    0.5021 C   0  0  0

+   -4.9710    1.8476   -0.3638 C   0  0  0

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+   -6.8683   -0.9603    1.0132 O   0  0  0

+   -7.5741    1.1850    0.3263 C   0  0  0

+   -5.9868    2.7677   -0.5291 C   0  0  0

+   -1.4270   -0.2403    2.6359 C   0  0  0

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+   -8.6664   -2.1599    0.0000 H   0  0  0

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+   -8.3811   -4.2225    0.0000 H   0  0  0

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+   16.6718   -1.0787    0.0000 H   0  0  0

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+  1  2  1  0

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+ 24 50  1  0

+ 24 51  1  0

+ 25 52  1  0

+ 25 53  1  0

+ 28 54  1  0

+ 30 55  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2898-11-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+   -1.5690   -1.2220   -0.4971 C   0  0  0

+   -2.1985    0.0813   -0.1993 C   0  0  0

+   -0.3500   -1.6662    0.2182 C   0  0  0

+   -2.1283   -1.9706   -1.4091 N   0  0  0

+   -3.5806    0.1435    0.0306 C   0  0  0

+   -1.4359    1.2468   -0.1515 C   0  0  0

+    0.7368   -2.1691   -0.4964 C   0  0  0

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+   -4.3180   -1.0331    0.0603 N   0  0  0

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+   -2.0515    2.4580    0.0921 C   0  0  0

+    1.8697   -2.5809    0.1754 C   0  0  0

+    0.8556   -1.9925    2.2689 C   0  0  0

+   -4.5477   -1.5043   -1.2942 C   0  0  0

+   -5.6352   -0.6919    0.6139 C   0  0  0

+   -3.4230    2.5205    0.2851 C   0  0  0

+   -1.1033    3.9107    0.1573 Cl  0  0  0

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+   12.8503    0.5023   -0.4127 Cl  0  0  0

+   -0.4643    1.1937    0.0000 H   0  0  0

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+ 19 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+2958-05-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 67                          1 V2000

+    1.4344   -1.0604   -0.3823 C   0  0  1

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+ 27 64  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+29767-20-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 78 85                          1 V2000

+    3.5086    0.4290   -1.1926 C   0  0  2

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+ 46 78  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+299-11-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 37                          1 V2000

+   -5.8954    1.0694   -0.1159 C   0  0  0

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+ 21 35  1  0

+ 20 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+299-75-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+    4.2760    0.0843   -0.1539 S   0  0  0

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+   -4.1198   -1.1201    0.0000 H   0  0  0

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+ 14 29  1  0

+ 14 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+2997-92-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 33                          1 V2000

+   -5.9610    1.5333   -0.4635 C   0  0  0

+   -6.8372    1.7282    0.7470 C   0  0  0

+   -4.8132    0.6959   -0.1059 N   0  0  0

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+   -3.0697   -3.5166    0.5523 N   0  0  0

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+    8.4473   -0.0760    0.0621 Cl  0  0  0

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+ 16 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+302-70-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 20                          1 V2000

+   -2.3320   -0.3723   -0.3825 N   0  3  0

+   -3.3192    0.3675    0.4151 C   0  0  0

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+   -5.7683    1.5579    0.5398 Cl  0  0  0

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+ 10 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+304-20-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 22 22                          1 V2000

+   -2.3592   -0.3745   -0.3667 C   0  0  0

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+ 13 22  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+3054-01-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 27                          1 V2000

+    1.0968    0.4011   -0.9329 C   0  0  0

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+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3081-61-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 25                          1 V2000

+    0.5695   -0.5838    0.4154 C   0  0  0

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+ 12 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+316-42-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 79 81                          1 V2000

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+ 37 79  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+320-51-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 17                          1 V2000

+   -1.1495   -1.0412   -0.0007 C   0  0  0

+   -0.8937   -2.4166   -0.0020 F   0  0  0

+   -1.8849   -0.7026   -1.1416 F   0  0  0

+   -1.8815   -0.7041    1.1429 F   0  0  0

+    0.1555   -0.2875   -0.0021 C   0  0  0

+    0.1545    1.0961   -0.0012 C   0  0  0

+    1.3514   -0.9787    0.0013 C   0  0  0

+   -1.3504    1.9614    0.0022 Cl  0  0  0

+    1.3512    1.7914   -0.0025 C   0  0  0

+    2.5536   -0.2835    0.0000 C   0  0  0

+    2.5497    1.1057   -0.0048 C   0  0  0

+    3.7651   -0.9801    0.0039 N   0  0  0

+    1.3515   -2.0185    0.0000 H   0  0  0

+    1.3477    2.8312    0.0000 H   0  0  0

+    3.4484    1.6286    0.0000 H   0  0  0

+    3.7669   -2.0199    0.0000 H   0  0  0

+    4.6647   -0.4586    0.0000 H   0  0  0

+  2  1  1  0

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+  9 14  1  0

+ 11 15  1  0

+ 12 16  1  0

+ 12 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+33069-62-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+113119                          1 V2000

+   -3.3547   -0.1305    0.4632 C   0  0  1

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+ 62113  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3311-98-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 23                          1 V2000

+    0.9665    1.1726    0.0415 C   0  0  0

+    1.7178   -0.4463    0.0846 S   0  0  0

+    2.0553    1.9853   -0.0550 C   0  0  0

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+   -6.3024   -0.8153   -0.0726 Cl  0  0  0

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+ 14 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+33237-74-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 57                          1 V2000

+   -0.1862   -0.5410   -1.2614 C   0  0  0

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+ 25 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3387-36-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 35                          1 V2000

+   -3.7501    0.9224   -0.1903 C   0  0  2

+   -4.6718    0.0003    0.4777 N   0  0  0

+   -2.5633    0.2067   -0.5965 O   0  0  0

+   -3.2490    1.9743    0.8240 C   0  0  1

+   -5.9155   -0.1669   -0.0076 C   0  0  0

+   -4.2579   -0.6872    1.5860 C   0  0  0

+   -1.5398    1.2159   -0.7372 C   0  0  1

+   -1.7614    2.1718    0.4559 C   0  0  1

+   -3.9554    3.2007    0.6266 O   0  0  0

+   -6.7827   -1.0076    0.5864 N   0  0  0

+   -6.2611    0.4506   -0.9963 O   0  0  0

+   -5.1075   -1.5371    2.2017 C   0  0  0

+   -0.1608    0.5637   -0.6188 C   0  0  0

+   -1.5507    3.5200    0.0317 O   0  0  0

+   -6.4152   -1.6994    1.6839 C   0  0  0

+    0.0085   -0.3868   -1.6723 O   0  0  0

+   -7.1991   -2.4603    2.2219 O   0  0  0

+    1.4725   -1.0307   -1.4872 P   0  0  0

+    1.7107   -2.0290   -2.5535 O   0  0  0

+    2.5848    0.1296   -1.5802 O   0  0  0

+    1.5650   -1.7489   -0.0493 O   0  0  0

+   12.0848   -0.2358    0.1768 Na  0  3  0

+   20.6099    0.1832    1.6422 Na  0  3  0

+   -4.5045    1.4551    0.0000 H   0  0  0

+   -4.1718    1.9383    0.0000 H   0  0  0

+   -3.3412   -0.7993    0.0000 H   0  0  0

+   -0.8208    1.7955    0.0000 H   0  0  0

+   -0.8385    2.2054    0.0000 H   0  0  0

+   -4.4163    4.0010    0.0000 H   0  0  0

+   -7.6950   -0.8638    0.0000 H   0  0  0

+   -4.7020   -2.3668    0.0000 H   0  0  0

+    0.7623    0.5362    0.0000 H   0  0  0

+    0.0549    1.4617    0.0000 H   0  0  0

+   -1.4081    4.4324    0.0000 H   0  0  0

+    3.2239    0.7963    0.0000 H   0  0  0

+    1.6830   -2.6648    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  1  0

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+  8 14  1  0

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+ 15 17  2  0

+ 16 18  1  0

+ 18 19  2  0

+ 18 20  1  0

+ 18 21  1  0

+  7  8  1  0

+ 12 15  1  0

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+  8 28  1  0

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+ 12 31  1  0

+ 13 32  1  0

+ 13 33  1  0

+ 14 34  1  0

+ 20 35  1  0

+ 21 36  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3414-62-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 33 35                          1 V2000

+   -0.0155   -0.2988   -0.0345 N   0  0  0

+   -1.2222    0.2790   -0.3386 C   0  0  0

+    1.3078    0.2195   -0.3898 C   0  0  2

+   -0.2738   -1.4405    0.6641 C   0  0  0

+   -2.2043   -0.5677    0.2020 C   0  0  0

+   -1.6004    1.3783   -0.9830 N   0  0  0

+    2.2373   -0.8789   -0.5150 O   0  0  0

+    1.8575    1.0707    0.7763 C   0  0  1

+   -1.5584   -1.5947    0.8046 N   0  0  0

+   -3.5533   -0.2105    0.0348 C   0  0  0

+   -2.8764    1.6731   -1.1150 C   0  0  0

+    3.5448   -0.2938   -0.3305 C   0  0  1

+    3.3630    0.7253    0.8161 C   0  0  1

+    1.6949    2.4574    0.4716 O   0  0  0

+   -3.8350    0.9081   -0.6249 N   0  0  0

+   -4.5647   -1.0050    0.5457 N   0  0  0

+    4.5324   -1.3788    0.1033 C   0  0  0

+    4.1286    1.8990    0.5361 O   0  0  0

+   -5.9183   -0.6295    0.3677 O   0  0  0

+    4.6324   -2.3693   -0.9219 O   0  0  0

+    0.6892    0.9762    0.0000 H   0  0  0

+    0.3808   -2.1663    0.0000 H   0  0  0

+    0.9055    1.2919    0.0000 H   0  0  0

+   -3.0928    2.6262    0.0000 H   0  0  0

+    4.4217    0.1379    0.0000 H   0  0  0

+    4.3207    0.5304    0.0000 H   0  0  0

+    1.5811    3.4281    0.0000 H   0  0  0

+   -4.3728   -1.9633    0.0000 H   0  0  0

+    5.4882   -1.5829    0.0000 H   0  0  0

+    5.0192   -0.5313    0.0000 H   0  0  0

+    4.6626    2.7176    0.0000 H   0  0  0

+   -6.8601   -0.3682    0.0000 H   0  0  0

+    4.7306   -3.3417    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

+  2  5  2  0

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+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+ 18 31  1  0

+ 19 32  1  0

+ 20 33  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+343-94-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -2.6361    0.2073   -0.1815 C   0  0  0

+   -3.6260    0.5533    0.7562 C   0  0  0

+   -1.4920   -0.2737    0.5967 C   0  0  0

+   -2.8827    0.3686   -1.5463 C   0  0  0

+   -3.1089    0.2967    2.0062 N   0  0  0

+   -4.8458    1.0499    0.3077 C   0  0  0

+   -1.8373   -0.1953    1.8915 C   0  0  0

+   -0.1771   -0.7641    0.0476 C   0  0  0

+   -4.0860    0.8624   -1.9645 C   0  0  0

+   -5.0695    1.1968   -1.0435 C   0  0  0

+   -0.2570   -2.2725   -0.1963 C   0  0  0

+    1.0248   -2.7505   -0.7314 N   0  0  0

+    9.9402    0.7216   -0.0525 Cl  0  0  0

+   -2.4493    1.1924    0.0000 H   0  0  0

+   -3.4841   -0.5551    0.0000 H   0  0  0

+   -5.2788    0.2259    0.0000 H   0  0  0

+   -2.1090   -1.0856    0.0000 H   0  0  0

+    0.7427   -0.9071    0.0000 H   0  0  0

+    0.0583    0.1365    0.0000 H   0  0  0

+   -3.7593    1.7340    0.0000 H   0  0  0

+   -5.9059    1.6054    0.0000 H   0  0  0

+   -1.1768   -2.1295    0.0000 H   0  0  0

+   -0.4923   -3.1731    0.0000 H   0  0  0

+    1.1792   -3.6684    0.0000 H   0  0  0

+    1.7425   -2.1578    0.0000 H   0  0  0

+   10.8710    0.7216    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

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+  3  7  2  0

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+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 12 24  1  0

+ 12 25  1  0

+ 13 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+34381-68-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 53                          1 V2000

+   -1.9575   -0.5124   -0.4685 C   0  0  0

+   -3.0853    0.2374   -0.8391 C   0  0  0

+   -0.8116    0.1359   -0.0326 C   0  0  0

+   -1.9906   -1.8671   -0.5312 O   0  0  0

+   -3.0422    1.6347   -0.7650 C   0  0  0

+   -4.3025   -0.4399   -1.3022 C   0  0  0

+   -0.7779    1.5136    0.0374 C   0  0  0

+   -0.7113   -2.3321   -0.0962 C   0  0  0

+   -1.8913    2.2646   -0.3281 C   0  0  0

+   -5.5105    0.3690   -1.6989 C   0  0  0

+   -4.3360   -1.6508   -1.3654 O   0  0  0

+   -0.6813   -3.8611   -0.1432 C   0  0  0

+   -1.8457    3.6632   -0.2536 N   0  0  0

+    0.6884   -4.3589    0.3225 C   0  0  0

+   -1.6958   -4.3840    0.7167 O   0  0  0

+   -2.7755    4.3308    0.4579 C   0  0  0

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+   -2.8039    5.8373    0.4346 C   0  0  0

+   -3.5894    3.7190    1.1171 O   0  0  0

+    2.0517   -6.2372    0.7340 C   0  0  0

+   -3.9469    6.3396    1.3189 C   0  0  0

+    2.0343   -6.4309    2.2516 C   0  0  0

+    2.4404   -7.5528    0.0564 C   0  0  0

+   -3.9758    7.8692    1.2952 C   0  0  0

+   15.5316    3.1473   -0.3994 Cl  0  0  0

+    0.0673   -0.3912    0.0000 H   0  0  0

+   -3.9157    2.1708    0.0000 H   0  0  0

+    0.1328    1.9836    0.0000 H   0  0  0

+    0.3081   -2.4376    0.0000 H   0  0  0

+   -0.4818   -1.3333    0.0000 H   0  0  0

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+   -6.0807   -0.4826    0.0000 H   0  0  0

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+   -2.6068   -4.8535    0.0000 H   0  0  0

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+    1.4575   -7.8432    0.0000 H   0  0  0

+    2.7308   -8.5357    0.0000 H   0  0  0

+    3.4233   -7.2624    0.0000 H   0  0  0

+   -2.9511    7.8886    0.0000 H   0  0  0

+   -3.9952    8.8939    0.0000 H   0  0  0

+   -5.0005    7.8498    0.0000 H   0  0  0

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+ 23 50  1  0

+ 24 51  1  0

+ 24 52  1  0

+ 24 53  1  0

+ 25 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+352-11-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 15 15                          1 V2000

+   -1.9417    0.0044   -0.9563 C   0  0  0

+   -2.9531   -0.0023    0.5363 Cl  0  0  0

+   -0.4837    0.0026   -0.5751 C   0  0  0

+    0.1843   -1.1956   -0.4058 C   0  0  0

+    0.1861    1.1995   -0.4005 C   0  0  0

+    1.5216   -1.1985   -0.0563 C   0  0  0

+    1.5230    1.1990   -0.0510 C   0  0  0

+    2.1918   -0.0008    0.1244 C   0  0  0

+    3.4989   -0.0024    0.4661 F   0  0  0

+   -1.4286    0.8960    0.0000 H   0  0  0

+   -2.4596    0.8932    0.0000 H   0  0  0

+   -0.3377   -2.0820    0.0000 H   0  0  0

+   -0.3340    2.0870    0.0000 H   0  0  0

+    2.0409   -2.0864    0.0000 H   0  0  0

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+  2  1  1  0

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+  1 10  1  0

+  1 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3546-10-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+103107                          1 V2000

+    4.2136    0.2279    1.2277 C   0  0  2

+    3.2979   -0.0932    0.0385 C   0  0  1

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+   -8.0792   -4.6431    0.2200 Cl  0  0  0

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3546-41-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+159168                          1 V2000

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+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+362-74-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 59                          1 V2000

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+ 32 55  1  0

+ 32 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+366-70-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 36                          1 V2000

+   -2.6156    0.2917    0.2083 C   0  0  0

+   -3.8811    1.0048    0.4838 C   0  0  0

+   -1.5312    0.4273    1.0768 C   0  0  0

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+    2.9348   -4.0129    1.0305 C   0  0  0

+   11.9782    2.1761   -0.1553 Cl  0  0  0

+   -1.3361    1.4114    0.0000 H   0  0  0

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+ 16 36  1  0

+ 17 37  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+372-47-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -2.1811   -0.0459   -0.0004 F   0  0  0

+   -0.8312    0.0090   -0.0013 C   0  0  0

+   -0.1769    1.2336    0.0012 C   0  0  0

+   -0.0817   -1.1552    0.0012 C   0  0  0

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+    1.8893    0.0374   -0.0022 C   0  0  0

+   -0.7120    2.1212    0.0000 H   0  0  0

+   -0.5617   -2.0737    0.0000 H   0  0  0

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+  3  8  1  0

+  4  9  1  0

+  5 10  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3778-76-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 31                          1 V2000

+   -1.0396   -1.5989   -0.3958 C   0  0  0

+   -2.0111   -0.9714    0.4166 C   0  0  0

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+ 17 30  1  0

+ 18 31  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+379-79-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+172185                          1 V2000

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+3836-23-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 68 71                          1 V2000

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+38915-28-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 55 55                          1 V2000

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+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+39013-93-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 57 58                          1 V2000

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+ 29 56  1  0

+ 30 57  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+40297-54-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 50                          1 V2000

+    2.7109    0.0073    0.2090 N   0  0  0

+    1.8146   -1.0089    0.4242 C   0  0  0

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+ 25 47  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+41372-08-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 31 30                          1 V2000

+   -3.0577    0.7565    0.3727 C   0  0  1

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+ 16 31  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+43000-65-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 82 86                          1 V2000

+    6.1057    0.4666    0.4854 C   0  0  2

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+ 36 82  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4494-26-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    1.0958   -0.7276    0.4512 C   0  0  2

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+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4691-65-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 38                          1 V2000

+   -3.9287    0.5054   -0.1820 N   0  0  0

+   -4.9312    1.4196   -0.3559 C   0  0  0

+   -2.7256    0.6838    0.6347 C   0  0  2

+   -4.2564   -0.6040   -0.9027 C   0  0  0

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+   -1.6526   -0.1165    0.0925 O   0  0  0

+   -2.9721    0.1086    2.0471 C   0  0  1

+   -5.3965   -0.4185   -1.5031 N   0  0  0

+   -7.0222    1.5492   -1.5646 C   0  0  0

+   -6.2283    3.3203   -0.2390 C   0  0  0

+   -0.7317   -0.3107    1.1879 C   0  0  1

+   -1.6302   -0.5607    2.4194 C   0  0  1

+   -3.2397    1.1777    2.9567 O   0  0  0

+   -7.1711    2.7949   -1.0613 N   0  0  0

+   -7.8628    1.0684   -2.3049 O   0  0  0

+    0.1242   -1.5505    0.9210 C   0  0  0

+   -1.0705    0.0958    3.5586 O   0  0  0

+    0.8895   -1.3536   -0.2697 O   0  0  0

+    1.7614   -2.6892   -0.4886 P   0  0  0

+    2.6485   -2.8960    0.6779 O   0  0  0

+    0.7767   -3.9534   -0.6447 O   0  0  0

+    2.6530   -2.5358   -1.8204 O   0  0  0

+   13.0296    0.9133   -0.2437 Na  0  3  0

+   21.4944    2.7111   -0.5834 Na  0  3  0

+   -2.5136    1.5251    0.0000 H   0  0  0

+   -3.7947   -1.3385    0.0000 H   0  0  0

+   -3.6485   -0.4347    0.0000 H   0  0  0

+   -6.2096    4.1877    0.0000 H   0  0  0

+   -0.2510    0.4116    0.0000 H   0  0  0

+   -1.7131   -1.4243    0.0000 H   0  0  0

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+   -0.6426   -1.9563    0.0000 H   0  0  0

+    0.4374   -2.3596    0.0000 H   0  0  0

+   -0.5076    0.7560    0.0000 H   0  0  0

+    0.2436   -4.6379    0.0000 H   0  0  0

+    3.5080   -2.3887    0.0000 H   0  0  0

+  1  2  1  0

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+  5  9  1  0

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+ 17 34  1  0

+ 17 35  1  0

+ 18 36  1  0

+ 22 37  1  0

+ 23 38  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+480-81-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 47 49                          1 V2000

+    2.8361   -0.3136   -0.7287 C   0  0  2

+    1.9300   -1.1704    0.1195 C   0  0  1

+    4.0849   -0.1519    0.1150 N   0  0  0

+    2.2629    1.0765   -0.8603 C   0  0  0

+    2.5841   -1.3814    1.4675 C   0  0  0

+    0.6865   -1.6276   -0.2391 O   0  0  0

+    3.5253   -0.1302    1.5165 C   0  0  0

+    4.4395    1.2718   -0.1383 C   0  0  0

+    3.1527    1.9640   -0.5057 C   0  0  0

+    0.8742    1.3988   -1.3486 C   0  0  0

+   -0.4793   -1.2213    0.3072 C   0  0  0

+   -0.0994    1.0610   -0.3268 O   0  0  0

+   -1.7500   -1.7823   -0.1710 C   0  0  0

+   -0.4775   -0.3915    1.1951 O   0  0  0

+   -1.3496    1.5450   -0.4091 C   0  0  0

+   -3.0498   -1.3300    0.4434 C   0  0  0

+   -1.7534   -2.6891   -1.1451 C   0  0  0

+   -2.3679    1.1829    0.6411 C   0  0  2

+   -1.6576    2.2707   -1.3247 O   0  0  0

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+   -3.1832    2.4238    1.0104 C   0  0  0

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+   -5.0217   -0.1921    0.0000 H   0  0  0

+  1  2  1  0

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+ 24 46  1  0

+ 24 47  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+4801-39-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 23 22                          1 V2000

+   -2.5850   -0.9993    0.0998 C   0  0  0

+   -3.5940   -0.0301    0.1137 N   0  0  0

+   -1.5080   -0.8950    0.9700 C   0  0  0

+   -2.6614   -2.0710   -0.7805 C   0  0  0

+   -3.2805    1.2713   -0.0430 C   0  0  0

+   -0.5134   -1.8535    0.9537 C   0  0  0

+   -1.6640   -3.0259   -0.7918 C   0  0  0

+   -4.3476    2.3259    0.0993 C   0  0  0

+   -2.1396    1.5938   -0.2986 O   0  0  0

+   -0.5896   -2.9160    0.0723 C   0  0  0

+   -3.7562    3.6532   -0.1160 N   0  0  0

+    9.6805    0.6145   -0.0607 Cl  0  0  0

+   -4.5576   -0.3120    0.0000 H   0  0  0

+   -1.1777    0.0531    0.0000 H   0  0  0

+   -3.5982   -2.4322    0.0000 H   0  0  0

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+   -2.7577    3.7579    0.0000 H   0  0  0

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+  1  2  1  0

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+ 10 20  1  0

+ 11 21  1  0

+ 11 22  1  0

+ 12 23  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+491-36-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+   -0.4744    0.8955   -0.0026 C   0  0  0

+   -0.0830   -0.4620   -0.0014 C   0  0  0

+    0.4834    1.8562   -0.0018 N   0  0  0

+   -1.8333    1.2155    0.0011 C   0  0  0

+    1.3558   -0.7655    0.0007 C   0  0  0

+   -1.0479   -1.4667   -0.0018 C   0  0  0

+    1.7469    1.5576    0.0002 C   0  0  0

+   -2.7713    0.2073    0.0058 C   0  0  0

+    2.2133    0.2816    0.0014 N   0  0  0

+    1.7599   -1.9138    0.0014 O   0  0  0

+   -2.3831   -1.1257   -0.0034 C   0  0  0

+   -2.1338    2.2040    0.0000 H   0  0  0

+   -0.7646   -2.4603    0.0000 H   0  0  0

+    2.4330    2.3301    0.0000 H   0  0  0

+   -3.7766    0.4458    0.0000 H   0  0  0

+    3.2319    0.1090    0.0000 H   0  0  0

+   -3.1014   -1.8683    0.0000 H   0  0  0

+  1  2  1  0

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+  9 16  1  0

+ 11 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+4914-30-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 73 77                          1 V2000

+   -2.4299    1.2606   -0.3233 C   0  0  1

+   -3.6754    0.4198   -0.2332 C   0  0  0

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+   -3.2601    1.7695    0.0000 H   0  0  0

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+ 35 73  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+50-63-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 64 63                          1 V2000

+  -10.7486    1.5967    0.1556 C   0  0  0

+  -11.9717    2.0060   -0.4269 C   0  0  0

+  -10.5298    0.2182    0.3907 C   0  0  0

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+  -12.8982    1.0944   -0.7452 N   0  0  0

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+  -11.5344   -0.6678    0.0348 C   0  0  0

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+  -11.5107    5.9687   -0.6207 Cl  0  0  0

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+ 29 62  1  0

+ 30 63  1  0

+ 31 64  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+514-10-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 52 54                          1 V2000

+    2.1108    0.3691   -1.0184 C   0  0  1

+    1.2318    1.4024   -0.2998 C   0  0  1

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+ 22 52  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+518-47-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 41                          1 V2000

+   -2.3278    0.4146   -0.3520 C   0  0  0

+   -3.0463    1.4630    0.4335 C   0  0  0

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+ 24 38  1  0

+ 25 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+528-53-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 35 36                          1 V2000

+   -1.7234   -0.4456   -0.1731 C   0  0  0

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+ 22 34  1  0

+ 23 35  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+531-85-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 29                          1 V2000

+   -4.4871   -0.6481    0.0232 C   0  0  0

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+ 15 29  1  0

+ 16 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5323-95-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 54                          1 V2000

+    2.4337   -1.8497   -0.8391 C   0  0  1

+    1.2048   -0.9715   -0.5956 C   0  0  0

+    3.5625   -1.4189    0.0996 C   0  0  0

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+ 18 54  1  0

+ 18 55  1  0

+ 21 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+535-83-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 18                          1 V2000

+   -0.4411    0.1537    0.0032 C   0  0  0

+    0.5522   -0.8343    0.0028 C   0  0  0

+   -0.0520    1.5041    0.0007 C   0  0  0

+   -1.8603   -0.2144    0.0002 C   0  0  0

+    1.8251   -0.5013    0.0002 N   0  3  0

+    1.2995    1.7955   -0.0020 C   0  0  0

+   -2.7985    0.7390    0.0006 O   0  0  0

+   -2.2169   -1.5037   -0.0031 O   0  0  0

+    2.2171    0.7594   -0.0022 C   0  0  0

+    2.8372   -1.5605    0.0003 C   0  0  0

+    0.2821   -1.8360    0.0000 H   0  0  0

+   -0.7602    2.2623    0.0000 H   0  0  0

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+ 10 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+  8 18  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+53956-04-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+124129                          1 V2000

+   -2.8886    0.5786    0.3926 C   0  0  1

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+   -3.0784   -1.3007    1.8811 O   0  0  0

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+    4.7952   -3.6317   -2.5409 C   0  0  0

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+ 59124  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+54-21-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 16                          1 V2000

+   -1.4989    0.1525   -0.0867 C   0  0  0

+   -2.3974   -0.8854    0.2252 C   0  0  0

+   -0.1726   -0.1596   -0.4227 C   0  0  0

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+   -0.6487   -2.4844   -0.1377 C   0  0  0

+    9.9342    0.2541    0.0811 Na  0  3  0

+    0.5204    0.5864    0.0000 H   0  0  0

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+  7 15  1  0

+ 10 16  1  0

+  9 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5418-93-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 18                          1 V2000

+    0.9188    0.8768   -0.0027 C   0  0  0

+    0.6202   -0.4955   -0.0002 C   0  0  0

+    2.3014    0.9702   -0.0023 N   0  0  0

+   -0.1076    1.8091    0.0001 C   0  0  0

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+   -0.7143   -0.9092    0.0004 C   0  0  0

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+   -1.4205    1.3855    0.0053 C   0  0  0

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+   -3.3800   -0.4835   -0.0006 Cl  0  0  0

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+    0.1113    2.8227    0.0000 H   0  0  0

+   -0.9457   -1.9200    0.0000 H   0  0  0

+   -2.1871    2.0838    0.0000 H   0  0  0

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+  1  2  2  0

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+  6 14  1  0

+  8 15  1  0

+ 10 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+54556-98-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 59                          1 V2000

+   -0.9408   -1.1874    0.5011 C   0  0  0

+   -1.8113   -1.8769   -0.5177 C   0  0  0

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+   -1.6093    0.0850    0.9542 C   0  0  0

+   -0.7474   -2.0498    1.6241 O   0  0  0

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+    1.2692   -0.0124    0.5351 C   0  0  0

+    0.7458   -1.4141   -1.3341 C   0  0  0

+   -1.8915    1.0487    0.0635 O   0  0  0

+   -1.8911    0.2376    2.1191 O   0  0  0

+    0.2130   -3.0319    1.2300 C   0  0  0

+   -3.1711   -3.7389   -1.1630 C   0  0  0

+   -2.8513   -1.9094   -2.6741 C   0  0  0

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+    1.9705   -1.1146   -1.9015 C   0  0  0

+   -2.5356    2.2746    0.5000 C   0  0  0

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+   -3.4081   -3.1419   -2.3868 C   0  0  0

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+   -4.7247    3.4467    0.7505 C   0  0  0

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+   -1.6426   -3.6782    0.0000 H   0  0  0

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+   -1.3236    2.9215    0.0000 H   0  0  0

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+    0.8322   -5.6923    0.0000 H   0  0  0

+    2.1436   -5.7069    0.0000 H   0  0  0

+    2.1582   -4.3955    0.0000 H   0  0  0

+   -2.0209    5.0681    0.0000 H   0  0  0

+   -3.1280    5.5843    0.0000 H   0  0  0

+   -5.4766    3.9895    0.0000 H   0  0  0

+   -5.4307    2.8454    0.0000 H   0  0  0

+   -4.1631    6.1613    0.0000 H   0  0  0

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+  1  2  1  0

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+ 25 54  1  0

+ 27 55  1  0

+ 27 56  1  0

+ 27 57  1  0

+ 28 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+5461-85-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 24 23                          1 V2000

+    0.7336   -0.4281   -0.3698 N   0  0  0

+   -0.5165    0.1682   -0.3168 C   0  0  0

+    1.9029    0.3565   -0.7739 C   0  0  0

+    0.8683   -1.6727   -0.0583 N   0  0  0

+   -1.5825   -0.5166    0.2163 N   0  0  0

+   -0.6809    1.3754   -0.7713 N   0  0  0

+    2.8489    0.5130    0.4183 C   0  0  0

+    1.9669   -2.1967   -0.1050 O   0  0  0

+   -2.8682    0.0376    0.1635 N   0  3  0

+    4.1768    1.1048   -0.0585 C   0  0  0

+    2.2163    1.4468    1.4522 C   0  0  0

+   -3.0658    1.0581   -0.4713 O   0  0  0

+   -3.7882   -0.5011    0.7525 O   0  5  0

+    2.1026    1.2610    0.0000 H   0  0  0

+    1.1376    0.8784    0.0000 H   0  0  0

+   -1.5066   -1.4398    0.0000 H   0  0  0

+   -0.8059    2.2933    0.0000 H   0  0  0

+    3.1152   -0.3742    0.0000 H   0  0  0

+    4.5539    0.2587    0.0000 H   0  0  0

+    5.0229    1.4819    0.0000 H   0  0  0

+    3.7997    1.9509    0.0000 H   0  0  0

+    2.9832    1.9663    0.0000 H   0  0  0

+    1.6968    2.2137    0.0000 H   0  0  0

+    1.4494    0.9273    0.0000 H   0  0  0

+  1  2  1  0

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+ 10 21  1  0

+ 11 22  1  0

+ 11 23  1  0

+ 11 24  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+548-42-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 36 39                          1 V2000

+   -1.5481    0.0853    0.0953 C   0  0  0

+   -0.6144   -0.9233    0.3579 C   0  0  0

+   -1.2833    1.5244    0.1159 C   0  0  0

+   -2.8964   -0.1079   -0.2262 C   0  0  0

+    0.7632   -0.4588    0.7082 C   0  0  2

+   -1.0878   -2.1922    0.2646 C   0  0  0

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+   -3.4178    1.1414   -0.3784 N   0  0  0

+   -3.3522   -1.4226   -0.3080 C   0  0  0

+    1.0740    0.8703    0.0171 C   0  0  1

+    1.8023   -1.4720    0.3217 C   0  0  0

+   -2.4225   -2.4249   -0.0654 C   0  0  0

+    2.4634    1.2402    0.3009 N   0  0  0

+    2.9385   -1.1095   -0.2023 C   0  0  0

+    3.3048    0.3197   -0.4719 C   0  0  0

+    2.6685    2.5787   -0.2685 C   0  0  0

+    3.9368   -2.1818   -0.5554 C   0  0  0

+    0.0020    0.2329    0.0000 H   0  0  0

+   -0.4306   -2.9834    0.0000 H   0  0  0

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+    1.5658   -2.4730    0.0000 H   0  0  0

+   -2.7511   -3.3995    0.0000 H   0  0  0

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+    3.1840   -2.8826    0.0000 H   0  0  0

+    4.6376   -2.9346    0.0000 H   0  0  0

+    4.6896   -1.4810    0.0000 H   0  0  0

+  1  2  2  0

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+ 17 33  1  0

+ 18 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+55-55-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 42                          1 V2000

+  -14.0848    0.1542   -0.4443 S   0  0  0

+  -14.9926   -0.9784    0.0136 O   0  0  0

+  -12.8167   -0.4762   -1.0020 O   0  0  0

+  -14.7408    0.7496   -1.5553 O   0  0  0

+  -13.6895    0.8346    0.7389 O   0  0  0

+   -1.6857    0.7680    0.8370 C   0  0  0

+   -2.5137   -0.2651    1.2547 C   0  0  0

+   -0.4463    0.4814    0.2797 C   0  0  0

+   -2.1020    2.0972    0.9721 N   0  0  0

+   -2.1043   -1.5770    1.1157 C   0  0  0

+   -0.0386   -0.8306    0.1415 C   0  0  0

+   -1.2279    3.1870    0.5312 C   0  0  0

+   -0.8666   -1.8623    0.5591 C   0  0  0

+   -0.4641   -3.1543    0.4230 O   0  0  0

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+   13.9163    0.8105   -0.6932 C   0  0  0

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+   14.3241   -0.5020   -0.8315 C   0  0  0

+   13.1351    3.5161   -0.4419 C   0  0  0

+   13.4964   -1.5333   -0.4140 C   0  0  0

+   13.8989   -2.8253   -0.5500 O   0  0  0

+  -15.6274   -1.7703    0.0000 H   0  0  0

+  -11.9079   -0.9280    0.0000 H   0  0  0

+   -3.5110   -0.0768    0.0000 H   0  0  0

+    0.2443    1.2251    0.0000 H   0  0  0

+   -3.0994    2.2851    0.0000 H   0  0  0

+   -2.7942   -2.3214    0.0000 H   0  0  0

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+   -0.5929    3.9787    0.0000 H   0  0  0

+   -2.0196    3.8220    0.0000 H   0  0  0

+   -0.1622   -4.1233    0.0000 H   0  0  0

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+   14.6069    1.5542    0.0000 H   0  0  0

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+   13.7701    4.3078    0.0000 H   0  0  0

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+  1  2  1  0

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+ 20 39  1  0

+ 21 40  1  0

+ 21 41  1  0

+ 21 42  1  0

+ 23 43  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5550-12-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 40                          1 V2000

+   -0.1306   -2.0967    0.0779 C   0  0  0

+   -1.1463   -1.2103    0.3136 N   0  0  0

+    0.8408   -1.8420    1.0528 C   0  0  0

+    0.0722   -3.0650   -0.8230 N   0  0  0

+   -2.3900   -1.0942   -0.4519 C   0  0  2

+   -0.7892   -0.4548    1.3927 C   0  0  0

+    0.3795   -0.8285    1.8252 N   0  0  0

+    2.0211   -2.6217    1.0523 C   0  0  0

+    1.1742   -3.7813   -0.8140 C   0  0  0

+   -2.8750    0.2642   -0.3792 O   0  0  0

+   -3.4907   -1.9430    0.2221 C   0  0  1

+    2.1574   -3.5790    0.1082 N   0  0  0

+    2.8940   -2.4343    1.8825 O   0  0  0

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+   -5.7193   -1.7814   -0.7311 O   0  0  0

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+   -5.2785    3.8343   -0.0791 P   0  0  0

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+   -4.7519    5.2034   -0.7428 O   0  0  0

+   13.4407    1.1307   -0.3108 Na  0  3  0

+   21.8659    3.1342   -0.3302 Na  0  3  0

+   -2.1257   -2.0067    0.0000 H   0  0  0

+   -1.1678    0.4166    0.0000 H   0  0  0

+   -2.6679   -2.4180    0.0000 H   0  0  0

+    2.9343   -4.1258    0.0000 H   0  0  0

+    0.6042   -5.3678    0.0000 H   0  0  0

+    2.2274   -5.0976    0.0000 H   0  0  0

+   -5.2345    0.1028    0.0000 H   0  0  0

+   -5.5235   -0.5099    0.0000 H   0  0  0

+   -3.7810   -4.1090    0.0000 H   0  0  0

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+   -6.4862   -2.3422    0.0000 H   0  0  0

+   -4.0758    4.0080    0.0000 H   0  0  0

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+  1  2  1  0

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+  6  7  2  0

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+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 19 38  1  0

+ 23 39  1  0

+ 24 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+569-26-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 38 41                          1 V2000

+   -1.5804    0.0735    0.0930 C   0  0  0

+   -0.6387   -0.9405    0.2793 C   0  0  0

+   -1.3085    1.5099    0.1452 C   0  0  0

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+   -2.4727    2.0994   -0.0790 C   0  0  0

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+    1.7675   -0.2290    0.0000 H   0  0  0

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+    3.4150   -2.7722    0.0000 H   0  0  0

+    4.8828   -2.7732    0.0000 H   0  0  0

+    4.8838   -1.3054    0.0000 H   0  0  0

+  1  2  2  0

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+ 17 35  1  0

+ 18 36  1  0

+ 18 37  1  0

+ 18 38  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+57-47-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 41 43                          1 V2000

+    1.7749   -0.8789   -0.4939 C   0  0  1

+    0.5251   -0.0372   -0.3642 C   0  0  0

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+   -0.7873   -0.2946   -0.7067 C   0  0  0

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+ 20 40  1  0

+ 20 41  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+570-74-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 73 76                          1 V2000

+   -0.8456   -2.9065   -0.5295 C   0  0  0

+    0.2939   -1.8903   -0.4306 C   0  0  0

+    0.0987   -0.9939    0.8206 C   0  0  0

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+ 27 72  1  0

+ 27 73  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58-19-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 57                          1 V2000

+    0.9037    0.8825   -0.0725 C   0  0  2

+    0.0092   -0.2399    0.4740 C   0  0  1

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+   -3.6360   -1.2230   -0.2597 C   0  0  2

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+ 21 52  1  0

+ 21 53  1  0

+ 21 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+58-56-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 25 24                          1 V2000

+   -2.2907    0.6288    0.2282 C   0  0  0

+   -3.0960   -0.4875    0.3889 C   0  0  0

+   -1.0885    0.4836   -0.4562 C   0  0  0

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+    0.5580   -0.9382   -1.6942 C   0  0  0

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+ 12 24  1  0

+ 13 25  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+581-64-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 28 29                          1 V2000

+   -2.6592    1.0317   -0.3856 C   0  0  0

+   -3.3516   -0.0367    0.3611 C   0  0  0

+   -1.4118    0.9261   -0.7720 N   0  0  0

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+    0.8107    0.2058   -1.2094 C   0  0  0

+    0.2601   -2.2305    0.1320 C   0  0  0

+   -6.6627    1.4089    0.8365 N   0  0  0

+    1.7536   -0.7574   -1.0846 C   0  0  0

+    1.5072   -1.9714   -0.4269 C   0  0  0

+    2.5142   -2.9194   -0.3320 N   0  0  0

+   11.4437    1.2907    0.4848 Cl  0  0  0

+   -2.9141    3.0486    0.0000 H   0  0  0

+   -5.1872   -0.7396    0.0000 H   0  0  0

+   -5.1481    3.1682    0.0000 H   0  0  0

+    1.1216    1.1389    0.0000 H   0  0  0

+   -0.0147   -3.1749    0.0000 H   0  0  0

+   -7.0551    2.3108    0.0000 H   0  0  0

+   -7.2475    0.6181    0.0000 H   0  0  0

+    2.6969   -0.4787    0.0000 H   0  0  0

+    2.2884   -3.8767    0.0000 H   0  0  0

+    3.4561   -2.6363    0.0000 H   0  0  0

+   12.4273    1.2907    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  1  0

+  6 10  2  0

+  7 11  2  0

+  9 12  2  0

+ 10 13  1  0

+ 11 14  1  0

+ 12 15  1  0

+ 15 16  1  0

+  7  9  1  0

+  8 10  1  0

+ 14 15  2  0

+  4 18  1  0

+  6 19  1  0

+  8 20  1  0

+ 11 21  1  0

+ 12 22  1  0

+ 13 23  1  0

+ 13 24  1  0

+ 14 25  1  0

+ 16 26  1  0

+ 16 27  1  0

+ 17 28  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+5858-81-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 43 43                          1 V2000

+    0.3033    1.2638   -0.4367 C   0  0  0

+   -0.6922    0.4328    0.2405 C   0  0  0

+    1.5467    0.6935   -0.8105 C   0  0  0

+    0.0466    2.6086   -0.7263 C   0  0  0

+   -0.3911   -0.9039    0.5018 C   0  0  0

+   -1.8912    0.9550    0.6097 N   0  0  0

+    1.8078   -0.6535   -0.5294 C   0  0  0

+    2.5023    1.4964   -1.4622 C   0  0  0

+    0.9950    3.3570   -1.3592 C   0  0  0

+    0.8571   -1.4392    0.1156 C   0  0  0

+   -1.2981   -1.6901    1.1279 O   0  0  0

+   -2.9835    0.3375    0.3100 N   0  0  0

+    2.2199    2.8024   -1.7226 C   0  0  0

+    1.1557   -2.8425    0.3975 C   0  0  0

+   -4.1918    0.9106    0.5916 C   0  0  0

+    1.6582   -3.1939    1.5874 O   0  0  0

+    0.9267   -3.7759   -0.5344 O   0  0  0

+   -5.3750    0.2964    0.1724 C   0  0  0

+   -4.2505    2.1111    1.3053 C   0  0  0

+   -6.5908    0.8807    0.4602 C   0  0  0

+   -5.3138   -1.2204   -0.7222 S   0  0  0

+   -5.4733    2.6834    1.5857 C   0  0  0

+   -6.6408    2.0721    1.1622 C   0  0  0

+   -5.4737   -2.2471    0.2472 O   0  0  0

+   -6.1403   -1.0298   -1.8623 O   0  0  0

+   -3.8981   -1.3753   -1.2590 O   0  0  0

+   -7.9731    2.7043    1.4722 C   0  0  0

+   13.7227   -0.0746   -0.2529 Na  0  3  0

+   22.3057    0.6026    0.6815 Na  0  3  0

+   -0.8902    2.9581    0.0000 H   0  0  0

+    2.7489   -0.9910    0.0000 H   0  0  0

+    3.4483    1.1729    0.0000 H   0  0  0

+    0.8739    4.3495    0.0000 H   0  0  0

+   -2.0536   -2.3450    0.0000 H   0  0  0

+    2.9978    3.4305    0.0000 H   0  0  0

+   -3.4202    2.6682    0.0000 H   0  0  0

+   -7.4258    0.3308    0.0000 H   0  0  0

+   -5.4956    3.6830    0.0000 H   0  0  0

+   -7.5445    3.6076    0.0000 H   0  0  0

+   -8.8764    3.1329    0.0000 H   0  0  0

+   -8.4017    1.8010    0.0000 H   0  0  0

+    0.6885   -4.7469    0.0000 H   0  0  0

+   -2.9042   -1.4840    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  2  0

+  3  8  1  0

+  4  9  2  0

+  5 10  2  0

+  5 11  1  0

+  6 12  2  0

+  8 13  2  0

+ 10 14  1  0

+ 12 15  1  0

+ 14 16  2  0

+ 14 17  1  0

+ 15 18  2  0

+ 15 19  1  0

+ 18 20  1  0

+ 18 21  1  0

+ 19 22  2  0

+ 20 23  2  0

+ 21 24  2  0

+ 21 25  2  0

+ 21 26  1  0

+ 23 27  1  0

+  7 10  1  0

+  9 13  1  0

+ 22 23  1  0

+  4 30  1  0

+  7 31  1  0

+  8 32  1  0

+  9 33  1  0

+ 11 34  1  0

+ 13 35  1  0

+ 19 36  1  0

+ 20 37  1  0

+ 22 38  1  0

+ 27 39  1  0

+ 27 40  1  0

+ 27 41  1  0

+ 17 42  1  0

+ 26 43  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59-88-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 18 17                          1 V2000

+   -3.1677   -0.4493   -0.0975 C   0  0  0

+   -4.0547    0.5194   -0.5489 C   0  0  0

+   -1.9700   -0.0682    0.4945 C   0  0  0

+   -3.4817   -1.8035   -0.2331 N   0  0  0

+   -3.7437    1.8578   -0.4081 C   0  0  0

+   -1.6653    1.2715    0.6321 C   0  0  0

+   -2.6082   -2.7550    0.2114 N   0  0  0

+   -2.5508    2.2336    0.1815 C   0  0  0

+    8.2177   -0.0160   -0.0773 Cl  0  0  0

+   -5.0054    0.2700    0.0000 H   0  0  0

+   -1.2463   -0.7333    0.0000 H   0  0  0

+   -4.4322   -2.0537    0.0000 H   0  0  0

+   -4.4649    2.5256    0.0000 H   0  0  0

+   -0.7155    1.5243    0.0000 H   0  0  0

+   -2.9029   -3.6927    0.0000 H   0  0  0

+   -1.6488   -2.5414    0.0000 H   0  0  0

+   -2.2973    3.1832    0.0000 H   0  0  0

+    9.2006   -0.0160    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  2  0

+  4  7  1  0

+  5  8  2  0

+  6  8  1  0

+  2 10  1  0

+  3 11  1  0

+  4 12  1  0

+  5 13  1  0

+  6 14  1  0

+  7 15  1  0

+  7 16  1  0

+  8 17  1  0

+  9 18  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+593-51-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  7                          1 V2000

+   -5.7285    0.5850   -0.0029 C   0  0  0

+   -4.8024   -0.5553    0.0028 N   0  0  0

+    3.8387    0.0212   -0.0001 Cl  0  0  0

+   -4.8733    1.2796    0.0000 H   0  0  0

+   -6.4231    1.4402    0.0000 H   0  0  0

+   -6.5837   -0.1096    0.0000 H   0  0  0

+   -5.1958   -1.5844    0.0000 H   0  0  0

+   -3.7145   -0.3814    0.0000 H   0  0  0

+    4.9404    0.0212    0.0000 H   0  0  0

+  1  2  1  0

+  1  4  1  0

+  1  5  1  0

+  1  6  1  0

+  2  7  1  0

+  2  8  1  0

+  3  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+59708-57-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 44                          1 V2000

+   -4.0307    0.4010   -0.0300 C   0  0  0

+   -5.1335    1.1669    0.3181 C   0  0  0

+   -2.8730    0.5160    0.6725 O   0  0  0

+   -4.1132   -0.4870   -1.0930 C   0  0  0

+   -6.3093    1.0482   -0.3978 C   0  0  0

+   -5.0492    2.1281    1.4757 C   0  0  0

+   -1.9389   -0.3888    0.0803 C   0  0  0

+   -5.2927   -0.6061   -1.8018 C   0  0  0

+   -6.3873    0.1667   -1.4598 C   0  0  0

+   -7.5079    1.8801   -0.0202 C   0  0  0

+   -0.6067   -0.3085    0.8283 C   0  0  0

+    0.3935   -1.2772    0.1942 C   0  0  0

+   -0.0954    1.0236    0.7490 O   0  0  0

+    1.6726   -1.2001    0.9125 N   0  0  0

+    2.5826   -2.1489    0.2571 C   0  0  0

+    3.9418   -2.1197    0.9590 C   0  0  0

+    1.9956   -3.5594    0.3409 C   0  0  0

+    2.7583   -1.7560   -1.2111 C   0  0  0

+   12.4339    1.7649   -0.4737 Cl  0  0  0

+   -3.4170   -1.1777    0.0000 H   0  0  0

+   -4.0723    2.0424    0.0000 H   0  0  0

+   -4.9635    3.1050    0.0000 H   0  0  0

+   -6.0261    2.2138    0.0000 H   0  0  0

+   -2.7727   -0.9050    0.0000 H   0  0  0

+   -1.6423   -1.3235    0.0000 H   0  0  0

+   -5.5420   -1.5545    0.0000 H   0  0  0

+   -7.2771   -0.2456    0.0000 H   0  0  0

+   -6.9487    2.6857    0.0000 H   0  0  0

+   -8.3135    2.4393    0.0000 H   0  0  0

+   -8.0671    1.0745    0.0000 H   0  0  0

+   -0.9472   -1.2282    0.0000 H   0  0  0

+   -0.4403   -1.7934    0.0000 H   0  0  0

+    0.6901   -2.2119    0.0000 H   0  0  0

+    0.2560    1.9391    0.0000 H   0  0  0

+    2.0300   -0.2869    0.0000 H   0  0  0

+    3.9629   -3.1001    0.0000 H   0  0  0

+    4.9222   -2.0986    0.0000 H   0  0  0

+    3.9207   -1.1393    0.0000 H   0  0  0

+    1.0902   -3.1826    0.0000 H   0  0  0

+    1.6188   -4.4648    0.0000 H   0  0  0

+    2.9010   -3.9362    0.0000 H   0  0  0

+    3.6535   -2.1563    0.0000 H   0  0  0

+    3.1586   -0.8608    0.0000 H   0  0  0

+    1.8631   -1.3557    0.0000 H   0  0  0

+   13.4146    1.7649    0.0000 H   0  0  0

+  1  2  2  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  4  8  2  0

+  5  9  2  0

+  5 10  1  0

+  7 11  1  0

+ 11 12  1  0

+ 11 13  1  0

+ 12 14  1  0

+ 14 15  1  0

+ 15 16  1  0

+ 15 17  1  0

+ 15 18  1  0

+  8  9  1  0

+  4 20  1  0

+  6 21  1  0

+  6 22  1  0

+  6 23  1  0

+  7 24  1  0

+  7 25  1  0

+  8 26  1  0

+  9 27  1  0

+ 10 28  1  0

+ 10 29  1  0

+ 10 30  1  0

+ 11 31  1  0

+ 12 32  1  0

+ 12 33  1  0

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+ 16 36  1  0

+ 16 37  1  0

+ 16 38  1  0

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+ 17 40  1  0

+ 17 41  1  0

+ 18 42  1  0

+ 18 43  1  0

+ 18 44  1  0

+ 19 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+598-57-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  8                          1 V2000

+    0.4154   -0.0096   -0.0016 N   0  3  0

+   -0.8067   -0.6947   -0.0011 N   0  0  0

+    0.4309    1.2083    0.0001 O   0  0  0

+    1.4624   -0.6320    0.0013 O   0  5  0

+   -2.0660    0.0539    0.0014 C   0  0  0

+   -0.8192   -1.6768    0.0000 H   0  0  0

+   -1.5641    0.8981    0.0000 H   0  0  0

+   -2.9102    0.5558    0.0000 H   0  0  0

+   -2.5679   -0.7903    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  2  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  5  7  1  0

+  5  8  1  0

+  5  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60-57-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 31                          1 V2000

+   -0.6413    0.8053    1.2452 C   0  0  1

+   -0.6473   -0.7546    1.2732 C   0  0  2

+    0.4894    1.1471    0.2257 C   0  0  1

+   -1.9885    1.1856    0.5627 C   0  0  2

+    0.4802   -1.1413    0.2663 C   0  0  2

+   -1.9977   -1.1488    0.6049 C   0  0  2

+    1.5204    0.0040    0.5434 C   0  0  0

+   -0.0620    0.6416   -1.1125 C   0  0  0

+    1.1181    2.8364    0.2663 Cl  0  0  0

+   -3.0708    0.8145    1.6213 C   0  0  2

+   -2.1515    0.0003   -0.4518 C   0  0  0

+   -0.0673   -0.6790   -1.0890 C   0  0  0

+    1.0787   -2.8400    0.3505 Cl  0  0  0

+   -3.0768   -0.7309    1.6493 C   0  0  1

+    2.9007   -0.0221   -0.6164 Cl  0  0  0

+    2.0771    0.0339    2.2580 Cl  0  0  0

+   -0.5891    1.6358   -2.4343 Cl  0  0  0

+   -4.1062    0.0346    1.0199 O   0  0  0

+   -0.6037   -1.7152   -2.3744 Cl  0  0  0

+   -0.6502    1.7674    0.0000 H   0  0  0

+   -0.6696   -1.7165    0.0000 H   0  0  0

+   -2.0150    2.1474    0.0000 H   0  0  0

+   -2.0388   -2.1100    0.0000 H   0  0  0

+   -3.5219    1.6643    0.0000 H   0  0  0

+   -2.9613    0.5198    0.0000 H   0  0  0

+   -2.9632   -0.5163    0.0000 H   0  0  0

+   -3.5418   -1.5732    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  1  0

+  3  7  1  0

+  3  8  1  0

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+  4 10  1  0

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+  7 15  1  0

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+  8 17  1  0

+ 10 18  1  0

+ 12 19  1  0

+  5  7  1  0

+  6 11  1  0

+  8 12  2  0

+ 10 14  1  0

+ 14 18  1  0

+  1 20  1  0

+  2 21  1  0

+  4 22  1  0

+  6 23  1  0

+ 10 24  1  0

+ 11 25  1  0

+ 11 26  1  0

+ 14 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+60254-83-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 56                          1 V2000

+   -0.5002    0.1914   -0.0615 C   0  0  0

+   -0.5225    1.5629   -0.7394 C   0  0  0

+   -1.7907   -0.5319   -0.3487 C   0  0  0

+    0.6242   -0.5914   -0.5801 N   0  0  0

+    0.6811    2.3582   -0.3037 C   0  0  0

+   -2.9646    0.0043    0.0398 N   0  0  0

+   -1.7729   -1.5965   -0.9294 O   0  0  0

+    1.8274   -0.5242    0.0235 C   0  0  0

+    1.7904    2.4385   -1.1243 C   0  0  0

+    0.6736    3.0121    0.9144 C   0  0  0

+   -4.2192   -0.6989   -0.2395 C   0  0  0

+    2.9841   -1.3295   -0.5100 C   0  0  0

+    1.9792    0.1844    0.9959 O   0  0  0

+    2.8946    3.1681   -0.7246 C   0  0  0

+    1.7775    3.7415    1.3140 C   0  0  0

+   -5.2426   -0.3674    0.8485 C   0  0  0

+   -4.7519   -0.2626   -1.5799 C   0  0  0

+    4.1706   -1.0847    0.3137 N   0  0  0

+    2.8893    3.8171    0.4957 C   0  0  0

+   -4.8772   -1.1096    2.1355 C   0  0  0

+   -4.5232    0.8516   -1.9874 O   0  0  0

+   -5.4805   -1.1119   -2.3213 O   0  0  0

+    5.3324   -1.7026    0.0223 C   0  0  0

+   -4.7656   -0.1086    3.2873 C   0  0  0

+   -5.9634   -2.1380    2.4571 C   0  0  0

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+   -0.1270    3.4368    0.0000 H   0  0  0

+   -4.1298   -1.6007    0.0000 H   0  0  0

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+   -4.0659   -1.5134    0.0000 H   0  0  0

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+    7.6038   -3.1388    0.0000 H   0  0  0

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+  2  1  1  0

+  3  1  1  0

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+  5  2  1  0

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+ 15 19  1  0

+  1 29  1  0

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+ 26 53  1  0

+ 26 54  1  0

+ 28 55  1  0

+ 28 56  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6028-07-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+   -1.9852   -1.0148   -0.2383 C   0  0  0

+   -3.0856   -0.1597   -0.4011 C   0  0  0

+   -0.9852   -0.2666    0.4225 C   0  0  0

+   -1.7332   -2.3519   -0.5789 C   0  0  0

+   -2.7593    1.0590    0.1396 C   0  0  0

+   -4.4356   -0.3959   -1.0263 C   0  0  0

+   -1.4875    1.0007    0.6416 N   0  0  0

+    0.2329   -0.8643    0.7220 C   0  0  0

+   -0.5313   -2.9191   -0.2777 C   0  0  0

+   -3.7305    2.1625    0.1088 C   0  0  0

+   -5.4558    0.5039   -0.3257 C   0  0  0

+    0.4578   -2.1826    0.3727 C   0  0  0

+   -4.9722    1.8622   -0.1295 N   0  0  0

+   -3.3023    3.5879    0.3453 C   0  0  0

+    1.6495   -2.7650    0.6669 O   0  0  0

+   11.0618    1.0793   -0.2537 Cl  0  0  0

+   -2.5383   -2.9743    0.0000 H   0  0  0

+   -5.2620   -0.9897    0.0000 H   0  0  0

+   -4.0411   -1.3339    0.0000 H   0  0  0

+   -0.8965    1.8291    0.0000 H   0  0  0

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+   -0.4302   -3.9317    0.0000 H   0  0  0

+   -6.3636    0.9638    0.0000 H   0  0  0

+   -6.0269   -0.3384    0.0000 H   0  0  0

+   -2.3277    3.2951    0.0000 H   0  0  0

+   -3.0095    4.5625    0.0000 H   0  0  0

+   -4.2769    3.8807    0.0000 H   0  0  0

+    2.5638   -3.2118    0.0000 H   0  0  0

+   12.0794    1.0793    0.0000 H   0  0  0

+  1  2  1  0

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+ 15 28  1  0

+ 16 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+604-35-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 79 82                          1 V2000

+   -2.6259    1.4932    1.2529 C   0  0  0

+   -2.3536    0.3076    0.3249 C   0  0  0

+   -0.8500    0.0953    0.2325 C   0  0  0

+   -3.0427   -0.9115    0.8836 C   0  0  0

+   -2.9546    0.6107   -1.0455 C   0  0  0

+   -0.5745   -1.2983   -0.3553 C   0  0  0

+   -0.2091    1.1804   -0.6343 C   0  0  0

+   -2.4582   -2.0527    1.0663 C   0  0  0

+   -4.5219   -0.7628    1.1996 C   0  0  0

+   -4.3974    0.1104   -1.1063 C   0  0  0

+    0.9149   -1.4228   -0.6059 C   0  0  0

+   -1.0349   -2.3349    0.6746 C   0  0  0

+    1.3236    1.0219   -0.6042 C   0  0  0

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+ 31 78  1  0

+ 31 79  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61-76-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 26                          1 V2000

+   -2.6992   -0.6537   -0.1055 C   0  0  0

+   -3.7030    0.4185    0.2323 C   0  0  2

+   -1.6048   -0.8566    0.7123 C   0  0  0

+   -2.8777   -1.4373   -1.2308 C   0  0  0

+   -3.2864    1.7337   -0.4292 C   0  0  0

+   -3.7543    0.5934    1.6496 O   0  0  0

+   -0.6813   -1.8442    0.4010 C   0  0  0

+   -1.9590   -2.4219   -1.5432 C   0  0  0

+   -4.2648    2.7788   -0.0999 N   0  0  0

+   -0.8598   -2.6254   -0.7312 C   0  0  0

+    0.3966   -2.0456    1.2039 O   0  0  0

+   -3.8082    4.0081   -0.7620 C   0  0  0

+   10.4778    0.8036   -0.0775 Cl  0  0  0

+   -4.4941   -0.0333    0.0000 H   0  0  0

+   -1.1672   -0.0576    0.0000 H   0  0  0

+   -3.7572   -1.6745    0.0000 H   0  0  0

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+   -0.3594   -3.3866    0.0000 H   0  0  0

+    1.2921   -2.2129    0.0000 H   0  0  0

+   -2.9542    3.6909    0.0000 H   0  0  0

+   -3.4910    4.8621    0.0000 H   0  0  0

+   -4.6622    4.3253    0.0000 H   0  0  0

+   11.3888    0.8036    0.0000 H   0  0  0

+  1  2  1  0

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+  1  4  1  0

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+ 12 24  1  0

+ 12 25  1  0

+ 12 26  1  0

+ 13 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+61-82-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10 10                          1 V2000

+   -2.0436   -0.0255   -0.0004 N   0  0  0

+   -0.7362   -0.0069   -0.0012 C   0  0  0

+    0.0505    1.0991    0.0012 N   0  0  0

+    0.0970   -1.1107    0.0014 N   0  0  0

+    1.3068    0.7532   -0.0005 C   0  0  0

+    1.4070   -0.6027   -0.0008 N   0  0  0

+   -3.0623   -0.0400    0.0000 H   0  0  0

+   -0.1817   -2.0906    0.0000 H   0  0  0

+    2.0939    1.4001    0.0000 H   0  0  0

+    2.2683   -1.1469    0.0000 H   0  0  0

+  2  1  2  0

+  3  2  1  0

+  4  2  1  0

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+  5  6  1  0

+  1  7  1  0

+  4  8  1  0

+  5  9  1  0

+  6 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6109-97-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 33                          1 V2000

+   -1.8855   -1.3376   -0.0767 C   0  0  0

+   -2.8780   -0.2586   -0.2356 C   0  0  0

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+   -2.7148   -3.1331    0.0000 H   0  0  0

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+  1  2  1  0

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+ 16 31  1  0

+ 17 32  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+611-53-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 30                          1 V2000

+    1.4074    3.4526    0.4951 O   0  0  0

+    0.5787    2.5726    0.3637 C   0  0  0

+    0.9778    1.2906    0.3703 N   0  0  0

+   -0.7172    2.9069    0.2208 N   0  0  0

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+   -2.9367    2.2125   -0.0703 N   0  0  0

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+    4.1184   -0.0255   -0.8197 C   0  0  0

+   -2.6028   -1.0507   -0.1487 I   0  0  0

+    4.2297   -2.1003    0.5961 C   0  0  0

+    4.3482   -0.4476   -2.1655 O   0  0  0

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+ 13 25  1  0

+ 15 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+62-33-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 39 35                          1 V2000

+   -5.1162   -1.8897    0.1856 N   0  0  0

+   -5.7432   -0.5633    0.2601 C   0  0  0

+   -4.2290   -2.0033    1.3509 C   0  0  0

+   -6.1892   -2.8750    0.3743 C   0  0  0

+   -4.6761    0.5166    0.0705 C   0  0  0

+   -3.1183   -2.9744    1.0438 C   0  0  0

+   -6.8041   -3.2100   -0.9602 C   0  0  0

+   -5.3030    1.8430    0.1450 N   0  0  0

+   -2.2655   -3.2150    1.8873 O   0  0  0

+   -3.0695   -3.5223   -0.0490 O   0  0  0

+   -7.7978   -3.9215   -1.0145 O   0  0  0

+   -6.3094   -2.7704   -1.9892 O   0  0  0

+   -5.7869    2.0044    1.5226 C   0  0  0

+   -4.2300    2.8283   -0.0437 C   0  0  0

+   -6.9212    2.9964    1.5436 C   0  0  0

+   -4.0602    3.1106   -1.5143 C   0  0  0

+   -7.3728    3.4315    0.4932 O   0  0  0

+   -7.3904    3.3666    2.6112 O   0  0  0

+   -3.1362    3.8138   -1.8995 O   0  0  0

+   -4.8465    2.6365   -2.3230 O   0  0  0

+    9.8371    0.0136   -0.5902 Ca  0  2  0

+   18.4788    0.0776   -0.0264 Na  0  3  0

+   27.1204    0.1417    0.5375 Na  0  3  0

+   -6.1734   -0.0256    0.0000 H   0  0  0

+   -6.3273   -0.9280    0.0000 H   0  0  0

+   -3.6334   -1.6577    0.0000 H   0  0  0

+   -4.3653   -1.3283    0.0000 H   0  0  0

+   -6.1503   -3.5625    0.0000 H   0  0  0

+   -5.5512   -3.1341    0.0000 H   0  0  0

+   -4.2459   -0.0211    0.0000 H   0  0  0

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+   -3.0084   -4.2082    0.0000 H   0  0  0

+   -5.7946   -2.3130    0.0000 H   0  0  0

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+   -5.4362    2.2809    0.0000 H   0  0  0

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+ 14 35  1  0

+ 10 36  1  0

+ 12 37  1  0

+ 18 38  1  0

+ 20 39  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+621-44-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 26                          1 V2000

+   -1.7380    0.0211   -0.8533 C   0  0  0

+   -2.5654   -0.0673    0.4306 C   0  0  0

+   -0.3341    0.4541   -0.5174 C   0  0  0

+   -4.0290   -0.1465    0.0805 C   0  0  0

+   -2.1761   -1.2679    1.1823 N   0  0  0

+    0.6782   -0.4843   -0.4426 C   0  0  0

+   -0.0597    1.7903   -0.2902 C   0  0  0

+   -4.5519   -1.2222   -0.0906 O   0  0  0

+   -4.7517    0.9781   -0.0412 O   0  0  0

+    1.9662   -0.0898   -0.1352 C   0  0  0

+    1.2262    2.1898    0.0174 C   0  0  0

+    3.0496   -1.0950   -0.0557 N   0  3  0

+    2.2430    1.2492    0.0983 C   0  0  0

+    3.1592   -1.9422   -0.9238 O   0  0  0

+    3.8316   -1.0749    0.8779 O   0  5  0

+    3.5090    1.6397    0.4012 O   0  0  0

+   -2.0871   -0.9267    0.0000 H   0  0  0

+   -1.0432   -0.7121    0.0000 H   0  0  0

+   -2.6464    0.9395    0.0000 H   0  0  0

+   -2.8524   -2.0181    0.0000 H   0  0  0

+   -1.1882   -1.4785    0.0000 H   0  0  0

+    0.4527   -1.4689    0.0000 H   0  0  0

+   -0.8083    2.4684    0.0000 H   0  0  0

+   -5.2978    1.8279    0.0000 H   0  0  0

+    1.4492    3.1750    0.0000 H   0  0  0

+    4.4742    1.9374    0.0000 H   0  0  0

+  2  1  1  0

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+  5 21  1  0

+  6 22  1  0

+  7 23  1  0

+  9 24  1  0

+ 11 25  1  0

+ 16 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+624-18-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 18                          1 V2000

+   -6.7272    1.3425    0.0636 C   0  0  0

+   -7.5214    0.3880    0.6848 C   0  0  0

+   -5.5500    0.9623   -0.5675 C   0  0  0

+   -7.1161    2.6874    0.0685 N   0  0  0

+   -7.1407   -0.9396    0.6750 C   0  0  0

+   -5.1694   -0.3649   -0.5773 C   0  0  0

+   -5.9639   -1.3197    0.0440 C   0  0  0

+   -5.5780   -2.6654    0.0341 N   0  0  0

+    4.6508   -0.2767   -0.4398 Cl  0  0  0

+   13.2645    0.2448    0.2900 Cl  0  0  0

+   -8.4839    0.5905    0.0000 H   0  0  0

+   -4.8431    1.6462    0.0000 H   0  0  0

+   -6.4344    3.3964    0.0000 H   0  0  0

+   -8.0710    2.9232    0.0000 H   0  0  0

+   -7.8476   -1.6235    0.0000 H   0  0  0

+   -4.2069   -0.5674    0.0000 H   0  0  0

+   -6.2612   -3.3729    0.0000 H   0  0  0

+   -4.6237   -2.9033    0.0000 H   0  0  0

+    5.6344   -0.2767    0.0000 H   0  0  0

+   14.2481    0.2448    0.0000 H   0  0  0

+  1  2  2  0

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+  6 16  1  0

+  8 17  1  0

+  8 18  1  0

+  9 19  1  0

+ 10 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+6285-68-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+    0.2448    0.8179   -0.0028 C   0  0  0

+    0.0862   -0.5776   -0.0007 C   0  0  0

+    1.6105    1.0504   -0.0022 N   0  0  0

+   -0.8707    1.6414    0.0001 C   0  0  0

+    1.3317   -1.1216    0.0010 N   0  0  0

+   -1.1997   -1.1237   -0.0001 C   0  0  0

+    2.2285   -0.1671    0.0002 C   0  0  0

+   -2.1339    1.0866    0.0050 C   0  0  0

+   -2.2962   -0.2909   -0.0015 C   0  0  0

+    3.5935   -0.3626    0.0019 N   0  0  0

+   -3.6831   -0.8805   -0.0008 C   0  0  0

+    2.0766    1.9766    0.0000 H   0  0  0

+   -0.7558    2.6719    0.0000 H   0  0  0

+   -1.3279   -2.1526    0.0000 H   0  0  0

+   -2.9674    1.7034    0.0000 H   0  0  0

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+   -4.0888    0.0737    0.0000 H   0  0  0

+   -4.6373   -1.2862    0.0000 H   0  0  0

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+  1  2  2  0

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+ 11 18  1  0

+ 11 19  1  0

+ 11 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63-45-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 56 55                          1 V2000

+  -10.4417    0.1727   -0.1776 C   0  0  0

+  -10.7444    1.4433   -0.7170 C   0  0  0

+   -9.8567    0.0810    1.0646 C   0  0  0

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+  -11.5975    2.7346   -2.4287 C   0  0  0

+   -8.9799    1.1123    3.0250 O   0  0  0

+  -10.1534   -3.3104   -1.3671 C   0  0  0

+   -9.2285   -1.4554   -2.7620 C   0  0  0

+  -11.3226    3.9159   -1.7437 C   0  0  0

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+ 26 54  1  0

+ 27 55  1  0

+ 28 56  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+63-56-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 45                          1 V2000

+   -1.3709    1.0593    0.0698 N   0  0  0

+   -2.1809    1.1797    1.1857 C   0  0  0

+   -0.2552    0.1098    0.0736 C   0  0  0

+   -1.6329    1.8770   -1.1171 C   0  0  0

+   -3.1854    2.0432    1.1654 N   0  0  0

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+   -0.7566   -1.2559   -0.3196 C   0  0  0

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+ 21 42  1  0

+ 21 43  1  0

+ 21 44  1  0

+ 22 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+63166-73-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+109115                          1 V2000

+   -4.4718    3.5772   -0.1053 C   0  0  2

+   -4.3292    2.1714   -0.6926 C   0  0  1

+   -3.2529    3.7446    0.8342 C   0  0  1

+   -5.8200    4.1894    0.2332 C   0  0  0

+   -4.9997    4.6678   -0.8381 O   0  0  0

+   -3.1259    1.6008   -0.1370 O   0  0  0

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+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+633-03-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 69 70                          1 V2000

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+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+64-75-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 58 60                          1 V2000

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+ 33 58  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+64-86-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 56                          1 V2000

+    0.5809   -0.4091   -0.5079 C   0  0  0

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+ 29 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6428-31-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 87 90                          1 V2000

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+ 24 87  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+650-51-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+  9  7                          1 V2000

+   -1.2868   -0.1075   -0.0689 C   0  0  0

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+  2  6  2  0

+  2  7  1  0

+  7  9  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6533-68-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 54 53                          1 V2000

+  -10.9151   -2.6322   -1.1445 C   0  0  1

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+ 26 54  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+66357-59-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 45 44                          1 V2000

+   -5.8095    2.2535   -0.6929 C   0  0  0

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+ 22 45  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+6637-88-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 69 70                          1 V2000

+   -1.5461   -0.6947   -0.6987 C   0  0  0

+   -2.9218   -0.1527   -0.7834 C   0  0  0

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+    2.2911   -2.2165   -0.4701 N   0  0  0

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+ 38 68  1  0

+ 41 69  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+668-17-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 77 81                          1 V2000

+    0.1123   -0.5190   -0.4049 C   0  0  0

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+ 42 77  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+67199-66-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 33                          1 V2000

+    0.1268    0.3306    0.0035 C   0  0  0

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+ 19 29  1  0

+ 19 30  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+68884-32-2

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 28                          1 V2000

+    0.4661   -0.5590    0.4309 C   0  0  0

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+   -3.0827    0.2083   -0.3637 C   0  0  0

+   -1.9034    2.2424    0.1055 C   0  0  0

+    3.8016    1.2494   -0.0847 C   0  0  0

+    3.7802   -0.1303   -0.4562 O   0  0  0

+   -3.0709    1.5635   -0.2393 C   0  0  0

+    1.7971    1.1869    0.0000 H   0  0  0

+    0.8627    0.7025    0.0000 H   0  0  0

+    1.3453   -2.4343    0.0000 H   0  0  0

+    0.1481    2.0944    0.0000 H   0  0  0

+    2.0343    1.4399    0.0000 H   0  0  0

+   -0.7154   -3.6266    0.0000 H   0  0  0

+   -2.7650   -2.4437    0.0000 H   0  0  0

+   -3.9865   -0.2908    0.0000 H   0  0  0

+   -1.9045    3.2749    0.0000 H   0  0  0

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+    3.4610    2.2241    0.0000 H   0  0  0

+   -3.9636    2.0822    0.0000 H   0  0  0

+  1  2  2  0

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+ 12 24  1  0

+ 12 25  1  0

+ 14 26  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+69-74-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 32 32                          1 V2000

+   -1.7627   -0.9742    0.4785 C   0  0  2

+   -2.7781    0.0486    0.2157 N   0  0  0

+   -0.7285   -0.4205    1.3210 O   0  0  0

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+   -1.1478   -0.2456   -1.7555 O   0  0  0

+   -4.7975    0.6539   -0.7797 N   0  0  0

+   -3.9822   -1.3854   -0.9706 O   0  0  0

+   -3.5707    2.2391    0.4771 C   0  0  0

+    1.6949   -0.4766    1.4750 C   0  0  0

+    0.8271   -2.8763   -0.6656 O   0  0  0

+   -4.6888    1.8888   -0.3074 C   0  0  0

+    1.6518   -0.1459    2.8645 O   0  0  0

+   -5.6638    2.8210   -0.5774 N   0  0  0

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+   -2.3149   -1.7331    0.0000 H   0  0  0

+   -1.3198   -2.2353    0.0000 H   0  0  0

+   -1.7389    1.6104    0.0000 H   0  0  0

+   -0.4033   -1.6807    0.0000 H   0  0  0

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+  1  2  1  0

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+ 14 28  1  0

+ 16 29  1  0

+ 17 30  1  0

+ 17 31  1  0

+ 18 32  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+69245-38-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+112118                          1 V2000

+   -4.4116    1.6153   -0.1786 C   0  0  0

+   -3.4430    0.8289    0.4005 C   0  0  0

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+ 59112  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+70-18-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 37 36                          1 V2000

+   -1.3560   -1.0901    0.0003 C   0  0  1

+   -2.0281    0.1996    0.3951 C   0  0  0

+   -0.0250   -1.1535    0.6093 N   0  0  0

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+   -1.4521    0.9882    1.1142 O   0  0  0

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+  1  2  1  0

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+ 16 34  1  0

+ 18 35  1  0

+ 18 36  1  0

+ 19 37  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+71-33-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 11 11                          1 V2000

+   -2.3214    0.9491   -0.0005 O   0  0  0

+   -1.1485    0.2746   -0.0012 C   0  0  0

+   -0.0001    0.9394    0.0005 N   0  0  0

+   -1.1453   -1.0545    0.0019 N   0  0  0

+    1.1485    0.2745   -0.0002 C   0  0  0

+    0.0000   -1.7139    0.0011 C   0  0  0

+    2.3214    0.9491    0.0011 O   0  0  0

+    1.1455   -1.0543   -0.0027 N   0  0  0

+   -3.1848    1.4456    0.0000 H   0  0  0

+    0.0000   -2.7099    0.0000 H   0  0  0

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+  6  8  1  0

+  1  9  1  0

+  6 10  1  0

+  7 11  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+71376-34-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 10  9                          1 V2000

+   -2.0887    0.6897   -0.0395 C   0  0  0

+   -2.9850   -0.4305    0.3514 C   0  0  0

+   -1.1221   -0.3177   -0.5510 C   0  0  0

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+    8.6323   -0.0278    0.3297 Na  0  3  0

+   -1.9761   -2.3041    0.0000 H   0  0  0

+    1.0680   -0.2556    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  2  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  5  2  0

+  5  9  1  0

+  7 10  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+72-17-3

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 13 11                          1 V2000

+   -1.7564   -0.6003   -0.3342 C   0  0  0

+   -2.6427    0.5919   -0.0804 C   0  0  0

+   -0.6117   -0.6101    0.6809 C   0  0  0

+   -2.5217   -1.7997   -0.2007 O   0  0  0

+   -2.1803    1.7227   -0.1454 O   0  0  0

+   -3.8245    0.4289    0.1907 O   0  0  0

+    8.5517    0.0782   -0.0310 Na  0  3  0

+   -1.3414    0.2166    0.0000 H   0  0  0

+   -0.6195   -1.5263    0.0000 H   0  0  0

+    0.3045   -0.6179    0.0000 H   0  0  0

+   -0.6039    0.3061    0.0000 H   0  0  0

+   -3.0146   -2.5721    0.0000 H   0  0  0

+   -4.7322    0.3037    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  2  0

+  2  6  1  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  3 11  1  0

+  4 12  1  0

+  6 13  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7336-20-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 40 39                          1 V2000

+   -1.4448   -3.0718    0.1219 C   0  0  0

+   -2.2692   -1.9871   -0.1911 C   0  0  0

+    0.0697   -2.8090    0.9832 S   0  0  0

+   -1.8209   -4.3471   -0.2389 C   0  0  0

+   -1.8736   -0.6224    0.1978 C   0  0  0

+   -3.4701   -2.2008   -0.8748 C   0  0  0

+    1.0175   -2.4359   -0.0075 O   0  0  0

+   -0.2668   -2.0407    2.1303 O   0  0  0

+    0.5330   -4.1592    1.5112 O   0  0  0

+   -3.0187   -4.5561   -0.9136 C   0  0  0

+   -2.6672    0.4187   -0.1039 C   0  0  0

+   -3.8363   -3.4781   -1.2371 C   0  0  0

+   -3.3958   -5.8493   -1.2777 N   0  0  0

+   -2.2715    1.7834    0.2850 C   0  0  0

+   -3.0962    2.8684   -0.0281 C   0  0  0

+   -1.0735    1.9965    0.9732 C   0  0  0

+   -4.6112    2.6055   -0.8884 S   0  0  0

+   -2.7228    4.1427    0.3372 C   0  0  0

+   -0.7070    3.2742    1.3351 C   0  0  0

+   -4.2659    2.5320   -2.2648 O   0  0  0

+   -5.3002    1.5996   -0.1584 O   0  0  0

+   -5.4451    3.8698   -0.7381 O   0  0  0

+   -1.5271    4.3513    1.0168 C   0  0  0

+   -1.1521    5.6440    1.3847 N   0  0  0

+   13.3671    0.4312    0.1914 Na  0  3  0

+   21.9031    1.1654   -1.0729 Na  0  3  0

+   -1.1571   -5.0913    0.0000 H   0  0  0

+   -0.8933   -0.4394    0.0000 H   0  0  0

+   -4.1380   -1.4603    0.0000 H   0  0  0

+   -3.6475    0.2357    0.0000 H   0  0  0

+   -4.8165   -3.6614    0.0000 H   0  0  0

+   -4.3645   -6.0862    0.0000 H   0  0  0

+   -2.7063   -6.5697    0.0000 H   0  0  0

+   -0.4057    1.2559    0.0000 H   0  0  0

+   -3.3872    4.8863    0.0000 H   0  0  0

+    0.2731    3.4583    0.0000 H   0  0  0

+   -0.1838    5.8823    0.0000 H   0  0  0

+   -1.8426    6.3635    0.0000 H   0  0  0

+    0.8567   -5.1024    0.0000 H   0  0  0

+   -5.9942    4.7022    0.0000 H   0  0  0

+  1  2  2  0

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+ 10 12  1  0

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+ 18 35  1  0

+ 19 36  1  0

+ 24 37  1  0

+ 24 38  1  0

+  9 39  1  0

+ 22 40  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+7570-86-7

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 29 31                          1 V2000

+    0.9423    0.8257    0.6935 C   0  0  2

+    0.1322    1.0569   -0.5836 C   0  0  2

+    0.9514    2.0736   -0.0028 O   0  0  0

+    2.1947    0.0561    0.3615 C   0  0  0

+   -1.3099    1.3081   -0.2252 C   0  0  0

+    3.3525    0.7320    0.0255 C   0  0  0

+    2.1870   -1.3260    0.3986 C   0  0  0

+   -2.2507    0.1808   -0.1264 C   0  0  0

+   -1.6950    2.4391   -0.0182 O   0  0  0

+    4.5014    0.0259   -0.2792 C   0  0  0

+    3.3356   -2.0318    0.0942 C   0  0  0

+   -3.5895    0.4097    0.2059 C   0  0  0

+   -1.8116   -1.1247   -0.3700 C   0  0  0

+    4.4922   -1.3558   -0.2476 C   0  0  0

+   -4.4649   -0.6520    0.2966 C   0  0  0

+   -2.6990   -2.1755   -0.2754 C   0  0  0

+   -4.0215   -1.9413    0.0597 C   0  0  0

+    0.5320   -0.1067    0.0000 H   0  0  0

+   -0.0953    0.0640    0.0000 H   0  0  0

+    3.3640    1.7506    0.0000 H   0  0  0

+    1.2965   -1.8207    0.0000 H   0  0  0

+    5.3922    0.5201    0.0000 H   0  0  0

+    3.3244   -3.0504    0.0000 H   0  0  0

+   -3.9445    1.3645    0.0000 H   0  0  0

+   -0.8110   -1.3155    0.0000 H   0  0  0

+    5.3741   -1.8657    0.0000 H   0  0  0

+   -5.4673   -0.4705    0.0000 H   0  0  0

+   -2.3525   -3.1334    0.0000 H   0  0  0

+   -4.6835   -2.7155    0.0000 H   0  0  0

+  1  2  1  0

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+  2  3  1  0

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+ 12 24  1  0

+ 13 25  1  0

+ 14 26  1  0

+ 15 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+79-92-5

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 26 27                          1 V2000

+    0.4900   -1.1854   -0.4501 C   0  0  1

+   -0.8309   -0.4995    0.0143 C   0  0  0

+    1.0481   -0.0883   -1.4246 C   0  0  0

+    1.4510   -1.0082    0.7651 C   0  0  0

+   -0.5124    0.9883    0.0365 C   0  0  0

+   -1.9581   -0.7876   -0.9793 C   0  0  0

+   -1.2175   -0.9819    1.4139 C   0  0  0

+    0.9548    1.0968   -0.4005 C   0  0  1

+    1.7544    0.5073    0.8008 C   0  0  0

+   -1.3192    1.9683    0.3600 C   0  0  0

+    0.3536   -2.0984    0.0000 H   0  0  0

+    1.6839   -0.7577    0.0000 H   0  0  0

+    1.8914    0.2874    0.0000 H   0  0  0

+    1.5024   -1.9299    0.0000 H   0  0  0

+    2.3718   -1.0736    0.0000 H   0  0  0

+   -2.1867    0.1068    0.0000 H   0  0  0

+   -2.8525   -1.0162    0.0000 H   0  0  0

+   -1.7295   -1.6820    0.0000 H   0  0  0

+   -1.9379   -0.4046    0.0000 H   0  0  0

+   -1.7948   -1.7023    0.0000 H   0  0  0

+   -0.4971   -1.5592    0.0000 H   0  0  0

+    1.2106    1.9838    0.0000 H   0  0  0

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+    2.1884    1.3221    0.0000 H   0  0  0

+   -0.9953    2.8328    0.0000 H   0  0  0

+   -2.2298    1.8165    0.0000 H   0  0  0

+  1  2  1  0

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+  4  9  1  0

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+  5  8  1  0

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+  7 21  1  0

+  8 22  1  0

+  9 23  1  0

+  9 24  1  0

+ 10 25  1  0

+ 10 26  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+8048-52-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 60 63                          1 V2000

+  -11.2930    0.7080   -0.0186 C   0  0  0

+  -11.9799   -0.3780    0.5781 C   0  0  0

+   -9.9818    0.5721   -0.4023 N   0  3  0

+  -11.9572    1.9135   -0.2064 C   0  0  0

+  -11.3179   -1.5970    0.7767 C   0  0  0

+  -13.3265   -0.2245    0.9680 C   0  0  0

+   -9.3178   -0.6152   -0.2147 C   0  0  0

+   -9.2848    1.7040   -1.0180 C   0  0  0

+  -13.2789    2.0417    0.1897 C   0  0  0

+   -9.9796   -1.7188    0.3782 C   0  0  0

+  -13.9575    0.9618    0.7699 C   0  0  0

+   -7.9916   -0.7461   -0.6056 C   0  0  0

+  -13.9393    3.2469    0.0007 N   0  0  0

+   -9.2866   -2.9324    0.5638 C   0  0  0

+   -7.3310   -1.9492   -0.4120 C   0  0  0

+   -7.9898   -3.0383    0.1725 C   0  0  0

+   -6.0062   -2.0767   -0.8035 N   0  0  0

+    6.7727    1.0836   -0.3249 C   0  0  0

+    6.0617   -0.0406    0.2928 C   0  0  0

+    8.0430    0.9607   -0.6996 N   0  0  0

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+  1  2  1  0

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+ 31 32  2  0

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+ 32 57  1  0

+ 33 58  1  0

+ 33 59  1  0

+ 34 60  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+83-95-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 34 36                          1 V2000

+    0.3310    0.4700   -0.1491 C   0  0  0

+   -0.0572   -0.8907   -0.1575 C   0  0  0

+    1.7024    0.7882   -0.1317 C   0  0  0

+   -0.5967    1.4330   -0.1631 N   0  0  0

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+    2.6373   -0.2272   -0.1271 C   0  0  0

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+   -1.8925    1.1587   -0.1812 C   0  0  0

+   -2.3302   -0.1700   -0.1701 C   0  0  0

+   -1.8613   -2.4909   -0.1730 O   0  0  0

+    2.2384   -1.5650   -0.1395 C   0  0  0

+    3.9621    0.0790   -0.1102 O   0  0  0

+    2.2097    2.4752    1.2514 C   0  0  0

+   -2.9491    2.0161   -0.2109 O   0  0  0

+   -3.8460   -0.1394   -0.1664 C   0  0  0

+   -1.9869   -2.8909    1.1931 C   0  0  0

+    4.6726   -1.1609   -0.1095 C   0  0  0

+   -4.1349    1.3271    0.2179 C   0  0  0

+    0.6362   -2.8874    0.0000 H   0  0  0

+    2.9500   -2.3077    0.0000 H   0  0  0

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+    1.2178    2.7473    0.0000 H   0  0  0

+   -4.8668   -0.2655    0.0000 H   0  0  0

+   -3.7932   -1.1666    0.0000 H   0  0  0

+   -2.9682   -2.5828    0.0000 H   0  0  0

+   -2.2950   -3.8722    0.0000 H   0  0  0

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+  1  2  2  0

+  1  3  1  0

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+ 18 32  1  0

+ 19 33  1  0

+ 19 34  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+86-54-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 20 21                          1 V2000

+   -0.2740    0.3514    0.4165 C   0  0  0

+   -1.1255   -0.8769    0.1458 C   0  0  0

+    1.1993    0.2134    0.1329 C   0  0  0

+   -0.8396    1.6884    0.0322 C   0  0  0

+   -0.4691   -2.0451   -0.0538 C   0  0  0

+   -2.5095   -0.6968    0.0266 C   0  0  0

+    1.6413   -1.0475   -0.0748 N   0  0  0

+    1.9981    1.2451    0.0908 N   0  0  0

+   -2.1567    1.7402   -0.2286 C   0  0  0

+    0.8654   -2.0615   -0.1178 N   0  0  0

+   -3.0012    0.5574   -0.1462 C   0  0  0

+    3.3614    1.0650   -0.1770 N   0  0  0

+   -1.2790    0.4553    0.0000 H   0  0  0

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+   -3.1316   -1.4929    0.0000 H   0  0  0

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+   -4.0039    0.6816    0.0000 H   0  0  0

+    3.7476    0.1314    0.0000 H   0  0  0

+    3.9768    1.8663    0.0000 H   0  0  0

+  1  2  1  0

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+  9 17  1  0

+ 11 18  1  0

+ 12 19  1  0

+ 12 20  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+868-14-4

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 17 15                          1 V2000

+   -2.1468   -0.4878   -0.6246 C   0  0  2

+   -3.0704   -0.1432    0.5455 C   0  0  2

+   -0.9348   -1.2202   -0.1089 C   0  0  0

+   -1.7348    0.7151   -1.2765 O   0  0  0

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+   -2.3719    0.6874    1.4751 O   0  0  0

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+   -5.0225    0.0513   -0.7824 O   0  0  0

+   -4.5263    1.7216    0.4235 O   0  0  0

+    9.1664    0.3747    0.0076 K   0  3  0

+   -2.5299   -1.2802    0.0000 H   0  0  0

+   -3.4535   -0.9356    0.0000 H   0  0  0

+   -1.4496    1.5478    0.0000 H   0  0  0

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+   -1.1908   -3.2579    0.0000 H   0  0  0

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+  6 15  1  0

+  7 16  1  0

+ 10 17  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+89925-00-8

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 14 14                          1 V2000

+   -1.0732    0.2670   -0.3806 C   0  0  0

+   -2.4221   -0.4492   -0.4736 C   0  0  0

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+   -0.7148    1.1955    0.0000 H   0  0  0

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+   -0.7237   -1.4068    0.0000 H   0  0  0

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+  6 13  1  0

+  6 14  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+89930-60-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 61 63                          1 V2000

+   -6.5055   -0.7718   -0.4382 C   0  0  0

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+ 30 61  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+9002-92-0

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 88 87                          1 V2000

+   -0.4000    3.5300   -1.1259 C   0  0  0

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+ 34 88  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+90597-22-1

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 30 31                          1 V2000

+    0.4795   -0.4867    0.3916 C   0  0  2

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+ 10 15  2  0

+ 13 16  1  0

+ 15 17  1  0

+  7  8  1  0

+ 12 15  1  0

+  1 18  1  0

+  3 19  1  0

+  4 20  1  0

+  6 21  1  0

+  8 22  1  0

+  9 23  1  0

+ 12 24  1  0

+ 13 25  1  0

+ 13 26  1  0

+ 14 27  1  0

+ 16 28  1  0

+ 17 29  1  0

+ 17 30  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+924-43-6

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 16 15                          1 V2000

+    0.8588   -0.5040   -0.3115 C   0  0  0

+   -0.4295   -0.2556    0.3106 O   0  0  0

+    1.8864    0.4929    0.2281 C   0  0  0

+    1.3137   -1.9292    0.0092 C   0  0  0

+   -1.3921    0.0341   -0.3771 N   0  0  0

+    1.4315    1.9180   -0.0926 C   0  0  0

+   -2.4727    0.2425    0.1448 O   0  0  0

+    0.5647    0.4820    0.0000 H   0  0  0

+    2.4813   -0.3466    0.0000 H   0  0  0

+    2.8071    0.9522    0.0000 H   0  0  0

+    0.3335   -2.2421    0.0000 H   0  0  0

+    1.6266   -2.9094    0.0000 H   0  0  0

+    2.2939   -1.6163    0.0000 H   0  0  0

+    2.4117    2.2309    0.0000 H   0  0  0

+    1.1186    2.8982    0.0000 H   0  0  0

+    0.4513    1.6051    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  3  6  1  0

+  5  7  2  0

+  1  8  1  0

+  3  9  1  0

+  3 10  1  0

+  4 11  1  0

+  4 12  1  0

+  4 13  1  0

+  6 14  1  0

+  6 15  1  0

+  6 16  1  0

+M  END

+>  <Ames test categorisation>

+mutagen

+

+$$$$

+97534-21-9

+Prepared by Jeroen Kazius, Ross McGuire and Roberta Bursi.

+

+ 27 28                          1 V2000

+    0.7923    0.2032   -1.0604 C   0  0  0

+   -0.5959    0.4471   -0.5271 C   0  0  0

+    1.7005    1.3460   -0.6478 C   0  0  0

+    1.2471   -1.1899   -0.6681 C   0  0  0

+   -1.5778   -0.4432   -0.7714 N   0  0  0

+   -0.8296    1.4447    0.1220 O   0  0  0

+    2.8273    1.0349    0.0275 N   0  0  0

+    1.4249    2.4961   -0.9148 O   0  0  0

+    2.4099   -1.2991    0.0087 N   0  0  0

+    0.5903   -2.1688   -0.9516 O   0  0  0

+   -2.8307   -0.2861   -0.1684 C   0  0  0

+    3.1460   -0.2289    0.3295 C   0  0  0

+   -3.7996   -1.2710   -0.3101 C   0  0  0

+   -3.1059    0.8522    0.5776 C   0  0  0

+    4.6021   -0.4962    1.1894 S   0  0  0

+   -5.0351   -1.1129    0.2862 C   0  0  0

+   -4.3437    1.0043    1.1715 C   0  0  0

+   -5.3081    0.0247    1.0238 C   0  0  0

+    1.7244    0.0355    0.0000 H   0  0  0

+   -1.2926   -1.3463    0.0000 H   0  0  0

+    3.5044    1.6970    0.0000 H   0  0  0

+    2.8110   -2.1570    0.0000 H   0  0  0

+   -3.4899   -2.1660    0.0000 H   0  0  0

+   -2.4758    1.5592    0.0000 H   0  0  0

+   -5.6675   -1.8178    0.0000 H   0  0  0

+   -4.6555    1.8985    0.0000 H   0  0  0

+   -6.2206    0.2782    0.0000 H   0  0  0

+  1  2  1  0

+  1  3  1  0

+  1  4  1  0

+  2  5  1  0

+  2  6  2  0

+  3  7  1  0

+  3  8  2  0

+  4  9  1  0

+  4 10  2  0

+  5 11  1  0

+  7 12  1  0

+ 11 13  1  0

+ 11 14  2  0

+ 12 15  2  0

+ 13 16  2  0

+ 14 17  1  0

+ 16 18  1  0

+  9 12  1  0

+ 17 18  2  0

+  1 19  1  0

+  5 20  1  0

+  7 21  1  0

+  9 22  1  0

+ 13 23  1  0

+ 14 24  1  0

+ 16 25  1  0

+ 17 26  1  0

+ 18 27  1  0

+M  END

+>  <Ames test categorisation>

+nonmutagen

+

+$$$$

+

diff --git a/data/parts/cas_4337.zip b/data/parts/cas_4337.zip
new file mode 100644
index 0000000..2d36c66
--- /dev/null
+++ b/data/parts/cas_4337.zip
diff --git a/data/parts/efsa.tsv b/data/parts/efsa.tsv
new file mode 100644
index 0000000..2a2c848
--- /dev/null
+++ b/data/parts/efsa.tsv
@@ -0,0 +1,18425 @@
+"SUB_NAME"	"SUB_ECSUBINVENTENTRYREF"	"SUB_CASNUMBER"	"SUB_TYPE"	"QUALIFIER"	"COM_NAME"	"COM_ECSUBINVENTENTRYREF"	"COM_CASNUMBER"	"IUPACNAME"	"COMPARAMNAME"	"MOLECULARFORMULA"	"SMILESNOTATION"	"INCHI"	"COM_TYPE"	"COM_STRUCTURESHOWN"	"SMILESNOTATIONSOURCE"	"INCHI_NOTATIONSOURCE"	"GENOTOX_ENDPOINT"	"TESTTYPE"	"METHOD_TYPE"	"GUIDELINE_QUALIFIER"	"GENOTOXGUIDELINEFULLTXT"	"DEVIATION"	"ACCEPTABILITY"	"SPECIES"	"STRAIN"	"NUMBER_INDIVIDUALS"	"SEX"	"ROUTE"	"EXP_PERIOD"	"EXPPERIODUNIT"	"CONTROL"	"MET_INDICATOR"	"RESULTS"	"MOUSELYMPHTEST"	"INVIVOTISSUEEXP"	"DARAuthor"	"DARTitle"	"DARYear"	"OpinionType"	"OpinionAuthor"	"OpinionTitle"	"PUBLICATIONDATE"	"OpinionPubYear"	"DOI"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"small colonies"	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D6"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D6"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	"no information"	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	"no information"	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"ethyl 1-naphthylacetate"	""	"2122-70-5"	"ethyl 2-naphthalen-1-ylacetate"	"Not in list"	"C14H14O2"	"CCOC(=O)CC1=CC=CC2=CC=CC=C21"	"InChI=1S/C14H14O2/c1-2-16-14(15)10-12-8-5-7-11-6-3-4-9-13(11)12/h3-9H,2,10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"6-Benzyladenine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"no information"	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is a metabolite of the substance"	"bis(8-hydroxyquinolinium) sulphate"	""	""	"quinolin-8-ol"	"Not in list"	"C18H16N2O6S"	"C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.OS(=O)(=O)O"	"InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"no data"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"15"	"Male"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"15"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"15"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"12"	"Male"	"intraperitoneal"	"17"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"12"	"Male"	"intraperitoneal"	"36"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"68"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"44"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"6"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"6"	"Male"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"7"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Avermectin B1a"	"265-610-3"	"65195-55-3"	"(2aZ,4Z,5'S,6S,6'R,7S,8Z,11R,13S,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Abamectin (Avermectin B1a)"	"C48H72O14"	"CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C"	"InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12-,27-15-,32-14-/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"Not reported"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Acequinocyl (Revised addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Acequinocyl (Revised addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dodecyl-3-hydroxy-1,4-naphthoquinone"	""	""	"2-dodecyl-3-hydroxy-1,4-naphthoquinone"	"Not in list"	"C22H30O3"	"O=C2c1ccccc1C(=O)C(/O)=C2/CCCCCCCCCCCC"	"InChI=1/C22H30O3/c1-2-3-4-5-6-7-8-9-10-11-16-19-20(23)17-14-12-13-15-18(17)21(24)22(19)25/h12-15,25H,2-11,16H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"13"	"week"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"20"	"Male/Female"	"inhalation: unspecified"	"2"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"20"	"Male/Female"	"inhalation: unspecified"	"2"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"13"	"week"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"13"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"2"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"20"	"Male/Female"	"inhalation: unspecified"	"2"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"13"	"week"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"20"	"Male/Female"	"inhalation: unspecified"	"2"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"20"	"Male/Female"	"inhalation: unspecified"	"2"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"13"	"week"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"2"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"2"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"13"	"week"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"13"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"24"	"Male/Female"	"inhalation: unspecified"	"13"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"10"	"Male"	"inhalation: aerosol"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"inhalation: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"11"	"Male"	"Not reported"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"11"	"Male"	"Not reported"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"11"	"Male"	"Not reported"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide (Addendum 1)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, historical"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, historical"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Aminopyralid"	"604-721-7"	"150114-71-9"	"single chemical entity"	"Component is identical to the substance"	"Aminopyralid"	"604-721-7"	"150114-71-9"	"4-amino-3,6-dichloropyridine-2-carboxylic acid"	"Aminopyralid"	"C6H4Cl2N2O2"	"Clc1c(nc(Cl)cc1N)C(=O)O"	"InChI=1S/C6H4Cl2N2O2/c7-3-1-2(9)4(8)5(10-3)6(11)12/h1H,(H2,9,10)(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Male"	"oral: gavage"	"24"	"D"	"yes, historical"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Aminopyralid (Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aminopyralid."	"41528"	"2013"	"doi:10.2903/j.efsa.2013.3352"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"3"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Female"	"oral: gavage"	"4"	"D"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Female"	"oral: gavage"	"3"	"D"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Female"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Female"	"oral: gavage"	"3"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"Male"	"oral: gavage"	"3"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Female"	"oral: gavage"	"3"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[[(4-hydroxy-6-methoxypyrimidin-2-yl)amino]carbonyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"N-[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C12H14N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(O)cc(OC)n3"	"InChI=1S/C12H14N10O5S/c1-21-10(6(5-13-21)9-17-20-22(2)18-9)28(25,26)19-12(24)16-11-14-7(23)4-8(15-11)27-3/h4-5H,1-3H3,(H3,14,15,16,19,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	""	""	"1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Not in list"	"C6H9N7O2S"	"Cn1nc(nn1)c2cnn(C)c2S(N)(=O)=O"	"InChI=1/C6H9N7O2S/c1-12-6(16(7,14)15)4(3-8-12)5-9-11-13(2)10-5/h3H,1-2H3,(H2,7,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"Yes"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"Yes"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Not reported"	"4"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Not reported"	"3"	"No data"	"oral: gavage"	"21"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"12"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Male/Female"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	"5"	"Male"	"oral: feed"	"3"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"large colonies"	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	"2"	"week"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male/Female"	"oral: feed"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"no information"	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chlorophenol"	"203-402-6"	"106-48-9"	"4-chlorophenol"	"Not in list"	"C6H5ClO"	"C1=CC(=CC=C1O)Cl"	"InChI=1S/C6H5ClO/c7-5-1-3-6(8)4-2-5/h1-4,8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Butyrac 200"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Butyrac 200"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Butyrac 200"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Butyrac 200"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Butyrac 200"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"α-[(4,6-dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-o-toluic acid"	""	""	"2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}methyl)benzoic acid"	"Not in list"	"C15H16N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC"	"InChI=1S/C15H16N4O7S/c1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"α-[(4,6-dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-o-toluic acid"	""	""	"2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}methyl)benzoic acid"	"Not in list"	"C15H16N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC"	"InChI=1S/C15H16N4O7S/c1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"α-[(4,6-dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-o-toluic acid"	""	""	"2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}methyl)benzoic acid"	"Not in list"	"C15H16N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC"	"InChI=1S/C15H16N4O7S/c1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"α-[(4,6-dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-o-toluic acid"	""	""	"2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}methyl)benzoic acid"	"Not in list"	"C15H16N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC"	"InChI=1S/C15H16N4O7S/c1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"α-[(4,6-dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-o-toluic acid"	""	""	"2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}methyl)benzoic acid"	"Not in list"	"C15H16N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC"	"InChI=1S/C15H16N4O7S/c1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"α-[(4,6-dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-o-toluic acid"	""	""	"2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}methyl)benzoic acid"	"Not in list"	"C15H16N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC"	"InChI=1S/C15H16N4O7S/c1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"α-[(4,6-dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-o-toluic acid"	""	""	"2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}methyl)benzoic acid"	"Not in list"	"C15H16N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC"	"InChI=1S/C15H16N4O7S/c1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"α-[(4,6-dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-o-toluic acid"	""	""	"2-({[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl}methyl)benzoic acid"	"Not in list"	"C15H16N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC"	"InChI=1S/C15H16N4O7S/c1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(sulfamoylmethyl)benzoate"	"419-010-5"	"112941-26-1"	"methyl 2-(sulfamoylmethyl)benzoate"	"Not in list"	"C9H11NO4S"	"COC(=O)C1=CC=CC=C1CS(=O)(=O)N"	"InChI=1S/C9H11NO4S/c1-14-9(11)8-5-3-2-4-7(8)6-15(10,12)13/h2-5H,6H2,1H3,(H2,10,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(sulfamoylmethyl)benzoate"	"419-010-5"	"112941-26-1"	"methyl 2-(sulfamoylmethyl)benzoate"	"Not in list"	"C9H11NO4S"	"COC(=O)C1=CC=CC=C1CS(=O)(=O)N"	"InChI=1S/C9H11NO4S/c1-14-9(11)8-5-3-2-4-7(8)6-15(10,12)13/h2-5H,6H2,1H3,(H2,10,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(sulfamoylmethyl)benzoate"	"419-010-5"	"112941-26-1"	"methyl 2-(sulfamoylmethyl)benzoate"	"Not in list"	"C9H11NO4S"	"COC(=O)C1=CC=CC=C1CS(=O)(=O)N"	"InChI=1S/C9H11NO4S/c1-14-9(11)8-5-3-2-4-7(8)6-15(10,12)13/h2-5H,6H2,1H3,(H2,10,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(sulfamoylmethyl)benzoate"	"419-010-5"	"112941-26-1"	"methyl 2-(sulfamoylmethyl)benzoate"	"Not in list"	"C9H11NO4S"	"COC(=O)C1=CC=CC=C1CS(=O)(=O)N"	"InChI=1S/C9H11NO4S/c1-14-9(11)8-5-3-2-4-7(8)6-15(10,12)13/h2-5H,6H2,1H3,(H2,10,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(sulfamoylmethyl)benzoate"	"419-010-5"	"112941-26-1"	"methyl 2-(sulfamoylmethyl)benzoate"	"Not in list"	"C9H11NO4S"	"COC(=O)C1=CC=CC=C1CS(=O)(=O)N"	"InChI=1S/C9H11NO4S/c1-14-9(11)8-5-3-2-4-7(8)6-15(10,12)13/h2-5H,6H2,1H3,(H2,10,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-2, 3-benzothiazin-4(3H)-one 2,2-dioxide"	"244-577-9"	"21784-53-2"	"2,2-dioxo-1H-2$l^{6},3-benzothiazin-4-one"	"Not in list"	"C8H7NO3S"	"C1C2=CC=CC=C2C(=O)NS1(=O)=O"	"InChI=1S/C8H7NO3S/c10-8-7-4-2-1-3-6(7)5-13(11,12)9-8/h1-4H,5H2,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"20"	"Male"	"intraperitoneal"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"20"	"Male"	"oral: feed"	"13"	"week"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"8"	"Male"	"intraperitoneal"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"8"	"Male/Female"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"8"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	"5"	"Male"	"oral: gavage"	"28"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"6"	"Male"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"According to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	"200"	"Male"	"oral: feed"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Sordaria brevicollis (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"50"	"Male"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bixafen"	""	"581809-46-3"	"single chemical entity"	"Component is identical to the substance"	"Bixafen"	""	"581809-46-3"	"N-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Bixafen"	"C18H12Cl2F3N3O"	"FC(F)c3nn(C)cc3C(=O)Nc2ccc(F)cc2c1ccc(Cl)c(Cl)c1"	"InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Bixafen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bixafen"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2917"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromadiolone"	"249-205-9"	"28772-56-7"	"single chemical entity"	"Component is identical to the substance"	"Bromadiolone"	"249-205-9"	"28772-56-7"	"3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-
+hydroxychromen-2-one"	"Bromadiolone"	"C30H23BrO4"	"C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O"	"InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Bromadiolone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromadiolone"	"40464"	"2010"	"doi:10.2903/j.efsa.2010.1783"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	"no information"	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"Male"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"12"	"Male/Female"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is identical to the substance"	"Bromuconazole"	""	"116255-48-2"	"2,5-anhydro-4-bromo-1,3,4-trideoxy-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)pentitol"	"Bromuconazole (sum of diasteroisomers)"	"C13H12BrCl2N3O"	"BrC1CC(CN2N=CN=C2)(C3=C(Cl)C=C(Cl)C=C3)OC1"	"InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"12"	"Male/Female"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"15"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Ethirimol"	"245-949-3"	""	"5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one"	"Not in list"	"C11H19N3O"	"CCCCC1=C(NC(=NC1=O)NCC)C"	"InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"15"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: unspecified"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is identical to the substance"	"Buprofezin"	""	"69327-76-0"	"2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one"	"Buprofezin"	"C16H23N3OS"	"O=C1N(C(C)C)C(SCN1C2=CC=CC=C2)=NC(C)(C)C"	"InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Buprofezin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"3T3"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"3T3"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Cadusafos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Cadusafos"	""	"95465-99-9"	"single chemical entity"	"Component is identical to the substance"	"Cadusafos"	""	"95465-99-9"	"2-[Butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane"	"Cadusafos"	"C10H23O2PS2"	"CCC(C)SP(=O)(OCC)SC(C)CC"	"InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cadusafos (Addendum 3)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cadusafos"	"39953"	"2009"	"doi:10.2903/j.efsa.2009.262r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1536"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1536"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"no information"	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mouse spot test"	"in vivo"	"According to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Female"	"oral: feed"	"4"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"6"	"Male"	"oral: gavage"	"5"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"Male"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"No data"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"54"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: gavage"	"4"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"5"	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male"	"oral: feed"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"No data"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: gavage"	"4"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male"	"oral: feed"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"5"	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"No data"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"15"	"Male"	"oral: unspecified"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"15"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"15"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"15"	"Male"	"intraperitoneal"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"15"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"Captan"	"205-087-0"	"133-06-2"	"single chemical entity"	"Component is identical to the substance"	"Captan"	"205-087-0"	"133-06-2"	"2-[(trichloromethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione"	"Captan"	"C9H8Cl3NO2S"	"ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O"	"InChI=1/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Captan"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance captan"	"40108"	"2009"	"doi:10.2903/j.efsa.2009.296r"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	"small colonies"	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	"large colonies"	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"1-Methylcyclopropene"	""	"3100-04-7"	"single chemical entity"	"Component is identical to the substance"	"1-Methylcyclopropene"	""	"3100-04-7"	"1-methylcyclopropene"	"1-methylcyclopropene"	"C4H6"	"CC1=CC1"	"InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"1-Methylcyclopropene"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance 1-methylcyclopropene"	"38484"	"2005"	"doi:10.2903/j.efsa.2005.30r"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"7"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is part of a group assessment"	"Geranyl acetate"	"203-341-5"	"105-87-3"	"[(2E)-3,7-dimethylocta-2,6-dienyl] acetate"	"Not in list"	"C12H20O2"	"CC(=CCCC(=CCOC(=O)C)C)C"	"InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"single chemical entity"	"Component is identical to the substance"	"2-(1-Naphthyl)acetamide"	"201-704-2"	"86-86-2"	"2-naphthalen-1-ylacetamide"	"Not in list"	"C12H11NO"	"NC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphthaleneacetamide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2-(1-naphthyl)acetamide (notified as 1-naphthylacetamide)"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2020"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 1-naphthylacetate"	""	"61-31-4"	"sodium;2-naphthalen-1-ylacetate"	"Not in list"	"C12H9NaO2"	"C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]"	"InChI=1S/C12H10O2.Na/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-7H,8H2,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"single chemical entity"	"Component is identical to the substance"	"1-Naphthylacetic acid"	"201-705-8"	"86-87-3"	"1-2-naphthalen-1-ylacetic acid"	"1-naphthylacetic acid"	"C12H10O2"	"OC(=O)Cc1cccc2ccccc12"	"InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Naphtaleneacetic acid"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1-naphthylacetic acid"	"40597"	"2011"	"doi:10.2903/j.efsa.2011.2019"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"4"	"Male"	"intraperitoneal"	"23"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"single chemical entity"	"Component is identical to the substance"	"8-Hydroxyquinoline"	"205-711-1"	"148-24-3"	"Quinolin-8-ol"	"Not in list"	"C9H7NO"	"C1=CC2=C(C(=C1)O)N=CC=C2"	"InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"4"	"Male"	"intraperitoneal"	"42"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"8-Hydroxyquinoline (Variant: 8-Hydroxyquinoline neutral sulphate)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 8-hydroxyquinoline"	"40571"	"2011"	"doi:10.2903/j.efsa.2011.1964"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"mixture or formulation"	"Component is identical to the substance"	"Abamectin"	""	"71751-41-2"	"(9Z,13Z,15Z)-6'-(butan-2-yl)-19,21b-dihydroxy-5',10,12,20-tetramethyl-1-oxo-3,4,5',6',8,11,12,18,18a,19,21a,21b-dodecahydro-1H,7H,16H-spiro[3,7-methanopyrano[3,4,5-pq][2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methylhexopyranosyl)-3-O-methylhexopyranoside"	"Abamectin (sum of Avermectin B1a, AvermectinB1b and delta-8,9 isomer of Avermectin B1a)"	"C49H74O14"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COCC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C"	"InChI=1S/C49H74O14/c1-11-26(2)45-29(5)17-18-48(63-45)23-35-20-34(62-48)16-15-28(4)44(60-41-22-39(55-10)46(32(8)58-41)61-40-21-38(54-9)43(51)31(7)57-40)27(3)13-12-14-33-24-56-25-37-42(50)30(6)19-36(47(52)59-35)49(33,37)53/h12-15,17-19,26-27,29,31-32,34-46,50-51,53H,11,16,20-25H2,1-10H3/b13-12-,28-15-,33-14-"	"organic"	"representative compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Abamectin"	""	"71751-41-2"	"single chemical entity"	"Component is a metabolite of the substance"	"[8,9-Z]-isomer of avermectin B1a"	""	""	"{(2aZ,4Z,5'S,6R,6'R,7Z,10R,12S,14S,16aR,19R,19aR,19bS)-6'-[(2S)-butan-2-yl]-19,19b-dihydroxy-5',6,7,18-tetramethyl-16-oxo-5',6,6',9,10,13,14,16,16a,19,19a,19b-dodecahydro-2H-spiro[10,14-methanofuro[4,3,2-op][2,6]benzodioxacycloheptadecine-12,2'-pyran]-6-yl}methyl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-3-O-methyl-a-L-arabino-hexopyranoside"	"Avermectin B1a, delta-8,9 isomer"	"C47H70O14"	"CO[C@H]1C[C@@H](O[C@@H](C)[C@@H]1O)O[C@@H]2[C@@H](OC)C[C@@H](O[C@H]2C)OC[C@]5(C)C=CC=C6CO[C@@H]7[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]3C[C@H](O[C@]4(C3)C=C[C@H](C)[C@H](O4)[C@@H](C)CC)CC=C5C)[C@]67O"	"InChI=1S/C48H72O14/c1-11-26(2)42-27(3)16-18-47(62-42)23-34-20-33(61-47)15-14-29(5)46(8,17-12-13-32-24-55-44-40(49)28(4)19-35(45(51)59-34)48(32,44)52)25-56-38-22-37(54-10)43(31(7)58-38)60-39-21-36(53-9)41(50)30(6)57-39/h12-14,16-19,26-27,30-31,33-44,49-50,52H,11,15,20-25H2,1-10H3/b17-12-,29-14-,32-13-/t26-,27-,30-,31-,33+,34-,35-,36-,37-,38+,39-,40+,41-,42+,43-,44+,46-,47+,48+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Abamectin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance abamectin. Please note the current definition for the ISO name is exactly an 80% to 20% mixture of avermectins B1a and B1b. However the material discussed in thi"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.147r"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is identical to the substance"	"Acequinocyl"	""	"57960-19-7"	"3-dodecyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate"	"Acequinocyl"	"C24H32O4"	"CC(=O)OC2=C(CCCCCCCCCCCC)C(=O)c1ccccc1C2=O"	"InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acequinocyl"	""	"57960-19-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2-oxotetradecanoyl)benzoic acid"	""	""	"2-(2-oxododecanoyl)benzoic acid"	"Not in list"	"C19H26O4"	"O=C(O)c1ccccc1C(=O)C(=O)CCCCCCCCCC"	"InChI=1/C19H26O4/c1-2-3-4-5-6-7-8-9-14-17(20)18(21)15-12-10-11-13-16(15)19(22)23/h10-13H,2-9,14H2,1H3,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Acequinocyl (Revised version of September 2007)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acequinocyl."	"41396"	"2013"	"doi:10.2903/j.efsa.2013.3212"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"6-Benzyladenine (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"6-Benzyladenine (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"6-Benzyladenine (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"single chemical entity"	"Component is identical to the substance"	"6-Benzyladenine"	"214-927-5"	"1214-39-7"	"N-benzyl-7H-purin-6-amine"	"6-Benzyladenine"	"C12H11N5"	"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3"	"InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"6-Benzyladenine (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 6-benzyladenine"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1716"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"4"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is identical to the substance"	"Acibenzolar-S-methyl"	""	"135158-54-2"	"Benzo[1,2,3]thiadiazole-7-carbothioic acid S-methyl ester"	"Acybenzolar-S-methyl"	"C8H6N2OS2"	"CSC(=O)C1=C2C(=CC=C1)N=NS2"	"InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"4"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France - CoRMS: Spain"	"Acibenzolar-S-Methyl (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,3-benzothiadiazole-7-carboxylic acid"	""	"35272-27-6"	"1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O2S"	"C1=CC(=C2C(=C1)N=NS2)C(=O)O"	"InChI=1S/C7H4N2O2S/c10-7(11)4-2-1-3-5-6(4)12-9-8-5/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"4-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1ccc(O)c2nnsc12"	"InChI=1/C7H4N2O3S/c10-4-2-1-3(7(11)12)6-5(4)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Acibenzolar-S-methyl"	""	"135158-54-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	""	""	"5-hydroxy-1,2,3-benzothiadiazole-7-carboxylic acid"	"Not in list"	"C7H4N2O3S"	"O=C(O)c1cc(O)cc2nnsc12"	"InChI=1/C7H4N2O3S/c10-3-1-4(7(11)12)6-5(2-3)8-9-13-6/h1-2,10H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acibenzolar-s-methyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acibenzolar-S-methyl"	"41863"	"2014"	"doi:10.2903/j.efsa.2014.3691"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"Aclonifen"	"277-704-1"	"74070-46-5"	"single chemical entity"	"Component is identical to the substance"	"Aclonifen"	"277-704-1"	"74070-46-5"	"2-chloro-6-nitro-3-phenoxyaniline"	"Aclonifen"	"C12H9ClN2O3"	"Clc2c(N)c(ccc2Oc1ccccc1)[N+]([O-])=O"	"InChI=1S/C12H9ClN2O3/c13-11-10(18-8-4-2-1-3-5-8)7-6-9(12(11)14)15(16)17/h1-7H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aclonifen"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Aclonifen"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.149r"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	"5"	"Male/Female"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	"5"	"Male/Female"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is identical to the substance"	"Acrinathrin"	""	"101007-06-1"	"[(S)-cyano-(3-phenoxyphenyl)methyl](1R,3S)-3-[(Z)-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Acrinathrin"	"C26H21F6NO5"	"CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C\C(=O)OC(C(F)(F)F)C(F)(F)F)C"	"InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11-/t18-,19+,21-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	""	""	"(2Z)-3-(3-{[cyano(3-phenoxyphenyl)methoxy]carbonyl}-2,2-dimethylcyclopropyl)prop-2-enoic acid"	"Acrinathrin"	"C23H21NO5"	"OC(=O)/C=C\C3C(C(=O)OC(C#N)c2cccc(Oc1ccccc1)c2)C3(C)C"	"InChI=1/C23H21NO5/c1-23(2)18(11-12-20(25)26)21(23)22(27)29-19(14-24)15-7-6-10-17(13-15)28-16-8-4-3-5-9-16/h3-13,18-19,21H,1-2H3,(H,25,26)/b12-11-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Acrinathrin"	""	"101007-06-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"3-[(Z)-2-carboxyethenyl]-2,2-dimethylcyclopropanecarboxylic acid"	"Acrinathrin"	"C9H12O4"	"OC(=O)/C=C\C1C(C(=O)O)C1(C)C"	"InChI=1/C9H12O4/c1-9(2)5(3-4-6(10)11)7(9)8(12)13/h3-5,7H,1-2H3,(H,10,11)(H,12,13)/b4-3-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Acrinathrin (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance acrinathrin."	"41627"	"2013"	"doi:10.2903/j.efsa.2013.3469"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is identical to the substance"	"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"Aluminum;azanium;disulfate;dodecahydrate"	"Aluminium ammonium sulphate dodecahydrate"	"AlH28NO20S2"	"[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]"	"InChI=1S/Al.H3N.2H2O4S.12H2O/c;;2*1-5(2,3)4;;;;;;;;;;;;/h;1H3;2*(H2,1,2,3,4);12*1H2/q+3;;;;;;;;;;;;;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is identical to the substance"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"Trimagnesium;phosphorus(3-)"	"Not in list"	"Mg3P2"	"[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]"	"InChI=1S/3Mg.2P/q3*+2;2*-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is identical to the substance"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"phosphinidyne aluminum"	"Not in list"	"AlP"	"[Al]#P"	"InChI=1/Al.P/rAlP/c1-2"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Phosphine"	"232-260-8"	"7803-51-2"	"single chemical entity"	"Component is identical to the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Phosphane"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance phosphane"	"40970"	"2012"	"doi:10.2903/j.efsa.2012.2595"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Magnesium phosphide"	"235-023-7"	"12057-74-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Magnesium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance magnesium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.190r"
+"Zinc phosphide"	"215-244-5"	"1314-84-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Zinc phosphide"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance zinc phosphide"	"40378"	"2010"	"doi:10.2903/j.efsa.2010.1671"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Calcium phosphide"	"215-142-0"	"1305-99-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Calcium phosphide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance calcium phosphide"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.183r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Aluminium phosphide"	"244-088-0"	"20859-73-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphine"	"232-260-8"	"7803-51-2"	"phosphine"	"Not in list"	"H3P"	"P"	"InChI=1S/H3P/h1H3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Aluminium phosphide (Final Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance aluminium phosphide"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.182r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is identical to the substance"	"Amidosulfuron"	""	"120923-37-7"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[methyl(methylsulfonyl)sulfamoyl]urea"	"Amidosulfuron"	"C9H15N5O7S2"	"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	""	""	"3-(4-hydroxy-6-methoxypyrimidin-2-yl)-1-(N-methyl-N-methylsulfonylaminosulfonyl)-urea"	"Not in list"	"C8H13N5O7S2"	"O=C(Nc1nc(O)cc(OC)n1)NS(=O)(=O)N(C)S(C)(=O)=O"	"InChI=1/C8H13N5O7S2/c1-13(21(3,16)17)22(18,19)12-8(15)11-7-9-5(14)4-6(10-7)20-2/h4H,1-3H3,(H3,9,10,11,12,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dihydroxypyrimidine"	"200-256-5"	"56-09-7"	"2-amino-4-hydroxy-1H-pyrimidin-6-one"	"Not in list"	"C4H5N3O2"	"C1=C(N=C(NC1=O)N)O"	"InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H,(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Amidosulfuron"	""	"120923-37-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Amidosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance amidosulfuron"	"39761"	"2008"	"doi:10.2903/j.efsa.2008.116r"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"oral: gavage"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Female"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Female"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Female"	"oral: gavage"	"8"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Female"	"oral: gavage"	"0.25"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Female"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Female"	"oral: gavage"	"1"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Female"	"oral: gavage"	"1.5"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Female"	"oral: gavage"	"0.5"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"6"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is identical to the substance"	"Carbetamide"	"240-286-6"	"16118-49-3"	"1-(ethylamino)-1-oxopropan-2-yl phenylcarbamate"	"Carbetamide"	"C12H16N2O3"	"O=C(NCC)C(OC(NC1=CC=CC=C1)=O)C"	"InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"6"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is identical to the substance"	"Amisulbrom"	""	"348635-87-0"	"3-(3-bromo-6-fluoro-2-methylindol-1-ylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-sulfonamide"	"Amisulbrom"	"C13H13BrFN5O4S2"	"CC1=C(C2=C(N1S(=O)(=O)C3=NN(C=N3)S(=O)(=O)N(C)C)C=C(C=C2)F)Br"	"InChI=1S/C13H13BrFN5O4S2/c1-8-12(14)10-5-4-9(15)6-11(10)20(8)25(21,22)13-16-7-19(17-13)26(23,24)18(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Amisulbrom"	""	"348635-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	""	""	"3-bromo-6-fluoro-2-methyl-1-(1H-1,2,4-triazol-3-ylsulfonyl)-1H-indole"	"Not in list"	"C11H8BrFN4O2S"	"O=S(=O)(n2c1cc(F)ccc1c(Br)c2C)c3ncnn3"	"InChI=1/C11H8BrFN4O2S/c1-6-10(12)8-3-2-7(13)4-9(8)17(6)20(18,19)11-14-5-15-16-11/h2-5H,1H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Amisulbrom"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amisulbrom"	"41736"	"2014"	"doi:10.2903/j.efsa.2014.3237"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is identical to the substance"	"Azoxystrobin"	""	"131860-33-8"	"methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate"	"Azoxystrobin"	"C22H17N3O5"	"N#CC1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3/C(C(OC)=O)=C\OC)=C2"	"InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyprop-2-enoic acid"	""	""	"(2Z)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-4-oxopent-2-enoic acid"	"Not in list"	"C22H15N3O5"	"CC(=O)\C=C(/C(=O)O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C22H15N3O5/c1-14(26)10-17(22(27)28)16-7-3-5-9-19(16)30-21-11-20(24-13-25-21)29-18-8-4-2-6-15(18)12-23/h2-11,13H,1H3,(H,27,28)/b17-10-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Azoxystrobin"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Ambiguous"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Ambiguous"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"L-ascorbic acid"	"200-066-2"	"50-81-7"	"single chemical entity"	"Component is identical to the substance"	"L-ascorbic acid"	"200-066-2"	"50-81-7"	"(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one"	"L-ascorbic acid"	"C6H8O6"	"C(C(C1C(=C(C(=O)O1)O)O)O)O"	"InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"L-ascorbic acid"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance L-ascorbic acid"	"41389"	"2013"	"doi: 10.2903/j.efsa.2013.3197"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Trifolio-M GmbH source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: microorganisms or derived from microorganisms"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Sipcam S.p.A source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Azadirachtin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Azadirachtin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Azadirachtin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Azadirachtin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Azadirachtin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Azadirachtin A"	""	"11141-17-6"	"complex product: derived from botanical sources"	"Component is the active ingredient of the mixture or formulation"	"Azadirachtin extract (Mitsui AgriScience International S.A/B.V source)"	""	""	"methyl 10,10a-bis(acetyloxy)-3,5-dihydroxy-4-(6a-hydroxy-7a-methyl-3a,6a,7,7a-tetrahydro-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-4-methyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}decahydro-1H-naphtho[1,8a-c:4,5-b'c']difuran-5-carboxylate"	"Not in list"	"C35H44O16"	"C24(C(C3C1(C=COC1OC2C3)O)(C)O4)C6(C8C5(C(CC(C7(C5C(C6O)OC7)OC(=O)C)OC(=O)C)OC(/C(=C/C)C)=O)COC8(C(=O)OC)O)C"	"InChI=1S/C35H44O16/c1-8-15(2)25(39)48-19-12-20(47-16(3)36)33(50-17(4)37)14-45-22-23(33)31(19)13-46-34(42,27(40)43-7)26(31)29(5,24(22)38)35-21-11-18(30(35,6)51-35)32(41)9-10-44-28(32)49-21/h8-10,18-24,26,28,38,41-42H,11-14H2,1-7H3/b15-8+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Azadirachtin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azadirachtin"	"40619"	"2011"	"doi:10.2903/j.efsa.2011.1858"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3052"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3052"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3076"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3076"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"IN-E6758"	""	""	"phenyl (4,6-dimethoxypyrimidin-2-yl)carbamate"	"Not in list"	"C13H13N3O4"	"O=C(Oc1ccccc1)Nc2nc(cc(OC)n2)OC"	"InChI=1/C13H13N3O4/c1-18-10-8-11(19-2)15-12(14-10)16-13(17)20-9-6-4-3-5-7-9/h3-8H,1-2H3,(H,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"IN-E6758"	""	""	"phenyl (4,6-dimethoxypyrimidin-2-yl)carbamate"	"Not in list"	"C13H13N3O4"	"O=C(Oc1ccccc1)Nc2nc(cc(OC)n2)OC"	"InChI=1/C13H13N3O4/c1-18-10-8-11(19-2)15-12(14-10)16-13(17)20-9-6-4-3-5-7-9/h3-8H,1-2H3,(H,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is a metabolite of the substance"	"IN-E6758"	""	""	"phenyl (4,6-dimethoxypyrimidin-2-yl)carbamate"	"Not in list"	"C13H13N3O4"	"O=C(Oc1ccccc1)Nc2nc(cc(OC)n2)OC"	"InChI=1/C13H13N3O4/c1-18-10-8-11(19-2)15-12(14-10)16-13(17)20-9-6-4-3-5-7-9/h3-8H,1-2H3,(H,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Azimsulfuron"	"601-676-5"	"120162-55-2"	"single chemical entity"	"Component is identical to the substance"	"Azimsulfuron"	"601-676-5"	"120162-55-2"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-1-methyl-4-(2-methyl-2H-tetrazol-5-yl)-1H-pyrazole-5-sulfonamide"	"Azimsulfuron"	"C13H16N10O5S"	"Cn1nc(nn1)c2cnn(C)c2S(=O)(=O)NC(=O)Nc3nc(OC)cc(OC)n3"	"InChI=1S/C13H16N10O5S/c1-22-11(7(6-14-22)10-18-21-23(2)19-10)29(25,26)20-13(24)17-12-15-8(27-3)5-9(16-12)28-4/h5-6H,1-4H3,(H2,15,16,17,20,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Sweden - CoRMS: Slovenia"	"Azimsulfuron (Corrigendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azimsulfuron"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1554"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfluralin"	"217-465-2"	"1861-40-1"	"single chemical entity"	"Component is identical to the substance"	"Benfluralin"	"217-465-2"	"1861-40-1"	"N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline"	"Benfluralin"	"C13H16F3N3O4"	"CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfluralin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benfluralin"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.127r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, historical"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, historical"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"single chemical entity"	"Component is identical to the substance"	"Bensulfuron-methyl"	"401-340-6"	"83055-99-6"	"Methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate"	"Bensulfuron-Methyl"	"C16H18N4O7S"	"COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC"	"InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Bensulfuron Methyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bensulfuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.178r"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"oral: gavage"	"3"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Ambiguous"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is part of a group assessment"	"bentazone sodium"	"256-735-4"	"50723-80-3"	"sodium;2,2-dioxo-3-propan-2-yl-2$l^{6},1,3-benzothiadiazin-1-id-4-one"	"Not in list"	"C10H11N2NaO3S"	"CC(C)N1C(=O)C2=CC=CC=C2[N-]S1(=O)=O.[Na+]"	"InChI=1S/C10H12N2O3S.Na/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15;/h3-7H,1-2H3,(H,11,13);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"Not reported"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male/Female"	"oral: feed"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"8-hydroxy-3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide"	"611-967-9"	"60374-43-8"	"8-hydroxy-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O4S"	"CC(C)N1C(=O)C2=C(C(=CC=C2)O)NS1(=O)=O"	"InChI=1S/C10H12N2O4S/c1-6(2)12-10(14)7-4-3-5-8(13)9(7)11-17(12,15)16/h3-6,11,13H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Bentazone"	"246-585-8"	"25057-89-0"	"single chemical entity"	"Component is identical to the substance"	"Bentazone"	"246-585-8"	"25057-89-0"	"2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one"	"Not in list"	"C10H12N2O3S"	"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O"	"InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Bentazone (RAR)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Bentazone"	"42114"	"2015"	"doi: 10.2903/j.efsa.2015.4077"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"single chemical entity"	"Component is identical to the substance"	"Beta-Cypermethrin"	"265-898-0"	"65731-84-2"	"A reaction mixture comprising two enantiomeric pairs in ratio ca. 2:3 of (R)-alpha-cyano-3-phenoxybenzyl (1S)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-cis-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate with (R)-alpha-cyano-3-phenoxybenzyl (1S)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate and (S)-alpha-cyano-3-phenoxybenzyl (1R)-trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate"	"Beta-cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Beta-Cypermethrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance beta-cypermethrin"	"41810"	"2014"	"doi:10.2903/j.efsa.2014.3717"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Bifenox"	"255-894-7"	"42576-02-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenox"	"255-894-7"	"42576-02-3"	"methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate"	"Bifenox"	"C14H9Cl2NO5"	"[O-][N+](C(C=C2)=C(C=C2OC1=CC=C(Cl)C=C1Cl)C(OC)=O)=O"	"InChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Bifenox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance bifenox"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.119r"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl"	"2000"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate"	""	""	"3-[(2,6-dimethylphenyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl"	"275-728-7"	"71626-11-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(malonyl)-N-(2,6-xylyl)-DL-alanine"	""	""	"N-(carboxyacetyl)-N-(2,6-dimethylphenyl)alanine"	"Not in list"	"C14H17NO5"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H17NO5/c1-8-5-4-6-9(2)13(8)15(10(3)14(19)20)11(16)7-12(17)18/h4-6,10H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: Portugal"	"Benalaxyl (Addendum 8)"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluoro-2-hydroxybenzothiazole"	""	""	"6-fluoro-1,3-benzothiazol-2-ol"	"Not in list"	"C7H4FNOS"	"Fc1ccc2nc(O)sc2c1"	"InChI=1/C7H4FNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-Fluorobenzothiazol-2-yl methyl ketone"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanone"	"Not in list"	"C9H6FNOS"	"CC(=O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H6FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-4H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(6-Fluorobenzothiazol-2-yl)ethanol"	""	""	"1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol"	"Not in list"	"C9H8FNOS"	"CC(O)c1nc2ccc(F)cc2s1"	"InChI=1/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	""	""	"Isopropyl (1S)-1-[(1R or S)-1-(6-fluoro-5-hydroxybenzothiazol-2-yl)ethylcarbamoyl]-2-methylpropylcarbamate"	"Not in list"	"C18H24FN3O4S"	"CC(C)C(NC(=O)OC(C)C)C(=O)NC(C)c1nc2cc(O)c(F)cc2s1"	"InChI=1/C18H24FN3O4S/c1-8(2)15(22-18(25)26-9(3)4)16(24)20-10(5)17-21-12-7-13(23)11(19)6-14(12)27-17/h6-10,15,23H,1-5H3,(H,20,24)(H,22,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"48"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"48"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"48"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is identical to the substance"	"Clomazone"	""	"81777-89-1"	"2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one"	"Clomazone"	"C12H14ClNO2"	"O=C1N(CC(C=CC=C2)=C2Cl)OCC(C)1C"	"InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Clomazone"	""	"81777-89-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Isoxazolidine"	""	"81778-07-6"	"4,4-dimethyl-1,2-oxazolidin-3-one"	"Not in list"	"C5H9NO2"	"CC1(CONC1=O)C"	"InChI=1S/C5H9NO2/c1-5(2)3-8-6-4(5)7/h3H2,1-2H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Clomazone"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clomazone"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.109r"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"single chemical entity"	"Component is identical to the substance"	"Diclofop-methyl"	"257-141-8"	"51338-27-3"	"Methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate"	"Diclofop-Methyl"	"C16H14Cl2O4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Diclofop-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diclofop (considered variant diclofop-methyl)"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1718"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is identical to the substance"	"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"2-chloro-N-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl}benzenesulfonamide"	"Chlorsulfuron"	"C12H12ClN5O4S"	"Cc2nc(NC(=O)NS(=O)(=O)c1ccccc1Cl)nc(OC)n2"	"InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: feed"	"10"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chlorobenzenesulfonamide"	"230-156-7"	"6961-82-6"	"2-chlorobenzenesulfonamide"	"Not in list"	"C6H6ClNO2S"	"C1=CC=C(C(=C1)S(=O)(=O)N)Cl"	"InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Chlorsulfuron"	"265-268-5"	"64902-72-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(Ncarbamoylcarbamimidoyl)carbamoyl]-2-chlorobenzenesulfonamide"	""	""	"N'-(N-{[(2-chlorophenyl)sulfonyl]carbamoyl}carbamimidoyl)carbamimidic acid"	"Not in list"	"C9H10ClN5O4S"	"O=S(=O)(NC(=O)NC(=N)/N=C(\N)O)c1ccccc1Cl"	"InChI=1/C9H10ClN5O4S/c10-5-3-1-2-4-6(5)20(18,19)15-9(17)14-7(11)13-8(12)16/h1-4H,(H6,11,12,13,14,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorsulfuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlorsulfuron"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.201r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"5"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Clopyralid"	"216-935-4"	"1702-17-6"	"single chemical entity"	"Component is identical to the substance"	"Clopyralid"	"216-935-4"	"1702-17-6"	"3,6-dichloropyridine-2-carboxylic acid"	"Clopyralid"	"C6H3Cl2NO2"	"C1=CC(=NC(=C1Cl)C(=O)O)Cl"	"InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"5"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Clopyralid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Clopyralid"	"38740"	"2006"	"doi: 10.2903/j.efsa.2006.50r"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is identical to the substance"	"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C20H20FNO4"	"CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F"	"InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Cyhalofop-butyl"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"3T3"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"3T3"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Diflubenzuron"	"252-529-3"	"35367-38-5"	"single chemical entity"	"Component is identical to the substance"	"Diflubenzuron"	"252-529-3"	"35367-38-5"	"N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Diflubenzuron"	"C14H9ClF2N2O2"	"Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2"	"InChI=1/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"5"	"Male"	"oral: unspecified"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Diflubenzuron (Addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance diflubenzuron"	"41159"	"2012"	"doi:10.2903/j.efsa.2012.2870"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carbetamide"	"240-286-6"	"16118-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS) 2-phenylcarbamoyl-propionic acid"	""	""	"{2-[(phenylcarbamoyl)oxy]propanoyl}carbamic acid"	"Not in list"	"C11H12N2O5"	"O=C(O)NC(=O)C(C)OC(=O)Nc1ccccc1"	"InChI=1/C11H12N2O5/c1-7(9(14)13-10(15)16)18-11(17)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,12,17)(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Carbetamide (Revised DAR of December 2005)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbetamide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1913"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	""	""	"2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide 4-oxide"	"Carboxin metabolite (P/V-54)"	"C6H9NO3S"	"CC=1OCCS(=O)C=1C(N)=O"	"InChI=1/C6H9NO3S/c1-4-5(6(7)8)11(9)3-2-10-4/h2-3H2,1H3,(H2,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"3"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Carboxin"	"226-031-1"	"5234-68-4"	"single chemical entity"	"Component is identical to the substance"	"Carboxin"	"226-031-1"	"5234-68-4"	"2-methyl-N-phenyl-5,6-dihydro-1,4-oxathiine-3-carboxamide"	"Carboxin"	"C12H13NO2S"	"CC1=C(SCCO1)C(=O)Nc2ccccc2"	"InChI=1/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Carboxin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carboxin"	"40469"	"2010"	"doi:10.2903/j.efsa.2010.1857"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"24"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"24"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"24"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Dichlorprop-P"	""	"15165-67-0"	"single chemical entity"	"Component is identical to the substance"	"Dichlorprop-P"	""	"15165-67-0"	"(2R)-2-(2,4-dichlorophenoxy)propanoic acid"	"Dichlorprop-p"	"C9H8Cl2O3"	"Clc1cc(Cl)ccc1O[C@H](C)C(=O)O"	"InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dichlorprop-p"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dichlorprop-P"	"41226"	"2012"	"doi:10.2903/j.efsa.2012.2950"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"intraperitoneal"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"609-284-6"	"36701-89-0"	"2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid"	"Not in list"	"C13H8F3NO3"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F"	"InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Diflufenican"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Not reported"	"3"	"Male/Female"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Cyromazine"	""	"66215-27-8"	"single chemical entity"	"Component is identical to the substance"	"Cyromazine"	""	"66215-27-8"	"N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine"	"Cyromazine"	"C6H10N6"	"Nc2nc(N)nc(NC1CC1)n2"	"InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mouse spot test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"71"	"Female"	"intraperitoneal"	"8"	"week"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	""	"RMS: Greece"	"Cyromazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyromazine"	"39742"	"2008"	"doi:10.2903/j.efsa.2008.168r"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Dicloran"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Dicloran"	"202-746-4"	"99-30-9"	"single chemical entity"	"Component is identical to the substance"	"Dicloran"	"202-746-4"	"99-30-9"	"2,6-dichloro-4-nitroaniline"	"Dicloran"	"C6H4Cl2N2O2"	"Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]"	"InChI=1/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Spain"	"Dicloran (Addendum II)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicloran"	"40393"	"2010"	"doi:10.2903/j.efsa.2010.1698"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"single chemical entity"	"Component is identical to the substance"	"Didecyldimethylammonium chloride"	"230-525-2"	"7173-51-5"	"N-decyl-N,N-dimethyldecan-1-aminium chloride"	"Didecyldimethylammonium chloride (mixture of alkyl-quaternary ammonium salts with alkyl chain lengths of C8, C10 and C12)"	"C22H48N.Cl"	"[Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC"	"InChI=1/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Didecyldimethylammonium Chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance didecyldimethylammonium chloride"	"39906"	"2009"	"doi: 10.2903/j.efsa.2009.214r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Diazinon"	"206-373-8"	"333-41-5"	"single chemical entity"	"Component is identical to the substance"	"Diazinon"	"206-373-8"	"333-41-5"	"O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate"	"Diazinon"	"C12H21N2O3PS"	"CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C"	"InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"16"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Diazinon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diazinon"	"38938"	"2006"	"doi:10.2903/j.efsa.2006.85r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male"	"oral: feed"	"10"	"week"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clodinafop-propargyl"	""	"105512-06-9"	"single chemical entity"	"Component is identical to the substance"	"Clodinafop-propargyl"	""	"105512-06-9"	"prop-2-yn-1-yl (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoate"	"Clodinafop-Propargyl"	"C17H13ClFNO4"	"O=C(OCC#C)[C@H](OC1=CC=C(OC2=NC=C(Cl)C=C2F)C=C1)C"	"InChI=1S/C17H13ClFNO4/c1-3-8-22-17(21)11(2)23-13-4-6-14(7-5-13)24-16-15(19)9-12(18)10-20-16/h1,4-7,9-11H,8H2,2H3/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clodinafop-propargyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clodinafop"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.34ar"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"5"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"5"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"5"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Cymoxanil"	"261-043-0"	"57966-95-7"	"single chemical entity"	"Component is identical to the substance"	"Cymoxanil"	"261-043-0"	"57966-95-7"	"(1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide"	"Cymoxanil"	"C7H10N4O3"	"CCNC(=O)NC(=O)/C(=N/OC)/C#N"	"InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"5"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cymoxanil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cymoxanil"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.167r"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: unspecified"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: unspecified"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"105"	"Male"	"oral: gavage"	"5"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	""	""	"1-oxo-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-5-ium"	"Not in list"	"C8H9N2O"	"O=C1NCC[n+]2ccccc12"	"InChI=1/C8H8N2O/c11-8-7-3-1-2-5-10(7)6-4-9-8/h1-3,5H,4,6H2/p+1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"single chemical entity"	"Component is identical to the substance"	"Dodemorph acetate"	"250-778-2"	"31717-87-0"	"Acetic acid;4-cyclododecyl-2,6-dimethylmorpholine"	"Not in list"	"C20H39NO3"	"CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O"	"InChI=1S/C18H35NO.C2H4O2/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18;1-2(3)4/h16-18H,3-15H2,1-2H3;1H3,(H,3,4)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Dodemorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dodemorph (considered variant dodemorph acetate)"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.170r"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Epoxiconazole"	""	"106325-08-0"	"single chemical entity"	"Component is identical to the substance"	"Epoxiconazole"	""	"106325-08-0"	"1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole"	"Epoxiconazole"	"C17H13ClFN3O"	"ClC3=C(C=CC=C3)C1OC(C4=CC=C(F)C=C4)1CN2N=CN=C2"	"InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Epoxiconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance epoxiconazole"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.138r"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"no information"	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	""	"7600-50-2"	"2,5-dichloro-3-hydroxy-6-methoxybenzoic acid"	"Not in list"	"C8H6Cl2O4"	"COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl"	"InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"3"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"3"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is identical to the substance"	"Esfenvalerate"	""	"66230-04-4"	"(alphaS)-alpha-cyano-3-phenoxybenzyl(2S)-2-(4-chlorophenyl)-3-methylbutyrate"	"Esfenvalerate"	"C25H22ClNO3"	"CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS,3RS)-3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	"66753-10-4"	"3-(4-chlorophenyl)-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C24H22ClNO"	"CC(C)C(C1=CC=C(C=C1)Cl)C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C24H22ClNO/c1-17(2)24(18-11-13-20(25)14-12-18)23(16-26)19-7-6-10-22(15-19)27-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Esfenvalerate"	""	"66230-04-4"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	""	""	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (2RS)-2-(4-chlorophenyl)-3-methylbutanoate"	"Not in list"	"C25H24ClNO4"	"Clc1ccc(cc1)C(C(C)C)C(=O)OC(c3cccc(Oc2ccccc2)c3)C(N)=O"	"InChI=1/C25H24ClNO4/c1-16(2)22(17-11-13-19(26)14-12-17)25(29)31-23(24(27)28)18-7-6-10-21(15-18)30-20-8-4-3-5-9-20/h3-16,22-23H,1-2H3,(H2,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Esfenvalerate"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance esfenvalerate"	"41946"	"2014"	"doi:10.2903/j.efsa.2014.3873"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM571"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM611"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP6"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D6"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D6"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"36"	"Male/Female"	"Not reported"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"36"	"Male/Female"	"Not reported"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"36"	"Male/Female"	"Not reported"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"42"	"Male/Female"	"Not reported"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"42"	"Male/Female"	"Not reported"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"42"	"Male/Female"	"Not reported"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"Not reported"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"Not reported"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"Not reported"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"Not reported"	"39"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is identical to the substance"	"Etridiazole"	"219-991-8"	"2593-15-9"	"5-ethoxy-3-(trichloromethyl)-1,2,4-thiadiazole"	"Etridiazole"	"C5H5Cl3N2OS"	"ClC(Cl)(Cl)C1=NSC(OCC)=N1"	"InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"Not reported"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"30"	"Male/Female"	"Not reported"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Etridiazole"	"219-991-8"	"2593-15-9"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	""	"67472-43-9"	"5-Ethoxy-1,2,4-thiadiazole-3-carboxylic acid"	"Not in list"	"C5H6N2O3S"	"CCOC1=NC(=NS1)C(=O)O"	"InChI=1S/C5H6N2O3S/c1-2-10-5-6-3(4(8)9)7-11-5/h2H2,1H3,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"30"	"Male/Female"	"Not reported"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Etridiazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance etridiazole"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1823"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is identical to the substance"	"Cyflufenamid"	""	"180409-60-3"	"N-[(cyclopropylmethoxyamino)-[2,3-difluoro-6-(trifluoromethyl)phenyl]methylidene]-2-phenylacetamide"	"Cyflufenamid: sum of cyflufenamid (Z-isomer) and its E-isomer"	"C20H17F5N2O2"	"C1CC1CONC(=NC(=O)CC2=CC=CC=C2)C3=C(C=CC(=C3F)F)C(F)(F)F"	"InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"N'-(cyclopropylmethoxy)-2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C12H11F5N2O"	"N/C(=N\OCC1CC1)c2c(ccc(F)c2F)C(F)(F)F"	"InChI=1/C12H11F5N2O/c13-8-4-3-7(12(15,16)17)9(10(8)14)11(18)19-20-5-6-1-2-6/h3-4,6H,1-2,5H2,(H2,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzenecarboximidamide"	"Not in list"	"C8H5F5N2"	"Fc1c(C(=N)N)c(ccc1F)C(F)(F)F"	"InChI=1/C8H5F5N2/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H3,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-difluoro-6-(trifluoromethyl)benzamide"	""	""	"2,3-difluoro-6-(trifluoromethyl)benzamide"	"Not in list"	"C8H4F5NO"	"Fc1c(C(N)=O)c(ccc1F)C(F)(F)F"	"InChI=1/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	""	""	"3-({(Z)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}amino)-3-oxopropanoic acid"	"Not in list"	"C15H13F5N2O4"	"FC(F)(F)c2ccc(F)c(F)c2C(\NC(=O)CC(=O)O)=N\OCC1CC1"	"InChI=1/C15H13F5N2O4/c16-9-4-3-8(15(18,19)20)12(13(9)17)14(21-10(23)5-11(24)25)22-26-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,24,25)(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	""	""	"N-{(E)-[(cyclopropylmethoxy)imino][2,3-difluoro-6-(trifluoromethyl)phenyl]methyl}-2-phenylacetamide"	"Not in list"	"C20H17F5N2O2"	"FC(F)(F)c3ccc(F)c(F)c3C(/NC(=O)Cc1ccccc1)=N\OCC2CC2"	"InChI=1/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropanecarboxylic acid"	"217-162-5"	"1759-53"	"cyclopropanecarboxylic acid"	"Not in list"	"C4H6O2"	"C1CC1C(=O)O"	"InChI=1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyflufenamid"	""	"180409-60-3"	"single chemical entity"	"Component is a metabolite of the substance"	"cyclopropylmethanol"	"219-735-5"	"2516-33-8"	"cyclopropylmethanol"	"Not in list"	"C4H8O"	"C1CC1CO"	"InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Cyflufenamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance cyflufenamid"	"39962"	"2009"	"doi:10.2903/j.efsa.2009.258r"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"20"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)-2-hexanoic acid"	""	""	"(2E)-5-(4-chlorophenyl)-5-hydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hex-2-enoic acid"	"Not in list"	"C15H16ClN3O3"	"OC(Cn1cncn1)(C(C)/C=C/C(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H16ClN3O3/c1-11(2-7-14(20)21)15(22,8-19-10-17-9-18-19)12-3-5-13(16)6-4-12/h2-7,9-11,22H,8H2,1H3,(H,20,21)/b7-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is identical to the substance"	"Cyproconazole"	""	"94361-06-5"	"2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Cyproconazole"	"C15H18ClN3O"	"ClC1=CC=C(C(CN2C=NC=N2)(C(C)C3CC3)O)C=C1"	"InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Cyproconazole (Addendum to the Draft Report and Proposed Decision)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is identical to the substance"	"Cyprodinil"	""	"121552-61-2"	"4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine"	"Cyprodinil"	"C14H15N3"	"CC1=NC(NC3=CC=CC=C3)=NC(C2CC2)=C1"	"InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyclopropyl-6-methyl-pyrimidine-2-ylamine"	""	"92238-61-4"	"4-cyclopropyl-6-methylpyrimidin-2-amine"	"Not in list"	"C8H11N3"	"CC1=NC(=NC(=C1)C2CC2)N"	"InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4-Cyclopropyl-6-methyl-pyrimidin-2-yl-amino)-phenol"	""	""	"3-[(4-cyclopropyl-6-methylpyrimidin-2-yl)amino]phenol"	"Not in list"	""	"Oc3cc(Nc1nc(C)cc(n1)C2CC2)ccc3"	"InChI=1S/C14H15N3O/c1-9-7-13(10-5-6-10)17-14(15-9)16-11-3-2-4-12(18)8-11/h2-4,7-8,10,18H,5-6H2,1H3,(H,15,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-Amino-6-cyclopropyl-pyrimidin-4-yl)-methanol"	""	""	"(2-amino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C8H11N3O"	"Nc1nc(cc(CO)n1)C2CC2"	"InChI=1/C8H11N3O/c9-8-10-6(4-12)3-7(11-8)5-1-2-5/h3,5,12H,1-2,4H2,(H2,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Cyclopropyl-6-methyl-pyrimidin-2-ol"	""	""	"4-cyclopropyl-6-methylpyrimidin-2-ol"	"Not in list"	"C8H10N2O"	"Cc1cc(nc(O)n1)C2CC2"	"InChI=1/C8H10N2O/c1-5-4-7(6-2-3-6)10-8(11)9-5/h4,6H,2-3H2,1H3,(H,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Cyprodinil"	""	"121552-61-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	""	""	"(2-anilino-6-cyclopropylpyrimidin-4-yl)methanol"	"Not in list"	"C14H15N3O"	"C1CC1C2=CC(=NC(=N2)NC3=CC=CC=C3)CO"	"InChI=1S/C14H15N3O/c18-9-12-8-13(10-6-7-10)17-14(16-12)15-11-4-2-1-3-5-11/h1-5,8,10,18H,6-7,9H2,(H,15,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Cypronidil"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyprodinil"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.51r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"30"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"30"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethomorph"	"404-200-2"	"110488-70-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethomorph"	"404-200-2"	"110488-70-5"	"(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one"	"Dimethomorph (sum of isomers)"	"C21H22ClNO4"	"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC"	"InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+"	"organic"	"representative isomer"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"30"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Germany"	"Dimethomorph"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethomorph"	"38919"	"2006"	"doi:10.2903/j.efsa.2006.82r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)oxalamic acid"	""	""	"[(2,6-dimethylphenyl)(2-methoxyethyl)amino](oxo)acetic acid"	"Not in list"	"C13H17NO4"	"O=C(O)C(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-methoxyethyl) carbamoyl]methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxyethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H18NNaO5S"	"O=S(=O)(O[Na])CC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1/C13H19NO5S.Na/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18;/h4-6H,7-9H2,1-3H3,(H,16,17,18);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,6-dimethylphenylcarbamoyl)-methanesulfonic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C10H12NNaO4S"	"O=C(Nc1c(C)cccc1C)CS(=O)(=O)O[Na]"	"InChI=1/C10H13NO4S.Na/c1-7-4-3-5-8(2)10(7)11-9(12)6-16(13,14)15;/h3-5H,6H2,1-2H3,(H,11,12)(H,13,14,15);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(2,6-dimethylphenyl)-(2-sulfoacetyl)amino]acetic acid sodium salt"	""	""	"sodium 2-[(2,6-dimethylphenyl)(2-methoxy-2-oxoethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C13H16NnaO6S"	"O=S(=O)(O[Na])CC(=O)N(CC(=O)OC)c1c(C)cccc1C"	"InChI=1/C13H17NO6S.Na/c1-9-5-4-6-10(2)13(9)14(7-12(16)20-3)11(15)8-21(17,18)19;/h4-6H,7-8H2,1-3H3,(H,17,18,19);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-[(2,6-dimethyl-phenyl)-(2-hydroxyacetyl)amino]ethylsulfanyl}-2-hydroxypropionic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(hydroxyacetyl)amino]ethyl}sulfanyl)-2-hydroxypropanoic acid"	"Not in list"	"C15H21NO5S"	"O=C(O)C(O)CSCCN(C(=O)CO)c1c(C)cccc1C"	"InChI=1/C15H21NO5S/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(2-hydroxyacetyl)-(2-methoxyethyl)amino]-3-methylbenzoic acid"	""	""	"2-[(hydroxyacetyl)(2-methoxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C13H17NO5"	"OCC(=O)N(CCOC)c1c(C)cccc1C(=O)O"	"InChI=1/C13H17NO5/c1-9-4-3-5-10(13(17)18)12(9)14(6-7-19-2)11(16)8-15/h3-5,15H,6-8H2,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Dimethachlor"	"256-625-6"	"50563-36-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethachlor"	"256-625-6"	"50563-36-5"	"2-chloro-N-(2,6-dimethylphenyl)-N-(2-methoxyethyl)acetamide"	"Dimethachlor"	"C13H18ClNO2"	"ClCC(=O)N(CCOC)c1c(C)cccc1C"	"InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Not reported"	"6"	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Dimethachlor (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimethachlor"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.169r"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Diethofencarb"	"403-870-3"	"87130-20-9"	"single chemical entity"	"Component is identical to the substance"	"Diethofencarb"	"403-870-3"	"87130-20-9"	"isopropyl (3,4-diethoxyphenyl)carbamate"	"Diethofencarb"	"C14H21NO4"	"O=C(OC(C)C)NC1=CC=C(OCC)C(OCC)=C1"	"InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Diethofencarb (Revised additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diethofencarb"	"40441"	"2010"	"doi:10.2903/j.efsa.2010.1721"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is identical to the substance"	"Etofenprox"	"407-980-2"	"80844-07-1"	"1-Ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene"	"Etofenprox"	"C25H28O3"	"CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Etofenprox"	"407-980-2"	"80844-07-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-ethoxyphenyl)-2-methylpropyl 3-phenoxybenzoate"	""	"117252-00-3"	"[2-(4-ethoxyphenyl)-2-methylpropyl] 3-phenoxybenzoate"	"Not in list"	"C25H26O4"	"CCOC1=CC=C(C=C1)C©©COC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3"	"InChI=1S/C25H26O4/c1-4-27-21-15-13-20(14-16-21)25(2,3)18-28-24(26)19-9-8-12-23(17-19)29-22-10-6-5-7-11-22/h5-17H,4,18H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Etofenprox"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance etofenprox"	"39904"	"2009"	"doi:10.2903/j.efsa.2009.213r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is identical to the substance"	"Dimoxystrobin"	""	"149961-52-4"	"(2Z)-2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyimino-N-methylacetamide"	"Dimoxystrobin"	"C19H22N2O3"	"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC"	"InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Dimoxystrobin"	""	"149961-52-4"	"single chemical entity"	"Component is a metabolite of the substance"	"((E)-2-(2-hydroxymethylphenyl)-2-methoxyimino-N-methyl-acetamide)"	""	""	"(2E)-2-[2-(hydroxymethyl)phenyl]-2-(methoxyimino)-N-methylacetamide"	"Not in list"	"C11H14N2O3"	"OCc1ccccc1/C(=N\OC)C(=O)NC"	"InChI=1S/C11H14N2O3/c1-12-11(15)10(13-16-2)9-6-4-3-5-8(9)7-14/h3-6,14H,7H2,1-2H3,(H,12,15)/b13-10+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimoxystrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dimoxystrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.46r"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"single chemical entity"	"Component is identical to the substance"	"Disodium phosphonate"	"237-249-1"	"13708-85-5"	"Disodium phosphonate"	"Not in list"	"H3O3P.2Na"	"[O-]P(=O)=O.[Na+].[Na+]"	"InChI=1S/2Na.HO3P/c;;1-4(2)3/h;;(H,1,2,3)/q2*+1;/p-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"12"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Disodium phosphonate (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance disodium phosphonate."	"41425"	"2013"	"doi:10.2903/j.efsa.2013.3213"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is identical to the substance"	"Bitertanol"	"259-513-5"	"55179-31-2"	"1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Bitertanol"	"C20H23N3O2"	"CC(C)(C)C(O)C(Oc1ccc(cc1)c2ccccc2)n3cncn3"	"InChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Inconclusive"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Bifenthrin"	"617-373-6"	"82657-04-3"	"single chemical entity"	"Component is identical to the substance"	"Bifenthrin"	"617-373-6"	"82657-04-3"	"(2-methylbiphenyl-3-yl)methyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Bifenthrin"	"C23H22ClF3O2"	"O=C(OCC2=CC=CC(C3=CC=CC=C3)=C2C)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Bifenthrin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bifenthrin"	"40682"	"2011"	"doi:10.2903/j.efsa.2011.2159"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	"no information"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	"no information"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	"no information"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: gavage"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	"no information"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	"no information"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"large colonies"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"small colonies"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"large colonies"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"small colonies"	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"large colonies"	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"large colonies"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"small colonies"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"small colonies"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"large colonies"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"large colonies"	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"small colonies"	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-ol"	"216-350-4"	"1563-38-8"	"2,2-dimethyl-3H-1-benzofuran-7-ol"	"Not in list"	"C10H12O2"	"CC1(CC2=C(O1)C(=CC=C2)O)C"	"InChI=1S/C10H12O2/c1-10(2)6-7-4-3-5-8(11)9(7)12-10/h3-5,11H,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"small colonies"	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	""	"16655-82-6"	"(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate"	"Not in list"	"C12H15NO4"	"CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C"	"InChI=1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Diphenylamine"	"204-539-4"	"122-39-4"	"single chemical entity"	"Component is identical to the substance"	"Diphenylamine"	"204-539-4"	"122-39-4"	"N-phenylaniline"	"Diphenylamine"	"C12H11N"	"N(c1ccccc1)c2ccccc2"	"InChI=1/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"oral: unspecified"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Diphenylamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diphenylamine"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2486"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin benzoate"	""	"155569-91-8"	"-"	"Not in list"	"C56H81NO15"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)[NH2+]C)OC)OC)C)C.C1=CC=C(C=C1)C(=O)[O-]"	"InChI=1S/C49H75NO13.C7H6O2/c1-12-26(2)44-29(5)18-19-48(63-44)24-35-21-34(62-48)17-16-28(4)43(27(3)14-13-15-33-25-56-46-42(51)30(6)20-36(47(52)59-35)49(33,46)53)60-40-23-38(55-11)45(32(8)58-40)61-39-22-37(54-10)41(50-9)31(7)57-39;8-7(9)6-4-2-1-3-5-6/h13-16,18-20,26-27,29,31-32,34-46,50-51,53H,12,17,21-25H2,1-11H3;1-5H,(H,8,9)/b14-13+,28-16+,33-15+;/t26-,27-,29-,31-,32-,34+,35-,36-,37-,38-,39-,40-,41-,42+,43-,44+,45-,46+,48+,49+;/m0./s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin benzoate"	""	"155569-91-8"	"-"	"Not in list"	"C56H81NO15"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)[NH2+]C)OC)OC)C)C.C1=CC=C(C=C1)C(=O)[O-]"	"InChI=1S/C49H75NO13.C7H6O2/c1-12-26(2)44-29(5)18-19-48(63-44)24-35-21-34(62-48)17-16-28(4)43(27(3)14-13-15-33-25-56-46-42(51)30(6)20-36(47(52)59-35)49(33,46)53)60-40-23-38(55-11)45(32(8)58-40)61-39-22-37(54-10)41(50-9)31(7)57-39;8-7(9)6-4-2-1-3-5-6/h13-16,18-20,26-27,29,31-32,34-46,50-51,53H,12,17,21-25H2,1-11H3;1-5H,(H,8,9)/b14-13+,28-16+,33-15+;/t26-,27-,29-,31-,32-,34+,35-,36-,37-,38-,39-,40-,41-,42+,43-,44+,45-,46+,48+,49+;/m0./s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin Hydrochloride"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin benzoate"	""	"155569-91-8"	"-"	"Not in list"	"C56H81NO15"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)[NH2+]C)OC)OC)C)C.C1=CC=C(C=C1)C(=O)[O-]"	"InChI=1S/C49H75NO13.C7H6O2/c1-12-26(2)44-29(5)18-19-48(63-44)24-35-21-34(62-48)17-16-28(4)43(27(3)14-13-15-33-25-56-46-42(51)30(6)20-36(47(52)59-35)49(33,46)53)60-40-23-38(55-11)45(32(8)58-40)61-39-22-37(54-10)41(50-9)31(7)57-39;8-7(9)6-4-2-1-3-5-6/h13-16,18-20,26-27,29,31-32,34-46,50-51,53H,12,17,21-25H2,1-11H3;1-5H,(H,8,9)/b14-13+,28-16+,33-15+;/t26-,27-,29-,31-,32-,34+,35-,36-,37-,38-,39-,40-,41-,42+,43-,44+,45-,46+,48+,49+;/m0./s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin benzoate"	""	"155569-91-8"	"-"	"Not in list"	"C56H81NO15"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)[NH2+]C)OC)OC)C)C.C1=CC=C(C=C1)C(=O)[O-]"	"InChI=1S/C49H75NO13.C7H6O2/c1-12-26(2)44-29(5)18-19-48(63-44)24-35-21-34(62-48)17-16-28(4)43(27(3)14-13-15-33-25-56-46-42(51)30(6)20-36(47(52)59-35)49(33,46)53)60-40-23-38(55-11)45(32(8)58-40)61-39-22-37(54-10)41(50-9)31(7)57-39;8-7(9)6-4-2-1-3-5-6/h13-16,18-20,26-27,29,31-32,34-46,50-51,53H,12,17,21-25H2,1-11H3;1-5H,(H,8,9)/b14-13+,28-16+,33-15+;/t26-,27-,29-,31-,32-,34+,35-,36-,37-,38-,39-,40-,41-,42+,43-,44+,45-,46+,48+,49+;/m0./s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Emamectin"	"605-015-1"	"119791-41-2"	"single chemical entity"	"Component is part of a group assessment"	"Emamectin benzoate"	""	"155569-91-8"	"-"	"Not in list"	"C56H81NO15"	"CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)[NH2+]C)OC)OC)C)C.C1=CC=C(C=C1)C(=O)[O-]"	"InChI=1S/C49H75NO13.C7H6O2/c1-12-26(2)44-29(5)18-19-48(63-44)24-35-21-34(62-48)17-16-28(4)43(27(3)14-13-15-33-25-56-46-42(51)30(6)20-36(47(52)59-35)49(33,46)53)60-40-23-38(55-11)45(32(8)58-40)61-39-22-37(54-10)41(50-9)31(7)57-39;8-7(9)6-4-2-1-3-5-6/h13-16,18-20,26-27,29,31-32,34-46,50-51,53H,12,17,21-25H2,1-11H3;1-5H,(H,8,9)/b14-13+,28-16+,33-15+;/t26-,27-,29-,31-,32-,34+,35-,36-,37-,38-,39-,40-,41-,42+,43-,44+,45-,46+,48+,49+;/m0./s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Emamectin"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance emamectin"	"41234"	"2012"	"doi:10.2903/j.efsa.2012.2955"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is identical to the substance"	"Bispyribac-sodium"	""	"125401-92-5"	"Sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C19H17N4NaO8"	"COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]"	"InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxy-4,6-dimethoxypyrimidine"	""	"13223-26-2"	"4,6-dimethoxy-1H-pyrimidin-2-one"	"Not in list"	"C6H8N2O3"	"COC1=CC(=NC(=O)N1)OC"	"InChI=1S/C6H8N2O3/c1-10-4-3-5(11-2)8-6(9)7-4/h3H,1-2H3,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dihydroxy-6-methoxypyrimidine"	""	"29458-38-6"	"6-methoxy-1H-pyrimidine-2,4-dione"	"Not in list"	"C5H6N2O3"	"COC1=CC(=O)NC(=O)N1"	"InChI=1S/C5H6N2O3/c1-10-4-2-3(8)6-5(9)7-4/h2H,1H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxy-5-hydroxypyrimidin-2-yl)oxy-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(5-hydroxy-4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid"	"Not in list"	"C19H18N4O9"	"COc1nc(nc(OC)c1)Oc3cccc(Oc2nc(OC)c(O)c(OC)n2)c3C(=O)O"	"InChI=1/C19H18N4O9/c1-27-11-8-12(28-2)21-18(20-11)31-9-6-5-7-10(13(9)17(25)26)32-19-22-15(29-3)14(24)16(23-19)30-4/h5-8,24H,1-4H3,(H,25,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-hydroxy-6-(4-hydroxy-6-methoxypyrimidin-2-yl)oxybenzoate"	""	""	"sodium 2-hydroxy-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C12H5N2NaO6"	"[Na+].[O-]C(=O)c2c(Oc1nc(O)cc(OC)n1)cccc2O"	"InChI=1/C12H10N2O6.Na/c1-19-9-5-8(16)13-12(14-9)20-7-4-2-3-6(15)10(7)11(17)18;/h2-5,15H,1H3,(H,17,18)(H,13,14,16);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-hydroxybenzoic acid"	""	""	"2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-hydroxybenzoic acid"	"Not in list"	"C13H12N2O3"	"O=C(O)c2c(Oc1nc(cc(OC)n1)OC)cccc2O"	"InChI=1/C13H12N2O6/c1-19-9-6-10(20-2)15-13(14-9)21-8-5-3-4-7(16)11(8)12(17)18/h3-6,16H,1-2H3,(H,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Bispyribac-sodium"	""	"125401-92-5"	"single chemical entity"	"Component is a metabolite of the substance"	"benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-[(4-hydroxy-6-methoxy-2-pyrimidinyl)oxy],sodium salt"	""	""	"sodium 2-[(4,6-dimethoxypyrimidin-2-yl)oxy]-6-[(4-hydroxy-6-methoxypyrimidin-2-yl)oxy]benzoate"	"Not in list"	"C18H15N4NaO8"	"[Na+].Oc1nc(nc(OC)c1)Oc3cccc(Oc2nc(cc(OC)n2)OC)c3C([O-])=O"	"InChI=1/C18H16N4O8.Na/c1-26-12-7-11(23)19-17(20-12)29-9-5-4-6-10(15(9)16(24)25)30-18-21-13(27-2)8-14(22-18)28-3;/h4-8H,1-3H3,(H,24,25)(H,19,20,23);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Bispyribac-Sodium"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bispyribac (unless otherwise stated all data evaluated refer to the variant bispyribac-sodium)"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1692"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6,6’-difluoro-2,2’-dibenzothiazole"	""	""	"6,6'-difluoro-2,2'-bibenzo[d]thiazole"	"Not in list"	"C14H6F2N2S2"	"Fc1ccc2nc(sc2c1)c3nc4ccc(F)cc4s3"	"InChI=1S/C14H6F2N2S2/c15-7-1-3-9-11(5-7)19-13(17-9)14-18-10-4-2-8(16)6-12(10)20-14/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"3"	"Male"	"Not reported"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is identical to the substance"	"Clethodim"	""	"99129-21-2"	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethylsulfanyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim"	"C17H26ClNO3S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)SCC)CC1=O"	"InChI=1S/C17H26ClNO3S/c1-4-14(19-22-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)23-5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"3"	"Male"	"Not reported"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxy-2-(1-iminopropan-1-yl)cyclohex-2-en-1-one"	""	""	"5-[2-(ethylsulfonyl)propyl]-3-hydroxy-2-propanimidoylcyclohex-2-en-1-one"	"Clethodim-Imin-Sulfon"	"C14H23NO4S"	"CCC(=N)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1/C14H23NO4S/c1-4-11(15)14-12(16)7-10(8-13(14)17)6-9(3)20(18,19)5-2/h9-10,15-16H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3,5-dihydroxycyclohex-2-en-1-one"	"Clethodim, 5-Hydroxy-Sulfon"	"C17H26ClNO6S"	"OC1(CC(C)S(=O)(=O)CC)CC(O)=C(C(=O)C1)C(\CC)=N\OC\C=C\Cl"	"InChI=1S/C17H26ClNO6S/c1-4-13(19-25-8-6-7-18)16-14(20)10-17(22,11-15(16)21)9-12(3)26(23,24)5-2/h6-7,12,20,22H,4-5,8-11H2,1-3H3/b7-6+,19-13+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Inconclusive"	"no information"	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Inconclusive"	""	"no evidence"	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(EZ)-1-[(E)-3-chloroallyloxyimino]propyl}-5-[(2RS)-2-(ethylsulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	""	""	"2-[(1E)-N-{[(2E)-3-chloroprop-2-en-1-yl]oxy}propanimidoyl]-5-[2-(ethanesulfonyl)propyl]-3-hydroxycyclohex-2-en-1-one"	"Clethodim-Sulfon"	"C17H26ClNO5S"	"CC/C(=N\OC\C=C\Cl)C1=C(O)CC(CC(C)S(=O)(=O)CC)CC1=O"	"InChI=1S/C17H26ClNO5S/c1-4-14(19-24-8-6-7-18)17-15(20)10-13(11-16(17)21)9-12(3)25(22,23)5-2/h6-7,12-13,20H,4-5,8-11H2,1-3H3/b7-6+,19-14+"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No data"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-ethyl-6-[(2RS)-2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	""	""	"2-ethyl-6-[2-(ethylsulfonyl)propyl]-6,7-dihydro-1,3-benzoxazol-4(5H)-one"	"Not in list"	"C14H21NO4S"	"CCS(=O)(=O)C(C)CC2Cc1oc(nc1C(=O)C2)CC"	"InChI=1/C14H21NO4S/c1-4-13-15-14-11(16)7-10(8-12(14)19-13)6-9(3)20(17,18)5-2/h9-10H,4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is identical to the substance"	"Ethametsulfuron methyl"	""	"97780-06-8"	"methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate"	"Ethametsulfuron-Methyl"	"C15H18N6O6S"	"CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H18N6O6S/c1-4-27-15-19-12(16-2)17-13(20-15)18-14(23)21-28(24,25)10-8-6-5-7-9(10)11(22)26-3/h5-8H,4H2,1-3H3,(H3,16,17,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is identical to the substance"	"Ethametsulfuron methyl"	""	"97780-06-8"	"methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate"	"Ethametsulfuron-Methyl"	"C15H18N6O6S"	"CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H18N6O6S/c1-4-27-15-19-12(16-2)17-13(20-15)18-14(23)21-28(24,25)10-8-6-5-7-9(10)11(22)26-3/h5-8H,4H2,1-3H3,(H3,16,17,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is identical to the substance"	"Ethametsulfuron methyl"	""	"97780-06-8"	"methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate"	"Ethametsulfuron-Methyl"	"C15H18N6O6S"	"CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H18N6O6S/c1-4-27-15-19-12(16-2)17-13(20-15)18-14(23)21-28(24,25)10-8-6-5-7-9(10)11(22)26-3/h5-8H,4H2,1-3H3,(H3,16,17,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is identical to the substance"	"Ethametsulfuron methyl"	""	"97780-06-8"	"methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate"	"Ethametsulfuron-Methyl"	"C15H18N6O6S"	"CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H18N6O6S/c1-4-27-15-19-12(16-2)17-13(20-15)18-14(23)21-28(24,25)10-8-6-5-7-9(10)11(22)26-3/h5-8H,4H2,1-3H3,(H3,16,17,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is identical to the substance"	"Ethametsulfuron methyl"	""	"97780-06-8"	"methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate"	"Ethametsulfuron-Methyl"	"C15H18N6O6S"	"CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H18N6O6S/c1-4-27-15-19-12(16-2)17-13(20-15)18-14(23)21-28(24,25)10-8-6-5-7-9(10)11(22)26-3/h5-8H,4H2,1-3H3,(H3,16,17,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is identical to the substance"	"Ethametsulfuron methyl"	""	"97780-06-8"	"methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate"	"Ethametsulfuron-Methyl"	"C15H18N6O6S"	"CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H18N6O6S/c1-4-27-15-19-12(16-2)17-13(20-15)18-14(23)21-28(24,25)10-8-6-5-7-9(10)11(22)26-3/h5-8H,4H2,1-3H3,(H3,16,17,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is identical to the substance"	"Ethametsulfuron methyl"	""	"97780-06-8"	"methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate"	"Ethametsulfuron-Methyl"	"C15H18N6O6S"	"CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H18N6O6S/c1-4-27-15-19-12(16-2)17-13(20-15)18-14(23)21-28(24,25)10-8-6-5-7-9(10)11(22)26-3/h5-8H,4H2,1-3H3,(H3,16,17,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is identical to the substance"	"Ethametsulfuron methyl"	""	"97780-06-8"	"methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate"	"Ethametsulfuron-Methyl"	"C15H18N6O6S"	"CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H18N6O6S/c1-4-27-15-19-12(16-2)17-13(20-15)18-14(23)21-28(24,25)10-8-6-5-7-9(10)11(22)26-3/h5-8H,4H2,1-3H3,(H3,16,17,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is identical to the substance"	"Ethametsulfuron methyl"	""	"97780-06-8"	"methyl 2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate"	"Ethametsulfuron-Methyl"	"C15H18N6O6S"	"CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H18N6O6S/c1-4-27-15-19-12(16-2)17-13(20-15)18-14(23)21-28(24,25)10-8-6-5-7-9(10)11(22)26-3/h5-8H,4H2,1-3H3,(H3,16,17,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, historical"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	""	""	"1-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]urea"	"Not in list"	"C7H12N6O2"	"CCOc1nc(nc(NC(N)=O)n1)NC"	"InChI=1/C7H12N6O2/c1-3-15-7-12-5(9-2)11-6(13-7)10-4(8)14/h3H2,1-2H3,(H4,8,9,10,11,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, historical"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-N-methyl-1,3,5-triazine-2,4-diamine"	"403-580-7"	"62096-63-3"	"6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H11N5O"	"CCOC1=NC(=NC(=N1)NC)N"	"InChI=1S/C6H11N5O/c1-3-12-6-10-4(7)9-5(8-2)11-6/h3H2,1-2H3,(H3,7,8,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(4-ethoxy-6-methylamino-1,3,5-triazin-2-yl)carbamoylsulfamoyl] benzoic acid"	""	""	"2-({[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoic acid"	"Not in list"	"C14H16N6O6S"	"CCOc2nc(nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2)NC"	"InChI=1/C14H16N6O6S/c1-3-26-14-18-11(15-2)16-12(19-14)17-13(23)20-27(24,25)9-7-5-4-6-8(9)10(21)22/h4-7H,3H2,1-2H3,(H,21,22)(H3,15,16,17,18,19,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	""	""	"methyl 2-({[4-hydroxy-6-(methylamino)-1,3,5-triazin-2-yl]carbamoyl}sulfamoyl)benzoate"	"Not in list"	"C13H14N6O6S"	"CNc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C13H14N6O6S/c1-14-10-15-11(17-12(21)16-10)18-13(22)19-26(23,24)8-6-4-3-5-7(8)9(20)25-2/h3-6H,1-2H3,(H4,14,15,16,17,18,19,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl} benzoic acid"	""	""	"2-{[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoic acid"	"Not in list"	"C13H14N6O6S"	"CCOc2nc(N)nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)O)n2"	"InChI=1/C13H14N6O6S/c1-2-25-13-16-10(14)15-11(18-13)17-12(22)19-26(23,24)8-6-4-3-5-7(8)9(20)21/h3-6H,2H2,1H3,(H,20,21)(H4,14,15,16,17,18,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoylbenzoic acid"	"211-174-4"	"632-24-6"	"2-sulfamoylbenzoic acid"	"Not in list"	"C7H7NO4S"	"C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N"	"InChI=1S/C7H7NO4S/c8-13(11,12)6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl] sulfamoyl}benzoate"	""	""	"methyl 2-{[(4-amino-6-hydroxy-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate"	"Not in list"	"C12H12N6O6S"	"Nc2nc(NC(=O)NS(=O)(=O)c1ccccc1C(=O)OC)nc(O)n2"	"InChI=1/C12H12N6O6S/c1-24-8(19)6-4-2-3-5-7(6)25(22,23)18-12(21)17-10-14-9(13)15-11(20)16-10/h2-5H,1H3,(H5,13,14,15,16,17,18,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 2)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 4)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 4)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"Not reported"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 4)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethametsulfuron methyl"	""	"97780-06-8"	"single chemical entity"	"Component is a metabolite of the substance"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	""	"2827-44-3"	"6-ethoxy-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H9N5O"	"CCOC1=NC(=NC(=N1)N)N"	"InChI=1S/C5H9N5O/c1-2-11-5-9-3(6)8-4(7)10-5/h2H2,1H3,(H4,6,7,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"Not reported"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: The United Kingdom"	"Ethametsulfuron methyl (Addendum 4)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ethametsulfuron (evaluated variant ethametsulfuron-methyl)"	"41841"	"2014"	"doi:10.2903/j.efsa.2014.3787"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"30"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"18"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Ethoprophos"	"236-152-1"	"13194-48-4"	"single chemical entity"	"Component is identical to the substance"	"Ethoprophos"	"236-152-1"	"13194-48-4"	"O-ethyl S,S-dipropyl dithiophosphate"	"Ethoprophos"	"C8H19O2PS2"	"O=P(SCCC)(OCC)SCCC"	"InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"24"	"Male"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Ethoprophos"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethoprophos"	"38835"	"2006"	"doi:10.2903/j.efsa.2006.66r"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"6"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"6"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"6"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male/Female"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Female"	"Not reported"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Female"	"Not reported"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Female"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Dithianon"	"222-098-6"	"3347-22-6"	"single chemical entity"	"Component is identical to the substance"	"Dithianon"	"222-098-6"	"3347-22-6"	"5,10-dioxo-5,10-dihydronaphtho[2,3-b][1,4]dithiine-2,3-dicarbonitrile"	"Dithianon"	"C14H4N2O2S2"	"O=C1C2=C(SC(=C(S2)C#N)C#N)C(=O)c3ccccc13"	"InChI=1/C14H4N2O2S2/c15-5-9-10(6-16)20-14-12(18)8-4-2-1-3-7(8)11(17)13(14)19-9/h1-4H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Female"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Dithianon (Additional Report to DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dithianon"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1904"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1978"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1978"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is identical to the substance"	"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate"	"Chlorthal-dimethyl"	"C10H6Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl"	"InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Positive"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"7"	"Male/Female"	"Not reported"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"7"	"Male/Female"	"Not reported"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,5,6-tetrachloroterephthalic acid"	""	"2136-79-0"	"2,3,5,6-tetrachloroterephthalic acid"	"Not in list"	"C8H2Cl4O4"	"C1(=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl)C(=O)O"	"InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h(H,13,14)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"7"	"Male/Female"	"Not reported"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Greece"	"Chlorthal-dimethyl"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Chlorthal-dimethyl"	"217-464-7"	"1861-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-carbomethoxy-2,3,5,6-tetrachlorobenzoic acid"	""	"887-54-7"	"2,3,5,6-tetrachloro-4-methoxycarbonylbenzoic acid"	"Not in list"	"C9H4Cl4O4"	"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl"	"InChI=1S/C9H4Cl4O4/c1-17-9(16)3-6(12)4(10)2(8(14)15)5(11)7(3)13/h1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Chlorthal-dimethyl (Addendum 1 to annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the focussed peer review of the pesticide risk assessment of the active substance chlorthal-dimethyl"	"40081"	"2009"	"doi:10.2903/j.efsa.2009.202r"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is identical to the substance"	"Benalaxyl-M"	""	"98243-83-5"	"methyl N-(2,6-dimethylphenyl)-N-(phenylacetyl)-D-alaninate"	"Benalaxyl-M"	"C20H23NO3"	"C[C@@H](N(C(=O)Cc1ccccc1)c2c(C)cccc2C)C(=O)OC"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is part of a group assessment"	"Benalaxyl"	"275-728-7"	"71626-11-4"	"Methyl 2-(2,6-dimethyl-N-(2-phenylacetyl)anilino)propanoate"	"Benalaxyl"	"C20H23NO3"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2"	"InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl-M"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is identical to the substance"	"Cyantraniliprole"	""	"736994-63-1"	"3-bromo-1-(3-chloro-2-pyridyl)-4'-cyano-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Not in list"	"C19H14BrClN6O2"	"CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)C#N"	"InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	""	""	"4-({[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]carbonyl}amino)-3-methyl-5-(methylcarbamoyl)benzoic acid"	"Not in list"	"C19H15BrClN5O4"	"O=C(O)c3cc(C)c(NC(=O)c2cc(Br)nn2c1ncccc1Cl)c(c3)C(=O)NC"	"InChI=1/C19H15BrClN5O4/c1-9-6-10(19(29)30)7-11(17(27)22-2)15(9)24-18(28)13-8-14(20)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)(H,29,30)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-8-methyl-4-oxo-1,4-dihydroquinazoline-6-carboxylic acid"	"Not in list"	"C18H11BrClN5O3"	"O=C(O)c1cc2C(=O)N=C(Nc2c(C)c1)c4cc(Br)nn4c3ncccc3Cl"	"InChI=1/C18H11BrClN5O3/c1-8-5-9(18(27)28)6-10-14(8)22-15(23-17(10)26)12-7-13(19)24-25(12)16-11(20)3-2-4-21-16/h2-7H,1H3,(H,27,28)(H,22,23,26)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	""	""	"6-chloro-4-methyl-11-oxo-11H-pyrido[2,1-b]quinazoline-2-carbonitrile"	"Not in list"	"C14H8ClN3O"	"Cc3cc(C#N)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C14H8ClN3O/c1-8-5-9(7-16)6-10-12(8)17-13-11(15)3-2-4-18(13)14(10)19/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA94"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA94"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA94"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-piperidyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(piperidin-1-yl)propan-1-one"	"Not in list"	"C15H21NO3"	"Oc1ccc(cc1OC)C(=O)CCN2CCCCC2"	"InChI=1/C15H21NO3/c1-19-15-11-12(5-6-14(15)18)13(17)7-10-16-8-3-2-4-9-16/h5-6,11,18H,2-4,7-10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-piperidyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(piperidin-1-yl)propan-1-one"	"Not in list"	"C15H21NO3"	"Oc1ccc(cc1OC)C(=O)CCN2CCCCC2"	"InChI=1/C15H21NO3/c1-19-15-11-12(5-6-14(15)18)13(17)7-10-16-8-3-2-4-9-16/h5-6,11,18H,2-4,7-10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1531"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-pyrrolidinyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(pyrrolidin-1-yl)propan-1-one"	"Not in list"	"C14H19NO3"	"O=C(CCN1CCCC1)c2ccc(O)c(OC)c2"	"InChI=1S/C14H19NO3/c1-18-14-10-11(4-5-13(14)17)12(16)6-9-15-7-2-3-8-15/h4-5,10,17H,2-3,6-9H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1964"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1532"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-pyrrolidinyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(pyrrolidin-1-yl)propan-1-one"	"Not in list"	"C14H19NO3"	"O=C(CCN1CCCC1)c2ccc(O)c(OC)c2"	"InChI=1S/C14H19NO3/c1-18-14-10-11(4-5-13(14)17)12(16)6-9-15-7-2-3-8-15/h4-5,10,17H,2-3,6-9H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1531"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1964"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-pyrrolidinyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(pyrrolidin-1-yl)propan-1-one"	"Not in list"	"C14H19NO3"	"O=C(CCN1CCCC1)c2ccc(O)c(OC)c2"	"InChI=1S/C14H19NO3/c1-18-14-10-11(4-5-13(14)17)12(16)6-9-15-7-2-3-8-15/h4-5,10,17H,2-3,6-9H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1532"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-piperidyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(piperidin-1-yl)propan-1-one"	"Not in list"	"C15H21NO3"	"Oc1ccc(cc1OC)C(=O)CCN2CCCCC2"	"InChI=1/C15H21NO3/c1-19-15-11-12(5-6-14(15)18)13(17)7-10-16-8-3-2-4-9-16/h5-6,11,18H,2-4,7-10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1532"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-piperidyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(piperidin-1-yl)propan-1-one"	"Not in list"	"C15H21NO3"	"Oc1ccc(cc1OC)C(=O)CCN2CCCCC2"	"InChI=1/C15H21NO3/c1-19-15-11-12(5-6-14(15)18)13(17)7-10-16-8-3-2-4-9-16/h5-6,11,18H,2-4,7-10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-piperidyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(piperidin-1-yl)propan-1-one"	"Not in list"	"C15H21NO3"	"Oc1ccc(cc1OC)C(=O)CCN2CCCCC2"	"InChI=1/C15H21NO3/c1-19-15-11-12(5-6-14(15)18)13(17)7-10-16-8-3-2-4-9-16/h5-6,11,18H,2-4,7-10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1532"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-piperidyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(piperidin-1-yl)propan-1-one"	"Not in list"	"C15H21NO3"	"Oc1ccc(cc1OC)C(=O)CCN2CCCCC2"	"InChI=1/C15H21NO3/c1-19-15-11-12(5-6-14(15)18)13(17)7-10-16-8-3-2-4-9-16/h5-6,11,18H,2-4,7-10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1964"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-piperidyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(piperidin-1-yl)propan-1-one"	"Not in list"	"C15H21NO3"	"Oc1ccc(cc1OC)C(=O)CCN2CCCCC2"	"InChI=1/C15H21NO3/c1-19-15-11-12(5-6-14(15)18)13(17)7-10-16-8-3-2-4-9-16/h5-6,11,18H,2-4,7-10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1531"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-pyrrolidinyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(pyrrolidin-1-yl)propan-1-one"	"Not in list"	"C14H19NO3"	"O=C(CCN1CCCC1)c2ccc(O)c(OC)c2"	"InChI=1S/C14H19NO3/c1-18-14-10-11(4-5-13(14)17)12(16)6-9-15-7-2-3-8-15/h4-5,10,17H,2-3,6-9H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-pyrrolidinyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(pyrrolidin-1-yl)propan-1-one"	"Not in list"	"C14H19NO3"	"O=C(CCN1CCCC1)c2ccc(O)c(OC)c2"	"InChI=1S/C14H19NO3/c1-18-14-10-11(4-5-13(14)17)12(16)6-9-15-7-2-3-8-15/h4-5,10,17H,2-3,6-9H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1531"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-pyrrolidinyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(pyrrolidin-1-yl)propan-1-one"	"Not in list"	"C14H19NO3"	"O=C(CCN1CCCC1)c2ccc(O)c(OC)c2"	"InChI=1S/C14H19NO3/c1-18-14-10-11(4-5-13(14)17)12(16)6-9-15-7-2-3-8-15/h4-5,10,17H,2-3,6-9H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-piperidyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(piperidin-1-yl)propan-1-one"	"Not in list"	"C15H21NO3"	"Oc1ccc(cc1OC)C(=O)CCN2CCCCC2"	"InChI=1/C15H21NO3/c1-19-15-11-12(5-6-14(15)18)13(17)7-10-16-8-3-2-4-9-16/h5-6,11,18H,2-4,7-10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1964"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-pyrrolidinyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(pyrrolidin-1-yl)propan-1-one"	"Not in list"	"C14H19NO3"	"O=C(CCN1CCCC1)c2ccc(O)c(OC)c2"	"InChI=1S/C14H19NO3/c1-18-14-10-11(4-5-13(14)17)12(16)6-9-15-7-2-3-8-15/h4-5,10,17H,2-3,6-9H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1532"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-pyrrolidinyl-1-(3’-methoxy-4’-hydroxyphenyl)-1-propanone"	""	""	"1-(4-hydroxy-3-methoxyphenyl)-3-(pyrrolidin-1-yl)propan-1-one"	"Not in list"	"C14H19NO3"	"O=C(CCN1CCCC1)c2ccc(O)c(OC)c2"	"InChI=1S/C14H19NO3/c1-18-14-10-11(4-5-13(14)17)12(16)6-9-15-7-2-3-8-15/h4-5,10,17H,2-3,6-9H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1964"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1964"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1531"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1531"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1532"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"leukemia cells (HL-60)"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ddy mouse"	"6"	"Male"	"Not reported"	"18"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ddy mouse"	"6"	"Male"	"Not reported"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	""	"Male"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Positive"	""	"no evidence"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	""	"Male"	"oral: gavage"	""	""	"no data"	"not applicable"	"Positive"	""	"no evidence"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"8"	"Male"	"intraperitoneal"	"30"	"h"	"yes"	"not applicable"	"Positive"	""	"no evidence"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"8"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	"no evidence"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"8"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	"no evidence"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"30"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"2"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"2"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"30"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Female"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"4"	"Male"	"oral: feed"	"58"	"D"	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"4"	"Male"	"oral: feed"	"58"	"D"	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: gavage"	"10"	"D"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No data"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: gavage"	"10"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	""	""	"No data"	"oral: capsule"	"22"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	""	""	"No data"	"oral: capsule"	"22"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	""	""	"No data"	"oral: capsule"	"8"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	""	""	"No data"	"oral: capsule"	"8"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Eugenol"	"202-589-1"	"97-53-0"	"single chemical entity"	"Component is identical to the substance"	"Eugenol"	"202-589-1"	"97-53-0"	"2-Methoxy-4-prop-2-enylphenol"	"Not in list"	"C10H12O2"	"COC1=C(C=CC(=C1)CC=C)O"	"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Eugenol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance eugenol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2914"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is identical to the substance"	"Chlorantraniliprole"	""	"500008-45-7"	"3-Bromo-4'-chloro-1-(3 chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide"	"Chlorantraniliprole (DPX E-2Y45)"	"C18H14BrCl2N5O2"	"CC1=C(C(=CC(=C1)Cl)C(=O)NC)NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br"	"InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1Hpyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-[3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazol-5-yl]-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C18H12BrCl2N5O"	"Cc4cc(Cl)cc3c4N=C(c2cc(Br)nn2c1ncccc1Cl)N(C)C3=O"	"InChI=1/C18H12BrCl2N5O/c1-9-6-10(20)7-11-15(9)23-17(25(2)18(11)27)13-8-14(19)24-26(13)16-12(21)4-3-5-22-16/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	""	""	"2-(3-bromo-1H-pyrazol-5-yl)-6-chloro-3,8-dimethylquinazolin-4(3H)-one"	"Not in list"	"C13H10BrClN4O"	"Brc1cc(nn1)C2=Nc3c(C)cc(Cl)cc3C(=O)N2C"	"InChI=1/C13H10BrClN4O/c1-6-3-7(15)4-8-11(6)16-12(19(2)13(8)20)9-5-10(14)18-17-9/h3-5H,1-2H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	""	""	"2,6-dichloro-4-methyl-11H-pyrido[2,1-b]quinazolin-11-one"	"Not in list"	"C13H8Cl2N2O"	"Cc3cc(Cl)cc2c3N=C1C(Cl)=CC=CN1C2=O"	"InChI=1/C13H8Cl2N2O/c1-7-5-8(14)6-9-11(7)16-12-10(15)3-2-4-17(12)13(9)18/h2-6H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Chlorantraniliprole"	""	"500008-45-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-N-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C5H6BrN3O"	"O=C(NC)c1cc(Br)nn1"	"InChI=1/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Chlorantraniliprole"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorantraniliprole."	"41431"	"2013"	"doi:10.2903/j.efsa.2013.3143"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1978"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1978"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: unspecified"	"96"	"h"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"4"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"4"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"4"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"18"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"42"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"mixture or formulation"	"Component is the active ingredient of the mixture or formulation"	"Carbosulfan formulation (Marshal 25CS)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	"6"	"Male/Female"	"intraperitoneal"	"12"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"mixture or formulation"	"Component is the active ingredient of the mixture or formulation"	"Carbosulfan formulation (Marshal 25CS)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	"6"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"mixture or formulation"	"Component is the active ingredient of the mixture or formulation"	"Carbosulfan formulation (Marshal 25CS)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	"6"	"Male/Female"	"intraperitoneal"	"6"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"12"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male"	"intraperitoneal"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"No data"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male"	"intraperitoneal"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"No data"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"5"	"Male"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"5"	"Male"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"5"	"Male"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"5"	"Male"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	"22"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	"22"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"Not reported"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"Not reported"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbofuran"	"216-353-0"	"1563-66-2"	"single chemical entity"	"Component is identical to the substance"	"Carbofuran"	"216-353-0"	"1563-66-2"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate"	"Carbofuran"	"C12H15NO3"	"CNC(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbofuran (Annex B)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Carbofuran"	"40004"	"2009"	"doi:10.2903/j.efsa.2009.310r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Chloridazon (Final Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Chloridazon (Final Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon (Final Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is identical to the substance"	"Chloridazon"	"216-920-2"	"1698-60-8"	"5-amino-4-chloro-2-phenylpyridazin-3(2H)-one"	"Chloridazon"	"C10H8ClN3O"	"NC1=C(Cl)C(=O)N(N=C1)c2ccccc2"	"InChI=1/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Chloridazon (Final Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-3(2H)-pyridazinone"	""	"6339-19-1"	"4-amino-5-chloro-1H-pyridazin-6-one"	"Not in list"	"C4H4ClN3O"	"C1=NNC(=O)C(=C1N)Cl"	"InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: unspecified"	"20"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chloridazon"	"216-920-2"	"1698-60-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-4-chloro-2-methyl-3(2H)-pyridazinone"	"605-639-4"	"17254-80-7"	"5-amino-4-chloro-2-methylpyridazin-3-one"	"Not in list"	"C5H6ClN3O"	"CN1C(=O)C(=C(C=N1)N)Cl"	"InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: unspecified"	"44"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Chloridazon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chloridazon"	"39307"	"2007"	"doi:10.2903/j.efsa.2007.108r"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is identical to the substance"	"Chromafenozide"	""	"143807-66-3"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Chromafenozide"	"C24H30N2O3"	"CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C"	"InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N‟-tert-butyl-N‟-(5-methyl-6-chromancarbonyl)-5-methyl-6-chroman-carbohydrazide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-4-hydroxy-5-methylchromane-6-carbohydrazide"	"Not in list"	"C24H30N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H30N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)18-7-8-20-21(16(18)3)19(27)9-10-30-20/h7-8,11-13,19,27H,9-10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	""	""	"N'-tert-butyl-N'-[(3,5-dimethylphenyl)carbonyl]-5-methyl-2-oxo-3,4-dihydro-2H-chromene-6-carbohydrazide"	"Not in list"	"C24H28N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c3ccc2OC(=O)CCc2c3C)C(C)(C)C"	"InChI=1/C24H28N2O4/c1-14-11-15(2)13-17(12-14)23(29)26(24(4,5)6)25-22(28)19-7-9-20-18(16(19)3)8-10-21(27)30-20/h7,9,11-13H,8,10H2,1-6H3,(H,25,28)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chromafenozide"	""	"143807-66-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	""	""	"3-({1-tert-butyl-2-[(4-hydroxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)carbonyl]hydrazinyl}carbonyl)-5-methylbenzoic acid"	"Not in list"	"C24H28N2O6"	"O=C(O)c1cc(C)cc(c1)C(=O)N(NC(=O)c3ccc2OCCC(O)c2c3C)C(C)(C)C"	"InChI=1/C24H28N2O6/c1-13-10-15(12-16(11-13)23(30)31)22(29)26(24(3,4)5)25-21(28)17-6-7-19-20(14(17)2)18(27)8-9-32-19/h6-7,10-12,18,27H,8-9H2,1-5H3,(H,25,28)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Chromafenozide"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chromafenozide."	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3461"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Klebsiella pneumoniae (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Citrobacter (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"PQ37"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"PQ37"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"Not reported"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"40"	"Male"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male"	"oral: gavage"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Chlormequat chloride"	"213-666-4"	"999-81-5"	"single chemical entity"	"Component is identical to the substance"	"Chlormequat chloride"	"213-666-4"	"999-81-5"	"2-Chloroethyl(trimethyl)azanium;chloride"	"Chlormequat"	"C5H13Cl2N"	"C[N+](C)(C)CCCl.[Cl-]"	"InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Chlormequat-chloride"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance chlormequat (considered variant chlormequat chloride)"	"39869"	"2009"	"doi:10.2903/j.efsa.2009.179r"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is identical to the substance"	"Cyflumetofen"	""	"400882-07-7"	"2-methoxyethyl 2-(4-tert-butylphenyl)-2-cyano-3-oxo-3-[2-(trifluoromethyl)phenyl]propanoate"	"Cyflumetofen"	"C24H24F3NO4"	"CC(C)(C)C1=CC=C(C=C1)C(C#N)(C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)OCCOC"	"InChI=1S/C24H24F3NO4/c1-22(2,3)16-9-11-17(12-10-16)23(15-28,21(30)32-14-13-31-4)20(29)18-7-5-6-8-19(18)24(25,26)27/h5-12H,13-14H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"large colonies"	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Alpha,alpha,alpha-trifluoro-o-toluic acid"	"207-093-9"	"433-97-6"	"2-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"C1=CC=C(C(=C1)C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Cyflumetofen"	""	"400882-07-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(Trifluoromethyl) benzamide"	"206-637-2"	"360-64-5"	"2-(trifluoromethyl)benzamide"	"Not in list"	"C8H6F3NO"	"C1=CC=C(C(=C1)C(=O)N)C(F)(F)F"	"InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Cyflumetofen (OK-5101)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyflumetofen"	"40931"	"2012"	"doi:10.2903/j.efsa.2012.2504"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"intraperitoneal"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"5"	"Male"	"intraperitoneal"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is identical to the substance"	"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"ethyl 2-chloro-3-[2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]-4-fluorophenyl]propanoate"	"Carfentrazone-ethyl"	"C15H14Cl2F3N3O3"	"CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl"	"InChI=1S/C15H14Cl2F3N3O3/c1-3-26-13(24)10(17)4-8-5-12(11(18)6-9(8)16)23-15(25)22(14(19)20)7(2)21-23/h5-6,10,14H,3-4H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propionic acid"	"603-289-7"	"128621-72-7"	"2-chloro-3-{2-chloro-5-[4-
+(difluoromethyl)-3-methyl-5-oxo-
+1,2,4-triazol-1-yl]-4-
+fluorophenyl}propanoic acid"	"Not in list"	"C13H10Cl2F3N3O3"	"CC1=NN(C(=O)N1C(F)F)C2=C(C=C(C(=C2)CC(C(=O)O)Cl)Cl)F"	"InChI=1S/C13H10Cl2F3N3O3/c1-5-19-21(13(24)20(5)12(17)18)10-3-6(2-8(15)11(22)23)7(14)4-9(10)16/h3-4,8,12H,2H2,1H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	""	"2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3O3"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C13H11ClF3N3O3"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h4-5,12H,2-3H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}-2-sulfopropanoic acid"	"Not in list"	"C13H11ClF3N3O6S"	"O=C(O)C(Cc1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F)S(=O)(=O)O"	"InChI=1/C13H11ClF3N3O6S/c1-5-18-20(13(23)19(5)12(16)17)9-2-6(7(14)4-8(9)15)3-10(11(21)22)27(24,25)26/h2,4,10,12H,3H2,1H3,(H,21,22)(H,24,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"Not reported"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	""	"380885-65-4"	"2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-4-fluorobenzoic acid"	"Not in list"	"C11H7ClF3N3O4"	"C1=C(C(=CC(=C1N2C(=O)N(C(=N2)CO)C(F)F)F)Cl)C(=O)O"	"InChI=1S/C11H7ClF3N3O4/c12-5-2-6(13)7(1-4(5)9(20)21)18-11(22)17(10(14)15)8(3-19)16-18/h1-2,10,19H,3H2,(H,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"Not reported"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-Chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	"97986-18-0"	"2-(4-chloro-2-fluoro-5-methoxyphenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one"	"Not in list"	"C11H9ClF3N3O2"	"CC1=NN(C(=O)N1C(F)F)C2=CC(=C(C=C2F)Cl)OC"	"InChI=1S/C11H9ClF3N3O2/c1-5-16-18(11(19)17(5)10(14)15)8-4-9(20-2)6(12)3-7(8)13/h3-4,10H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(5-Carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	""	""	"1-(5-carboxy-4-chloro-2-fluorophenyl)-4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C11H5ClF3N3O5"	"O=C(O)c1cc(c(F)cc1Cl)N2N=C(N(C2=O)C(F)F)C(=O)O"	"InChI=1/C11H5ClF3N3O5/c12-4-2-5(13)6(1-3(4)8(19)20)18-11(23)17(10(14)15)7(16-18)9(21)22/h1-2,10H,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Carfentrazone ethyl lysimeter percolate"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"20"	"Male/Female"	"Not reported"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"20"	"Male/Female"	"Not reported"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"20"	"Male/Female"	"Not reported"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"12"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"12"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"12"	"Male/Female"	"intraperitoneal"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"6"	"Female"	"oral: feed"	"7"	"D"	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"54"	"Male"	"Not reported"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is identical to the substance"	"Diuron"	"206-354-4"	"330-54-1"	"3-(3,4-dichlorophenyl)-1,1-dimethylurea"	"Diuron"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"54"	"Male"	"Not reported"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Monuron"	"205-766-1"	"150-68-5"	"3-(4-chlorophenyl)-1,1-dimethylurea"	"Monuron"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC=C(C=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Monuron"	"205-766-1"	"150-68-5"	"3-(4-chlorophenyl)-1,1-dimethylurea"	"Monuron"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC=C(C=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Monuron"	"205-766-1"	"150-68-5"	"3-(4-chlorophenyl)-1,1-dimethylurea"	"Monuron"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC=C(C=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Monuron"	"205-766-1"	"150-68-5"	"3-(4-chlorophenyl)-1,1-dimethylurea"	"Monuron"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC=C(C=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Monuron"	"205-766-1"	"150-68-5"	"3-(4-chlorophenyl)-1,1-dimethylurea"	"Monuron"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC=C(C=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Monuron"	"205-766-1"	"150-68-5"	"3-(4-chlorophenyl)-1,1-dimethylurea"	"Monuron"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC=C(C=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Monuron"	"205-766-1"	"150-68-5"	"3-(4-chlorophenyl)-1,1-dimethylurea"	"Monuron"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC=C(C=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"Monuron"	"205-766-1"	"150-68-5"	"3-(4-chlorophenyl)-1,1-dimethylurea"	"Monuron"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC=C(C=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-chlorophenyl)-1,1-dimethyl urea"	""	"587-34-8"	"3-(3-chlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC(=CC=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-4-7(10)6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-chlorophenyl)-1,1-dimethyl urea"	""	"587-34-8"	"3-(3-chlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC(=CC=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-4-7(10)6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-chlorophenyl)-1,1-dimethyl urea"	""	"587-34-8"	"3-(3-chlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC(=CC=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-4-7(10)6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-chlorophenyl)-1,1-dimethyl urea"	""	"587-34-8"	"3-(3-chlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC(=CC=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-4-7(10)6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-chlorophenyl)-1,1-dimethyl urea"	""	"587-34-8"	"3-(3-chlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC(=CC=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-4-7(10)6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-chlorophenyl)-1,1-dimethyl urea"	""	"587-34-8"	"3-(3-chlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC(=CC=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-4-7(10)6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-chlorophenyl)-1,1-dimethyl urea"	""	"587-34-8"	"3-(3-chlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC(=CC=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-4-7(10)6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-chlorophenyl)-1,1-dimethyl urea"	""	"587-34-8"	"3-(3-chlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H11ClN2O"	"CN(C)C(=O)NC1=CC(=CC=C1)Cl"	"InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-4-7(10)6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(3,5-dichlorophenyl)-1,1-dimethyl urea"	""	"10290-38-7"	"3-(3,5-dichlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-8-4-6(10)3-7(11)5-8/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(3,5-dichlorophenyl)-1,1-dimethyl urea"	""	"10290-38-7"	"3-(3,5-dichlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-8-4-6(10)3-7(11)5-8/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(3,5-dichlorophenyl)-1,1-dimethyl urea"	""	"10290-38-7"	"3-(3,5-dichlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-8-4-6(10)3-7(11)5-8/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(3,5-dichlorophenyl)-1,1-dimethyl urea"	""	"10290-38-7"	"3-(3,5-dichlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-8-4-6(10)3-7(11)5-8/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(3,5-dichlorophenyl)-1,1-dimethyl urea"	""	"10290-38-7"	"3-(3,5-dichlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-8-4-6(10)3-7(11)5-8/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(3,5-dichlorophenyl)-1,1-dimethyl urea"	""	"10290-38-7"	"3-(3,5-dichlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-8-4-6(10)3-7(11)5-8/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(3,5-dichlorophenyl)-1,1-dimethyl urea"	""	"10290-38-7"	"3-(3,5-dichlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-8-4-6(10)3-7(11)5-8/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Diuron"	"206-354-4"	"330-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(3,5-dichlorophenyl)-1,1-dimethyl urea"	""	"10290-38-7"	"3-(3,5-dichlorophenyl)-1,1-dimethylurea"	"Not in list"	"C9H10Cl2N2O"	"CN(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl"	"InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-8-4-6(10)3-7(11)5-8/h3-5H,1-2H3,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Diuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Diuron"	"38380"	"2005"	"doi:10.2903/j.efsa.2005.25r"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is identical to the substance"	"Cycloxydim"	""	"101205-02-1"	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Cycloxydim"	"C17H27NO3S"	"CCC/C(=N\OCC)C=1C(=O)CC(CC=1O)C2CCCSC2"	"InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethoxyimino)butyl]-3,5-dihydroxy-5-(3-thianyl)-2-cycloexene-1-one S-oxide"	""	""	"3-{4-[(1E)-N-ethoxybutanimidoyl]-1,3-dihydroxy-5-oxocyclohex-3-en-1-yl}-14-thian-1-one"	"Not in list"	"C17H27NO5S"	"O=S1CCCC(C1)C2(O)CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO5S/c1-3-6-13(18-23-4-2)16-14(19)9-17(21,10-15(16)20)12-7-5-8-24(22)11-12/h12,19,21H,3-11H2,1-2H3/b18-13+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[1-(ethylimino)butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-2-cyclohexen-1-one S-oxide"	""	""	"2-[(1E)-N-ethoxybutanimidoyl]-3-hydroxy-5-(1-oxidotetrahydro-2H-thiopyran-3-yl)cyclohex-2-en-1-one"	"Not in list"	"C17H27NO4S"	"O=S1CCCC(C1)C2CC(=O)C(C(\CCC)=N\OCC)=C(O)C2"	"InChI=1/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM881"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM881"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoic acid"	""	""	"2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoic acid"	"Not in list"	"C11H14O6S"	"CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C(=O)O"	"InChI=1/C11H14O6S/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16/h4-6,12H,1-3H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoate"	""	""	"sodium 2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoate"	"Not in list"	"C11H13NaO6S"	"[Na+].CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C([O-])=O"	"InChI=1/C11H14O6S.Na/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16;/h4-6,12H,1-3H3,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoate"	""	""	"sodium 2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoate"	"Not in list"	"C11H13NaO6S"	"[Na+].CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C([O-])=O"	"InChI=1/C11H14O6S.Na/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16;/h4-6,12H,1-3H3,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoate"	""	""	"sodium 2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoate"	"Not in list"	"C11H13NaO6S"	"[Na+].CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C([O-])=O"	"InChI=1/C11H14O6S.Na/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16;/h4-6,12H,1-3H3,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium 2-{2-hydroxy-5-[(methylsulfonyl)methyl]phenyl}-2-methylpropanoate"	""	""	"sodium 2-{2-hydroxy-5-[(methylsulfonyl)oxy]phenyl}-2-methylpropanoate"	"Not in list"	"C11H13NaO6S"	"[Na+].CC(C)(c1cc(ccc1O)OS(C)(=O)=O)C([O-])=O"	"InChI=1/C11H14O6S.Na/c1-11(2,10(13)14)8-6-7(4-5-9(8)12)17-18(3,15)16;/h4-6,12H,1-3H3,(H,13,14);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"spleen cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"spleen cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"no"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"no"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"no"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"Not reported"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"Not reported"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is identical to the substance"	"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate"	"Chlorpyrifos"	"C9H11Cl3NO3PS"	"S=P(OC1=NC(=C(C=C1Cl)Cl)Cl)(OCC)OCC"	"InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"Not reported"	"18"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Chlorpyrifos"	"220-864-4"	"2921-88-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Chlorpyrifos"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance chlorpyrifos"	"40574"	"2011"	"doi:10.2903/j.efsa.2011.1961"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1978"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM571"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM611"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"GY5027"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"GY4015"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"GY5027"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"GY4015"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-benzimidazol-2-yl"	""	"22769-68-2"	"methyl N-(6-hydroxy-1H-benzimidazol-2-yl)carbamate"	"Not in list"	"C9H9N3O3"	"COC(=O)NC1=NC2=C(N1)C=C(C=C2)O"	"InChI=1S/C9H9N3O3/c1-15-9(14)12-8-10-6-3-2-5(13)4-7(6)11-8/h2-4,13H,1H3,(H2,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-benzimidazol-2-yl"	""	"22769-68-2"	"methyl N-(6-hydroxy-1H-benzimidazol-2-yl)carbamate"	"Not in list"	"C9H9N3O3"	"COC(=O)NC1=NC2=C(N1)C=C(C=C2)O"	"InChI=1S/C9H9N3O3/c1-15-9(14)12-8-10-6-3-2-5(13)4-7(6)11-8/h2-4,13H,1H3,(H2,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-benzimidazol-2-yl"	""	"22769-68-2"	"methyl N-(6-hydroxy-1H-benzimidazol-2-yl)carbamate"	"Not in list"	"C9H9N3O3"	"COC(=O)NC1=NC2=C(N1)C=C(C=C2)O"	"InChI=1S/C9H9N3O3/c1-15-9(14)12-8-10-6-3-2-5(13)4-7(6)11-8/h2-4,13H,1H3,(H2,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-benzimidazol-2-yl"	""	"22769-68-2"	"methyl N-(6-hydroxy-1H-benzimidazol-2-yl)carbamate"	"Not in list"	"C9H9N3O3"	"COC(=O)NC1=NC2=C(N1)C=C(C=C2)O"	"InChI=1S/C9H9N3O3/c1-15-9(14)12-8-10-6-3-2-5(13)4-7(6)11-8/h2-4,13H,1H3,(H2,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-benzimidazol-2-yl"	""	"22769-68-2"	"methyl N-(6-hydroxy-1H-benzimidazol-2-yl)carbamate"	"Not in list"	"C9H9N3O3"	"COC(=O)NC1=NC2=C(N1)C=C(C=C2)O"	"InChI=1S/C9H9N3O3/c1-15-9(14)12-8-10-6-3-2-5(13)4-7(6)11-8/h2-4,13H,1H3,(H2,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-benzimidazol-2-yl"	""	"22769-68-2"	"methyl N-(6-hydroxy-1H-benzimidazol-2-yl)carbamate"	"Not in list"	"C9H9N3O3"	"COC(=O)NC1=NC2=C(N1)C=C(C=C2)O"	"InChI=1S/C9H9N3O3/c1-15-9(14)12-8-10-6-3-2-5(13)4-7(6)11-8/h2-4,13H,1H3,(H2,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-benzimidazol-2-yl"	""	"22769-68-2"	"methyl N-(6-hydroxy-1H-benzimidazol-2-yl)carbamate"	"Not in list"	"C9H9N3O3"	"COC(=O)NC1=NC2=C(N1)C=C(C=C2)O"	"InChI=1S/C9H9N3O3/c1-15-9(14)12-8-10-6-3-2-5(13)4-7(6)11-8/h2-4,13H,1H3,(H2,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"5-hydroxy-benzimidazol-2-yl"	""	"22769-68-2"	"methyl N-(6-hydroxy-1H-benzimidazol-2-yl)carbamate"	"Not in list"	"C9H9N3O3"	"COC(=O)NC1=NC2=C(N1)C=C(C=C2)O"	"InChI=1S/C9H9N3O3/c1-15-9(14)12-8-10-6-3-2-5(13)4-7(6)11-8/h2-4,13H,1H3,(H2,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male/Female"	"oral: feed"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Oregon-R"	""	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mouse spot test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"Female"	"Not reported"	""	""	"yes"	"not applicable"	"Inconclusive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"8"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"8"	"Male/Female"	"oral: unspecified"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"8"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"4"	"No data"	"oral: unspecified"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"4"	"No data"	"oral: unspecified"	"30"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"ICR"	""	"No data"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"ICR"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: unspecified"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: unspecified"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"20"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"20"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"22"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: feed"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Thiophanate-methyl"	"245-740-7"	"23564-05-8"	"methyl N-[[2-(methoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate"	"Thiophanate-methyl"	"C12H14N4O4S2"	"COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC"	"InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Thiophanate-methyl"	"245-740-7"	"23564-05-8"	"methyl N-[[2-(methoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate"	"Thiophanate-methyl"	"C12H14N4O4S2"	"COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC"	"InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"Male"	"oral: gavage"	"22"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	""	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"3"	"Male"	"oral: gavage"	"25"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-tert-butylphenyl)ethanol"	""	"34386-42-0"	"1-(4-tert-butylphenyl)ethanol"	"Not in list"	"C12H18O"	"CC(C1=CC=C(C=C1)C(C)(C)C)O"	"InChI=1S/C12H18O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-9,13H,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Greece"	"Fenazaquin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is a metabolite of the substance"	"quinazolin-4-ol"	"207-735-8"	"491-36-1"	"1H-quinazolin-4-one"	"Not in list"	"C8H6N2O"	"C1=CC=C2C(=C1)C(=O)N=CN2"	"InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fenazaquin (Addendum to DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Fenazaquin"	""	"120928-09-8"	"single chemical entity"	"Component is identical to the substance"	"Fenazaquin"	""	"120928-09-8"	"4-[2-(4-tert-butylphenyl)ethoxy]quinazoline"	"Fenazaquin"	"C20H22N2O"	"CC(C)(C)C3=CC=C(C=C3)CCOC1=NC=NC2=C1C=CC=C2"	"InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Greece"	"Fenazaquin (Additional report to volume 3)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenazaquin"	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3166"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is part of a group assessment"	"Geranyl acetate"	"203-341-5"	"105-87-3"	"[(2E)-3,7-dimethylocta-2,6-dienyl] acetate"	"Not in list"	"C12H20O2"	"CC(=CCCC(=CCOC(=O)C)C)C"	"InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Geraniol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Carbaryl"	"200-555-0"	"63-25-2"	"single chemical entity"	"Component is identical to the substance"	"Carbaryl"	"200-555-0"	"63-25-2"	"1-naphthyl methylcarbamate"	"Carbaryl"	"C12H11NO2"	"CNC(=O)Oc1cccc2ccccc12"	"InChI=1/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Carbaryl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance carbaryl"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.80r"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Fenpyroximate"	""	"134098-61-6"	"single chemical entity"	"Component is identical to the substance"	"Fenpyroximate"	""	"134098-61-6"	"Tert-butyl 4-[[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate"	"Fenpyroximate"	"C24H27N3O4"	"CC1=NN(C(=C1/C=N/OCC2=CC=C(C=C2)C(=O)OC(C)(C)C)OC3=CC=CC=C3)C"	"InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Fenpyroximate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyroximate"	"41621"	"2013"	"doi:10.2903/j.efsa.2013.3493"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	"no information"	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Inconclusive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"8"	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"8"	"No data"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"8"	"No data"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"3"	"Male"	"oral: unspecified"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"Male"	"intraperitoneal"	"4"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Male"	"intraperitoneal"	"6"	"h"	"yes"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"Male"	"intraperitoneal"	"4"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male"	"oral: gavage"	"42"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male"	"oral: gavage"	"66"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male"	"oral: gavage"	"18"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	"200"	"Male"	"oral: feed"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"Hep G2 human cell line"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"Hep G2 human cell line"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	"small colonies"	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"inhalation: unspecified"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"inhalation: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"inhalation: unspecified"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"inhalation: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"inhalation: unspecified"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"other"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"inhalation: unspecified"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"Male/Female"	"intraperitoneal"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"Male/Female"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"Male/Female"	"intraperitoneal"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"4"	"Male/Female"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Wistar"	"24"	"Male"	"inhalation: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"inhalation: unspecified"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 pKM 101 E. coli"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 pKM 101 E. coli"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazifop-P-butyl"	""	"79241-46-6"	"Butyl (2R)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Fluazifop-P-butyl"	"C19H20F3NO4"	"CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F"	"InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Fluazifop-P"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fluazifop-P (Addendum to the Additional Report of Volume 3 B6 – B7)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Fluazifop-P-butyl"	""	"79241-46-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fluazifop-P (Addendum to the Additional Report of Volume 3 B6 – B7)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluazifop-P (evaluated variant fluazifop-P-butyl)"	"41221"	"2012"	"doi:10.2903/j.efsa.2012.2945"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"LT2 S. typhimurium"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Aspergillus nidulans (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Ambiguous"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Ambiguous"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Ambiguous"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Ambiguous"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 472 (Genetic Toxicology: Escherichia coli, Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"XV 185-14C S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"XV 185-14C S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CHY832 E. coli"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CHY832 E. coli"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Aspergillus nidulans (as organism)"	"Strain P Aspergillus nidulans"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Aspergillus nidulans (as organism)"	"Strain P Aspergillus nidulans"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Aspergillus nidulans (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain T2 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain T1 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain T1 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain T2 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"58-161 E.coli"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"GY4015"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"GY5027"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain T2 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain T1 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain T2 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain T1 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain JD1 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain JD1 S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"3T3"	""	""	"Not reported"	""	""	"no data"	"without"	"Ambiguous"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"kidney cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"kidney cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"kidney cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"kidney cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Female"	"oral: feed"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"ICR"	""	"Male"	"oral: feed"	"49"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"Male"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Hungary"	"Amitrole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Amitrole"	"200-521-5"	"61-82-5"	"single chemical entity"	"Component is identical to the substance"	"Amitrole"	"200-521-5"	"61-82-5"	"1-H-1,2,4-triazol-3-amine"	"Amitrole"	"C2H4N4"	"C1=NNC(=N1)N"	"InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Amitrole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance amitrole"	"41821"	"2014"	"doi:10.2903/j.efsa.2014.3742"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Tif:RAIf(SPF) Rat"	"4"	"Male"	"oral: gavage"	"3"	"D"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Tif:RAIf(SPF) Rat"	"5"	"Male"	"oral: gavage"	"3"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Tif:RAIf(SPF) Rat"	"4"	"Male"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Tif:RAIf(SPF) Rat"	"4"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is identical to the substance"	"Fludioxonil"	""	"131341-86-1"	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile"	"Fludioxonil"	"C12H6F2N2O2"	"FC3(F)OC(C(O3)=CC=C2)=C2C1=CNC=C1C#N"	"InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"30"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2,2-difluoro-benzo[1,3]dioxol-4-carbocyclic acid"	""	""	"2,2-difluoro-1,3-benzodioxole-4-carboxylic acid"	"Not in list"	"C8H4F2O4"	"O=C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile"	"Not in list"	"C12H4F2N2O4"	"N#CC=3C(=O)NC(=O)C=3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H4F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2-hydroxy-acetamide"	""	""	"2-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-hydroxyacetamide"	"Not in list"	"C9H7F2NO4"	"NC(=O)C(O)c1cccc2OC(F)(F)Oc12"	"InChI=1/C9H7F2NO4/c10-9(11)15-5-3-1-2-4(7(5)16-9)6(13)8(12)14/h1-3,6,13H,(H2,12,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-2,5-dioxo-pyrrolidine-3-carbonitrile"	""	""	"4-(2,2-difluoro-1,3-benzodioxol-4-yl)-2,5-dioxopyrrolidine-3-carbonitrile"	"Not in list"	"C12H6F2N2O4"	"O=C3NC(=O)C(C#N)C3c1cccc2OC(F)(F)Oc12"	"InChI=1/C12H6F2N2O4/c13-12(14)19-7-3-1-2-5(9(7)20-12)8-6(4-15)10(17)16-11(8)18/h1-3,6,8H,(H,16,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	"no information"	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"Fludioxonil"	""	"131341-86-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-carbamoyl-2-cyano-3-(2,2-difluoro-benzo[1,3]dioxol-4-yl)-oxirane-2-carbocyclic acid"	""	""	"3-carbamoyl-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)oxirane-2-carboxylic acid"	"Not in list"	"C12H6F2N2O6"	"O=C(O)C3(C#N)OC3(c1cccc2OC(F)(F)Oc12)C(N)=O"	"InChI=1/C12H6F2N2O6/c13-12(14)20-6-3-1-2-5(7(6)21-12)11(8(16)17)10(4-15,22-11)9(18)19/h1-3H,(H2,16,17)(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Fludioxonil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fludioxonil"	"39311"	"2007"	"doi:10.2903/j.efsa.2007.110r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3076"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3052"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3052"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3076"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3052"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3076"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3076"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3052"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3076"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3052"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3076"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"C3052"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"other"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	"no information"	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is part of a group assessment"	"2-Phenylphenol sodium salt"	"205-055-6"	"132-27-4"	"2-Phenylphenol sodium salt"	"Not in list"	"C12H9NaO"	"C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]"	"InChI=1S/C12H10O.Na/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;/h1-9,13H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM571"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP100"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"Thymus cell"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"Thymus cell"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"Thymus cell"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"leukemia cells (HL-60)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"leukemia cells (HL-60)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"leukemia cells (HL-60)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"leukemia cells (HL-60)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"leukemia cells (HL-60)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"leukemia cells (HL-60)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"leukemia cells (HL-60)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"leukemia cells (HL-60)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is part of a group assessment"	"2-Phenylphenol sodium salt"	"205-055-6"	"132-27-4"	"2-Phenylphenol sodium salt"	"Not in list"	"C12H9NaO"	"C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]"	"InChI=1S/C12H10O.Na/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;/h1-9,13H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"6"	"No data"	"oral: feed"	"13"	"week"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"Thymus cell"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"Thymus cell"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"Thymus cell"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"Thymus cell"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"Hep G2 human cell line"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"No data"	"oral: feed"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: gavage"	"8"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: gavage"	"8"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"No data"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"2"	"Male"	"other"	"10"	"min"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"2"	"Male"	"other"	"10"	"min"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"2"	"Male"	"other"	"10"	"min"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"2"	"Male/Female"	"other"	"10"	"min"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"2"	"Male/Female"	"other"	"10"	"min"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"2"	"Male/Female"	"other"	"10"	"min"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"oral: gavage"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is part of a group assessment"	"2-Phenylphenol sodium salt"	"205-055-6"	"132-27-4"	"2-Phenylphenol sodium salt"	"Not in list"	"C12H9NaO"	"C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]"	"InChI=1S/C12H10O.Na/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;/h1-9,13H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"oral: gavage"	"16"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is part of a group assessment"	"2-Phenylphenol sodium salt"	"205-055-6"	"132-27-4"	"2-Phenylphenol sodium salt"	"Not in list"	"C12H9NaO"	"C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]"	"InChI=1S/C12H10O.Na/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;/h1-9,13H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"oral: gavage"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is part of a group assessment"	"2-Phenylphenol sodium salt"	"205-055-6"	"132-27-4"	"2-Phenylphenol sodium salt"	"Not in list"	"C12H9NaO"	"C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]"	"InChI=1S/C12H10O.Na/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;/h1-9,13H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"oral: gavage"	"16"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"oral: gavage"	"16"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"4"	"Male"	"oral: gavage"	"16"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	""	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	""	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	""	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Fischer344"	""	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C3H"	"15"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is identical to the substance"	"2-Phenylphenol"	"201-993-5"	"90-43-7"	"2-Phenylphenol"	"2-phenylphenol"	"C12H10O"	"C1=CC=C(C=C1)C2=CC=CC=C2O"	"InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Sodium aluminium sulphate"	"233-277-3"	"10102-71-3"	"aluminum;sodium;disulfate"	"Aluminium ammonium sulphate"	"AlNaO8S2"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+].[Al+3]"	"InChI=1S/Al.Na.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+3;+1;;/p-4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Sodium aluminium sulphate"	"233-277-3"	"10102-71-3"	"aluminum;sodium;disulfate"	"Aluminium ammonium sulphate"	"AlNaO8S2"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+].[Al+3]"	"InChI=1S/Al.Na.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+3;+1;;/p-4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Sodium aluminium sulphate"	"233-277-3"	"10102-71-3"	"aluminum;sodium;disulfate"	"Aluminium ammonium sulphate"	"AlNaO8S2"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+].[Al+3]"	"InChI=1S/Al.Na.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+3;+1;;/p-4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Sodium aluminium sulphate"	"233-277-3"	"10102-71-3"	"aluminum;sodium;disulfate"	"Aluminium ammonium sulphate"	"AlNaO8S2"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+].[Al+3]"	"InChI=1S/Al.Na.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+3;+1;;/p-4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium chloride"	"231-208-1"	"7446-70-0"	"trichloroalumane"	"Not in list"	"AlCl3"	"[Al](Cl)(Cl)Cl"	"InChI=1S/Al.3ClH/h;3*1H/q+3;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium oxide"	"618-619-5"	"1344-28-1"	"dialuminum;oxygen(2-)"	"Not in list"	"Al2O3"	"[O-2].[O-2].[O-2].[Al+3].[Al+3]"	"InChI=1S/2Al.3O/q2*+3;3*-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium oxide"	"618-619-5"	"1344-28-1"	"dialuminum;oxygen(2-)"	"Not in list"	"Al2O3"	"[O-2].[O-2].[O-2].[Al+3].[Al+3]"	"InChI=1S/2Al.3O/q2*+3;3*-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium chloride"	"231-208-1"	"7446-70-0"	"trichloroalumane"	"Not in list"	"AlCl3"	"[Al](Cl)(Cl)Cl"	"InChI=1S/Al.3ClH/h;3*1H/q+3;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium chloride"	"231-208-1"	"7446-70-0"	"trichloroalumane"	"Not in list"	"AlCl3"	"[Al](Cl)(Cl)Cl"	"InChI=1S/Al.3ClH/h;3*1H/q+3;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium chloride"	"231-208-1"	"7446-70-0"	"trichloroalumane"	"Not in list"	"AlCl3"	"[Al](Cl)(Cl)Cl"	"InChI=1S/Al.3ClH/h;3*1H/q+3;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium oxide"	"618-619-5"	"1344-28-1"	"dialuminum;oxygen(2-)"	"Not in list"	"Al2O3"	"[O-2].[O-2].[O-2].[Al+3].[Al+3]"	"InChI=1S/2Al.3O/q2*+3;3*-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium oxide"	"618-619-5"	"1344-28-1"	"dialuminum;oxygen(2-)"	"Not in list"	"Al2O3"	"[O-2].[O-2].[O-2].[Al+3].[Al+3]"	"InChI=1S/2Al.3O/q2*+3;3*-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	""	"10"	"Male/Female"	"Not reported"	""	""	"yes"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	"10"	"Male/Female"	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	"10"	"Male/Female"	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"2"	"No data"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"No data"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium potassium sulphate"	"233-141-3"	"10043-67-1"	"aluminum;potassium;disulfate"	"Aluminium potassium sulphate"	"AlKO8S2"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[K+]"	"InChI=1S/Al.K.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+3;+1;;/p-4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is identical to the substance"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium potassium sulphate"	"233-141-3"	"10043-67-1"	"aluminum;potassium;disulfate"	"Aluminium potassium sulphate"	"AlKO8S2"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[K+]"	"InChI=1S/Al.K.2H2O4S/c;;2*1-5(2,3)4/h;;2*(H2,1,2,3,4)/q+3;+1;;/p-4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminum"	"231-072-3"	"7429-90-5"	"Aluminum"	"Aluminum (Al)"	"Al"	"[Al]"	"InChI=1S/Al"	"metal"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Human (as organism)"	"astrocytes cell"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminum"	"231-072-3"	"7429-90-5"	"Aluminum"	"Aluminum (Al)"	"Al"	"[Al]"	"InChI=1S/Al"	"metal"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminum"	"231-072-3"	"7429-90-5"	"Aluminum"	"Aluminum (Al)"	"Al"	"[Al]"	"InChI=1S/Al"	"metal"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"astrocytes cell"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Aluminium sulphate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium sulfate"	"40487"	"2010"	"doi:10.2903/j.efsa.2010.1889"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Gibberellins"	"201-001-0"	"77-06-5"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Gibberellins"	"201-001-0"	"77-06-5"	"2,7-dihydroxy-1-methyl-8-methylidene-13-oxo-1,2,4b,5,6,7,8,9,10,10a-decahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid"	"Not in list"	"C19H22O6"	"CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O"	"InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10?,11-,12+,13+,16?,17-,18-,19+/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Gibberellins - GA4/GA7"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance gibberellins (GA4, GA7)1 (approved as giberelline)"	"40918"	"2012"	"doi:10.2903/j.efsa.2012.2502"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper oxychloride"	""	""	"copper;chloro hypochlorite"	"Not in list"	"Cl2CuO+2"	"O(Cl)Cl.[Cu+2]"	"InChI=1S/Cl2O.Cu/c1-3-2;/q;+2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Bordeaux mixture"	""	"1333-22-8"	"tetracopper;hexahydroxide;sulfate"	"Not in list"	"Cu4H6O10S"	"[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/4Cu.H2O4S.6H2O/c;;;;1-5(2,3)4;;;;;;/h;;;;(H2,1,2,3,4);6*1H2/q4*+2;;;;;;;/p-8"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper (I) oxide"	"215-270-7"	"1317-39-1"	"Copper;hydrate"	"Not in list"	"Cu2H2O"	"O.[Cu].[Cu]"	"InChI=1S/2Cu.H2O/h;;1H2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper (I) oxide"	"215-270-7"	"1317-39-1"	"Copper;hydrate"	"Not in list"	"Cu2H2O"	"O.[Cu].[Cu]"	"InChI=1S/2Cu.H2O/h;;1H2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper (I) oxide"	"215-270-7"	"1317-39-1"	"Copper;hydrate"	"Not in list"	"Cu2H2O"	"O.[Cu].[Cu]"	"InChI=1S/2Cu.H2O/h;;1H2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper (I) oxide"	"215-270-7"	"1317-39-1"	"Copper;hydrate"	"Not in list"	"Cu2H2O"	"O.[Cu].[Cu]"	"InChI=1S/2Cu.H2O/h;;1H2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Oxine copper"	"233-841-9"	"10380-28-6"	"copper;quinolin-8-olate"	"Not in list"	"C18H12CuN2O2"	"C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]"	"InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper chloride"	"231-210-2"	"7447-39-4"	"dichlorocopper"	"Not in list"	"Cl2Cu"	"Cl[Cu]Cl"	"InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper nitrate"	"221-838-5"	"3251-23-8"	"copper;dinitrate"	"Not in list"	"CuN2O6"	"[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]"	"InChI=1S/Cu.2NO3/c;2*2-1(3)4/q+2;2*-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper nitrate"	"221-838-5"	"3251-23-8"	"copper;dinitrate"	"Not in list"	"CuN2O6"	"[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]"	"InChI=1S/Cu.2NO3/c;2*2-1(3)4/q+2;2*-1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"6"	"h"	"no data"	"not applicable"	"Positive"	""	"no evidence"	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"subcutaneous"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"Male"	"intraperitoneal"	"6"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"Male"	"intraperitoneal"	"12"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Copper II sulphate pentahydrate"	"616-477-9"	"7758-99-8"	"copper;sulfate;pentahydrate"	"Not in list"	"CuSO4.5H2O"	"O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]"	"InChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CBA"	"6"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Copper"	"231-159-6"	"7440-50-8"	"single chemical entity"	"Component is part of a group assessment"	"Tribasic copper sulfate"	"215-582-3"	"1333-22-8"	"Tricopper;dihydroxide;disulfate"	"Tribasic copper sulfate"	"Cu3H2O10S2"	"[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]"	"InChI=1S/3Cu.2H2O4S.2H2O/c;;;2*1-5(2,3)4;;/h;;;2*(H2,1,2,3,4);2*1H2/q3*+2;;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CBA"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Copper"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Copper (I), copper (II) variants namely copper hydroxide, copper oxychloride, tribasic copper sulfate, copper (I) oxide, Bordeaux mixture."	"39743"	"2008"	"doi:10.2903/j.efsa.2008.187r"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"24"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"24"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is identical to the substance"	"Flufenoxuron"	"417-680-3"	"101463-69-8"	"N-({4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}carbamoyl)-2,6-difluorobenzamide"	"Flufenoxuron"	"C21H11ClF6N2O3"	"O=C(NC(NC2=C(F)C=C(OC3=C(Cl)C=C(C(F)(F)F)C=C3)C=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	""	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl urea"	""	""	"1-{4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl}urea"	"Not in list"	"C14H9ClF4N2O2"	"Clc2cc(ccc2Oc1ccc(NC(N)=O)c(F)c1)C(F)(F)F"	"InChI=1/C14H9ClF4N2O2/c15-9-5-7(14(17,18)19)1-4-12(9)23-8-2-3-11(10(16)6-8)21-13(20)22/h1-6H,(H3,20,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: unspecified"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Flufenoxuron"	"417-680-3"	"101463-69-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-[2-Chloro-4-(trifluoromethyl)phenoxy-2-fluorobenzenamine"	""	""	"4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluoroaniline"	"Not in list"	"C13H8ClF4NO"	"Clc2cc(ccc2Oc1ccc(N)c(F)c1)C(F)(F)F"	"InChI=1/C13H8ClF4NO/c14-9-5-7(13(16,17)18)1-4-12(9)20-8-2-3-11(19)10(15)6-8/h1-6H,19H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: unspecified"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flufenoxuron"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flufenoxuron"	"40616"	"2011"	"doi:10.2903/j.efsa.2011.2088"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is identical to the substance"	"Fluometuron"	"218-500-4"	"2164-17-2"	"1,1-dimethyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron"	"C10H11F3N2O"	"CN(C)C(=O)Nc1cccc(c1)C(F)(F)F"	"InChI=1/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Positive"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Fluometuron"	"218-500-4"	"2164-17-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Desmethyl-fluometuron"	""	"3032-40-4"	"1-methyl-3-[3-(trifluoromethyl)phenyl]urea"	"Fluometuron metabolite (CGA 41686)"	"C9H9F3N2O"	"CNC(=O)NC1=CC=CC(=C1)C(F)(F)F"	"InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Fluometuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluometuron"	"40556"	"2011"	"doi:10.2903/j.efsa.2011.1958"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain JD1 S. cerevisiae"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"kidney cells"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain JD1 S. cerevisiae"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain JD1 S. cerevisiae"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain JD1 S. cerevisiae"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"6"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is part of a group assessment"	"Alpha-Cypermethrin"	"614-054-3"	"67375-30-8"	"[(R)-cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"12"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"6"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"6"	"Male/Female"	"oral: unspecified"	"8"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"12"	"Male"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male/Female"	"oral: gavage"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"No data"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"No data"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"No data"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"dermal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"dermal"	"14"	"D"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Cypermethrin"	"257-842-9"	"52315-07-8"	"[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"According to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Cypermethrin"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is part of a group assessment"	"Desmethyl dichlorvos"	""	""	"methyl hydrogen phosphate"	"Not in list"	"CH4O4P"	"[O-]P(=O)(O)OC"	"InChI=1/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	"no information"	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	""	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Rat (as animal)"	""	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"24"	"Male/Female"	"inhalation: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"24"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"24"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"24"	"Male/Female"	"inhalation: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"24"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"24"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"24"	"Male/Female"	"inhalation: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"24"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"24"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"24"	"Male/Female"	"inhalation: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"20"	"Male"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"dermal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"dermal"	"1"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"dermal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"dermal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"dermal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"dermal"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"3"	"Male"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"3"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"10"	"Male/Female"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"10"	"Male/Female"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"2"	"No data"	"oral: unspecified"	"5"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"9"	"No data"	"subcutaneous"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"intraperitoneal"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"intraperitoneal"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"intraperitoneal"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"intraperitoneal"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"4"	"Male"	"intraperitoneal"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"intraperitoneal"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"intraperitoneal"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"2"	"Male"	"intraperitoneal"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"4"	"Male"	"intraperitoneal"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"12"	"Male"	"dermal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"12"	"Male"	"dermal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"20"	"Male"	"inhalation: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"20"	"Male"	"inhalation: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"20"	"Male"	"inhalation: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"20"	"Male"	"inhalation: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"20"	"Male"	"inhalation: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"20"	"Male"	"inhalation: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"20"	"Male"	"inhalation: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"20"	"Male"	"inhalation: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male"	"intraperitoneal"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"intraperitoneal"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraveneous"	"96"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraveneous"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraveneous"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraveneous"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Oregon-R"	""	"Male"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Oregon-R"	""	"Male"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"Yes"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Oregon-R"	""	"Male"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Female"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Oregon-R"	"200"	"Male/Female"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"4"	"No data"	"inhalation: unspecified"	"5"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Female"	"inhalation: unspecified"	"8"	"week"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Female"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	""	"Male"	"inhalation: unspecified"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"24"	"Male/Female"	"inhalation: unspecified"	"2"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"4"	"Female"	"oral: unspecified"	"8"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"8"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"8"	"Male"	"inhalation: unspecified"	"2"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"12"	"Male"	"inhalation: unspecified"	"2"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"8"	"Male"	"inhalation: unspecified"	"2"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"8"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"12"	"Male"	"inhalation: unspecified"	"2"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"8"	"Male"	"inhalation: unspecified"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"12"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"9"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraperitoneal"	"36"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"40"	"Male"	"oral: drinking water"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"92"	"Male"	"intraperitoneal"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"40"	"Male"	"oral: drinking water"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"8"	"Male"	"oral: drinking water"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"8"	"Male"	"oral: drinking water"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"20"	"Male"	"oral: drinking water"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"3"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"4"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"4"	"Male"	"intraperitoneal"	"17"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"8"	"Male"	"intraperitoneal"	"17"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"4"	"Male"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"Male"	"oral: unspecified"	"20"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Syrian"	"6"	"Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Dichlorvos"	"200-547-7"	"62-73-7"	"single chemical entity"	"Component is identical to the substance"	"Dichlorvos"	"200-547-7"	"62-73-7"	"2,2-dichlorovinyl dimethyl phosphate"	"Dichlorvos"	"C4H7Cl2O4P"	"COP(=O)(OC)OC=C(Cl)Cl"	"InChI=1/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	""	"20"	"Male"	"intraperitoneal"	""	""	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Dichlorvos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance dichlorvos"	"38887"	"2006"	"doi:10.2903/j.efsa.2006.77r"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is identical to the substance"	"Difenoconazole"	"601-613-1"	"119446-68-3"	"1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole"	"Difenoconazole"	"C19H17Cl2N3O3"	"CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl"	"InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-benzoic acid"	""	""	"2-chloro-4-(4-chlorophenoxy)benzoic acid"	"Difenoconazole-benzoic acid"	"C13H8Cl2O3"	"OC(=O)c1ccc(cc1Cl)Oc2ccc(Cl)cc2"	"InChI=1S/C13H8Cl2O3/c14-8-1-3-9(4-2-8)18-10-5-6-11(13(16)17)12(15)7-10/h1-7H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-ketone"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanone"	"Not in list"	"C16H11Cl2N3O2"	"O=C(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H11Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Difenoconazole-alcohol"	""	""	"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Not in list"	"C16H13Cl2N3O2"	"OC(Cn1cncn1)c3ccc(Oc2ccc(Cl)cc2)cc3Cl"	"InChI=1S/C16H13Cl2N3O2/c17-11-1-3-12(4-2-11)23-13-5-6-14(15(18)7-13)16(22)8-21-10-19-9-20-21/h1-7,9-10,16,22H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"No data"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	"no evidence"	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"intraperitoneal"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"intraperitoneal"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"O-desmethyldimethoate"	""	""	"S-methyl S-[2-(methylamino)-2-oxoethyl] hydrogen phosphorodithioate"	"Not in list"	"C4H10NO3PS2"	"O=P(O)(SC)SCC(=O)NC"	"InChI=1/C4H10NO3PS2/c1-5-4(6)3-11-9(7,8)10-2/h3H2,1-2H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CFLP"	"10"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CFLP"	"10"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CFLP"	"10"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"O-desmethyldimethoate"	""	""	"S-methyl S-[2-(methylamino)-2-oxoethyl] hydrogen phosphorodithioate"	"Not in list"	"C4H10NO3PS2"	"O=P(O)(SC)SCC(=O)NC"	"InChI=1/C4H10NO3PS2/c1-5-4(6)3-11-9(7,8)10-2/h3H2,1-2H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CFLP"	"10"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	"48"	"h"	"no"	"not applicable"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	"72"	"h"	"no"	"not applicable"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	"24"	"h"	"no"	"not applicable"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Syrian"	"4"	"Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: gavage"	"4"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: gavage"	"12"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is identical to the substance"	"Dimethoate"	"200-480-3"	"60-51-5"	"O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] dithiophosphate"	"Dimethoate"	"C5H12NO3PS2"	"CNC(=O)CSP(=S)(OC)OC"	"InChI=1/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"25"	"Male"	"oral: drinking water"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mouse spot test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Female"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Dimethoate"	"200-480-3"	"60-51-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Omethoate"	"214-197-8"	"1113-02-6"	"2-Dimethoxyphosphorylsulfanyl-N-methylacetamide"	"Omethoate"	"C5H12NO4PS"	"CNC(=O)CSP(=O)(OC)OC"	"InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Dimethoate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance dimethoate"	"41465"	"2013"	"doi:10.2903/j.efsa.2013.3233"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is identical to the substance"	"Teflubenzuron"	""	"83121-18-0"	"N-[(3,5-dichloro-2,4-difluorophenyl)carbamoyl]-2,6-difluorobenzamide"	"Teflubenzuron"	"C14H6Cl2F4N2O2"	"O=C(NC(NC2=C(F)C(Cl)=C(F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluoroaniline"	"617-438-9"	"83121-15-7"	"3,5-dichloro-2,4-difluoroaniline"	"Not in list"	"C6H3Cl2F2N"	"C1=C(C(=C(C(=C1Cl)F)Cl)F)N"	"InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Teflubenzuron"	""	"83121-18-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5-dichloro-2,4-difluorophenylurea"	""	""	"1-(3,5-dichloro-2,4-difluorophenyl)urea"	"Not in list"	"C7H4Cl2F2N2O"	"Clc1cc(NC(N)=O)c(F)c(Cl)c1F"	"InChI=1/C7H4Cl2F2N2O/c8-2-1-3(13-7(12)14)6(11)4(9)5(2)10/h1H,(H3,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Teflubenzuron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance teflubenzuron"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.184r"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"No guideline available"	"Not reported"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"No guideline available"	"Not reported"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is identical to the substance"	"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"ammonium (2RS)-2-amino-4-(methylphosphinato)butyric acid"	"Glufosinate-ammonium"	"C5H12NO4P.H3N"	"CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]"	"InChI=1S/C5H12NO4P.H3N/c1-11(9,10)3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10);1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-acetyl-glufosinate"	""	"73634-73-8"	"2-acetamido-4-[hydroxy(methyl)phosphoryl]butanoic acid"	"Not in list"	"C7H14NO5P"	"CC(=O)NC(CCP(=O)(C)O)C(=O)O"	"InChI=1S/C7H14NO5P/c1-5(9)8-6(7(10)11)3-4-14(2,12)13/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-metylphosphinico-propionic acid"	""	""	"3-[hydroxy(methyl)phosphoryl]propanoic acid"	"Not in list"	"C4H9O4P"	"O=C(O)CCP(C)(=O)O"	"InChI=1/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Glufosinate-ammonium"	"278-636-5"	"77182-82-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-methylphosphinico-acetic acid"	""	""	"[hydroxy(methyl)phosphoryl]acetic acid"	"Not in list"	"C3H7O4P"	"O=C(O)CP(C)(=O)O"	"InChI=1/C3H7O4P/c1-8(6,7)2-3(4)5/h2H2,1H3,(H,4,5)(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden"	"Glufosinate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance glufosinate"	"40998"	"2012"	"doi:10.2903/j.efsa.2012.2609"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is identical to the substance"	"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"methyl 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylate"	"Halosulfuron methyl"	"C13H15ClN6O7S"	"CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C13H15ClN6O7S/c1-20-10(8(9(14)18-20)11(21)27-4)28(23,24)19-13(22)17-12-15-6(25-2)5-7(16-12)26-3/h5H,1-4H3,(H2,15,16,17,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	""	""	"3-chloro-1-methyl-5-sulfamoyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H6ClN3O4S"	"OC(=O)c1c(n(C)nc1Cl)S(N)(=O)=O"	"InChI=1/C5H6ClN3O4S/c1-9-4(14(7,12)13)2(5(10)11)3(6)8-9/h1H3,(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Halosulfuron-methyl"	"600-130-3"	"100784-20-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)amino]-1-methyl-1H-pyrazole-4-carboxylate"	""	""	"3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-1-methyl-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C12H13lN4O4"	"OC(=O)c2c(Cc1nc(OC)cc(OC)n1)n(C)nc2Cl"	"InChI=1/C12H13ClN4O4/c1-17-6(10(12(18)19)11(13)16-17)4-7-14-8(20-2)5-9(15-7)21-3/h5H,4H2,1-3H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Halosulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance halosulfuron (evaluated variant halosulfuron-methyl)"	"41249"	"2012"	"doi:10.2903/j.efsa.2012.2987"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tetraconazole"	"407-760-6"	"112281-77-3"	"1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,
+4-triazole"	"Tetraconazole"	"C13H11Cl2F4N3O"	"C1=CC(=C(C=C1Cl)Cl)C(CN2C=NC=N2)COC(C(F)F)(F)F"	"InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,4-Dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	""	""	"2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Not in list"	"C11H9Cl2N3O2"	"OC(=O)C(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1S/C11H9Cl2N3O2/c12-7-1-2-8(10(13)3-7)9(11(17)18)4-16-6-14-5-15-16/h1-3,5-6,9H,4H2,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	""	""	"[2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propoxy](difluoro)acetic acid"	"Not in list"	"C13H11Cl2F2N3O3"	"O=C(O)C(F)(F)OCC(Cn1cncn1)c2ccc(Cl)cc2Cl"	"InChI=1/C13H11Cl2F2N3O3/c14-9-1-2-10(11(15)3-9)8(4-20-7-18-6-19-20)5-23-13(16,17)12(21)22/h1-3,6-8H,4-5H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is identical to the substance"	"Fluopicolide"	""	"239110-15-7"	"2,6-dichloro-N-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]benzamide"	"Fluopicolide"	"C14H8Cl3F3N2O"	"C1=CC(=C(C(=C1)Cl)C(=O)NCC2=C(C=C(C=N2)C(F)(F)F)Cl)Cl"	"InChI=1S/C14H8Cl3F3N2O/c15-8-2-1-3-9(16)12(8)13(23)22-6-11-10(17)4-7(5-21-11)14(18,19)20/h1-5H,6H2,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-Dichlorobenzamide"	"217-918-4"	"2008-58-4"	"2,6-dichlorobenzamide"	"Not in list"	"C7H5Cl2NO"	"C1=CC(=C(C(=C1)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Chloro-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(O)=O)C(F)(F)F"	"InChI=1S/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dichloro-3-hydroxybenzamide"	""	"22818-74-2"	"2,6-dichloro-3-hydroxybenzamide"	"Not in list"	"C7H5Cl2NO2"	"C1=CC(=C(C(=C1O)Cl)C(=O)N)Cl"	"InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(11)6(9)5(3)7(10)12/h1-2,11H,(H2,10,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Methylsulfinyl-5-trifluoromethylpyridine-2-carboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)pyridine-2-carboxylic acid"	"Not in list"	"C8H6F3NO3S"	"OC(=O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Sulfo-5-trifluoromethyl pyridine-2-carboxylic acid"	""	""	"2-sulfo-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O5S"	"OS(=O)(=O)c1cc(ccc1C(=O)O)C(F)(F)F"	"InChI=1S/C8H5F3O5S/c9-8(10,11)4-1-2-5(7(12)13)6(3-4)17(14,15)16/h1-3H,(H,12,13)(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"intraperitoneal"	"24"	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"Not reported"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Fluopicolide"	""	"239110-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	""	""	"3-(methylsulfonyl)-5-(trifluoromethyl)pyridin-2-ol"	"Not in list"	"C7H6F3NO3S"	"O=S(C)(=O)c1cc(cnc1O)C(F)(F)F"	"InChI=1/C7H6F3NO3S/c1-15(13,14)5-2-4(7(8,9)10)3-11-6(5)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"Not reported"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluopicolide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fluopicolide"	"40003"	"2009"	"doi:10.2903/j.efsa.2009.299r"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is identical to the substance"	"Tembotrione"	"608-879-8"	"335104-84-2"	"2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione"	"Tembotrione"	"C17H16ClF3O6S"	"CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F"	"InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	""	""	"2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]benzoic acid"	"Not in list"	"C11H10ClF3O5S"	"OC(=O)c1ccc(c(COCC(F)(F)F)c1Cl)S(C)(=O)=O"	"InChI=1/C11H10ClF3O5S/c1-21(18,19)8-3-2-6(10(16)17)9(12)7(8)4-20-5-11(13,14)15/h2-3H,4-5H2,1H3,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{2-Chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy) methyl]benzoyl}-4,6-dihydroxycyclohexane-1,3-dione"	""	""	"2-({2-chloro-4-(methylsulfonyl)-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)-4,6-dihydroxycyclohexane-1,3-dione"	"Tembotrione metabolite M5 (Dihydroxy-tembotrione)"	"C17H16ClF3O8S"	"O=C1C(C(=O)C(O)CC1O)C(=O)c2ccc(c(COCC(F)(F)F)c2Cl)S(C)(=O)=O"	"InChI=1/C17H16ClF3O8S/c1-30(27,28)11-3-2-7(13(18)8(11)5-29-6-17(19,20)21)14(24)12-15(25)9(22)4-10(23)16(12)26/h2-3,9-10,12,22-23H,4-6H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	""	""	"2-chloro-3-(hydroxymethyl)-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C9H9ClO5S"	"OC(=O)c1ccc(c(CO)c1Cl)S(C)(=O)=O"	"InChI=1/C9H9ClO5S/c1-16(14,15)7-3-2-5(9(12)13)8(10)6(7)4-11/h2-3,11H,4H2,1H3,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Tembotrione"	"608-879-8"	"335104-84-2"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(Methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	""	""	"6-(methylsulfonyl)-5-[(2,2,2-trifluoroethoxy)methyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione"	"Not in list"	"C17H15F3O6S"	"CS(=O)(=O)c2ccc1C(=O)C=3C(=O)CCCC=3Oc1c2COCC(F)(F)F"	"InChI=1/C17H15F3O6S/c1-27(23,24)13-6-5-9-15(22)14-11(21)3-2-4-12(14)26-16(9)10(13)7-25-8-17(18,19)20/h5-6H,2-4,7-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Austria"	"Tembotrione"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tembotrione"	"41348"	"2013"	"doi:10.2903/j.efsa.2013.3131"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is identical to the substance"	"Fluxapyroxad"	""	"907204-31-3"	"3-(Difluoromethyl)-1-methyl-N-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide"	"Fluxapyroxad"	"C18H12F5N3O"	"CN1C=C(C(=N1)C(F)F)C(=O)NC2=CC=CC=C2C3=CC(=C(C(=C3)F)F)F"	"InChI=1S/C18H12F5N3O/c1-26-8-11(16(25-26)17(22)23)18(27)24-14-5-3-2-4-10(14)9-6-12(19)15(21)13(20)7-9/h2-8,17H,1H3,(H,24,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Fluxapyroxad"	""	"907204-31-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-(b-Dglucopyranosyloxy)-N-(3',4',5'-trifluorobiphenyl-2-yl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C23H20F5N3O7"	"Fc1cc(cc(F)c1F)c4ccccc4NC(=O)c2cn(nc2C(F)F)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O"	"InChI=1S/C23H20F5N3O7/c24-12-5-9(6-13(25)16(12)26)10-3-1-2-4-14(10)29-22(36)11-7-31(30-17(11)21(27)28)38-23-20(35)19(34)18(33)15(8-32)37-23/h1-7,15,18-21,23,32-35H,8H2,(H,29,36)/t15-,18-,19+,20-,23+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: unspecified"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"BAS 700 F (Fluxapyroxad)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluxapyroxad (BAS 700 F)"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2522"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"48"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"48"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"48"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2-carboxylic acid"	""	"59337-97-2"	"3-sulfamoylthiophene-2-carboxylic acid"	"Not in list"	"C5H5NO4S2"	"C1=CSC(=C1S(=O)(=O)N)C(=O)O"	"InChI=1S/C5H5NO4S2/c6-12(9,10)3-1-2-11-4(3)5(7)8/h1-2H,(H,7,8)(H2,6,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"616-675-5"	"79277-67-1"	"3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid"	"Not in list"	"C11H11N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)O"	"InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)urea"	""	""	"1-(4-acetyl-6-methyl-1,3,5-triazin-2-yl)urea"	"Not in list"	"C7H9N5O2"	"O=C(N)Nc1nc(C)nc(n1)C(C)=O"	"InChI=1/C7H9N5O2/c1-3(13)5-9-4(2)10-7(11-5)12-6(8)14/h1-2H3,(H3,8,9,10,11,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"28"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"thieno[2,3-d][1,2]thiazol-3(2H)-one 1,1-dioxide"	""	""	"thieno[2,3-d]isothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C5H3NO3S2"	"O=S2(=O)NC(=O)c1sccc12"	"InChI=1/C5H3NO3S2/c7-5-4-3(1-2-10-4)11(8,9)6-5/h1-2H,(H,6,7)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"28"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	""	""	"3-{[(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid"	"Not in list"	"C10H9N5O6S2"	"OC(=O)c1sccc1S(=O)(=O)NC(=O)Nc2nc(C)nc(O)n2"	"InChI=1/C10H9N5O6S2/c1-4-11-8(13-9(18)12-4)14-10(19)15-23(20,21)5-2-3-22-6(5)7(16)17/h2-3H,1H3,(H,16,17)(H3,11,12,13,14,15,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"House mouse (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"5"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"5"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is identical to the substance"	"Thiamethoxam"	"428-650-4"	"153719-23-4"	"(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,
+5-oxadiazinan-4-ylidene]nitramide"	"Thiamethoxam"	"C8H10ClN5O3S"	"CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl"	"InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"5"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Clothianidin"	"433-460-1"	"210880-92-5"	"1-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-methyl-3-nitroguanidine"	"Clothianidin"	"C6H8ClN5O2S"	"CN=C(NCC1=CN=C(S1)Cl)N[N+](=O)[O-]"	"InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2-chlorothiazol-5-ylmethyl)-5-methyl-[1,3,5]oxadiazinan-4-ylideneamin"	""	""	"3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-imine"	"Not in list"	"C8H11ClN4OS"	"Clc2ncc(CN1COCN(C)C1=N)s2"	"InChI=1/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam"	"2001"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: gavage"	"2"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Thiamethoxam"	"428-650-4"	"153719-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"NOA 459602"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: gavage"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Thiamethoxam (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance thiamethoxam"	"41290"	"2013"	"doi:10.2903/j.efsa.2013.3067"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mouse spot test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	""	"subcutaneous"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	""	"subcutaneous"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-aminobenzimidazole"	"213-280-6"	"934-32-7"	"1H-benzimidazol-2-amine"	"Not in list"	"C7H7N3"	"C1=CC=C2C(=C1)NC(=N2)N"	"InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-aminobenzimidazole"	"213-280-6"	"934-32-7"	"1H-benzimidazol-2-amine"	"Not in list"	"C7H7N3"	"C1=CC=C2C(=C1)NC(=N2)N"	"InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-aminobenzimidazole"	"213-280-6"	"934-32-7"	"1H-benzimidazol-2-amine"	"Not in list"	"C7H7N3"	"C1=CC=C2C(=C1)NC(=N2)N"	"InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-aminobenzimidazole"	"213-280-6"	"934-32-7"	"1H-benzimidazol-2-amine"	"Not in list"	"C7H7N3"	"C1=CC=C2C(=C1)NC(=N2)N"	"InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-aminobenzimidazole"	"213-280-6"	"934-32-7"	"1H-benzimidazol-2-amine"	"Not in list"	"C7H7N3"	"C1=CC=C2C(=C1)NC(=N2)N"	"InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-aminobenzimidazole"	"213-280-6"	"934-32-7"	"1H-benzimidazol-2-amine"	"Not in list"	"C7H7N3"	"C1=CC=C2C(=C1)NC(=N2)N"	"InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-aminobenzimidazole"	"213-280-6"	"934-32-7"	"1H-benzimidazol-2-amine"	"Not in list"	"C7H7N3"	"C1=CC=C2C(=C1)NC(=N2)N"	"InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-aminobenzimidazole"	"213-280-6"	"934-32-7"	"1H-benzimidazol-2-amine"	"Not in list"	"C7H7N3"	"C1=CC=C2C(=C1)NC(=N2)N"	"InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3-phenazine-diamine"	"211-512-0"	"655-86-7"	"phenazine-2,3-diamine"	"Not in list"	"C12H10N4"	"C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N"	"InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"single chemical entity"	"Component is identical to the substance"	"1,4-Dimethylnaphthalene"	"209-335-9"	"571-58-4"	"1,4-dimethylnaphthalene"	"Not in list"	"C12H12"	"Cc1ccc(C)c2ccccc12"	"InChI=1/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"1,4-Dimethylnaphthalene (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 1,4-dimethylnaphthalene."	"41565"	"2013"	"doi:10.2903/j.efsa.2013.3229"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Inconclusive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Inconclusive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"8"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"8"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"8"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mouse spot test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Female"	"oral: feed"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"Rat (as animal)"	""	""	"Male"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male"	"intraperitoneal"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"3"	"Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Folpet"	"205-087-0"	"133-07-3"	"single chemical entity"	"Component is identical to the substance"	"Folpet"	"205-088-6"	"133-07-3"	"2-(Trichloromethylsulfanyl)isoindole-1,3-dione"	"Folpet"	"C9H4Cl3NO2S"	"C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl"	"InChI=1S/C9H4Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-4H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Female"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Folpet (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance folpet"	"40056"	"2009"	"doi:10.2903/j.efsa.2009.297r"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is identical to the substance"	"Florasulam"	"604-488-1"	"145701-23-1"	"N-(2,6-difluorophenyl)-8-fluoro-5-methoxy-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Florasulam"	"C12H8F3N5O3S"	"COC1=NC=C(C2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3F)F)F"	"InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Florasulam"	"1999"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-difluorophenyl)-8-fluoro-5-oxo-5,6-dihydro[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-difluorophenyl)-8-fluoro-5-hydroxy[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide"	"Not in list"	"C11H6F3N5O3S"	"Fc3cccc(F)c3NS(=O)(=O)c1nc2c(F)cnc(O)n2n1"	"InChI=1/C11H6F3N5O3S/c12-5-2-1-3-6(13)8(5)18-23(21,22)10-16-9-7(14)4-15-11(20)19(9)17-10/h1-4,18H,(H,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoyl-1H-1,2,4-triazole-5-carboxylic acid"	""	"313963-93-8"	"5-sulfamoyl-1H-1,2,4-triazole-3-carboxylic acid"	"Not in list"	"C3H4N4O4S"	"C1(=NNC(=N1)S(=O)(=O)N)C(=O)O"	"InChI=1S/C3H4N4O4S/c4-12(10,11)3-5-1(2(8)9)6-7-3/h(H,8,9)(H2,4,10,11)(H,5,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"Florasulam"	"604-488-1"	"145701-23-1"	"single chemical entity"	"Component is a metabolite of the substance"	"1H-1,2,4-triazole-3-sulfonamide"	""	"89517-96-4"	"1H-1,2,4-triazole-5-sulfonamide"	"Not in list"	"C2H4N4O2S"	"C1=NNC(=N1)S(=O)(=O)N"	"InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Poland"	"Florasulam (RAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance florasulam"	"42017"	"2015"	"doi:10.2903/j.efsa.2015.3984"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	"no information"	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylbenzoquinone"	""	"363-03-1"	"2-phenylcyclohexa-2,5-diene-1,4-dione"	"Not in list"	"C12H8O2"	"C1=CC=C(C=C1)C2=CC(=O)C=CC2=O"	"InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"2-Phenylphenol"	"201-993-5"	"90-43-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phenylhydroquinone"	""	"1079-21-6"	"2-phenylbenzene-1,4-diol"	"Not in list"	"C12H10O2"	"C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O"	"InChI=1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Spain"	"Ortho-phenylphenol"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2-phenylphenol"	"39878"	"2009"	"doi:10.2903/j.efsa.2009.217r"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium chloride"	"231-208-1"	"7446-70-0"	"trichloroalumane"	"Not in list"	"AlCl3"	"[Al](Cl)(Cl)Cl"	"InChI=1S/Al.3ClH/h;3*1H/q+3;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium chloride"	"231-208-1"	"7446-70-0"	"trichloroalumane"	"Not in list"	"AlCl3"	"[Al](Cl)(Cl)Cl"	"InChI=1S/Al.3ClH/h;3*1H/q+3;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium oxide"	"618-619-5"	"1344-28-1"	"dialuminum;oxygen(2-)"	"Not in list"	"Al2O3"	"[O-2].[O-2].[O-2].[Al+3].[Al+3]"	"InChI=1S/2Al.3O/q2*+3;3*-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium oxide"	"618-619-5"	"1344-28-1"	"dialuminum;oxygen(2-)"	"Not in list"	"Al2O3"	"[O-2].[O-2].[O-2].[Al+3].[Al+3]"	"InChI=1S/2Al.3O/q2*+3;3*-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium sulphate"	"233-135-0"	"10043-01-3"	"Dialuminum trisulfate"	"Aluminium sulphate"	"Al2O12S3"	"[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]"	"InChI=1S/2Al.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Aluminium ammonium sulphate dodecahydrate"	"232-055-3"	"7784-26-1"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Aluminium chloride"	"231-208-1"	"7446-70-0"	"trichloroalumane"	"Not in list"	"AlCl3"	"[Al](Cl)(Cl)Cl"	"InChI=1S/Al.3ClH/h;3*1H/q+3;;;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Portugal"	"Aluminium ammonium sulphate (Final Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance aluminium ammonium sulfate (approved as aluminium ammonium sulphate)"	"40983"	"2012"	"doi:10.2903/j.efsa.2012.2491"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	"no evidence"	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	"no evidence"	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	"no evidence"	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is identical to the substance"	"Benfuracarb"	""	"82560-54-1"	"ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate"	"Benfuracarb"	"C20H30N2O5S"	"CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C"	"InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-3,7-diol"	""	"17781-15-6"	"2,2-dimethyl-3H-1-benzofuran-3,7-diol"	"Not in list"	"C10H12O3"	"CC1(C(C2=C(O1)C(=CC=C2)O)O)C"	"InChI=1S/C10H12O3/c1-10(2)9(12)6-4-3-5-7(11)8(6)13-10/h3-5,9,11-12H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-3,7-diol"	""	"17781-15-6"	"2,2-dimethyl-3H-1-benzofuran-3,7-diol"	"Not in list"	"C10H12O3"	"CC1(C(C2=C(O1)C(=CC=C2)O)O)C"	"InChI=1S/C10H12O3/c1-10(2)9(12)6-4-3-5-7(11)8(6)13-10/h3-5,9,11-12H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-3,7-diol"	""	"17781-15-6"	"2,2-dimethyl-3H-1-benzofuran-3,7-diol"	"Not in list"	"C10H12O3"	"CC1(C(C2=C(O1)C(=CC=C2)O)O)C"	"InChI=1S/C10H12O3/c1-10(2)9(12)6-4-3-5-7(11)8(6)13-10/h3-5,9,11-12H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-3,7-diol"	""	"17781-15-6"	"2,2-dimethyl-3H-1-benzofuran-3,7-diol"	"Not in list"	"C10H12O3"	"CC1(C(C2=C(O1)C(=CC=C2)O)O)C"	"InChI=1S/C10H12O3/c1-10(2)9(12)6-4-3-5-7(11)8(6)13-10/h3-5,9,11-12H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benfuracarb"	""	"82560-54-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2,2-dimethyl-2,3-dihydro-1-benzofuran-3,7-diol"	""	"17781-15-6"	"2,2-dimethyl-3H-1-benzofuran-3,7-diol"	"Not in list"	"C10H12O3"	"CC1(C(C2=C(O1)C(=CC=C2)O)O)C"	"InChI=1S/C10H12O3/c1-10(2)9(12)6-4-3-5-7(11)8(6)13-10/h3-5,9,11-12H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Benfuracarb (Original version July 2004, revised in August 2008)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance benfuracarb"	"39911"	"2009"	"doi:10.2903/j.efsa.2009.239r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"single chemical entity"	"Component is identical to the substance"	"Benthiavalicarb-isopropyl"	""	"177406-68-7"	"Propan-2-yl N-[(2R)-1-[[(1R)-1-(6-fluoro-1,
+3-benzothiazol-2-yl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate"	"Benthiavalicarb isopropyl"	"C18H24FN3O3S"	"C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@@H](C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Benthiavalicarb-isopropyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance benthiavalicarb"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.107r"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Bromuconazole"	""	"116255-48-2"	"single chemical entity"	"Component is a metabolite of the substance"	"1-{[(2RS)-2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	""	""	"1-{[2-(2,4-dichlorophenyl)-2,5-dihydrofuran-2-yl]methyl}-1H-1,2,4-triazole"	"Not in list"	"C13H11Cl2N3O"	"Clc1cc(Cl)c(cc1)C2(C=CCO2)Cn3cncn3"	"InChI=1/C13H11Cl2N3O/c14-10-2-3-11(12(15)6-10)13(4-1-5-19-13)7-18-9-16-8-17-18/h1-4,6,8-9H,5,7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Bromuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bromuconazole"	"40417"	"2010"	"doi:10.2903/j.efsa.2010.1704"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"42"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Carbosulfan"	"259-565-9"	"55285-14-8"	"single chemical entity"	"Component is identical to the substance"	"Carbosulfan"	"259-565-9"	"55285-14-8"	"2,3-Dihydro-2,2-dimethyl-7-benzofuranyl ((dibutylamino)thio)methylcarbamate"	"Carbosulfan"	"C20H32N2O3S"	"CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12"	"InChI=1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"18"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Carbosulfan (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbosulfan"	"40122"	"2009"	"doi:10.2903/j.efsa.2009.1354"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Diquat"	"220-433-0"	"85-00-7"	"single chemical entity"	"Component is identical to the substance"	"Diquat"	"220-433-0"	"85-00-7"	"6,7-dihydrodipyrido[1,2-b:1',2'-e]pyrazine-5,8-diium"	"Diquat"	"C12H12N2+2"	"C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31"	"InChI=1S/C12H12N2/c1-3-7-13-9-10-14-8-4-2-6-12(14)11(13)5-1/h1-8H,9-10H2/q+2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: gavage"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Diquat"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance diquat"	"42335"	"2015"	"doi:10.2903/j.efsa.2015.4308"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Clofentezine"	"277-728-2"	"74115-24-5"	"single chemical entity"	"Component is identical to the substance"	"Clofentezine"	"277-728-2"	"74115-24-5"	"3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine"	"Clofentezine"	"C14H8Cl2N4"	"Clc3ccccc3c1nnc(nn1)c2ccccc2Cl"	"InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Clofentezine (Addendum1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance clofentezine"	"40014"	"2009"	"doi:10.2903/j.efsa.2009.269r"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Cyproconazole"	""	"94361-06-5"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chloro-phenyl)-3,5-dihydroxy-4-methyl-6-[1,2,4]triazol-1-yl-hexanoic acid"	""	""	"5-(4-chlorophenyl)-3,5-dihydroxy-4-methyl-6-(1H-1,2,4-triazol-1-yl)hexanoic acid"	"Not in list"	"C15H18ClN3O4"	"OC(Cn1cncn1)(C(C)C(O)CC(=O)O)c2ccc(Cl)cc2"	"InChI=1/C15H18ClN3O4/c1-10(13(20)6-14(21)22)15(23,7-19-9-17-8-18-19)11-2-4-12(16)5-3-11/h2-5,8-10,13,20,23H,6-7H2,1H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Cyproconazole"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyproconazole"	"40507"	"2010"	"doi:10.2903/j.efsa.2010.1897"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1536"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"PQ37"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"PQ37"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"PQ37"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"PQ37"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"spleen cells"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"House mouse (as animal)"	"spleen cells"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"Hep G2 human cell line"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male/Female"	"oral: gavage"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Dicamba"	"217-635-6"	"1918-00-9"	"single chemical entity"	"Component is identical to the substance"	"Dicamba"	"217-635-6"	"1918-00-9"	"3,6-dichloro-2-methoxybenzoic acid"	"Dicamba"	"C8H6Cl2O3"	"COc1c(Cl)ccc(Cl)c1C(=O)O"	"InChI=1/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Denmark"	"Dicamba (Revised draft assessment report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dicamba"	"40557"	"2011"	"doi:10.2903/j.efsa.2011.1965"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: the United Kingdom"	"Diflufenican (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Diflufenican"	""	"83164-33-4"	"single chemical entity"	"Component is identical to the substance"	"Diflufenican"	""	"83164-33-4"	"N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide"	"Diflufenican"	"C19H11F5N2O2"	"C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F"	"InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: the United Kingdom"	"Diflufenican (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance diflufenican"	"39492"	"2008"	"doi:10.2903/j.efsa.2008.122r"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Dodine"	"219-459-5"	"2439-10-3"	"single chemical entity"	"Component is identical to the substance"	"Dodine"	"219-459-5"	"2439-10-3"	"1-dodecylguanidine acetate"	"Dodine"	"C13H29N3.C2H4O2"	"CCCCCCCCCCCCNC(=N)N.CC(=O)O"	"InChI=1/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Portugal"	"Dodine (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dodine"	"40350"	"2010"	"doi:10.2903/j.efsa.2010.1631"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is identical to the substance"	"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate"	"Thifensulfuron-methyl"	"C12H13N5O6S2"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC"	"InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"in vitro gene mutation assay in fungi"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Aspergillus nidulans (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	""	"No data"	"oral: gavage"	""	""	"no data"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Thiophanate-methyl"	"245-740-7"	"23564-05-8"	"methyl N-[[2-(methoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate"	"Thiophanate-methyl"	"C12H14N4O4S2"	"COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC"	"InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Thiophanate-methyl"	"245-740-7"	"23564-05-8"	"methyl N-[[2-(methoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate"	"Thiophanate-methyl"	"C12H14N4O4S2"	"COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC"	"InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Other"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	"Female"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"Not reported"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Germany"	"Carbendazim"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is identical to the substance"	"Carbendazim"	"234-232-0"	"10605-21-7"	"methyl 1H-benzimidazol-2-ylcarbamate"	"Carbendazim"	"C9H9N3O2"	"N(C(=O)OC)C1=Nc2ccccc2N1"	"InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Male"	"oral: gavage"	"28"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Carbendazim, Benomyl, Thiophanate-methyl (Addendum)"	"2002"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"Male"	"Not reported"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"Male"	"Not reported"	""	""	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is part of a group assessment"	"2,4-D dimethyl amine salt"	"217-915-8"	"2008-39-1"	"2-(2,4-dichlorophenoxy)acetic acid;N-methylmethanamine"	"Not in list"	"C10H13Cl2NO3"	"CNC.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3.C2H7N/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;1-3-2/h1-3H,4H2,(H,11,12);3H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is part of a group assessment"	"2,4-D dimethyl amine salt"	"217-915-8"	"2008-39-1"	"2-(2,4-dichlorophenoxy)acetic acid;N-methylmethanamine"	"Not in list"	"C10H13Cl2NO3"	"CNC.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3.C2H7N/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;1-3-2/h1-3H,4H2,(H,11,12);3H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Human (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Human (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is part of a group assessment"	"2,4-D dimethyl amine salt"	"217-915-8"	"2008-39-1"	"2-(2,4-dichlorophenoxy)acetic acid;N-methylmethanamine"	"Not in list"	"C10H13Cl2NO3"	"CNC.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3.C2H7N/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;1-3-2/h1-3H,4H2,(H,11,12);3H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is part of a group assessment"	"2,4-D dimethyl amine salt"	"217-915-8"	"2008-39-1"	"2-(2,4-dichlorophenoxy)acetic acid;N-methylmethanamine"	"Not in list"	"C10H13Cl2NO3"	"CNC.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3.C2H7N/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;1-3-2/h1-3H,4H2,(H,11,12);3H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-D"	"202-361-1"	"94-75-7"	"single chemical entity"	"Component is identical to the substance"	"2,4-D"	"202-361-1"	"94-75-7"	"(2,4-dichlorophenoxy)acetic acid"	"2,4-D"	"C8H6Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"	"InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Greece - CoRMS: Poland"	"2,4-D (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance 2,4-D"	"41893"	"2014"	"doi:10.2903/j.efsa.2014.3812"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2,4-dichlorophenol"	"204-429-6"	"120-83-2"	"2,4-dichlorophenol"	"Not in list"	"C6H4Cl2O"	"C1=CC(=C(C=C1Cl)Cl)O"	"InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"2,4-DB"	"202-366-9"	"94-82-6"	"single chemical entity"	"Component is identical to the substance"	"2,4-DB"	"202-366-9"	"94-82-6"	"4-(2,4-dichlorophenoxy)butanoic acid"	"2,4-DB (sum of 2,4-DB, its salts, its esters and its conjugates, expressed as 2,4-DB)"	"C10H10Cl2O3"	"C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O"	"InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"Yes"	"Acceptable"	"Human (as organism)"	""	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"2,4-DB"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance 2,4-DB"	"42521"	"2016"	"doi:10.2903/j.efsa.2016.4500"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Azoxystrobin"	""	"131860-33-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]benzoic acid"	""	""	"2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}benzoic acid"	"Not in list"	"C18H11N3O4"	"O=C(O)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2"	"InChI=1/C18H11N3O4/c19-10-12-5-1-3-7-14(12)24-16-9-17(21-11-20-16)25-15-8-4-2-6-13(15)18(22)23/h1-9,11H,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Czech Republic"	"Azoxystrobin (Final Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance azoxystrobin"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1542"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl N-(malonyl)-N-(2,6-xylyl)-D-alaninate"	""	""	"3-{(2,6-dimethylphenyl)[(2R)-1-methoxy-1-oxopropan-2-yl]amino}-3-oxopropanoic acid"	"Not in list"	"C15H19NO5"	"C[C@@H](N(C(=O)CC(=O)O)c1c(C)cccc1C)C(=O)OC"	"InChI=1/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"Not reported"	"68"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(2RS)-1-methoxy-1-oxo-2-propanyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-methoxy-1-oxopropan-2-yl)amino]-3-methylbenzoic acid"	"Not in list"	""	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)OC"	"InChI=1/C15H17NO7/c1-8-5-4-6-10(14(20)21)13(8)16(9(2)15(22)23-3)11(17)7-12(18)19/h4-6,9H,7H2,1-3H3,(H,18,19)(H,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"Not reported"	"44"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"Not reported"	"68"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Benalaxyl-M"	""	"98243-83-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{(Carboxyacetyl)[(1RS)-1-carboxyethyl]amino}-3-methylbenzoic acid"	""	""	"2-[(carboxyacetyl)(1-carboxyethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H15NO7"	"CC(N(C(=O)CC(=O)O)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H15NO7/c1-7-4-3-5-9(14(21)22)12(7)15(8(2)13(19)20)10(16)6-11(17)18/h3-5,8H,6H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"Not reported"	"44"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Portugal"	"Benalaxyl-M (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance benalaxyl-M."	"41368"	"2013"	"doi:10.2903/j.efsa.2013.3148"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Bupirimate"	"255-391-2"	"41483-43-6"	"single chemical entity"	"Component is identical to the substance"	"Bupirimate"	"255-391-2"	"41483-43-6"	"5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate"	"Bupirimate"	"C13H24N4O3S"	"O=S(OC1=C(CCCC)C(C)=NC(NCC)=N1)(N(C)C)=O"	"InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Bupirimate (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bupirimate"	"40456"	"2010"	"doi:10.2903/j.efsa.2010.1786"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	""	""	"5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinane-2,4-dione"	"Not in list"	"C12H14N2O2S"	"CC(C)N2C(=O)SCN(c1ccccc1)C2=O"	"InChI=1/C12H14N2O2S/c1-9(2)14-11(15)13(8-17-12(14)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidic diamide"	"Not in list"	"C15H23N3O2"	"O=C(Nc1ccccc1)N(C(=O)NC(C)(C)C)C(C)C"	"InChI=1/C15H23N3O2/c1-11(2)18(14(20)17-15(3,4)5)13(19)16-12-9-7-6-8-10-12/h6-11H,1-5H3,(H,16,19)(H,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"1-phenyl-3-propan-2-ylurea"	""	"19895-44-4"	"1-phenyl-3-propan-2-ylurea"	"Not in list"	"C10H14N2O"	"CC(C)NC(=O)NC1=CC=CC=C1"	"InChI=1S/C10H14N2O/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Buprofezin"	""	"69327-76-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	""	""	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"Not in list"	"C15H23N3OS"	"O=C(Nc1ccccc1)N(C(=S)NC(C)(C)C)C(C)C"	"N-tert-butyl-N'-phenyl-N-propan-2-yldicarbonimidothioic diamide"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Buprofezin (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance buprofezin"	"40332"	"2010"	"doi:10.2903/j.efsa.2010.1624"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-3-{2-Chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}acrylic acid"	""	""	"(2E)-3-{2-chloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}prop-2-enoic acid"	"Not in list"	"C13H9ClF3N3O3"	"O=C(O)/C=C/c1cc(c(F)cc1Cl)N2N=C(C)N(C2=O)C(F)F"	"InChI=1/C13H9ClF3N3O3/c1-6-18-20(13(23)19(6)12(16)17)10-4-7(2-3-11(21)22)8(14)5-9(10)15/h2-5,12H,1H3,(H,21,22)/b3-2+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-Chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"2-chloro-3-{2-chloro-5-[4-(difluoromethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C12H8Cl2F3N3O3"	"O=C(O)C(Cl)Cc1cc(c(F)cc1Cl)N2N=CN(C2=O)C(F)F"	"InChI=1/C12H8Cl2F3N3O3/c13-6-3-8(15)9(2-5(6)1-7(14)10(21)22)20-12(23)19(4-18-20)11(16)17/h2-4,7,11H,1H2,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	""	""	"4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C4H5F2N3O"	"O=C1NN=C(C)N1C(F)F"	"InChI=1/C4H5F2N3O/c1-2-7-8-4(10)9(2)3(5)6/h3H,1H3,(H,8,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Carfentrazone-ethyl"	"603-291-8"	"128639-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{2-Chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	""	""	"3-{2-chloro-5-[4-(difluoromethyl)-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-4-fluorophenyl}propanoic acid"	"Not in list"	"C11H11ClF3N3O4"	"O=C(O)CCc1cc(c(F)cc1Cl)N2N=C(CO)N(C2=O)C(F)F"	"InChI=1/C13H11ClF3N3O4/c14-7-4-8(15)9(3-6(7)1-2-11(22)23)20-13(24)19(12(16)17)10(5-21)18-20/h3-4,12,21H,1-2,5H2,(H,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: France"	"Carfentrazone-ethyl"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance carfentrazone-ethyl"	"42612"	"2016"	"doi:10.2903/j.efsa.2016.4569"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfinyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfinyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O5S"	"CCS(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O5S/c1-3-16(15)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Clethodim"	""	"99129-21-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[(2RS)-2-(ethylsulfonyl)propyl]pentanedioic acid"	""	""	"3-[2-(ethylsulfonyl)propyl]pentanedioic acid"	"Not in list"	"C10H18O6S"	"CCS(=O)(=O)C(C)CC(CC(=O)O)CC(=O)O"	"InChI=1/C10H18O6S/c1-3-17(15,16)7(2)4-8(5-9(11)12)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Clethodim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance clethodim"	"40837"	"2011"	"doi:10.2903/j.efsa.2011.2417"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cyantraniliprole"	""	"736994-63-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	""	""	"3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide"	"Not in list"	"C9H6BrClN4O"	"NC(=O)c2cc(Br)nn2c1ncccc1Cl"	"InChI=1/C9H6BrClN4O/c10-7-4-6(8(12)16)15(14-7)9-5(11)2-1-3-13-9/h1-4H,(H2,12,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: France"	"Cyantraniliprole (Final Addendum)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cyantraniliprole"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3814"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(3-thianyl)glutaric acid S-dioxide"	""	""	"3-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O6S"	"O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O6S/c11-9(12)4-8(5-10(13)14)7-2-1-3-17(15,16)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-3-(3-thianyl)glutaric acid S-dioxide"	""	""	"2-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)-2-hydroxybutanedioic acid"	"Not in list"	"C9H14O7S"	"O=S1(=O)CCCC(C1)C(O)(CC(=O)O)C(=O)O"	"InChI=1/C9H14O7S/c10-7(11)4-9(14,8(12)13)6-2-1-3-17(15,16)5-6/h6,14H,1-5H2,(H,10,11)(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-3-(3-thianyl)glutaric acid S-dioxide"	""	""	"2-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)-2-hydroxybutanedioic acid"	"Not in list"	"C9H14O7S"	"O=S1(=O)CCCC(C1)C(O)(CC(=O)O)C(=O)O"	"InChI=1/C9H14O7S/c10-7(11)4-9(14,8(12)13)6-2-1-3-17(15,16)5-6/h6,14H,1-5H2,(H,10,11)(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-3-(3-thianyl)glutaric acid S-dioxide"	""	""	"2-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)-2-hydroxybutanedioic acid"	"Not in list"	"C9H14O7S"	"O=S1(=O)CCCC(C1)C(O)(CC(=O)O)C(=O)O"	"InChI=1/C9H14O7S/c10-7(11)4-9(14,8(12)13)6-2-1-3-17(15,16)5-6/h6,14H,1-5H2,(H,10,11)(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-3-(3-thianyl)glutaric acid S-dioxide"	""	""	"2-(1,1-dioxidotetrahydro-2H-thiopyran-3-yl)-2-hydroxybutanedioic acid"	"Not in list"	"C9H14O7S"	"O=S1(=O)CCCC(C1)C(O)(CC(=O)O)C(=O)O"	"InChI=1/C9H14O7S/c10-7(11)4-9(14,8(12)13)6-2-1-3-17(15,16)5-6/h6,14H,1-5H2,(H,10,11)(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cycloxydim"	""	"101205-02-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	""	""	"3-(1-oxidotetrahydro-2H-thiopyran-3-yl)pentanedioic acid"	"Not in list"	"C10H16O5S"	"O=S1CCCC(C1)C(CC(=O)O)CC(=O)O"	"InChI=1/C10H16O5S/c11-9(12)4-8(5-10(13)14)7-2-1-3-16(15)6-7/h7-8H,1-6H2,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Cycloxydim (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance cycloxydim"	"40367"	"2010"	"doi:10.2903/j.efsa.2010.1669"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Cyhalofop-butyl"	"601-817-0"	"122008-85-9"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	""	""	"4-{4-[(1R)-1-carboxyethoxy]phenoxy}-3-fluorobenzoic acid"	"Cyhalofop-butyl (sum of cyhalofop butyl and its free acids)"	"C16H13FO6"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ccc(cc2F)C(=O)O"	"InChI=1/C16H13FO6/c1-9(15(18)19)22-11-3-5-12(6-4-11)23-14-7-2-10(16(20)21)8-13(14)17/h2-9H,1H3,(H,18,19)(H,20,21)/t9-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Austria"	"Cyhalofop-butyl (RAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance cyhalofop (variant evaluated cyhalofop-butyl)"	"42034"	"2015"	"doi: 10.2903/j.efsa.2015.3943"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Dazomet"	"208-576-7"	"533-74-4"	"single chemical entity"	"Component is identical to the substance"	"Dazomet"	"208-576-7"	"533-74-4"	"3,5-dimethyl-1,3,5-thiadiazinane-2-thione"	"Dazomet"	"C5H10N2S2"	"CN1CSC(=S)N(C)C1"	"InChI=1/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Dazomet (Revised)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance dazomet"	"40458"	"2010"	"doi:10.2903/j.efsa.2010.1833"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Geraniol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Geraniol"	"269-750-6"	"106-24-1"	"single chemical entity"	"Component is identical to the substance"	"Geraniol"	"269-750-6"	"106-24-1"	"(2E)-3,7-dimethylocta-2,6-dien-1-ol"	"geraniol"	"C10H18O"	"CC(=CCCC(=CCO)C)C"	"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Geraniol (Final Addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance geraniol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2915"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Ethofumesate"	"247-525-3"	"26225-79-6"	"single chemical entity"	"Component is identical to the substance"	"Ethofumesate"	"247-525-3"	"26225-79-6"	"(2-ethoxy-3,3-dimethyl-2H-1-benzofuran-5-yl) methanesulfonate"	"Ethofumesate"	"C13H18O5S"	"CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C"	"InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Denmark"	"Ethofumesate"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance ethofumesate"	"42388"	"2016"	"doi:10.2903/j.efsa.2016.4374"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"24"	"Male"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Female"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"16"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"16"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imazaquin"	""	"81335-37-7"	"single chemical entity"	"Component is identical to the substance"	"Imazaquin"	""	"81335-37-7"	"2-(4-Methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic
+acid"	"Imazaquin"	"C17H17N3O3"	"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C"	"InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male"	"oral: gavage"	"5"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Imazaquin"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazaquin"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1968"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"1"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is identical to the substance"	"Imidacloprid"	""	"138261-41-3"	"(2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine"	"Imidacloprid"	"C9H10ClN5O2"	"ClC(C=C2)=NC=C2CN1/C(NCC1)=N/[N+]([O-])=O"	"InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, historical"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, historical"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Ipconazole"	""	"125225-28-7"	"single chemical entity"	"Component is identical to the substance"	"Ipconazole"	""	"125225-28-7"	"2-(4-chlorobenzyl)-5-isopropyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Ipconazole"	"C18H24ClN3O"	"OC1(CN3N=CN=C3)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C"	"InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Ipconazole"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ipconazole."	"41373"	"2013"	"doi:10.2903/j.efsa.2013.3181"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"18"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"16"	"Male"	"oral: feed"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is identical to the substance"	"Kresoxim-methyl"	""	"143390-89-0"	"methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate"	"Kresoxim-methyl"	"C18H19NO4"	"CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC"	"InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-(2-{[2-(hydroxymethyl)phenoxy] methyl}phenyl)(methoxyimino)acetic acid"	""	""	"(2E)-(2-{[2-(hydroxymethyl)phenoxy]methyl}phenyl)(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccccc1CO"	"InChI=1/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2E)-{2-[(4-hydroxy-2-methylphenoxy) methyl]phenyl}(methoxyimino)acetic acid"	""	""	"(2E)-{2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"OC(=O)\C(=N\OC)c2ccccc2COc1ccc(O)cc1C"	"InChI=1/C17H17NO5/c1-11-9-13(19)7-8-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[2-(5-hydroxy-2-methylphenoxymethyl)phenyl]-2-methoxyiminoacetic acid"	""	""	"(2E)-{2-[(5-hydroxy-2-methylphenoxy)methyl]phenyl}(methoxyimino)ethanoic acid"	"Not in list"	"C17H17NO5"	"O=C(O)\C(=N\OC)c2ccccc2COc1cc(O)ccc1C"	"InChI=1/C17H17NO5/c1-11-7-8-13(19)9-15(11)23-10-12-5-3-4-6-14(12)16(17(20)21)18-22-2/h3-9,19H,10H2,1-2H3,(H,20,21)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"intraperitoneal"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	"9"	"Female"	"oral: feed"	"7"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	"9"	"Female"	"oral: feed"	"7"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is identical to the substance"	"Iprovalicarb"	"604-209-3"	""	"propan-2-yl N-[(2R)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate"	"Iprovalicarb"	"C18H28N2O3"	"CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C"	"InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	"9"	"Female"	"oral: feed"	"7"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Not reported"	"9"	"Male"	"oral: gavage"	"18"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"25"	"Male"	"oral: feed"	"19"	"week"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Iprovalicarb"	"604-209-3"	""	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-(4-methylphenyl)ethanamine"	""	""	"(1RS)-1-(4-methylphenyl)ethanamine"	"Not in list"	"C9H13N"	"Cc1ccc(cc1)C(N)C"	"InChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Iprovalicarb"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iprovalicarb"	"42108"	"2015"	"doi:10.2903/j.efsa.2015.4060"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-5-ol dihydro-2-(nitroamino)-1H-imidazol-5-ol"	"Not in list"	"C9H10ClN5O3"	"OC2C\N=C(\N[N+]([O-])=O)N2Cc1cnc(Cl)cc1"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)5-14-8(16)4-12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	""	""	"1[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-2-(nitroamino)-1H-imidazol-4-ol dihydro-2-(nitroamino)-1H-imidazol-4-ol"	"Not in list"	"C18H20Cl2N10O6"	"OC/2CN(Cc1cnc(Cl)cc1)C(\N[N+]([O-])=O)=N\2"	"InChI=1/C9H10ClN5O3/c10-7-2-1-6(3-11-7)4-14-5-8(16)12-9(14)13-15(17)18/h1-3,8,16H,4-5H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	""	""	"1-[(6-Chloro-3-pyridinyl)methyl]N-nitro-1H-imidazol-2-amine"	"Not in list"	"C9H8ClN5O2"	"O=[N+]([O-])Nc2nccn2Cc1ccc(Cl)nc1"	"InChI=1/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	""	"Male"	"oral: gavage"	""	""	"no data"	"not applicable"	"Inconclusive"	""	"no evidence"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	""	"Male"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Inconclusive"	""	"no evidence"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"intraperitoneal"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Imidacloprid"	""	"138261-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	""	""	"1-[(6-chloro-3-pyridinyl)methyl]-,oxohydrazone"	"Not in list"	"C9H10ClN5O"	"Clc2ncc(CN1CCN/C1=N\N=O)cc2"	"InChI=1/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Imidacloprid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance imidacloprid"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.148r"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-{3-[(2RS)-2-hydroxybutan-2-yl]-1,2-oxazol-5-yl} -2,6-dimethoxybenzamide"	""	""	"N-(3-ethylisoxazol-5-yl)-2,6-dimethoxybenzamide"	"Not in list"	"C15H20N2O5"	"CCc2cc(NC(=O)c1c(OC)cccc1OC)on2"	"InChI=1/C14H16N2O4/c1-4-9-8-12(20-16-9)15-14(17)13-10(18-2)6-5-7-11(13)19-3/h5-8H,4H2,1-3H3,(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Sweden"	"Isoxaben"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethoxybenzamide"	""	""	"2,6-dimethoxybenzamide"	"Not in list"	"C9H11NO3"	"COc1cccc(OC)c1C(N)=O"	"InChI=1/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Isoxaben"	"407-190-8"	"82558-50-7"	"single chemical entity"	"Component is identical to the substance"	"Isoxaben"	"407-190-8"	"82558-50-7"	"2,6-Dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide"	"Isoxaben"	"C18H24N2O4"	"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC"	"InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Isoxaben (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoxaben"	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1714"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"7"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"7"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA94"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA94"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"DIS13"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"PQ37"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"5"	"Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"5"	"Female"	"other"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"5"	"Female"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"5"	"Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"5"	"Female"	"other"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"5"	"Female"	"other"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ddy mouse"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"single chemical entity"	"Component is identical to the substance"	"Iron sulfate anhydrous"	"231-753-5"	"7720-78-7"	"Iron(2+);sulfate"	"Not in list"	"FeO4S"	"[O-]S(=O)(=O)[O-].[Fe+2]"	"InChI=1S/Fe.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"kidney cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Iron sulphate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance iron sulfate"	"40933"	"2012"	"doi:10.2903/j.efsa.2012.2521"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Kresoxim-methyl"	""	"143390-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(E)-methoxyamino(α-(o-tolyloxy)-o-tolyl]acetic acid"	""	""	"(2E)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}ethanoic acid"	"Not in list"	"C17H17NO4"	"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C"	"InChI=1/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Lithuania"	"Kresoxim-methyl"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance kresoxim-methyl"	"40501"	"2010"	"doi:10.2903/j.efsa.2010.1891"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is identical to the substance"	"Isopyrazam"	""	"881685-58-1"	"3-(difluoromethyl)-1-methyl-N-[9-(propan-2-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-1H-pyrazole-4-carboxamide"	"Isopyrazam"	"C20H23F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2C1CCC(C1C(C)C)c23"	"InChI=1S/C20H23F2N3O/c1-10(2)16-12-7-8-13(16)17-11(12)5-4-6-15(17)23-20(26)14-9-25(3)24-18(14)19(21)22/h4-6,9-10,12-13,16,19H,7-8H2,1-3H3,(H,23,26)"	"organic"	"representative compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1S,4R,9S)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-N-[(1R,8S,11S)-11-(2-hydroxypropan-2-yl)tricyclo[6.2.1.02,7]undeca-2,4,6-trien-3-yl]-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@H]1CC[C@H]([C@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Isopyrazam"	""	"881685-58-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	""	""	"3-(difluoromethyl)-1-methyl-N-[(1R,4S,9R)-1,2,3,4-tetrahydro-9-(2-hydroxypropan-2-yl)-1,4-methanonaphthalen-5-yl]pyrazole-4-carboxamide"	"Not in list"	"C20H23F2N3O2"	"FC(F)c4nn(C)cc4C(=O)Nc3cccc2[C@@H]1CC[C@@H]([C@@H]1C(C)(C)O)c23"	"InChI=1/C20H23F2N3O2/c1-20(2,27)16-11-7-8-12(16)15-10(11)5-4-6-14(15)23-19(26)13-9-25(3)24-17(13)18(21)22/h4-6,9,11-12,16,18,27H,7-8H2,1-3H3,(H,23,26)/t11-,12+,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Isopyrazam"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isopyrazam"	"40997"	"2012"	"doi:10.2903/j.efsa.2012.2600"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"large colonies"	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"large colonies"	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"3"	"Male"	"oral: unspecified"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"3"	"Male"	"oral: unspecified"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"3"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"3"	"Male"	"oral: unspecified"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"diethyl (2RS)-2-{[methoxy(methylsulfanyl)phosphoryl]sulfanyl}butanedioate"	""	""	"diethyl 2-[methoxy(methylsulfanyl)phosphoryl]sulfanylbutanedioate"	"Not in list"	"C10H19O6PS2"	"CCOC(=O)CC(C(=O)OCC)SP(=O)(OC)SC"	"InChI=1S/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(13,14-3)18-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-[(dimethoxyphosphoryl)sulfanyl]butanedioate"	""	"1634-78-2"	"Diethyl 2-dimethoxyphosphorylsulfanylbutanedioate"	"Malaoxon"	"C10H19O7PS"	"CCOC(=O)CC(C(=O)OCC)SP(=O)(OC)OC"	"InChI=1S/C10H19O7PS/c1-5-16-9(11)7-8(10(12)17-6-2)19-18(13,14-3)15-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"12"	"week"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"6"	"week"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"12"	"week"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"12"	"week"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"6"	"week"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"12"	"week"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"6"	"week"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"12"	"week"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"6"	"week"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"12"	"week"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"12"	"week"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"6"	"week"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"12"	"week"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"6"	"week"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"6"	"week"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: feed"	"6"	"week"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"single chemical entity"	"Component is identical to the substance"	"Indolylbutyric acid"	"205-101-5"	"133-32-4"	"4-(1H-indol-3-yl)butanoic acid"	"Not in list"	"C12H13NO2"	"OC(=O)CCCc1c[nH]c2ccccc12"	"InChI=1/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Indolylbutiric acid (Revised DAR of September 2007)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance indolylbutyric acid"	"40435"	"2010"	"doi:10.2903/j.efsa.2010.1720"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"single chemical entity"	"Component is identical to the substance"	"2,4,6,8-Tetramethyl-1,3,5,7-tetraoxacyclooctane"	"203-600-2"	"108-62-3"	"2,4,6,8-Tetramethyl-1,3,5,7-tetroxocane"	"Metaldehyde"	"C8H16O4"	"CC1OC(C)OC(C)OC(C)O1"	"InChI=1/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Metaldehyde"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaldehyde"	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1856"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is identical to the substance"	"Metobromuron"	"221-301-5"	"3060-89-7"	"3-(4-bromophenyl)-1-methoxy-1-methylurea"	"Metobromuron"	"C9H11BrN2O2"	"CN(C(=O)NC1=CC=C(C=C1)Br)OC"	"InChI=1S/C9H11BrN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Picolinafen"	"604-030-0"	"137641-05-5"	"single chemical entity"	"Component is identical to the substance"	"Picolinafen"	"604-030-0"	"137641-05-5"	"N-(4-fluorophenyl)-6-[3(trifluoromethyl)phenoxy]pyridine-2carboxamide"	"Picolinafen"	"C19H12F4N2O2"	"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F"	"InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany - CoRMS: Latvia"	"Picolinafen"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picolinafen"	"42312"	"2015"	"doi:10.2903/j.efsa.2015.4279"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Picloram"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Picloram"	"217-636-1"	"1918-02-1"	"single chemical entity"	"Component is identical to the substance"	"Picloram"	"217-636-1"	"1918-02-1"	"4-amino-3,5,6-trichloropyridine-2-carboxylic acid"	"Picloram"	"C6H3Cl3N2O2"	"C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N"	"InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Picloram (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance picloram"	"40150"	"2009"	"doi:10.2903/j.efsa.2009.1390"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"40"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"40"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Pyriproxyfen"	""	"95737-68-1"	"single chemical entity"	"Component is identical to the substance"	"Pyriproxyfen"	""	"95737-68-1"	"2-[1-methyl-2-(4-phenoxyphenoxy)ethoxy]pyridine"	"Pyriproxyfen"	"C20H19NO3"	"CC(OC3=NC=CC=C3)COC2=CC=C(C=C2)OC1=CC=CC=C1"	"InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"40"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Pyriproxyfen"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance pyriproxyfen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.336r"
+"Propargite"	"219-006-1"	"2312-35-8"	"single chemical entity"	"Component is identical to the substance"	"Propargite"	"219-006-1"	"2312-35-8"	"2-(4-tert-butylphenoxy)cyclohexyl prop-2-yn-1-yl sulfite"	"Propargite"	"C19H26O4S"	"CC(C)(C)c1ccc(cc1)OC2CCCCC2OS(=O)OCC#C"	"InChI=1S/C19H26O4S/c1-5-14-21-24(20)23-18-9-7-6-8-17(18)22-16-12-10-15(11-13-16)19(2,3)4/h1,10-13,17-18H,6-9,14H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Propargite"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance propargite"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2087"
+"Propargite"	"219-006-1"	"2312-35-8"	"single chemical entity"	"Component is identical to the substance"	"Propargite"	"219-006-1"	"2312-35-8"	"2-(4-tert-butylphenoxy)cyclohexyl prop-2-yn-1-yl sulfite"	"Propargite"	"C19H26O4S"	"CC(C)(C)c1ccc(cc1)OC2CCCCC2OS(=O)OCC#C"	"InChI=1S/C19H26O4S/c1-5-14-21-24(20)23-18-9-7-6-8-17(18)22-16-12-10-15(11-13-16)19(2,3)4/h1,10-13,17-18H,6-9,14H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Propargite"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance propargite"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2087"
+"Propargite"	"219-006-1"	"2312-35-8"	"single chemical entity"	"Component is identical to the substance"	"Propargite"	"219-006-1"	"2312-35-8"	"2-(4-tert-butylphenoxy)cyclohexyl prop-2-yn-1-yl sulfite"	"Propargite"	"C19H26O4S"	"CC(C)(C)c1ccc(cc1)OC2CCCCC2OS(=O)OCC#C"	"InChI=1S/C19H26O4S/c1-5-14-21-24(20)23-18-9-7-6-8-17(18)22-16-12-10-15(11-13-16)19(2,3)4/h1,10-13,17-18H,6-9,14H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Propargite"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance propargite"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2087"
+"Propargite"	"219-006-1"	"2312-35-8"	"single chemical entity"	"Component is identical to the substance"	"Propargite"	"219-006-1"	"2312-35-8"	"2-(4-tert-butylphenoxy)cyclohexyl prop-2-yn-1-yl sulfite"	"Propargite"	"C19H26O4S"	"CC(C)(C)c1ccc(cc1)OC2CCCCC2OS(=O)OCC#C"	"InChI=1S/C19H26O4S/c1-5-14-21-24(20)23-18-9-7-6-8-17(18)22-16-12-10-15(11-13-16)19(2,3)4/h1,10-13,17-18H,6-9,14H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Propargite"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance propargite"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2087"
+"Propargite"	"219-006-1"	"2312-35-8"	"single chemical entity"	"Component is identical to the substance"	"Propargite"	"219-006-1"	"2312-35-8"	"2-(4-tert-butylphenoxy)cyclohexyl prop-2-yn-1-yl sulfite"	"Propargite"	"C19H26O4S"	"CC(C)(C)c1ccc(cc1)OC2CCCCC2OS(=O)OCC#C"	"InChI=1S/C19H26O4S/c1-5-14-21-24(20)23-18-9-7-6-8-17(18)22-16-12-10-15(11-13-16)19(2,3)4/h1,10-13,17-18H,6-9,14H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Propargite"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance propargite"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2087"
+"Propargite"	"219-006-1"	"2312-35-8"	"single chemical entity"	"Component is identical to the substance"	"Propargite"	"219-006-1"	"2312-35-8"	"2-(4-tert-butylphenoxy)cyclohexyl prop-2-yn-1-yl sulfite"	"Propargite"	"C19H26O4S"	"CC(C)(C)c1ccc(cc1)OC2CCCCC2OS(=O)OCC#C"	"InChI=1S/C19H26O4S/c1-5-14-21-24(20)23-18-9-7-6-8-17(18)22-16-12-10-15(11-13-16)19(2,3)4/h1,10-13,17-18H,6-9,14H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Propargite"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance propargite"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2087"
+"Propargite"	"219-006-1"	"2312-35-8"	"single chemical entity"	"Component is identical to the substance"	"Propargite"	"219-006-1"	"2312-35-8"	"2-(4-tert-butylphenoxy)cyclohexyl prop-2-yn-1-yl sulfite"	"Propargite"	"C19H26O4S"	"CC(C)(C)c1ccc(cc1)OC2CCCCC2OS(=O)OCC#C"	"InChI=1S/C19H26O4S/c1-5-14-21-24(20)23-18-9-7-6-8-17(18)22-16-12-10-15(11-13-16)19(2,3)4/h1,10-13,17-18H,6-9,14H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Propargite"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance propargite"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2087"
+"Propargite"	"219-006-1"	"2312-35-8"	"single chemical entity"	"Component is identical to the substance"	"Propargite"	"219-006-1"	"2312-35-8"	"2-(4-tert-butylphenoxy)cyclohexyl prop-2-yn-1-yl sulfite"	"Propargite"	"C19H26O4S"	"CC(C)(C)c1ccc(cc1)OC2CCCCC2OS(=O)OCC#C"	"InChI=1S/C19H26O4S/c1-5-14-21-24(20)23-18-9-7-6-8-17(18)22-16-12-10-15(11-13-16)19(2,3)4/h1,10-13,17-18H,6-9,14H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Propargite"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance propargite"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2087"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Prosulfocarb"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden"	"Prosulfocarb (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Prosulfocarb"	"401-730-6"	"52888-80-9"	"single chemical entity"	"Component is identical to the substance"	"Prosulfocarb"	"401-730-6"	"52888-80-9"	"S-benzyl dipropylcarbamothioate"	"Prosulfocarb"	"C14H21NOS"	"CCCN(CCC)C(=O)SCc1ccccc1"	"InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden"	"Prosulfocarb (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prosulfocarb"	"39322"	"2007"	"doi:10.2903/j.efsa.2007.111r"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"3"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is identical to the substance"	"Pyriofenone"	""	"688046-61-9"	"(5-Chloro-2-methoxy-4-methylpyridin-3-yl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Not in list"	"C18H20ClNO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C(=CN=C2OC)Cl)C)OC)OC)OC"	"InChI=1S/C18H20ClNO5/c1-9-7-12(22-3)16(23-4)17(24-5)13(9)15(21)14-10(2)11(19)8-20-18(14)25-6/h7-8H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyriofenone"	""	"688046-61-9"	"single chemical entity"	"Component is a metabolite of the substance"	"(5-chloro-2-methoxy-4-methyl-3-pyridinyl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	""	""	"(5-chloro-2-methoxy-4-methylpyridin-3-yl)(4-hydroxy-2,3-dimethoxy-6-methylphenyl)methanone"	"Not in list"	"C17H18ClNO5"	"COc2ncc(Cl)c(C)c2C(=O)c1c(C)cc(O)c(OC)C1oc"	"InChI=1/C17H18ClNO5/c1-8-6-11(20)15(22-3)16(23-4)12(8)14(21)13-9(2)10(18)7-19-17(13)24-5/h6-7,20H,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyriofenone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyriofenone."	"41367"	"2013"	"doi:10.2903/j.efsa.2013.3147"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"12"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is identical to the substance"	"Pyridaben"	"405-700-3"	"96489-71-3"	"2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2H)-one"	"Pyridaben"	"C19H25ClN2OS"	"O=C1N(C(C)(C)C)N=CC(SCC2=CC=C(C(C)(C)C)C=C2)=C1Cl"	"InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"12"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"CM871"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Pyridaben"	"405-700-3"	"96489-71-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(1-tert-butyl-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)sulfanyl]methyl}phenyl)-2-methylpropanoic acid"	"Not in list"	"C19H23ClN2O3S"	"CC(C)(C)N2N=CC(SCc1ccc(cc1)C(C)(C)C(=O)O)=C(Cl)C2=O"	"InChI=1/C19H23ClN2O3S/c1-18(2,3)22-16(23)15(20)14(10-21-22)26-11-12-6-8-13(9-7-12)19(4,5)17(24)25/h6-10H,11H2,1-5H3,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP67"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridaben"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridaben"	"40337"	"2010"	"doi:10.2903/j.efsa.2010.1632"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Meptyldinocap"	"228-088-8"	"131-72-6"	"single chemical entity"	"Component is identical to the substance"	"Meptyldinocap"	"228-088-8"	"131-72-6"	"(2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate"	"Meptyldinocap (sum of 2,4 DNOPC and 2,4 DNOP expressed as meptyldinocap)"	"C18H24N2O6"	"CCCCCCC(C)C1=CC(=CC(=C1OC(=O)C=CC)[N+](=O)[O-])[N+](=O)[O-]"	"InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Meptyldinocap (DE-126)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance DE-126, referred to as meptyldinocap in Commission Decision 2006/589/EC"	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3473"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is identical to the substance"	"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"1,1-Dimethylpiperidin-1-ium;chloride"	"Not in list"	"C7H16ClN"	"C[N+]1(CCCCC1)C.[Cl-]"	"InChI=1S/C7H16N.ClH/c1-8(2)6-4-3-5-7-8;/h3-7H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"20"	"Male"	"oral: feed"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Mepiquat chloride"	"246-147-6"	"24307-26-4"	"single chemical entity"	"Component is a metabolite of the substance"	"4-hydroxy-1,1-dimethylpiperidinium chloride"	""	""	"4-hydroxy-1,1-dimethylpiperidinium chloride"	"Not in list"	"C7H16ClNO"	"[Cl-].C[N+]1(C)CCC(O)CC1"	"InChI=1/C7H16NO.ClH/c1-8(2)5-3-7(9)4-6-8;/h7,9H,3-6H2,1-2H3;1H/q+1;/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Mepiquat-chloride (Addendum 2)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance mepiquat"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.146r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"20"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is identical to the substance"	"Oxamyl"	""	"23135-22-0"	"(EZ)-N,N-dimethyl-2-methylcarbamoyloxyimino-2-(methylthio)acetamide"	"Oxamyl"	"C7H13N3O3S"	"CNC(=O)O/N=C(/C(=O)N(C)C)\SC"	"InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"20"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Oxamyl"	""	"23135-22-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-1-cyanoformamide"	""	""	"[(cyanocarbonyl)azanediyl]dimethane"	"Not in list"	"C4H6N2O"	"CN(C)C(=O)C#N"	"InChI=1S/C4H6N2O/c1-6(2)4(7)3-5/h1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Oxamyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxamyl"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.26r"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: unspecified"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"single chemical entity"	"Component is identical to the substance"	"Pyraflufen-ethyl"	"603-347-1"	"129630-19-9"	"ethyl 2-[2-chloro-5-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-4-fluorophenoxy]acetate"	"Pyraflufen-ethyl"	"C15H13Cl2F3N2O4"	"CCOC(=O)COC1=C(C=C(C(=C1)C2=NN(C(=C2Cl)OC(F)F)C)F)Cl"	"InChI=1S/C15H13Cl2F3N2O4/c1-3-24-11(23)6-25-10-4-7(9(18)5-8(10)16)13-12(17)14(22(2)21-13)26-15(19)20/h4-5,15H,3,6H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Pyraflufen-ethyl (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyraflufen-ethyl"	"42040"	"2015"	"doi:10.2903/j.efsa.2015.4001"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Methomyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Methomyl"	"240-815-0"	"16752-77-5"	"single chemical entity"	"Component is identical to the substance"	"Methomyl"	"240-815-0"	"16752-77-5"	"methyl N-[(methylcarbamoyl)oxy]ethanimidothioate"	"Methomyl"	"C5H10N2O2S"	"CSC(C)=NOC(NC)=O"	"InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methomyl (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance methomyl"	"39909"	"2009"	"doi:10.2903/j.efsa.2009.222r"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Metrafenone"	""	"220899-03-6"	"single chemical entity"	"Component is identical to the substance"	"Metrafenone"	""	"220899-03-6"	"(3-Bromo-6-methoxy-2-methylphenyl)-(2,3,4-trimethoxy-6-methylphenyl)methanone"	"Metrafenone"	"C19H21BrO5"	"CC1=CC(=C(C(=C1C(=O)C2=C(C=CC(=C2C)Br)OC)OC)OC)OC"	"InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Metrafenone"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metrafenone"	"38749"	"2006"	"doi:10.2903/j.efsa.2006.58r"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Prohexadione-calcium"	""	"127277-53-6"	"single chemical entity"	"Component is identical to the substance"	"Prohexadione-calcium"	""	"127277-53-6"	"Calcium;1-(4-carboxy-2,6-dioxocyclohexylidene)propan-1-olate"	"Not in list"	"C20H22CaO10"	"CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]"	"InChI=1S/2C10H12O5.Ca/c2*1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h2*5,11H,2-4H2,1H3,(H,14,15);/q;;+2/p-2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Prohexadione-calcium"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prohexadione (considered variant prohexadione-calcium)"	"40263"	"2010"	"doi:10.2903/j.efsa.2010.1555"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is identical to the substance"	"Proquinazid"	""	"189278-12-4"	"6-iodo-2-propoxy-3-propylquinazolin-4(3H)-one"	"Proquinazid"	"C14H17IN2O2"	"Ic1ccc2N=C(OCCC)N(CCC)C(=O)c2c1"	"InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Proquinazid"	""	"189278-12-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Propoxy-3-propylquinazolin-4(3H)-one"	""	""	"2-propoxy-3-propylquinazolin-4(3H)-one"	"Not in list"	"C14H18N2O2"	"CCCOC2=Nc1ccccc1C(=O)N2CCC"	"InChI=1S/C14H18N2O2/c1-3-9-16-13(17)11-7-5-6-8-12(11)15-14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Proquinazid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance proquinazid"	"40115"	"2009"	"doi:10.2903/j.efsa.2009.1350"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM881"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM881"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"6"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is identical to the substance"	"Pyrimethanil"	"414-220-3"	"53112-28-0"	"4,6-dimethyl-N-phenylpyrimidin-2-amine"	"Pyrimethanil"	"C12H13N3"	"CC1=NC(NC2=CC=CC=C2)=NC(C)=C1"	"InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"6"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Pyrimethanil"	"414-220-3"	"53112-28-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4,6-dimethylpyrimidine"	""	""	"4,6-dimethylpyrimidin-2-amine"	"Pyrimethanil metabolite (AEF132593)"	"C6H9N3"	"Cc1cc(C)nc(N)n1"	"InChI=1/C6H9N3/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Pyrimethanil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pyrimethanil"	"38769"	"2006"	"doi:10.2903/j.efsa.2006.61r"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"2"	"Male"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Oxadiazon"	"243-215-7"	"19666-30-9"	"single chemical entity"	"Component is identical to the substance"	"Oxadiazon"	"243-215-7"	"19666-30-9"	"5-Tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one"	"Oxadiazon"	"C15H18Cl2N2O3"	"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl"	"InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"Male"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Oxadiazon"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxadiazon"	"40228"	"2010"	"doi:10.2903/j.efsa.2010.1389"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Methiocarb"	"217-991-2"	"2032-65-7"	"single chemical entity"	"Component is identical to the substance"	"Methiocarb"	"217-991-2"	"2032-65-7"	"3,5-dimethyl-4-(methylsulfanyl)phenyl methylcarbamate"	"Methiocarb"	"C11H15NO2S"	"CNC(=O)Oc1cc(C)c(SC)c(C)c1"	"InChI=1/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"50"	"Male"	"oral: unspecified"	"48"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Methiocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance methiocarb"	"41120"	"2012"	"doi:10.2903/j.efsa.2012.2758"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Pyrethrins"	""	"8003-34-7"	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Pyrethrins"	""	"8003-34-7"	"[(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate;[2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate"	"Pyrethrins"	"C43H56O8"	"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C.CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C"	"InChI=1S/C22H28O5.C21H28O3/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6;1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h7-9,11,16,18-19H,1,10,12H2,2-6H3;7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8+,13-11+;9-8+/t16?,18?,19-;16?,18-,19-/m00/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Pyrethrins (Final Addendum to the DAR)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyrethrins"	"41283"	"2013"	"doi:10.2903/j.efsa.2013.3032"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"25.5"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"25.5"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"50"	"Male"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is identical to the substance"	"Metamitron"	"255-349-3"	"41394-05-2"	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one"	"Metamitron"	"C10H10N4O"	"O=C1C(C2=CC=CC=C2)=NN=C(C)N1N"	"InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"30"	"Male"	"oral: gavage"	"10"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-methyl-4-amino-6-phenyl-1,2,4-triazine-5-one-oxide"	""	""	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one 1-oxide"	"Not in list"	"C10H10N4O2"	"O=C2C(c1ccccc1)=[N+]([O-])N=C(C)N2N"	"InChI=1/C10H10N4O2/c1-7-12-14(16)9(10(15)13(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-methyl-4-amino-6-phenyl-1,2,4-triazine-5-one-oxide"	""	""	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one 1-oxide"	"Not in list"	"C10H10N4O2"	"O=C2C(c1ccccc1)=[N+]([O-])N=C(C)N2N"	"InChI=1/C10H10N4O2/c1-7-12-14(16)9(10(15)13(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-methyl-4-amino-6-phenyl-1,2,4-triazine-5-one-oxide"	""	""	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one 1-oxide"	"Not in list"	"C10H10N4O2"	"O=C2C(c1ccccc1)=[N+]([O-])N=C(C)N2N"	"InChI=1/C10H10N4O2/c1-7-12-14(16)9(10(15)13(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-methyl-4-amino-6-phenyl-1,2,4-triazine-5-one-oxide"	""	""	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one 1-oxide"	"Not in list"	"C10H10N4O2"	"O=C2C(c1ccccc1)=[N+]([O-])N=C(C)N2N"	"InChI=1/C10H10N4O2/c1-7-12-14(16)9(10(15)13(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-methyl-4-amino-6-phenyl-1,2,4-triazine-5-one-oxide"	""	""	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one 1-oxide"	"Not in list"	"C10H10N4O2"	"O=C2C(c1ccccc1)=[N+]([O-])N=C(C)N2N"	"InChI=1/C10H10N4O2/c1-7-12-14(16)9(10(15)13(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-methyl-4-amino-6-phenyl-1,2,4-triazine-5-one-oxide"	""	""	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one 1-oxide"	"Not in list"	"C10H10N4O2"	"O=C2C(c1ccccc1)=[N+]([O-])N=C(C)N2N"	"InChI=1/C10H10N4O2/c1-7-12-14(16)9(10(15)13(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-methyl-4-amino-6-phenyl-1,2,4-triazine-5-one-oxide"	""	""	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one 1-oxide"	"Not in list"	"C10H10N4O2"	"O=C2C(c1ccccc1)=[N+]([O-])N=C(C)N2N"	"InChI=1/C10H10N4O2/c1-7-12-14(16)9(10(15)13(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metamitron"	"255-349-3"	"41394-05-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-methyl-4-amino-6-phenyl-1,2,4-triazine-5-one-oxide"	""	""	"4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one 1-oxide"	"Not in list"	"C10H10N4O2"	"O=C2C(c1ccccc1)=[N+]([O-])N=C(C)N2N"	"InChI=1/C10H10N4O2/c1-7-12-14(16)9(10(15)13(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metamitron"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metamitron"	"39743"	"2008"	"doi:10.2903/j.efsa.2008.185r"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"20"	"Male"	"oral: unspecified"	"8"	"week"	"yes, concurrent no treatment"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is identical to the substance"	"Mandipropamid"	""	"374726-62-2"	"2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide"	"Mandipropamid"	"C23H22ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2"	"InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Mandipropamid"	""	"374726-62-2"	"single chemical entity"	"Component is a metabolite of the substance"	"(4-Chloro-phenyl)-prop-2-ynyloxy-acetic acid"	""	""	"3-{[(4-chlorophenyl)(prop-2-yn-1-yloxy)acetyl]amino}propanoic acid"	"Not in list"	"C14H14ClNO4"	"Clc1ccc(cc1)C(OCC#C)C(=O)NCCC(=O)O"	"InChI=1/C14H14ClNO4/c1-2-9-20-13(10-3-5-11(15)6-4-10)14(19)16-8-7-12(17)18/h1,3-6,13H,7-9H2,(H,16,19)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Mandipropamid"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance mandipropamid"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2935"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"16"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"16"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"16"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is identical to the substance"	"Lufenuron"	""	"103055-07-8"	"N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide"	"Lufenuron"	"C17H8Cl2F8N2O3"	"O=C(NC(NC2=C(Cl)C=C(OC(F)(F)C(F)C(F)(F)F)C(Cl)=C2)=O)C1=C(F)C=CC=C1F"	"InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Lufenuron"	""	"103055-07-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoro-propoxy)-phenylamine"	""	""	"2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)aniline"	"Not in list"	"C9H5Cl2F6NO"	"Clc1cc(N)c(Cl)cc1OC(F)(F)C(F)C(F)(F)F"	"InChI=1S/C9H5Cl2F6NO/c10-3-2-6(4(11)1-5(3)18)19-9(16,17)7(12)8(13,14)15/h1-2,7H,18H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Portugal"	"Lufenuron"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance lufenuron"	"39986"	"2009"	"doi:10.2903/j.efsa.2009.189r"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	""	""	"5-amino-N-(2,6-dichloro-3-methylphenyl)-1H-1,2,4-triazole-3-sulfonamide"	"Not in list"	"C9H9Cl2N5O2S"	"O=S(=O)(Nc1c(Cl)c(C)ccc1Cl)c2nc(N)nn2"	"InChI=1S/C9H9Cl2N5O2S/c1-4-2-3-5(10)7(6(4)11)16-19(17,18)9-13-8(12)14-15-9/h2-3,16H,1H3,(H3,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4] triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C13H11Cl2N5O4S"	"Clc1c(C)ccc(Cl)c1NS(=O)(=O)c2nc3nc(cc(O)n3n2)OC"	"InChI=1S/C13H11Cl2N5O4S/c1-6-3-4-7(14)11(10(6)15)19-25(22,23)13-17-12-16-8(24-2)5-9(21)20(12)18-13/h3-5,19,21H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	""	""	"N-(2,6-dichloro-3-methylphenyl)-5,7-dihydroxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Not in list"	"C12H9Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(O)cc(O)n2n1"	"InChI=1S/C12H9Cl2N5O4S/c1-5-2-3-6(13)10(9(5)14)18-24(22,23)12-16-11-15-7(20)4-8(21)19(11)17-12/h2-4,18,21H,1H3,(H,15,16,17,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"20"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metosulam"	""	"139528-85-1"	"single chemical entity"	"Component is identical to the substance"	"Metosulam"	""	"139528-85-1"	"N-(2,6-dichloro-3-methylphenyl)-5,7-dimethoxy[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide"	"Metosulam"	"C14H13Cl2N5O4S"	"Clc3c(C)ccc(Cl)c3NS(=O)(=O)c1nc2nc(cc(OC)n2n1)OC"	"InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Metosulam (Addendum)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metosulam"	"40303"	"2010"	"doi:10.2903/j.efsa.2010.1592"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: unspecified"	"14"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is identical to the substance"	"Metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(E)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Metaflumizone (sum of E- and Z- isomers)"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: unspecified"	"3"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is part of a group assessment"	"Z-isomer of metaflumizone"	"604-167-6"	"139968-49-3"	"1-[(Z)-[2-(4-cyanophenyl)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]-3-[4-(trifluoromethoxy)phenyl]urea"	"Not in list"	"C24H16F6N4O2"	"C1=CC(=CC(=C1)C(F)(F)F)C(=NNC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CC3=CC=C(C=C3)C#N"	"InChI=1S/C24H16F6N4O2/c25-23(26,27)18-3-1-2-17(13-18)21(12-15-4-6-16(14-31)7-5-15)33-34-22(35)32-19-8-10-20(11-9-19)36-24(28,29)30/h1-11,13H,12H2,(H2,32,34,35)/b33-21-"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{(5RS)-5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	""	""	"4-{5-hydroxy-3-oxo-4-[4-(trifluoromethoxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazin-5-yl}benzonitrile"	"Not in list"	"C25H17F5N4O3"	"CC(F)(F)Oc1ccc(cc1)N3C(=O)NN=C(c2cc(ccc2)C(F)(F)F)C3(O)c4ccc(C#N)cc4"	"InChI=1/C25H17F5N4O3/c1-23(26,27)37-20-11-9-19(10-12-20)34-22(35)33-32-21(16-3-2-4-18(13-16)25(28,29)30)24(34,36)17-7-5-15(14-31)6-8-17/h2-13,36H,1H3,(H,33,35)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}benzonitrile"	""	""	"4-{2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}benzonitrile"	"Not in list"	"C16H10F3NO"	"FC(F)(F)c1cccc(c1)C(=O)Cc2ccc(C#N)cc2"	"InChI=1/C16H10F3NO/c17-16(18,19)14-3-1-2-13(9-14)15(21)8-11-4-6-12(10-20)7-5-11/h1-7,9H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}benzonitrile"	""	""	"4-{2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}benzonitrile"	"Not in list"	"C16H10F3NO"	"FC(F)(F)c1cccc(c1)C(=O)Cc2ccc(C#N)cc2"	"InChI=1/C16H10F3NO/c17-16(18,19)14-3-1-2-13(9-14)15(21)8-11-4-6-12(10-20)7-5-11/h1-7,9H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}benzonitrile"	""	""	"4-{2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}benzonitrile"	"Not in list"	"C16H10F3NO"	"FC(F)(F)c1cccc(c1)C(=O)Cc2ccc(C#N)cc2"	"InChI=1/C16H10F3NO/c17-16(18,19)14-3-1-2-13(9-14)15(21)8-11-4-6-12(10-20)7-5-11/h1-7,9H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}benzonitrile"	""	""	"4-{2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}benzonitrile"	"Not in list"	"C16H10F3NO"	"FC(F)(F)c1cccc(c1)C(=O)Cc2ccc(C#N)cc2"	"InChI=1/C16H10F3NO/c17-16(18,19)14-3-1-2-13(9-14)15(21)8-11-4-6-12(10-20)7-5-11/h1-7,9H,8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Metaflumizone"	"604-167-6"	"139968-49-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-cyanobenzoic acid"	"210-606-9"	""	"4-cyanobenzoic acid"	"Not in list"	"C8H5NO2"	"C1=CC(=CC=C1C#N)C(=O)O"	"InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Metaflumizone"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metaflumizone."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3373"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"14"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	""	""	"N-(6-chloro-7-hydroxy-5-methoxy[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"N-(6-chloro-7-hydroxy-5-methoxy [1,2,4] triazolo[1,5-a]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl) pyridine -3-sulfonamide"	"C13H10ClF3N6O5S"	"FC(F)(F)c1ccnc(OC)c1S(=O)(=O)Nc2nc3nc(OC)c(Cl)c(O)n3n2"	"InChI=1S/C13H10ClF3N6O5S/c1-27-8-6(14)10(24)23-12(19-8)20-11(21-23)22-29(25,26)7-5(13(15,16)17)3-4-18-9(7)28-2/h3-4,24H,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)-3-pyridinesulfonic acid"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonic acid"	"Not in list"	"C7H6F3NO4S"	"COc1nccc(c1S(=O)(=O)O)C(F)(F)F"	"InChI=1S/C7H6F3NO4S/c1-15-6-5(16(12,13)14)4(2-3-11-6)7(8,9)10/h2-3H,1H3,(H,12,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	""	""	"2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"2-Methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"C7H7F3N2O3S"	"COc1nccc(c1S(N)(=O)=O)C(F)(F)F"	"InChI=1S/C7H7F3N2O3S/c1-15-6-5(16(11,13)14)4(2-3-12-6)7(8,9)10/h2-3H,1H3,(H2,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is identical to the substance"	"Prothioconazole"	""	"178928-70-6"	"2-[2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,
+4-triazole-3-thione"	"Prothioconazole"	"C14H15Cl2N3OS"	"C1CC1(C(CC2=CC=CC=C2Cl)(CN3C(=S)N=CN3)O)Cl"	"InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1Hpyrazole-5-sulfonic acid"	""	""	"1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-pyrazole-5-sulfonic acid"	"Not in list"	"C15H16Cl2N2O4S"	"OC(Cn1nccc1S(=O)(=O)O)(Cc2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C15H16Cl2N2O4S/c16-12-4-2-1-3-11(12)9-15(20,14(17)6-7-14)10-19-13(5-8-18-19)24(21,22)23/h1-5,8,20H,6-7,9-10H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl)-1H-1,2,4-triazol-5(4H)-one"	""	""	"2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,4-dihydro-3H-1,2,4-triazol-3-one"	"Not in list"	"C14H15Cl2N3O2"	"O=C3NC=NN3CC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)7-14(21,13(16)5-6-13)8-19-12(20)17-9-18-19/h1-4,9,21H,5-8H2,(H,17,18,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)propane-1,2-diol"	"Not in list"	"C14H15Cl2N3O2"	"OC(Cn1cncn1)(C(O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1/C14H15Cl2N3O2/c15-11-4-2-1-3-10(11)12(20)14(21,13(16)5-6-13)7-19-9-17-8-18-19/h1-4,8-9,12,20-21H,5-7H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	""	""	"2-(1-chlorocyclopropyl)-1-(2-chlorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl acetate"	"Not in list"	"C16H17Cl2N3O3"	"OC(Cn1cncn1)(C(OC(C)=O)c2ccccc2Cl)C3(Cl)CC3"	"InChI=1S/C16H17Cl2N3O3/c1-11(22)24-14(12-4-2-3-5-13(12)17)16(23,15(18)6-7-15)8-21-10-19-9-20-21/h2-5,9-10,14,23H,6-8H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Prothioconazole"	""	"178928-70-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(1-Chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	""	""	"2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)propane-1,2-diol"	"Not in list"	"C12H14Cl2O2"	"OCC(O)(Cc1ccccc1Cl)C2(Cl)CC2"	"InChI=1S/C12H14Cl2O2/c13-10-4-2-1-3-9(10)7-12(16,8-15)11(14)5-6-11/h1-4,15-16H,5-8H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Prothioconazole (JAU 6476)"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance prothioconazole"	"39295"	"2007"	"doi:10.2903/j.efsa.2007.106r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is identical to the substance"	"Penoxsulam (DE 638)"	""	"219714-96-2"	"2-(2,2-difluoroethoxy)-N-(5,8-dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Penoxsulam"	"C16H14F5N5O5S"	"COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC"	"InChI=1S/C16H14F5N5O5S/c1-29-10-6-22-15(30-2)26-13(10)23-14(24-26)25-32(27,28)12-8(16(19,20)21)4-3-5-9(12)31-7-11(17)18/h3-6,11H,7H2,1-2H3,(H,24,25)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Penoxsulam (DE-638)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(5-hydroxy-8-methoxy[1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C15H12F5N5O5S"	"FC(F)(F)c1cccc(OCC(F)F)c1S(=O)(=O)Nc2nc3c(cnc(O)n3n2)OC"	"InChI=1S/C15H12F5N5O5S/c1-29-9-5-21-14(26)25-12(9)22-13(23-25)24-31(27,28)11-7(15(18,19)20)3-2-4-8(11)30-6-10(16)17/h2-5,10H,6H2,1H3,(H,21,26)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-({[2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	""	""	"3-({[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonyl}amino)-1H-1,2,4-triazole-5-carboxylic acid"	"Not in list"	"C11H9F5N4O5S"	"OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1"	"InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Penoxsulam"	""	"219714-96-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(2,2-Difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	""	""	"2-(2,2-difluoroethoxy)-N-(1H-1,2,4-triazol-3-yl)-6-(trifluoromethyl)benzenesulfonamide"	"Not in list"	"C11H9F5N4O3S"	"O=S(=O)(Nc1ncnn1)c2c(cccc2OCC(F)F)C(F)(F)F"	"InChI=1/C11H9F5N4O3S/c12-8(13)4-23-7-3-1-2-6(11(14,15)16)9(7)24(21,22)20-10-17-5-18-19-10/h1-3,5,8H,4H2,(H2,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Penoxsulam (Final Addendum to the DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance penoxsulam"	"40078"	"2009"	"doi:10.2903/j.efsa.2009.343r"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mouse spot test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male/Female"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is identical to the substance"	"Pyridate"	"259-686-7"	"55512-33-9"	"O-6-chloro-3-phenylpyridazin-4-yl S-octyl thiocarbonate"	"Pyridate"	"C19H23CIN2O2S"	"CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No data"	"Acceptable"	"Rat (as animal)"	"Fischer344"	""	"No data"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"Pyridafol"	"254-752-1"	"40020-01-7"	"6-chloro-3-phenylpyridazin-4-ol"	"CL 9673 (6-chloro-4-hydroxy-3-phenylpyridazin)"	"C10H7ClN2O"	"C1=CC=C(C=C1)C2=NN=C(C=C2O)Cl"	"InChI=1S/C10H7ClN2O/c11-9-6-8(14)10(13-12-9)7-4-2-1-3-5-7/h1-6H,(H,12,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Pyridate"	"259-686-7"	"55512-33-9"	"single chemical entity"	"Component is a metabolite of the substance"	"6-chloro-4-methoxy-3-phenylpyridazine"	""	"40020-02-8"	"6-chloro-4-methoxy-3-phenylpyridazine"	"Not in list"	"C11H9ClN2O"	"COC1=CC(=NN=C1C2=CC=CC=C2)Cl"	"InChI=1S/C11H9ClN2O/c1-15-9-7-10(12)13-14-11(9)8-5-3-2-4-6-8/h2-7H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria - CoRMS: Latvia"	"Pyridate (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridate"	"41859"	"2014"	"doi:10.2903/j.efsa.2014.3801"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is identical to the substance"	"Prosulfuron"	""	"94125-34-5"	"1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea"	"Prosulfuron"	"C15H16F3N5O4S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F"	"InChI=1S/C15H16F3N5O4S/c1-9-19-12(22-14(20-9)27-2)21-13(24)23-28(25,26)11-6-4-3-5-10(11)7-8-15(16,17)18/h3-6H,7-8H2,1-2H3,(H2,19,20,21,22,23,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C11H13F3N4O3S"	"O=S(=O)(NC(=O)NC(=N)N)c1ccccc1CCC(F)(F)F"	"InChI=1S/C11H13F3N4O3S/c12-11(13,14)6-5-7-3-1-2-4-8(7)22(20,21)18-10(19)17-9(15)16/h1-4H,5-6H2,(H5,15,16,17,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"10"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"10"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Prosulfuron"	""	"94125-34-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	""	""	"2-(3,3,3-trifluoropropyl)benzenesulfonamide"	"Not in list"	"C9H10F3NO2S"	"C1=CC=C(C(=C1)CCC(F)(F)F)S(=O)(=O)N"	"InChI=1S/C9H10F3NO2S/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15/h1-4H,5-6H2,(H2,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France - CoRMS: Slovakia"	"Prosulfuron"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prosulfuron"	"41884"	"2014"	"doi:10.2903/j.efsa.2014.3815"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"Not reported"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is identical to the substance"	"Pyridalyl"	""	"179101-81-6"	"2,6-dichloro-4-(3,3-dichloroallyloxy)phenyl 3-[5-(trifluoromethyl)-2-pyridyloxy]propyl ether"	"Pyridalyl"	"C18H14Cl4F3NO3"	"C1=CC(=NC(=C1)OCCCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F"	"InChI=1S/C18H14Cl4F3NO3/c19-12-9-11(27-8-5-15(21)22)10-13(20)17(12)29-7-2-6-28-16-4-1-3-14(26-16)18(23,24)25/h1,3-5,9-10H,2,6-8H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"Not reported"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"4"	"Male"	"Not reported"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(Trifluoromethyl)-2(1H)-pyridinone"	""	"33252-63-0"	"5-(Trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H4F3NO"	"C1=CC(=O)NC=C1C(F)(F)F"	"InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"4"	"Male"	"Not reported"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Pyridalyl"	""	"179101-81-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	""	""	"3-hydroxy-5-(trifluoromethyl)pyridin-2(1H)-one"	"Not in list"	"C6H4F3NO2"	"OC1=CC(=CNC1=O)C(F)(F)F"	"InChI=1S/C6H4F3NO2/c7-6(8,9)3-1-4(11)5(12)10-2-3/h1-2,11H,(H,10,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Pyridalyl (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyridalyl."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3240"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"15"	"Female"	"intraperitoneal"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"10"	"Male"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"15"	"Male"	"oral: gavage"	"5"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Oryzalin"	"242-777-0"	"19044-88-3"	"single chemical entity"	"Component is identical to the substance"	"Oryzalin"	"242-777-0"	"19044-88-3"	"4-(dipropylamino)-3,5-dinitrobenzenesulfonamide"	"Oryzalin"	"C12H18N4O6S"	"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(N)(=O)=O"	"InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oryzalin (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oryzalin."	"40424"	"2010"	"doi:10.2903/j.efsa.2010.1707"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"RAW 264.7"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"30"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"30"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is identical to the substance"	"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"[Cyano-(3-phenoxyphenyl)methyl] 3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropane-1-carboxylate"	"Lambda-Cyhalothrin"	"C23H19ClF3NO3"	"C1([C@H]([C@H]1C(O[C@@H](c1cc(Oc2ccccc2)ccc1)C#N)=O)\C=C(\C(F)(F)F)Cl)(C)C"	"InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18+,20-/m0/s1"	"organic"	"representative isomer"	"ChemIDPlus"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"30"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl (1RS,3RS)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylate"	""	""	"2-amino-2-oxo-1-(3-phenoxyphenyl)ethyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate"	"Not in list"	"C23H21ClF3NO4"	"Cl\C(=C/C3C(C(=O)OC(c2cccc(Oc1ccccc1)c2)C(N)=O)C3(C)C)C(F)(F)F"	"InChI=1S/C23H21ClF3NO4/c1-22(2)16(12-17(24)23(25,26)27)18(22)21(30)32-19(20(28)29)13-7-6-10-15(11-13)31-14-8-4-3-5-9-14/h3-12,16,18-19H,1-2H3,(H2,28,29)/b17-12-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-hydroxy(3-phenoxyphenyl)acetonitrile"	""	""	"hydroxy(3-phenoxyphenyl)acetonitrile"	"Not in list"	"C14H11NO2"	"N#CC(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H11NO2/c15-10-14(16)11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9,14,16H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-phenoxyphenyl)methanol"	"237-525-1"	"13826-35-2"	"(3-phenoxyphenyl)methanol"	"Not in list"	"C13H12O2"	"C1=CC=C(C=C1)OC2=CC=CC(=C2)CO"	"InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"hydroxy(3-phenoxyphenyl)acetic acid"	""	""	"hydroxy(3-phenoxyphenyl)acetic acid"	"Not in list"	"C14H12O4"	"O=C(O)C(O)c2cc(Oc1ccccc1)ccc2"	"InChI=1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"44"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"44"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1S,3S)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@@H]1[C@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"68"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Lambda-cyhalothrin"	"415-130-7"	"91465-08-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	""	""	"(1R,3R)-3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylic acid"	"Not in list"	"C9H10ClF3O2"	"Cl\C(=C/[C@H]1[C@@H](C(=O)O)C1(C)C)C(F)(F)F"	"InChI=1/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"68"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden - CoRMS: Spain"	"Lambda-Cyhalothrin"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lambda-cyhalothrin"	"41772"	"2014"	"doi:10.2903/j.efsa.2014.3677"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"3"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is identical to the substance"	"Pymetrozine"	""	"123312-89-0"	"6-methyl-4-[(E)-pyridin-3-ylmethylideneamino]-2,5-dihydro-1,2,4-triazin-3-one"	"Pymetrozine"	"C10H11N5O"	"CC1=NNC(=O)N(C1)N=CC2=CN=CC=C2"	"InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"3"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	""	""	"4-amino-6-methyl-4,5-dihydro-1,2,4-triazin-3(2H)-one"	"Not in list"	"C4H8N4O"	"O=C1NN=C(C)CN1N"	"InChI=1S/C4H8N4O/c1-3-2-8(5)4(9)7-6-3/h2,5H2,1H3,(H,7,9)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"4"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"4"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Pymetrozine"	""	"123312-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"nicotinaldehyde"	"207-900-4"	""	"pyridine-3-carbaldehyde"	"Not in list"	"C6H5NO"	"C1=CC(=CN=C1)C=O"	"InChI=1S/C6H5NO/c8-5-6-2-1-3-7-4-6/h1-5H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany - CoRMS: Belgium"	"Pymetrozine (Final Addendum to the DAR)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pymetrozine"	"41891"	"2014"	"doi:10.2903/j.efsa.2014.3817"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propaquizafop"	""	"111479-05-1"	"single chemical entity"	"Component is identical to the substance"	"Propaquizafop"	""	"111479-05-1"	"2-[(propan-2-ylideneamino)oxy]ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate"	"Propaquizafop"	"C22H22ClN3O5"	"C/C(C)=N\OCCOC(=O)[C@@H](C)Oc1ccc(cc1)Oc2cnc3cc(Cl)ccc3n2"	"InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Italy"	"Propaquizafop"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of propaquizafop (an ester variant of quizalofop-P)"	"39889"	"2009"	"doi:10.2903/j.efsa.2009.204r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"36"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CFLP"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"single chemical entity"	"Component is identical to the substance"	"Propamocarb hydrochloride"	"247-125-9"	"25606-41-1"	"Dimethyl-[3-(propoxycarbonylamino)propyl]azanium;chloride"	"N-desmethyl propamocarb"	"C9H21ClN2O2"	"CCCOC(=O)NCCC[NH+](C)C.[Cl-]"	"InChI=1S/C9H20N2O2.ClH/c1-4-8-13-9(12)10-6-5-7-11(2)3;/h4-8H2,1-3H3,(H,10,12);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"ICR"	"25"	"Male"	"oral: drinking water"	"8"	"week"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Propamocarb"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance propamocarb"	"38903"	"2006"	"doi:10.2903/j.efsa.2006.78r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: gavage"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	""	"Male"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Female"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Female"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is identical to the substance"	"Metribuzin"	"244-209-7"	"21087-64-9"	"4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one"	"Metribuzin"	"C8H14N4OS"	"CC(C)(C)C1=NN=C(N(C1=O)N)SC"	"InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Metribuzin"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Metribuzin"	"244-209-7"	"21087-64-9"	"single chemical entity"	"Component is a metabolite of the substance"	"desaminodiketo-metribuzin"	""	""	"6-tert-butyl-2H-1,2,4-triazine-3,5-dione"	"Not in list"	"C7H11N3O2"	"CC(C)(C)C1=NNC(=O)NC1=O"	"InChI=1S/C7H11N3O2/c1-7(2,3)4-5(11)8-6(12)10-9-4/h1-3H3,(H2,8,10,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Metribuzin (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metribuzin"	"38978"	"2006"	"doi:10.2903/j.efsa.2006.88r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: unspecified"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Hamster (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Hamster (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Hamster (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Hamster (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Hamster (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Hamster (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Hamster (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Prochloraz-Copper"	""	"156065-03-1"	"Dichlorotetrakids-[N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl] imidazole-1-carboxamide]copper(II)"	"Not in list"	"C60H64Cl14CuN12O8"	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male"	"oral: feed"	"8"	"week"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Formyl-1-propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	""	""	"N-[propyl-[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl]formamide"	"Not in list"	"C13H15Cl3N2O3"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)NC=O"	"InChI=1S/C13H15Cl3N2O3/c1-2-3-18(13(20)17-8-19)4-5-21-12-10(15)6-9(14)7-11(12)16/h6-8H,2-5H2,1H3,(H,17,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Propyl-1-[2-(2,4,6 trichlorophenoxy)ethyl]urea"	""	""	"1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea"	"Not in list"	"C12H15Cl3N2O2"	"CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N"	"InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No data"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	""	"Male"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Prochloraz"	"266-994-5"	"67747-09-5"	"single chemical entity"	"Component is identical to the substance"	"Prochloraz"	"266-994-5"	"67747-09-5"	"N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-1H-imidazole-1-carboxamide"	"Prochloraz"	"C15H16Cl3N3O2"	"O=C(N(CCOc1c(Cl)cc(Cl)cc1Cl)CCC)n2ccnc2"	"InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Prochloraz (Addendum)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance prochloraz"	"40746"	"2011"	"doi:10.2903/j.efsa.2011.2323"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"large colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No data"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"10"	"Male"	"oral: unspecified"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No data"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"10"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is identical to the substance"	"Pirimicarb"	"245-430-1"	"23103-98-2"	"[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate"	"Pirimicarb"	"C11H18N4O2"	"CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C"	"InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"15"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"large colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	""	""	"5,6-dimethyl-2-(methylamino)pyrimidin-4-ol"	"Not in list"	"C7H11N3O"	"Cc1nc(NC)nc(O)c1C"	"InChI=1S/C7H11N3O/c1-4-5(2)9-7(8-3)10-6(4)11/h1-3H3,(H2,8,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"large colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"large colonies"	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"6"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"6"	"Male/Female"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimicarb"	"245-430-1"	"23103-98-2"	"single chemical entity"	"Component is a metabolite of the substance"	"2-dimethylamino-5,6-dimethylpyrimidin-4-ol"	""	""	"2-(dimethylamino)-5,6-dimethylpyrimidin-4-ol"	"Not in list"	"C8H13N3O"	"Cc1nc(nc(O)c1C)N(C)C"	"InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pirimicarb"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance pirimicarb"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.43r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"5"	"Male"	"oral: gavage"	"16"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"5"	"Male"	"oral: gavage"	"2"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"15"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1532"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1532"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male"	"oral: unspecified"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"single chemical entity"	"Component is identical to the substance"	"Pirimiphos-methyl"	"249-528-5"	"29232-93-7"	"O-[2-(diethylamino)-6-methylpyrimidin-4-yl] O,O-dimethyl thiophosphate"	"Pirimiphos-methyl"	"C11H20N3O3PS"	"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1"	"InChI=1/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"ICR"	"4"	"Female"	"Not reported"	""	""	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pirimiphos-methyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance pirimiphos-methyl"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.44r"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: unspecified"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is identical to the substance"	"Isoxaflutole"	"604-222-4"	"141112-29-0"	"(5-cyclopropyl-1,2-oxazol-4-yl)-[2-methylsulfonyl-4-(trifluoromethyl)phenyl]methanone"	"Isoxaflutole"	"C15H12F3NO4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C2=C(ON=C2)C3CC3"	"InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	""	""	"3-cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3-oxopropanenitrile"	"Not in list"	"C15H12F3NO4S"	"O=C(C(C#N)C(=O)C1CC1)c2ccc(cc2S(C)(=O)=O)C(F)(F)F"	"InChI=1S/C15H12F3NO4S/c1-24(22,23)12-6-9(15(16,17)18)4-5-10(12)14(21)11(7-19)13(20)8-2-3-8/h4-6,8,11H,2-3H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Isoxaflutole"	"604-222-4"	"141112-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-mesyl-4-trifluoromethylbenzoic acid"	""	"142994-06-7"	"2-methylsulfonyl-4-(trifluoromethyl)benzoic acid"	"Not in list"	"C9H7F3O4S"	"CS(=O)(=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)O"	"InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy - CoRMS: Slovenia"	"Isoxaflutole"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance isoxaflutole"	"42424"	"2016"	"doi:10.2903/j.efsa.2016.4416"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"3"	"Male"	"Not reported"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is identical to the substance"	"Pinoxaden"	""	"243973-20-8"	"[8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl] 2,2-dimethylpropanoate"	"Pinoxaden"	"C23H32N2O4"	"CCC1=CC(=CC(=C1C2=C(N3CCOCCN3C2=O)OC(=O)C(C)(C)C)CC)C"	"InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"3"	"Male"	"Not reported"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"3"	"No data"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (NOA 447204)"	""	""	"8-(2,6-diethyl-4-methyl-phenyl)-8-hydroxy -tetrahydropyrazolo[1,2-d][1,4,5]oxadiazepine-7,9-dione"	"Not in list"	"C18H24N2O4"	"CCc1cc(C)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O4/c1-4-13-10-12(3)11-14(5-2)15(13)18(23)16(21)19-6-8-24-9-7-20(19)17(18)22/h10-11,23H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"3"	"No data"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 502836)"	""	""	"3,5-diethyl-4-(9-hydroxy-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-8-yl)benzoic acid"	"Not in list"	"C18H22N2O5"	"O=C(O)c3cc(CC)c(C=2C(=O)N1CCOCCN1C=2O)c(CC)c3"	"InChI=1S/C18H22N2O5/c1-3-11-9-13(18(23)24)10-12(4-2)14(11)15-16(21)19-5-7-25-8-6-20(19)17(15)22/h9-10,21H,3-8H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"large colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"35"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"35"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"3"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pinoxaden"	""	"243973-20-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Pinoxaden metabolite (SYN 505887)"	""	""	"8-[2,6-diethyl-4-(hydroxymethyl)phenyl]-8-hydroxytetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepine-7,9(8H)-dione"	"Not in list"	"C18H24N2O5"	"CCc1cc(CO)cc(CC)c1C3(O)C(=O)N2CCOCCN2C3=O"	"InChI=1S/C18H24N2O5/c1-3-13-9-12(11-21)10-14(4-2)15(13)18(24)16(22)19-5-7-25-8-6-20(19)17(18)23/h9-10,21,24H,3-8,11H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"3"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Pinoxaden (NOA 407855)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pinoxaden."	"41502"	"2013"	"doi:10.2903/j.efsa.2013.3269"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Strain S211c S. cerevisiae"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"S138"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"Yes"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is identical to the substance"	"Pencycuron"	"266-096-3"	"66063-05-6"	"1-(4-chlorobenzyl)-1-cyclopentyl-3-phenylurea"	"Pencycuron"	"C19H21ClN2O"	"O=C(NC2=CC=CC=C2)N(C3CCCC3)CC1=CC=C(Cl)C=C1"	"InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Pencycuron"	"266-096-3"	"66063-05-6"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-chlorobenzyl)cyclopentanamine"	""	""	"N-(4-chlorobenzyl)cyclopentanamine"	"Not in list"	"C12H16ClN"	"Clc1ccc(cc1)CNC2CCCC2"	"InChI=1S/C12H16ClN/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12,14H,1-4,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Pencycuron (Final Addendum to the DAR)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pencycuron"	"40455"	"2010"	"doi:10.2903/j.efsa.2010.1828"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"4"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	"direct evidence-cytotoxicity"	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is identical to the substance"	"Phosalone"	"218-996-2"	"2310-17-0"	"S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate"	"Phosalone"	"C12H15ClNO4PS2"	"CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12"	"InChI=1/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Phosalone"	"218-996-2"	"2310-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-7-chloro-3H-phenoxazin-3-one"	""	""	"2-amino-7-chloro-3H-phenoxazin-3-one"	"Not in list"	"C12H7ClN2O2"	"NC1=CC2=Nc3ccc(Cl)cc3OC2=CC1=O"	"InChI=1S/C12H7ClN2O2/c13-6-1-2-8-11(3-6)17-12-5-10(16)7(14)4-9(12)15-8/h1-5H,14H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Phosalone"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosalone"	"38782"	"2006"	"doi:10.2903/j.efsa.2006.60r"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is identical to the substance"	"Penflufen"	""	"494793-67-8"	"5-fluoro-1,3-dimethyl-N-[2-(4-methylpentan-2-yl)phenyl]-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O"	"O=C(Nc1ccccc1C(C)CC(C)C)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O/c1-11(2)10-12(3)14-8-6-7-9-15(14)20-18(23)16-13(4)21-22(5)17(16)19/h6-9,11-12H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-fluoro-N-[2-(3-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"5-fluoro-N-[2-(4-hydroxy-4-methylpentan-2-yl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H24FN3O2"	"O=C(Nc1ccccc1C(C)CC(C)(C)O)c2c(F)n(C)nc2C"	"InChI=1S/C18H24FN3O2/c1-11(10-18(3,4)24)13-8-6-7-9-14(13)20-17(23)15-12(2)21-22(5)16(15)19/h6-9,11,24H,10H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Penflufen"	""	"494793-67-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	""	""	"N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C14H14FN3O2"	"O=C(Nc1ccccc1C(C)=O)c2c(F)n(C)nc2C"	"InChI=1S/C14H14FN3O2/c1-8-12(13(15)18(3)17-8)14(20)16-11-7-5-4-6-10(11)9(2)19/h4-7H,1-3H3,(H,16,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penflufen"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penflufen"	"41142"	"2012"	"doi:10.2903/j.efsa.2012.2860"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"60"	"Male/Female"	"oral: gavage"	"51"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"60"	"Male/Female"	"oral: gavage"	"27"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"60"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"single chemical entity"	"Component is identical to the substance"	"Oxyfluorfen"	"255-983-0"	"42874-03-3"	"2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)benzene"	"Oxyfluorfen"	"C15H11ClF3NO4"	"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Oxyfluorfen"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance oxyfluorfen"	"40505"	"2010"	"doi:10.2903/j.efsa.2010.1906"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"16"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"16"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"16"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"6"	"Male"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"5"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"5"	"Male"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is identical to the substance"	"Paclobutrazol"	""	"76738-62-0"	"1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol"	"Paclobutrazol"	"C15H20ClN3O"	"OC(C(C)(C)C)C(CC(C=C1)=CC=C1Cl)N2N=CN=C2"	"InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male"	"oral: gavage"	"5"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Paclobutrazol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Paclobutrazol"	""	"76738-62-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole lactic acid"	""	""	"2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole lactic acid"	"C5H7N3O3"	"OC(Cn1cncn1)C(=O)O"	"InChI=1S/C5H7N3O3/c9-4(5(10)11)1-8-3-6-2-7-8/h2-4,9H,1H2,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"Rms: The United Kingdom"	"Paclobutrazol (Additional Report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance paclobutrazol"	"40486"	"2010"	"doi:10.2903/j.efsa.2010.1876"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"24"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"24"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[2-(dimethylcarbamoyl)phenyl] sulfamic acid"	""	""	"[2-(dimethylcarbamoyl)phenyl]sulfamic acid"	"Not in list"	"C9H12N2O4S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)O"	"InChI=1S/C9H12N2O4S/c1-11(2)9(12)7-5-3-4-6-8(7)10-16(13,14)15/h3-6,10H,1-2H3,(H,13,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"(4,6-dimethoxypyrimidin-2-yl)urea"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)urea"	"Not in list"	"C7H10N4O3"	"O=C(N)Nc1nc(cc(OC)n1)OC"	"InChI=1S/C7H10N4O3/c1-13-4-3-5(14-2)10-7(9-4)11-6(8)12/h3H,1-2H3,(H3,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-methoxy-6-hydroxypyrimidin-2-yl)-3-[2-(2-dimethylcarbamoyl)phenylsulfamoyl]urea"	""	""	"2-{[({[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]amino}oxy)sulfinyl]amino}-N,N-dimethylbenzamide"	"Not in list"	"C15H18N6O6S"	"O=C(Nc1nc(O)cc(OC)n1)NOS(=O)Nc2ccccc2C(=O)N(C)C"	"InChI=1S/C15H18N6O6S/c1-21(2)13(23)9-6-4-5-7-10(9)20-28(25)27-19-15(24)18-14-16-11(22)8-12(17-14)26-3/h4-8,20H,1-3H3,(H3,16,17,18,19,22,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Orthosulfamuron"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"no information"	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"no information"	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"no data"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"5"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"5"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"AB/Jena Halle House mouse"	"6"	"Male"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"AB/Jena Halle House mouse"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"AB/Jena Halle House mouse"	"6"	"Male"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Phosmet"	"211-987-4"	"732-11-6"	"single chemical entity"	"Component is identical to the substance"	"Phosmet"	"211-987-4"	"732-11-6"	"S-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O,O-dimethyl dithiophosphate"	"Phosmet"	"C11H12NO4PS2"	"COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O"	"InChI=1/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"AB/Jena Halle House mouse"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Phosmet"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance phosmet"	"38889"	"2006"	"doi:10.2903/j.efsa.2006.75r"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is identical to the substance"	"Penthiopyrad"	""	"183675-82-3"	"1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Penthiopyrad"	"C16H20F3N3OS"	"O=C(Nc1ccsc1C(C)CC(C)C)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"5-(Trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H3F3N2O2"	"C1=NNC(=C1C(=O)O)C(F)(F)F"	"InChI=1S/C5H3F3N2O2/c6-5(7,8)3-2(4(11)12)1-9-10-3/h1H,(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"5-(Trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H3F3N2O2"	"C1=NNC(=C1C(=O)O)C(F)(F)F"	"InChI=1S/C5H3F3N2O2/c6-5(7,8)3-2(4(11)12)1-9-10-3/h1H,(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"5-(Trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H3F3N2O2"	"C1=NNC(=C1C(=O)O)C(F)(F)F"	"InChI=1S/C5H3F3N2O2/c6-5(7,8)3-2(4(11)12)1-9-10-3/h1H,(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"5-(Trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H3F3N2O2"	"C1=NNC(=C1C(=O)O)C(F)(F)F"	"InChI=1S/C5H3F3N2O2/c6-5(7,8)3-2(4(11)12)1-9-10-3/h1H,(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"5-(Trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H3F3N2O2"	"C1=NNC(=C1C(=O)O)C(F)(F)F"	"InChI=1S/C5H3F3N2O2/c6-5(7,8)3-2(4(11)12)1-9-10-3/h1H,(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"5-(Trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H3F3N2O2"	"C1=NNC(=C1C(=O)O)C(F)(F)F"	"InChI=1S/C5H3F3N2O2/c6-5(7,8)3-2(4(11)12)1-9-10-3/h1H,(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"5-(Trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H3F3N2O2"	"C1=NNC(=C1C(=O)O)C(F)(F)F"	"InChI=1S/C5H3F3N2O2/c6-5(7,8)3-2(4(11)12)1-9-10-3/h1H,(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3-Trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"5-(Trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H3F3N2O2"	"C1=NNC(=C1C(=O)O)C(F)(F)F"	"InChI=1S/C5H3F3N2O2/c6-5(7,8)3-2(4(11)12)1-9-10-3/h1H,(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C6H5F3N2O2"	"FC(F)(F)c1nn(C)cc1C(=O)O"	"InChI=1S/C6H5F3N2O2/c1-11-2-3(5(12)13)4(10-11)6(7,8)9/h2H,1H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C6H5F3N2O2"	"FC(F)(F)c1nn(C)cc1C(=O)O"	"InChI=1S/C6H5F3N2O2/c1-11-2-3(5(12)13)4(10-11)6(7,8)9/h2H,1H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C6H5F3N2O2"	"FC(F)(F)c1nn(C)cc1C(=O)O"	"InChI=1S/C6H5F3N2O2/c1-11-2-3(5(12)13)4(10-11)6(7,8)9/h2H,1H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C6H5F3N2O2"	"FC(F)(F)c1nn(C)cc1C(=O)O"	"InChI=1S/C6H5F3N2O2/c1-11-2-3(5(12)13)4(10-11)6(7,8)9/h2H,1H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C6H5F3N2O2"	"FC(F)(F)c1nn(C)cc1C(=O)O"	"InChI=1S/C6H5F3N2O2/c1-11-2-3(5(12)13)4(10-11)6(7,8)9/h2H,1H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C6H5F3N2O2"	"FC(F)(F)c1nn(C)cc1C(=O)O"	"InChI=1S/C6H5F3N2O2/c1-11-2-3(5(12)13)4(10-11)6(7,8)9/h2H,1H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C6H5F3N2O2"	"FC(F)(F)c1nn(C)cc1C(=O)O"	"InChI=1S/C6H5F3N2O2/c1-11-2-3(5(12)13)4(10-11)6(7,8)9/h2H,1H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C6H5F3N2O2"	"FC(F)(F)c1nn(C)cc1C(=O)O"	"InChI=1S/C6H5F3N2O2/c1-11-2-3(5(12)13)4(10-11)6(7,8)9/h2H,1H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid"	""	""	"1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C6H5F3N2O2"	"FC(F)(F)c1nn(C)cc1C(=O)O"	"InChI=1S/C6H5F3N2O2/c1-11-2-3(5(12)13)4(10-11)6(7,8)9/h2H,1H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-(3-hydroxy-1,3-dimethylbutyl) thiophen-3-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-(4-hydroxy-4-methylpentan-2-yl)thiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O2S"	"O=C(Nc1ccsc1C(C)CC(C)(C)O)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3O2S/c1-9(7-15(2,3)24)12-11(5-6-25-12)20-14(23)10-8-22(4)21-13(10)16(17,18)19/h5-6,8-9,24H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-(3-hydroxy-1,3-dimethylbutyl) thiophen-3-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-(4-hydroxy-4-methylpentan-2-yl)thiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O2S"	"O=C(Nc1ccsc1C(C)CC(C)(C)O)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3O2S/c1-9(7-15(2,3)24)12-11(5-6-25-12)20-14(23)10-8-22(4)21-13(10)16(17,18)19/h5-6,8-9,24H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-(3-hydroxy-1,3-dimethylbutyl) thiophen-3-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-(4-hydroxy-4-methylpentan-2-yl)thiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O2S"	"O=C(Nc1ccsc1C(C)CC(C)(C)O)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3O2S/c1-9(7-15(2,3)24)12-11(5-6-25-12)20-14(23)10-8-22(4)21-13(10)16(17,18)19/h5-6,8-9,24H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-(3-hydroxy-1,3-dimethylbutyl) thiophen-3-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-(4-hydroxy-4-methylpentan-2-yl)thiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O2S"	"O=C(Nc1ccsc1C(C)CC(C)(C)O)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3O2S/c1-9(7-15(2,3)24)12-11(5-6-25-12)20-14(23)10-8-22(4)21-13(10)16(17,18)19/h5-6,8-9,24H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-(3-hydroxy-1,3-dimethylbutyl) thiophen-3-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-(4-hydroxy-4-methylpentan-2-yl)thiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O2S"	"O=C(Nc1ccsc1C(C)CC(C)(C)O)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3O2S/c1-9(7-15(2,3)24)12-11(5-6-25-12)20-14(23)10-8-22(4)21-13(10)16(17,18)19/h5-6,8-9,24H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-(3-hydroxy-1,3-dimethylbutyl) thiophen-3-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-(4-hydroxy-4-methylpentan-2-yl)thiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O2S"	"O=C(Nc1ccsc1C(C)CC(C)(C)O)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3O2S/c1-9(7-15(2,3)24)12-11(5-6-25-12)20-14(23)10-8-22(4)21-13(10)16(17,18)19/h5-6,8-9,24H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-(3-hydroxy-1,3-dimethylbutyl) thiophen-3-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-(4-hydroxy-4-methylpentan-2-yl)thiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O2S"	"O=C(Nc1ccsc1C(C)CC(C)(C)O)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3O2S/c1-9(7-15(2,3)24)12-11(5-6-25-12)20-14(23)10-8-22(4)21-13(10)16(17,18)19/h5-6,8-9,24H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-(3-hydroxy-1,3-dimethylbutyl) thiophen-3-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-(4-hydroxy-4-methylpentan-2-yl)thiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O2S"	"O=C(Nc1ccsc1C(C)CC(C)(C)O)c2cn(C)nc2C(F)(F)F"	"InChI=1S/C16H20F3N3O2S/c1-9(7-15(2,3)24)12-11(5-6-25-12)20-14(23)10-8-22(4)21-13(10)16(17,18)19/h5-6,8-9,24H,7H2,1-4H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[5-hydroxy-5-(1,3-dimethylbutyl)-2-oxo-2,5-dihydrothiophen-4-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-hydroxy-2-(4-methylpentan-2-yl)-5-oxo-2,5-dihydrothiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O3S"	"OC2(SC(=O)C=C2NC(=O)c1cn(C)nc1C(F)(F)F)C(C)CC(C)C"	"InChI=1S/C16H20F3N3O3S/c1-8(2)5-9(3)15(25)11(6-12(23)26-15)20-14(24)10-7-22(4)21-13(10)16(17,18)19/h6-9,25H,5H2,1-4H3,(H,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[5-hydroxy-5-(1,3-dimethylbutyl)-2-oxo-2,5-dihydrothiophen-4-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-hydroxy-2-(4-methylpentan-2-yl)-5-oxo-2,5-dihydrothiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O3S"	"OC2(SC(=O)C=C2NC(=O)c1cn(C)nc1C(F)(F)F)C(C)CC(C)C"	"InChI=1S/C16H20F3N3O3S/c1-8(2)5-9(3)15(25)11(6-12(23)26-15)20-14(24)10-7-22(4)21-13(10)16(17,18)19/h6-9,25H,5H2,1-4H3,(H,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[5-hydroxy-5-(1,3-dimethylbutyl)-2-oxo-2,5-dihydrothiophen-4-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-hydroxy-2-(4-methylpentan-2-yl)-5-oxo-2,5-dihydrothiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O3S"	"OC2(SC(=O)C=C2NC(=O)c1cn(C)nc1C(F)(F)F)C(C)CC(C)C"	"InChI=1S/C16H20F3N3O3S/c1-8(2)5-9(3)15(25)11(6-12(23)26-15)20-14(24)10-7-22(4)21-13(10)16(17,18)19/h6-9,25H,5H2,1-4H3,(H,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[5-hydroxy-5-(1,3-dimethylbutyl)-2-oxo-2,5-dihydrothiophen-4-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-hydroxy-2-(4-methylpentan-2-yl)-5-oxo-2,5-dihydrothiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O3S"	"OC2(SC(=O)C=C2NC(=O)c1cn(C)nc1C(F)(F)F)C(C)CC(C)C"	"InChI=1S/C16H20F3N3O3S/c1-8(2)5-9(3)15(25)11(6-12(23)26-15)20-14(24)10-7-22(4)21-13(10)16(17,18)19/h6-9,25H,5H2,1-4H3,(H,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[5-hydroxy-5-(1,3-dimethylbutyl)-2-oxo-2,5-dihydrothiophen-4-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-hydroxy-2-(4-methylpentan-2-yl)-5-oxo-2,5-dihydrothiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O3S"	"OC2(SC(=O)C=C2NC(=O)c1cn(C)nc1C(F)(F)F)C(C)CC(C)C"	"InChI=1S/C16H20F3N3O3S/c1-8(2)5-9(3)15(25)11(6-12(23)26-15)20-14(24)10-7-22(4)21-13(10)16(17,18)19/h6-9,25H,5H2,1-4H3,(H,20,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[5-hydroxy-5-(1,3-dimethylbutyl)-2-oxo-2,5-dihydrothiophen-4-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-hydroxy-2-(4-methylpentan-2-yl)-5-oxo-2,5-dihydrothiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O3S"	"OC2(SC(=O)C=C2NC(=O)c1cn(C)nc1C(F)(F)F)C(C)CC(C)C"	"InChI=1S/C16H20F3N3O3S/c1-8(2)5-9(3)15(25)11(6-12(23)26-15)20-14(24)10-7-22(4)21-13(10)16(17,18)19/h6-9,25H,5H2,1-4H3,(H,20,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[5-hydroxy-5-(1,3-dimethylbutyl)-2-oxo-2,5-dihydrothiophen-4-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-hydroxy-2-(4-methylpentan-2-yl)-5-oxo-2,5-dihydrothiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O3S"	"OC2(SC(=O)C=C2NC(=O)c1cn(C)nc1C(F)(F)F)C(C)CC(C)C"	"InChI=1S/C16H20F3N3O3S/c1-8(2)5-9(3)15(25)11(6-12(23)26-15)20-14(24)10-7-22(4)21-13(10)16(17,18)19/h6-9,25H,5H2,1-4H3,(H,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[5-hydroxy-5-(1,3-dimethylbutyl)-2-oxo-2,5-dihydrothiophen-4-yl]-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"N-[2-hydroxy-2-(4-methylpentan-2-yl)-5-oxo-2,5-dihydrothiophen-3-yl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide"	"Not in list"	"C16H20F3N3O3S"	"OC2(SC(=O)C=C2NC(=O)c1cn(C)nc1C(F)(F)F)C(C)CC(C)C"	"InChI=1S/C16H20F3N3O3S/c1-8(2)5-9(3)15(25)11(6-12(23)26-15)20-14(24)10-7-22(4)21-13(10)16(17,18)19/h6-9,25H,5H2,1-4H3,(H,20,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Penthiopyrad"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Penthiopyrad"	""	"183675-82-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-Methyl-3-trifluoromethyl-1H-pyrazole-4-carboxamide"	""	""	"1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxamide"	"Not in list"	"C6H6F3N3O"	"CN1C=C(C(=N1)C(F)(F)F)C(=O)N"	"InChI=1S/C6H6F3N3O/c1-12-2-3(5(10)13)4(11-12)6(7,8)9/h2H,1H3,(H2,10,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Penthiopyrad (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance penthiopyrad."	"41320"	"2013"	"doi:10.2903/j.efsa.2013.3111"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-proficient"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"DNA-polymerase-A-deficient"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is identical to the substance"	"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"Aluminum;ethoxy-oxido-oxophosphanium"	"Fosetyl-aluminium"	"C6H15AlO9P3+3"	"CCO[P+](=O)[O-].CCO[P+](=O)[O-].CCO[P+](=O)[O-].[Al+3]"	"InChI=1S/3C2H5O3P.Al/c3*1-2-5-6(3)4;/h3*2H2,1H3;/q;;;+3"	"organometallic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"K12"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Fosetyl-aluminium"	"254-320-2"	"39148-24-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Phosphorous acid"	"233-663-1"	"10294-56-1"	"Phosphorous acid"	"Not in list"	"H3O3P"	"OP(O)O"	"InChI=1S/H3O3P/c1-4(2)3/h1-3H"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Fosetyl-Al"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fosetyl"	"38735"	"2006"	"doi:10.2903/j.efsa.2006.54r"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Potassium phosphite"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"5"	"Male"	"intraveneous"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Potassium phosphite (Addendum 1)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Potassium phosphonates"	""	""	"mixture or formulation"	"Component is identical to the substance"	"Potassium phosphonates"	""	""	"tripotassium;phosphite"	"Not in list"	"K3O3P"	"[O-]P([O-])[O-].[K+].[K+].[K+]"	"InChI=1S/3K.O3P/c;;;1-4(2)3/q3*+1;-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"5"	"Male"	"intraveneous"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Potassium phosphite (Addendum 1)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance potassium phosphonates"	"41261"	"2012"	"doi:10.2903/j.efsa.2012.2963"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"S138"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"S138"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"S211α"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"S211α"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Testis cell"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"no information"	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No data"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mouse spot test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male/Female"	"oral: unspecified"	""	""	"yes"	"not applicable"	"Positive"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"Male"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male"	"intraperitoneal"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"20"	"Male"	"intraperitoneal"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"No data"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Oxydemeton-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"single chemical entity"	"Component is identical to the substance"	"Oxydemeton-methyl"	"206-110-7"	"301-12-2"	"1-Dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane"	"Oxydemeton-methyl"	"C6H15O4PS2"	"CCS(=O)CCSP(=O)(OC)OC"	"InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Oxydemeton-methyl (Final Addendum to the DAR)"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance oxydemeton-methyl"	"38926"	"2006"	"doi:10.2903/j.efsa.2006.86r"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male"	"oral: gavage"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"42"	"Male/Female"	"oral: gavage"	"51"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"42"	"Male/Female"	"oral: gavage"	"27"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"42"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is identical to the substance"	"Myclobutanil"	""	"88671-89-0"	"2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile"	"Myclobutanil"	"C15H17ClN4"	"Clc1ccc(cc1)C(CCCC)(Cn2cncn2)C#N"	"InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	""	"25"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Tetraconazole"	"407-760-6"	"112281-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Tetraconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Tetraconazole"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.152r"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Difenoconazole"	"601-613-1"	"119446-68-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden"	"Difenoconazole"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance difenoconazole"	"40550"	"2011"	"doi:10.2903/j.efsa.2011.1967"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Bitertanol"	"259-513-5"	"55179-31-2"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Bitertanol"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance bitertanol"	"40476"	"2010"	"doi:10.2903/j.efsa.2010.1850"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Myclobutanil"	""	"88671-89-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	""	""	"3-(4-chlorophenyl)-3-cyano-4-(1H-1,2,4-triazol-1-yl)butanoic acid"	"Not in list"	"C13H11ClN4O2"	"Clc1ccc(cc1)C(CC(=O)O)(Cn2cncn2)C#N"	"InChI=1S/C13H11ClN4O2/c14-11-3-1-10(2-4-11)13(6-15,5-12(19)20)7-18-9-16-8-17-18/h1-4,8-9H,5,7H2,(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"48"	"h"	"yes, historical"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium"	"Myclobutanil (Revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance myclobutanil1"	"40480"	"2010"	"doi:10.2903/j.efsa.2010.1682"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"5"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)ethanediamide"	"Not in list"	"C14H16N4O2"	"O=C(N(Cn1cccn1)c2c(C)cccc2C)C(N)=O"	"InChI=1S/C14H16N4O2/c1-10-5-3-6-11(2)12(10)18(14(20)13(15)19)9-17-8-4-7-16-17/h3-8H,9H2,1-2H3,(H2,15,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonic acid"	""	""	"2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonic acid"	"Not in list"	"C14H17N3O4S"	"O=C(CS(=O)(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"sodium N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfonate"	""	""	"sodium 2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethanesulfonate"	"Not in list"	"C14H16N3NaO4S"	"O=C(CS(=O)(=O)O[Na])N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H17N3O4S.Na/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21;/h3-8H,9-10H2,1-2H3,(H,19,20,21);/q;+1/p-1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is identical to the substance"	"Metazachlor"	"266-583-0"	"67129-08-2"	"2-chloro-N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Metazachlor"	"C14H16ClN3O"	"O=C(CCl)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl acetic acid"	""	""	"({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)acetic acid"	"Not in list"	"C16H19N3O4S"	"O=C(CS(=O)CC(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C16H19N3O4S/c1-12-5-3-6-13(2)16(12)19(11-18-8-4-7-17-18)14(20)9-24(23)10-15(21)22/h3-8H,9-11H2,1-2H3,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfoxide"	""	""	"N-(2,6-dimethylphenyl)-2-(methylsulfinyl)-N-(1H-pyrazol-1-ylmethyl)acetamide"	"Not in list"	"C15H19N3O2S"	"O=C(CS(C)=O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C15H19N3O2S/c1-12-6-4-7-13(2)15(12)18(14(19)10-21(3)20)11-17-9-5-8-16-17/h4-9H,10-11H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[(2-hydroxycarbonyl-6-methyl)phenyl]-N-(1H-pyrazol-1-ylmethyl)oxalamide"	""	""	"2-[(carboxycarbonyl)(1H-pyrazol-1-ylmethyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H13N3O5"	"O=C(N(Cn1cccn1)c2c(C)cccc2C(=O)O)C(=O)O"	"InChI=1S/C14H13N3O5/c1-9-4-2-5-10(13(19)20)11(9)17(12(18)14(21)22)8-16-7-3-6-15-16/h2-7H,8H2,1H3,(H,19,20)(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Metazachlor"	"266-583-0"	"67129-08-2"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[N-(2,6-dimethylphenyl)-N-(1H-pyrazol-1-ylmethyl)aminocarbonylmethylsulfinyl]-2-hydroxypropanoic acid"	""	""	"3-({2-[(2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino]-2-oxoethyl}sulfinyl)-2-hydroxypropanoic acid"	"Not in list"	"C17H21N3O5S"	"O=C(CS(=O)CC(O)C(=O)O)N(Cn1cccn1)c2c(C)cccc2C"	"InChI=1S/C17H21N3O5S/c1-12-5-3-6-13(2)16(12)20(11-19-8-4-7-18-19)15(22)10-26(25)9-14(21)17(23)24/h3-8,14,21H,9-11H2,1-2H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Metazachlor (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metazachlor"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.145r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Penconazole"	"266-275-6"	"66246-88-6"	"single chemical entity"	"Component is identical to the substance"	"Penconazole"	"266-275-6"	"66246-88-6"	"1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole"	"Penconazole"	"C13H15Cl2N3"	"ClC2=C(C=CC(Cl)=C2)C(CCC)CN1N=CN=C1"	"InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Penconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance penconazole"	"39751"	"2008"	"doi:10.2903/j.efsa.2008.175r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"3"	"Male"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"3"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"6"	"Male"	"oral: gavage"	"13"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"6"	"Male"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metconazole (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Metconazole"	""	"125116-23-6"	"single chemical entity"	"Component is identical to the substance"	"Metconazole"	""	"125116-23-6"	"5-[(4-Chlorophenyl)methyl]-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol"	"Metconazole (sum of isomers)"	"C17H22ClN3O"	"CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C"	"InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metconazole (Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance metconazole."	"38770"	"2006"	"doi:10.2903/j.efsa.2006.64r"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"5"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"5"	"Male"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"5"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"10"	"Male"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methylsulfonyl-2-nitro benzoic acid"	""	""	"4-(methylsulfonyl)-2-nitrobenzoic acid"	"Not in list"	"C8H7NO6S"	"O=S(C)(=O)c1cc(c(cc1)C(=O)O)N(=O)=O"	"InChI=1S/C8H7NO6S/c1-16(14,15)5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"10"	"Male"	"oral: gavage"	"28"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-amino-4-methylsulfonyl benzoic acid"	""	""	"2-amino-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C8H9NO4S"	"O=S(C)(=O)c1cc(N)c(cc1)C(=O)O"	"InChI=1S/C8H9NO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"3"	"Male"	"oral: gavage"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"Hep G2 human cell line"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"Hep G2 human cell line"	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is identical to the substance"	"Metam-sodium"	"205-293-0"	"137-42-8"	"Sodium;N-methylcarbamodithioate"	"Not in list"	"C2H4NNaS2"	"CNC(=S)[S-].[Na+]"	"InChI=1S/C2H5NS2.Na/c1-3-2(4)5;/h1H3,(H2,3,4,5);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isothiocyanate"	"209-132-5"	"556-61-6"	"Methylimino(sulfanylidene)methane"	"Methyl-Isothiocyanate"	"C2H3NS"	"CN=C=S"	"InChI=1S/C2H3NS/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"inhalation: unspecified"	"8"	"min"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	""	""	"Not reported"	""	""	"no"	"no data"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	""	"Male"	"inhalation: unspecified"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"inhalation: aerosol"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	""	"Male"	"inhalation: unspecified"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	""	"Male/Female"	"inhalation: unspecified"	"4"	"D"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	""	"Male"	"inhalation: unspecified"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	""	"Male/Female"	"inhalation: unspecified"	"4"	"D"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"other"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	""	"Male/Female"	"inhalation: unspecified"	"4"	"D"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Metam-sodium"	"205-293-0"	"137-42-8"	"single chemical entity"	"Component is a metabolite of the substance"	"Methyl isocyanate"	"210-866-3"	"624-83-9"	"methylimino(oxo)methane"	"Not in list"	"C2H3NO"	"CN=C=O"	"InChI=1S/C2H3NO/c1-3-2-4/h1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium"	"Metam-sodium (Updated DAR Re-submission)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metam"	"40798"	"2011"	"doi:10.2903/j.efsa.2011.2334"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"oral: gavage"	"27"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"5"	"Male"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is identical to the substance"	"Napropamide"	"239-333-3"	"15299-99-7"	"N,N-diethyl-2-(1-naphthyloxy)propanamide"	"Napropamide"	"C17H21NO2"	"CCN(CC)C(=O)C(C)Oc2cccc1ccccc12"	"InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"5"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(naphthalen-1-yloxy)propanoic acid"	""	""	"2-naphthalen-1-yloxypropanoic acid"	"Not in list"	"C13H12O3"	"CC(C(=O)O)OC1=CC=CC2=CC=CC=C21"	"InChI=1S/C13H12O3/c1-9(13(14)15)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H,14,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Denmark"	"Napropamide (Addendum 2)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Phthalic acid"	"201-873-2"	"88-99-3"	"phthalic acid"	"Not in list"	"C8H6O4"	"C1=CC=C(C(=C1)C(=O)O)C(=O)O"	"InChI=1S/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"20"	"Male"	"intraperitoneal"	"5"	"D"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"mouse spot test"	"in vivo"	"According to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male/Female"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"No data"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"No data"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"26"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"10"	"Male"	"oral: feed"	"10"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	""	"10"	"Male"	"oral: feed"	"10"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"complex product: derived from botanical sources"	"Component is identical to the substance"	"Orange oil"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"d-limonene"	"227-813-5"	"5989-27-5"	"(4R)-1-methyl-4-(1-methylethenyl)cyclohexene"	"Not in list"	"C10H16"	"CC(=C)[C@@H]1CCC(=CC1)C"	"InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1"	"organic"	"compound"	"DSSTox"	"DSSTox"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"Linalool"	"201-134-4"	"78-70-6"	"3,7-dimethylocta-1,6-dien-3-ol"	"linalool"	"C10H18O"	"CC(=CCCC(C)(C=C)O)C"	"InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"β-myrcene"	"204-622-5"	"123-35-3"	"7-methyl-3-methylideneocta-1,6-diene"	"myrcene"	"C10H16"	"CC(=CCCC(=C)C=C)C"	"InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"β-myrcene"	"204-622-5"	"123-35-3"	"7-methyl-3-methylideneocta-1,6-diene"	"myrcene"	"C10H16"	"CC(=CCCC(=C)C=C)C"	"InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"β-myrcene"	"204-622-5"	"123-35-3"	"7-methyl-3-methylideneocta-1,6-diene"	"myrcene"	"C10H16"	"CC(=CCCC(=C)C=C)C"	"InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"β-myrcene"	"204-622-5"	"123-35-3"	"7-methyl-3-methylideneocta-1,6-diene"	"myrcene"	"C10H16"	"CC(=CCCC(=C)C=C)C"	"InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"8"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Orange oil"	""	""	"single chemical entity"	"Component is part of a group assessment"	"β-myrcene"	"204-622-5"	"123-35-3"	"7-methyl-3-methylideneocta-1,6-diene"	"myrcene"	"C10H16"	"CC(=CCCC(=C)C=C)C"	"InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"8"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Orange oil"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orange oil"	"41316"	"2013"	"doi:10.2903/j.efsa.2013.3090"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"No data"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"6"	"Male/Female"	"oral: unspecified"	"28"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"5"	"Male"	"oral: unspecified"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"No data"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"no information"	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"No data"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"5"	"Male"	"oral: unspecified"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxynaphthalene-1,4-dione"	"201-496-3"	"83-72-7"	"4-hydroxynaphthalene-1,2-dione"	"Not in list"	"C10H6O3"	"C1=CC=C2C(=C1)C(=CC(=O)C2=O)O"	"InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	""	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	""	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"Male"	"oral: gavage"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: gavage"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"18"	"Male"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"18"	"Male"	"oral: gavage"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	"4"	"No data"	"oral: unspecified"	"3"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"12"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	""	"Male"	"oral: gavage"	"32"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	""	"Male"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	""	"Male"	"oral: gavage"	"18"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Chinese"	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	""	"No data"	"oral: gavage"	"18"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	""	"No data"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	""	"No data"	"oral: gavage"	"30"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"2"	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"20"	"Male"	"oral: unspecified"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"Male"	"Not reported"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Balb/c"	""	"Male"	"oral: gavage"	""	""	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"15"	"Male"	"oral: gavage"	"5"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"15"	"Male"	"oral: unspecified"	"3"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"30"	"D"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"CM891"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)-3-methylurea"	""	""	"1-methyl-3-(4-propan-2-ylphenyl)urea"	"Not in list"	"C11H16N2O"	"O=C(Nc1ccc(cc1)C(C)C)NC"	"InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"40"	"Male/Female"	"oral: unspecified"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	"no information"	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"48"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"48"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"4-methoxy-6-methyl-1,3,5-triazine-2-amine"	"216-790-7"	"1668-54-8"	"4-methoxy-6-methyl-1,3,5-triazin-2-amine"	"Not in list"	"C5H8N4O"	"CC1=NC(=NC(=N1)OC)N"	"InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"48"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-(carbamoylsulfamoyl)benzoate"	""	""	"methyl 2-(carbamoylsulfamoyl)benzoate"	"Not in list"	"C9H10N2O5S"	"O=S(=O)(NC(N)=O)c1ccccc1C(=O)OC"	"InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoylbenzoate"	""	""	"methyl 2-sulfamoylbenzoate"	"Not in list"	"C8H9NO4S"	"COC(=O)C1=CC=CC=C1S(=O)(=O)N"	"InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoylbenzoate"	""	""	"methyl 2-sulfamoylbenzoate"	"Not in list"	"C8H9NO4S"	"COC(=O)C1=CC=CC=C1S(=O)(=O)N"	"InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoylbenzoate"	""	""	"methyl 2-sulfamoylbenzoate"	"Not in list"	"C8H9NO4S"	"COC(=O)C1=CC=CC=C1S(=O)(=O)N"	"InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoylbenzoate"	""	""	"methyl 2-sulfamoylbenzoate"	"Not in list"	"C8H9NO4S"	"COC(=O)C1=CC=CC=C1S(=O)(=O)N"	"InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoylbenzoate"	""	""	"methyl 2-sulfamoylbenzoate"	"Not in list"	"C8H9NO4S"	"COC(=O)C1=CC=CC=C1S(=O)(=O)N"	"InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoylbenzoate"	""	""	"methyl 2-sulfamoylbenzoate"	"Not in list"	"C8H9NO4S"	"COC(=O)C1=CC=CC=C1S(=O)(=O)N"	"InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoylbenzoate"	""	""	"methyl 2-sulfamoylbenzoate"	"Not in list"	"C8H9NO4S"	"COC(=O)C1=CC=CC=C1S(=O)(=O)N"	"InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoylbenzoate"	""	""	"methyl 2-sulfamoylbenzoate"	"Not in list"	"C8H9NO4S"	"COC(=O)C1=CC=CC=C1S(=O)(=O)N"	"InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"4"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is identical to the substance"	"Nicosulfuron"	""	"111991-09-4"	"2-[(4,6-Dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Nicosulfuron"	"C15H18N6O6S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"4"	"Male"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N,N-dimethyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C8H11N3O3S"	"CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C8H11N3O3S/c1-11(2)8(12)6-4-3-5-10-7(6)15(9,13)14/h3-5H,1-2H3,(H2,9,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Amino-4,6-dimethoxypyrimidine"	"252-969-6"	"36315-01-2"	"4,6-Dimethoxypyrimidin-2-amine"	"Not in list"	"C6H9N3O2"	"COC1=CC(=NC(=N1)N)OC"	"InChI=1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamimidoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamimidoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H14N6O4S"	"O=S(=O)(NC(=O)NC(=N)N)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[(Carbamoylcarbamoyl)sulfamoyl]-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-[(carbamoylcarbamoyl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C10H13N5O5S"	"O=S(=O)(NC(=O)NC(N)=O)c1ncccc1C(=O)N(C)C"	"InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)"	"metal"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	""	""	"N-methyl-2-sulfamoylpyridine-3-carboxamide"	"Not in list"	"C7H9N3O3S"	"CNC(=O)C1=C(N=CC=C1)S(=O)(=O)N"	"InChI=1S/C7H9N3O3S/c1-9-6(11)5-3-2-4-10-7(5)14(8,12)13/h2-4H,1H3,(H,9,11)(H2,8,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"mixture or formulation"	"Component is part of a group assessment"	"Nicosulfuron leachate (lysimeter product)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"mixture or formulation"	"Component is part of a group assessment"	"Nicosulfuron leachate (lysimeter product)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"mixture or formulation"	"Component is part of a group assessment"	"Nicosulfuron leachate (lysimeter product)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"mixture or formulation"	"Component is part of a group assessment"	"Nicosulfuron leachate (lysimeter product)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"mixture or formulation"	"Component is part of a group assessment"	"Nicosulfuron leachate (lysimeter product)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"mixture or formulation"	"Component is part of a group assessment"	"Nicosulfuron leachate (lysimeter product)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"mixture or formulation"	"Component is part of a group assessment"	"Nicosulfuron leachate (lysimeter product)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"mixture or formulation"	"Component is part of a group assessment"	"Nicosulfuron leachate (lysimeter product)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Nicosulfuron"	""	"111991-09-4"	"single chemical entity"	"Component is a metabolite of the substance"	"2-{[(4-Hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,Ndimethylpyridine-3-carboxamide"	""	""	"2-{[(4-hydroxy-6-methoxypyrimidin-2-yl)carbamoyl]sulfamoyl}-N,N-dimethylpyridine-3-carboxamide"	"Not in list"	"C14H16N6O6S"	"O=S(=O)(NC(=O)Nc1nc(O)cc(OC)n1)c2ncccc2C(=O)N(C)C"	"InChI=1S/C14H16N6O6S/c1-20(2)12(22)8-5-4-6-15-11(8)27(24,25)19-14(23)18-13-16-9(21)7-10(17-13)26-3/h4-7H,1-3H3,(H3,16,17,18,19,21,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Nicosulfuron (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance nicosulfuron"	"39476"	"2008"	"doi:10.2903/j.efsa.2008.120r"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-[((RS)-1-Carboxy-ethyl)-(2-methoxy-acetyl)-amino]-3-methyl-benzoic acid"	""	""	"2-[(1-carboxyethyl)(methoxyacetyl)amino]-3-methylbenzoic acid"	"Not in list"	"C14H17NO6"	"CC(N(C(=O)COC)c1c(C)cccc1C(=O)O)C(=O)O"	"InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(RS)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"CC(N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(2,6-Dimethyl-phenyl)-2-methoxy-acetamide"	""	""	"N-(2,6-dimethylphenyl)-2-methoxyacetamide"	"Not in list"	"C11H15NO2"	"O=C(Nc1c(C)cccc1C)COC"	"InChI=1S/C11H15NO2/c1-8-5-4-6-9(2)11(8)12-10(13)7-14-3/h4-6H,7H2,1-3H3,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No data"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"Not reported"	"3"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Imazalil"	"252-615-0"	"35554-44-0"	"single chemical entity"	"Component is identical to the substance"	"Imazalil"	"252-615-0"	"35554-44-0"	"1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole"	"Imazalil"	"C14H14Cl2N2O"	"C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl"	"InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: The Netherlands - CoRMS: Spain"	"Imazalil"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance imazalil"	"40256"	"2010"	"doi:10.2903/j.efsa.2010.1526"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-hydroxy-terbuthylazine"	""	""	"4-amino-6-(tert-butylamino)-1,3,5-triazin-2-ol"	"Desethyl-hydroxy-terbuthylazine"	"C7H13N5O"	"Nc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Hydroxy-terbuthylazine"	""	""	"4-(tert-butylamino)-6-(ethylamino)-1,3,5-triazin-2-ol"	"Not in list"	"C9H17N5O"	"Oc1nc(NCC)nc(NC(C)(C)C)n1"	"InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	""	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4,6-diamino-s-triazin"	"222-260-6"	"3397-62-4"	"6-Chloro-1,3,5-triazine-2,4-diamine"	"Atrazine, Desethyl-Desisopropyl-"	"C3H4ClN5"	"C1(=NC(=NC(=N1)Cl)N)N"	"InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"16"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is identical to the substance"	"Terbuthylazine"	"227-637-9"	"5915-41-3"	"N-tert-butyl-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine"	"Terbuthylazine"	"C9H16ClN5"	"CCNc1nc(Cl)nc(NC(C)(C)C)n1"	"InChI=1/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"large colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"large colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"10"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"10"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"6"	"Male"	"Not reported"	"2"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Desethyl-terbuthylazine"	""	"30125-63-4"	"2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine"	"Terbuthylazine, Desethyl-"	"C7H12ClN5"	"CC(C)(C)NC1=NC(=NC(=N1)N)Cl"	"InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Alpk:APf SD Rat"	"6"	"Male"	"Not reported"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	""	""	"2,6-dihydroxy-7,7-dimethyl-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one"	"Not in list"	"C7H10N4O3"	"O=C1N=C(O)N=C2NC(C)(C)C(O)N12"	"InChI=1S/C7H10N4O3/c1-7(2)3(12)11-4(10-7)8-5(13)9-6(11)14/h3,12H,1-2H3,(H2,8,9,10,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	""	""	"6-(tert-butylamino)-1,3,5-triazine-2,4-diol"	"Not in list"	"C7H12N4O2"	"Oc1nc(NC(C)(C)C)nc(O)n1"	"InChI=1S/C7H12N4O2/c1-7(2,3)11-4-8-5(12)10-6(13)9-4/h1-3H3,(H3,8,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"large colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Terbuthylazine"	"227-637-9"	"5915-41-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	""	""	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"4-(Tert-butylamino)-6-hydroxy-1-methyl-1,3,5-triazin-2(1H)-one"	"C8H14N4O2"	"O=C1N=C(NC(C)(C)C)N=C(O)N1C"	"InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Terbuthylazine (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance terbuthylazine"	"40553"	"2011"	"doi:10.2903/j.efsa.2011.1969"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Lenacil"	"218-499-0"	"2164-08-1"	"single chemical entity"	"Component is identical to the substance"	"Lenacil"	"218-499-0"	"2164-08-1"	"3-cyclohexyl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione"	"Lenacil"	"C13H18N2O2"	"O=C1NC2=C(CCC2)C(=O)N1C3CCCCC3"	"InChI=1/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Belgium"	"Lenacil"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance lenacil"	"40093"	"2009"	"doi:10.2903/j.efsa.2009.1326"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Salmonella typhimurium (as organism)"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	""	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-[(dimethoxyphosphoryl)sulfanyl]butanedioate"	""	"1634-78-2"	"Diethyl 2-dimethoxyphosphorylsulfanylbutanedioate"	"Malaoxon"	"C10H19O7PS"	"CCOC(=O)CC(C(=O)OCC)SP(=O)(OC)OC"	"InChI=1S/C10H19O7PS/c1-5-16-9(11)7-8(10(12)17-6-2)19-18(13,14-3)15-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-[(dimethoxyphosphoryl)sulfanyl]butanedioate"	""	"1634-78-2"	"Diethyl 2-dimethoxyphosphorylsulfanylbutanedioate"	"Malaoxon"	"C10H19O7PS"	"CCOC(=O)CC(C(=O)OCC)SP(=O)(OC)OC"	"InChI=1S/C10H19O7PS/c1-5-16-9(11)7-8(10(12)17-6-2)19-18(13,14-3)15-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent no treatment"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is identical to the substance"	"Malathion"	"204-497-7"	"121-75-5"	"diethyl 2-[(dimethoxyphosphorothioyl)sulfanyl]succinate"	"Malathion"	"C10H19O6PS2"	"CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC"	"InChI=1/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	""	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	""	""	"No data"	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Malathion (Addendum 1)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid"	""	"1190-29-0"	"2-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid"	"Not in list"	"C8H15O6PS2"	"CCOC(=O)CC(C(=O)O)SP(=S)(OC)OC"	"InChI=1S/C8H15O6PS2/c1-4-14-7(9)5-6(8(10)11)17-15(16,12-2)13-3/h6H,4-5H2,1-3H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)- 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioic acid"	""	""	"2-dimethoxyphosphinothioylsulfanylbutanedioic acid"	"Not in list"	"C6H11O6PS2"	"COP(=S)(OC)SC(CC(=O)O)C(=O)O"	"InChI=1S/C6H11O6PS2/c1-11-13(14,12-2)15-4(6(9)10)3-5(7)8/h4H,3H2,1-2H3,(H,7,8)(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Malathion"	"204-497-7"	"121-75-5"	"single chemical entity"	"Component is a metabolite of the substance"	"Diethyl (2RS)-2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	""	""	"diethyl 2-{[hydroxy(methoxy)phosphorothioyl]sulfanyl}butanedioate"	"Not in list"	"C9H17O6PS2"	"CCOC(=O)CC(SP(=S)(O)OC)C(=O)OCC"	"InChI=1S/C9H17O6PS2/c1-4-14-8(10)6-7(9(11)15-5-2)18-16(12,17)13-3/h7H,4-6H2,1-3H3,(H,12,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Malathion (Report and Proposed Decision of the United Kingdom made to the European Commission under Article 8 of 91/414/EEC Summary, Scientific Evaluation and Assessment)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance malathion"	"40022"	"2009"	"doi:10.2903/j.efsa.2009.333r"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	"no information"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	"no information"	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No data"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No data"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Other"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2,6-dimethylaniline"	"201-758-7"	"87-62-7"	"2,6-dimethylaniline"	"Not in list"	"C8H11N"	"CC1=C(C(=CC=C1)C)N"	"InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methylurea"	""	""	"1-(4-bromophenyl)-3-methylurea"	"Not in list"	"C8H9BrN2O"	"Brc1ccc(NC(=O)NC)cc1"	"InChI=1/C8H9BrN2O/c1-10-8(12)11-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)urea"	""	""	"1-(4-bromophenyl)urea"	"Not in list"	"C7H7BrN2O"	"Brc1ccc(NC(N)=O)cc1"	"InChI=1/C7H7BrN2O/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metobromuron"	"221-301-5"	"3060-89-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-bromophenyl)-3-methoxyurea"	""	""	"1-(4-bromophenyl)-3-methoxyurea"	"Not in list"	"C8H9BrN2O2"	"Brc1ccc(NC(=O)NOC)cc1"	"InChI=1/C8H9BrN2O2/c1-13-11-8(12)10-7-4-2-6(9)3-5-7/h2-5H,1H3,(H2,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Metobromuron"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metobromuron."	"41674"	"2014"	"doi:10.2903/j.efsa.2014.3541"
+"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"single chemical entity"	"Component is identical to the substance"	"Metsulfuron-methyl"	"616-063-8"	"74223-64-6"	"methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate"	"Metsulfuron-methyl"	"C14H15N5O6S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Slovenia - CoRMS: Sweden"	"Metsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metsulfuron-methyl"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3936"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Napropamide"	"239-333-3"	"15299-99-7"	"single chemical entity"	"Component is a metabolite of the substance"	"naphthalen-1-ol"	"201-969-4"	"90-15-3"	"naphthalen-1-ol"	"Naphthol, 1-"	"C10H8O"	"C1=CC=C2C(=C1)C=CC=C2O"	"InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Napropamide (Addendum 1)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance napropamide"	"40283"	"2010"	"doi:10.2903/j.efsa.2010.1565"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is identical to the substance"	"Orthosulfamuron"	""	"213464-77-8"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(dimethylcarbamoyl)phenylsulfamoyl]urea"	"Orthosulfamuron"	"C16H20N6O6S"	"CN(C)C(=O)C1=CC=CC=C1NS(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-7-5-6-8-11(10)20-29(25,26)21-16(24)19-15-17-12(27-3)9-13(18-15)28-4/h5-9,20H,1-4H3,(H2,17,18,19,21,24)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Orthosulfamuron"	""	"213464-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)urea"	"Not in list"	"C6H8N4O3"	"O=C(N)Nc1nc(O)cc(OC)n1"	"InChI=1S/C6H8N4O3/c1-13-4-2-3(11)8-6(9-4)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Italy"	"Orthosulfamuron (Final Addendum to the DAR)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance orthosulfamuron"	"41711"	"2014"	"doi:10.2903/j.efsa.2014.3353"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Pyroxsulam"	""	"422556-08-9"	"single chemical entity"	"Component is identical to the substance"	"Pyroxsulam"	""	"422556-08-9"	"N-(5,7-dimethoxy-[1,2,4]triazolo[1,5-alpha]pyrimidin-2-yl)-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide"	"Pyroxsulam"	"C14H13F3N6O5S"	"COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC"	"InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No data"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Pyroxsulam"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance pyroxsulam."	"41394"	"2013"	"doi:10.2903/j.efsa.2013.3182"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"3"	"No data"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is identical to the substance"	"Isoproturon"	"251-835-4"	"34123-59-6"	"1,1-dimethyl-3-(4-propan-2-ylphenyl)urea"	"Isoproturon"	"C12H18N2O"	"CC(C)C1=CC=C(C=C1)NC(=O)N(C)C"	"InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{4-[(2RS-1-hydroxypropan-2-yl]phenyl}-1,1-dimethylurea"	""	""	"3-[4-(1-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)CO)N(C)C"	"InChI=1S/C12H18N2O2/c1-9(8-15)10-4-6-11(7-5-10)13-12(16)14(2)3/h4-7,9,15H,8H2,1-3H3,(H,13,16)"	"organic"	"compound"	"Other"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-[4-(2-hydroxy-2-propanyl)phenyl]-1,1-dimethylurea"	""	""	"3-[4-(2-hydroxypropan-2-yl)phenyl]-1,1-dimethylurea"	"Not in list"	"C12H18N2O2"	"O=C(Nc1ccc(cc1)C(C)(C)O)N(C)C"	"InChI=1S/C12H18N2O2/c1-12(2,16)9-5-7-10(8-6-9)13-11(15)14(3)4/h5-8,16H,1-4H3,(H,13,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-isopropylphenyl)urea"	""	""	"(4-propan-2-ylphenyl)urea"	"Not in list"	"C10H14N2O"	"O=C(N)Nc1ccc(cc1)C(C)C"	"InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)"	"organic"	"compound"	"Other"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Isoproturon"	"251-835-4"	"34123-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(2RS)-2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	""	""	"2-{4-[(dimethylcarbamoyl)amino]phenyl}propanoic acid"	"Not in list"	"C12H16N2O3"	"O=C(Nc1ccc(cc1)C(C)C(=O)O)N(C)C"	"InChI=1S/C12H16N2O3/c1-8(11(15)16)9-4-6-10(7-5-9)13-12(17)14(2)3/h4-8H,1-3H3,(H,13,17)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Czech Republic"	"Isoproturon (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance isoproturon"	"42236"	"2015"	"doi:10.2903/j.efsa.2015.4206"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Mesotrione"	"600-533-4"	"104206-82-8"	"single chemical entity"	"Component is identical to the substance"	"Mesotrione"	"600-533-4"	"104206-82-8"	"2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione"	"Mesotrione"	"C14H13NO7S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]"	"InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom - CoRMS: Belgium"	"Mesotrione (ZA1296)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance mesotrione"	"42436"	"2016"	"doi:10.2903/j.efsa.2016.4419"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is identical to the substance"	"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"methyl (2R)-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate"	"Metalaxyl-M"	"C15H21NO4"	"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC"	"InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3/t12-/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(R)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"(2R)-2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"C[C@@H](N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Metalaxyl-M"	"615-135-6"	"70630-17-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(R)-2-[(2,6-Dimethyl-phenyl)-(2-methoxy-acetyl)-amino]-propionic acid"	""	""	"(2R)-2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]propanoic acid"	"Not in list"	"C14H19NO4"	"C[C@@H](N(C(=O)COC)c1c(C)cccc1C)C(=O)O"	"InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)/t11-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium - CoRMS: Greece"	"Metalaxyl-M"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance metalaxyl-M"	"42066"	"2015"	"doi:10.2903/j.efsa.2015.3999"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: unspecified"	"14"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is identical to the substance"	"Ethephon"	"240-718-3"	"16672-87-0"	"(2-chloroethyl)phosphonic acid"	"Ethephon"	"C2H6ClO3P"	"ClCCP(O)(=O)O"	"InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: unspecified"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"Ethephon"	"240-718-3"	"16672-87-0"	"single chemical entity"	"Component is a metabolite of the substance"	"2-hydroxyethylphosphonic acid"	"245-370-6"	"22987-21-9"	"2-hydroxyethylphosphonic acid"	"2-Hydroxyethylphosphonic acid"	"C2H7O4P"	"C(CP(=O)(O)O)O"	"InChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Ethephon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance ethephon"	"39828"	"2009"	"doi:10.2903/j.efsa.2009.174r"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"S-abscisic acid"	"244-319-5"	"21293-29-8"	"single chemical entity"	"Component is identical to the substance"	"S-abscisic acid"	"244-319-5"	"21293-29-8"	"(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid"	"Not in list"	"C15H20O4"	"CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C"	"InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"S-abscisic acid"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance S-abscisic acid."	"41515"	"2013"	"doi:10.2903/j.efsa.2013.3341"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA1530"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"oral: feed"	"5"	"D"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA94"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA92"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA94"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"single chemical entity"	"Component is identical to the substance"	"Sodium hypochlorite"	"231-668-3"	"7681-52-9"	"Sodium;hypochlorite"	"Not in list"	"ClNaO"	"[O-]Cl.[Na+]"	"InChI=1S/ClO.Na/c1-2;/q-1;+1"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: The Netherlands"	"Sodium hypochlorite"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium hypochlorite"	"41092"	"2012"	"doi:10.2903/j.efsa.2012.2796"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	"no information"	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"inhalation: unspecified"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"inhalation: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"single chemical entity"	"Component is identical to the substance"	"Sulfuryl fluoride"	"220-281-5"	"2699-79-8"	"Sulfuryl difluoride"	"Sulfuryl fluoride"	"F2O2S"	"O=S(=O)(F)F"	"InChI=1S/F2O2S/c1-5(2,3)4"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"inhalation: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Sulfuryl Fluoride"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfuryl fluoride"	"40192"	"2010"	"doi:10.2903/j.efsa.2010.1441"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Positive"	""	"direct evidence-cytotoxicity"	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"Not reported"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is identical to the substance"	"Sulcotrione"	""	"99105-77-8"	"2-[2-chloro-4-(methylsulfonyl)benzoyl]cyclohexane-1,3-dione"	"Sulcotrione"	"C14H13ClO5S"	"O=C2CCCC(=O)C2C(=O)c1ccc(cc1Cl)S(C)(=O)=O"	"InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"Not reported"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulcotrione"	""	"99105-77-8"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Chloro-4-(methylsulfonyl)-benzoic acid"	"406-520-8"	"53250-83-2"	"2-Chloro-4-methylsulfonylbenzoic acid"	"Not in list"	"C8H7ClO4S"	"CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl"	"InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Sulcotrione"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance Sulcotrione"	"39737"	"2008"	"doi:10.2903/j.efsa.2008.150r"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, historical"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, historical"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is identical to the substance"	"Sulfosulfuron"	""	"141776-32-1"	"1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)urea"	"Sulfosulfuron"	"C16H18N6O7S2"	"CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC"	"InChI=1S/C16H18N6O7S2/c1-4-30(24,25)13-14(22-8-6-5-7-10(22)17-13)31(26,27)21-16(23)20-15-18-11(28-2)9-12(19-15)29-3/h5-9H,4H2,1-3H3,(H2,18,19,20,21,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, historical"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamimidoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H14N6O5S2"	"NC(=N)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H14N6O5S2/c1-2-23(19,20)8-9(17-6-4-3-5-7(17)14-8)24(21,22)16-11(18)15-10(12)13/h3-6H,2H2,1H3,(H5,12,13,15,16,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Sulfosulfuron"	""	"141776-32-1"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	""	""	"N-(carbamoylcarbamoyl)-2-(ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide"	"Not in list"	"C11H13N5O6S2"	"NC(=O)NC(=O)NS(=O)(=O)c1c(nc2ccccn12)S(=O)(=O)CC"	"InChI=1/C11H13N5O6S2/c1-2-23(19,20)8-9(16-6-4-3-5-7(16)13-8)24(21,22)15-11(18)14-10(12)17/h3-6H,2H2,1H3,(H4,12,14,15,17,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden - CoRMS: Ireland"	"Sulfosulfuron (Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfosulfuron"	"41834"	"2014"	"doi:10.2903/j.efsa.2014.3764"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebuconazole"	"403-640-2"	"107534-96-3"	"single chemical entity"	"Component is identical to the substance"	"Tebuconazole"	"403-640-2"	"107534-96-3"	"1-(4-chlorophenyl)-4,4-dimethyl-3-(1H-1,2,4-triazol-1-ylmethyl)pentan-3-ol"	"Tebuconazole"	"C16H22ClN3O"	"OC(C(C)(C)C)(CN2N=CN=C2)CCC1=CC=C(Cl)C=C1"	"InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"50"	"Male"	"oral: gavage"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Tebuconazole"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebuconazole."	"41642"	"2014"	"doi:10.2903/j.efsa.2014.3485"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is identical to the substance"	"Tebufenpyrad"	""	"119168-77-3"	"N-(4-tert-butylbenzyl)-4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Tebufenpyrad"	"C18H24ClN3O"	"O=C(NCC2=CC=C(C(C)(C)C)C=C2)C1=C(Cl)C(CC)=NN1C"	"InChI=1S/C18H24ClN3O/c1-6-14-15(19)16(22(5)21-14)17(23)20-11-12-7-9-13(10-8-12)18(2,3)4/h7-10H,6,11H2,1-5H3,(H,20,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	""	""	"2-(4-{[(4-chloro-3-ethyl-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}phenyl)-2-methylpropanoic acid"	"Not in list"	"C17H20ClN3O3"	"Clc2c(CC)nn(C)c2C(=O)Nc1ccc(cc1)C(C)(C)C(O)=O"	"InChI=1/C17H20ClN3O3/c1-5-12-13(18)14(21(4)20-12)15(22)19-11-8-6-10(7-9-11)17(2,3)16(23)24/h6-9H,5H2,1-4H3,(H,19,22)(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Tebufenpyrad"	""	"119168-77-3"	"single chemical entity"	"Component is a metabolite of the substance"	"4-chloro-3-ethyl-1-methyl-5-pyrazolecarboxamide"	""	""	"4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamide"	"Not in list"	"C7H10ClN3O"	"Clc1c(CC)nn(C)c1C(=O)N"	"InChI=1/C7H10ClN3O/c1-3-4-5(8)6(7(9)12)11(2)10-4/h3H2,1-2H3,(H2,9,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenpyrad"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tebufenpyrad"	"39902"	"2009"	"doi:10.2903/j.efsa.2009.192r"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Spain"	"Thiabendazole (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"3"	"Male"	"oral: gavage"	"4"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"3"	"Male"	"oral: gavage"	"14"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"8"	"Male/Female"	"Not reported"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Fischer344"	"15"	"Male"	"oral: feed"	"56"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"SOS/umu test"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"PQ37"	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"no data"	"Positive"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male/Female"	"intraperitoneal"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male/Female"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Positive"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"12"	"Male/Female"	"oral: gavage"	"42"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Thymol"	"201-944-8"	"89-83-8"	"single chemical entity"	"Component is identical to the substance"	"Thymol"	"201-944-8"	"89-83-8"	"5-Methyl-2-propan-2-ylphenol"	"Thymol"	"C10H14O"	"CC1=CC(=C(C=C1)C(C)C)O"	"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"12"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Thymol"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thymol"	"41218"	"2012"	"doi:10.2903/j.efsa.2012.2916"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"single chemical entity"	"Component is identical to the substance"	"Tolclofos-methyl"	"260-515-3"	"57018-04-9"	"O-(2,6-dichloro-4-methylphenyl) O,O-dimethyl thiophosphate"	"Tolclofos-methyl"	"C9H11Cl2O3PS"	"S=P(OC)(OC)OC1=C(Cl)C=C(C)C=C1Cl"	"InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"intraperitoneal"	"7"	"week"	"yes, historical"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Tolclofos-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolclofos-methyl"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.32ar"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is identical to the substance"	"Topramezone"	"606-699-4"	"210631-68-8"	"4-[3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoyl]-2-methyl-1H-pyrazol-3-one"	"Topramezone (BAS 670H)"	"C16H17N3O5S"	"CC1=C(C=CC(=C1C2=NOCC2)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C"	"InChI=1S/C16H17N3O5S/c1-9-10(15(20)11-8-17-19(2)16(11)21)4-5-13(25(3,22)23)14(9)12-6-7-24-18-12/h4-5,8,17H,6-7H2,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Topramezone"	"606-699-4"	"210631-68-8"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	""	""	"3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid"	"Not in list"	"C12H13NO5S"	"CS(=O)(=O)c2ccc(c(C)c2C=1CCON=1)C(O)=O"	"InChI=1/C12H13NO5S/c1-7-8(12(14)15)3-4-10(19(2,16)17)11(7)9-5-6-18-13-9/h3-4H,5-6H2,1-2H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Topramezone (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance topramezone"	"41673"	"2014"	"doi:10.2903/j.efsa.2014.3540"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"Not reported"	"6"	"h"	"yes"	"not applicable"	"Inconclusive"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"50"	"Male"	"oral: gavage"	"48"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"42"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"18"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Triazoxide"	"276-668-4"	"72459-58-6"	"single chemical entity"	"Component is identical to the substance"	"Triazoxide"	"276-668-4"	"72459-58-6"	"7-chloro-3-(1H-imidazol-1-yl)-1,2,4-benzotriazine 1-oxide"	"Triazoxide"	"C10H6ClN5O"	"Clc1ccc2nc(n[n+]([O-])c2c1)n3ccnc3"	"InChI=1S/C10H6ClN5O/c11-7-1-2-8-9(5-7)16(17)14-10(13-8)15-4-3-12-6-15/h1-6H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Triazoxide"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triazoxide"	"40603"	"2011"	"doi:10.2903/j.efsa.2011.2018"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male/Female"	"Not reported"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male/Female"	"Not reported"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Tribenuron-methyl"	""	"101200-48-0"	"single chemical entity"	"Component is identical to the substance"	"Tribenuron-methyl"	""	"101200-48-0"	"methyl2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate"	"Tribenuron-methyl"	"C15-H17-N5-O6-S"	"CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC"	"InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male/Female"	"Not reported"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Sweden"	"Tribenuron-methyl"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tribenuron"	"38442"	"2005"	"doi:10.2903/j.efsa.2005.15r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Inconclusive"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Trichlorfon"	"200-149-3"	"52-68-6"	"single chemical entity"	"Component is identical to the substance"	"Trichlorfon"	"200-149-3"	"52-68-6"	"2,2,2-Trichloro-1-dimethoxyphosphorylethanol"	"Trichlorfon"	"C4H8Cl3O4P"	"COP(=O)(C(C(Cl)(Cl)Cl)O)OC"	"InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"50"	"Male"	"oral: gavage"	"48"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Trichlorfon"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trichlorfon"	"38883"	"2006"	"doi:10.2903/j.efsa.2006.76r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: unspecified"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is part of a group assessment"	"Triclopyr-butoxyethyl ester"	"265-024-8"	"64470-88-8"	"2-Butoxyethyl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate"	"Triclopyr-butoxyethyl ester"	"C13H16Cl3NO4"	"CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl"	"InChI=1S/C13H16Cl3NO4/c1-2-3-4-19-5-6-20-11(18)8-21-13-10(15)7-9(14)12(16)17-13/h7H,2-6,8H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is identical to the substance"	"Triclopyr"	"259-597-3"	"55335-06-3"	"[(3,5,6-trichloropyridin-2-yl)oxy]acetic acid"	"Triclopyr"	"C7H4Cl3NO3"	"O=C(O)COC1=C(Cl)C=C(Cl)C(Cl)=N1"	"InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"30"	"Male"	"oral: feed"	"9"	"week"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triclopyr"	"259-597-3"	"55335-06-3"	"single chemical entity"	"Component is a metabolite of the substance"	"3,5,6-Trichloro-2-pyridinol"	"229-405-2"	"6515-38-4"	"3,5,6-trichloro-1H-pyridin-2-one"	"Not in list"	"C5H2Cl3NO"	"C1=C(C(=O)NC(=C1Cl)Cl)Cl"	"InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Triclopyr"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triclopyr"	"38736"	"2006"	"doi:10.2903/j.efsa.2006.56r"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Triflumizole"	""	"99387-89-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumizole"	""	"99387-89-0"	"N-[4-chloro-2-(trifluoromethyl)phenyl]-1-imidazol-1-yl-2-propoxyethanimine"	"Triflumizole"	"C15H15ClF3N3O"	"CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2"	"InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Triflumizole"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumizole"	"40161"	"2009"	"doi:10.2903/j.efsa.2009.1415"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male/Female"	"oral: gavage"	"18"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Zeta-cypermethrin"	"257-842-9"	"52315-07-8"	"single chemical entity"	"Component is identical to the substance"	"Zeta-Cypermethrin"	"257-842-9"	"52315-07-8"	"(S)-alpha-cyano-3-phenoxybenzyl (1RS,3RS;1RS,3SR)-3-(2,2-dichlorovinyl)-2,2 dimethylcyclopropanecarboxylate"	"Zeta-Cypermethrin"	"C22H19Cl2NO3"	"CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C"	"InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17?,18-,20?/m1/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male/Female"	"oral: gavage"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Zeta-cypermethrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance zeta-cypermethrin."	"39828"	"2009"	"doi:10.2903/j.efsa.2009.196r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is identical to the substance"	"Trinexapac-ethyl"	""	"95266-40-3"	"Ethyl 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylate"	"Trinexapac-Ethyl"	"C13H16O5"	"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1"	"InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Tricarballylic acid"	"202-733-3"	"99-14-9"	"1,2,3-propanetricarboxylic acid (tricarballylic acid)"	"Not in list"	"C6H8O6"	"C(C(CC(=O)O)C(=O)O)C(=O)O"	"InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA313458)"	""	""	"(2-(4-cyclopropyl-2,4-dioxobutyl)-succinic acid)"	"Trinexapac-ethyl metabolite (CGA313458)"	"C11H14O6"	"O=C(CC(CC(O)=O)C(O)=O)\C=C(/O)C1CC1"	"InChI=1/C11H14O6/c12-8(5-9(13)6-1-2-6)3-7(11(16)17)4-10(14)15/h5-7,13H,1-4H2,(H,14,15)(H,16,17)/b9-5-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Trinexapac-ethyl"	""	"95266-40-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Trinexapac-ethyl metabolite (CGA329773)"	""	""	"4-cyclopropanecarbonyl-3,5-dihydroxybenzoic acid
+oxo-butyl)-succinic acid"	"Trinexapac-ethyl metabolite (CGA329773)"	"C11H10O5"	"O=C(c1c(O)cc(cc1O)C(=O)O)C2CC2"	"InChI=1S/C11H10O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h3-5,12-13H,1-2H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Trinexapac-ethyl"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance trinexapac"	"38727"	"2006"	"doi:10.2903/j.efsa.2006.57r"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is identical to the substance"	"Triticonazole"	""	"131983-72-7"	"5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Triticonazole"	"C17H20ClN3O"	"OC1(CN2N=CN=C2)C(C)(C)CCC1=CC3=CC=C(Cl)C=C3"	"InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406341"	""	""	"[(E)-2-(4-chlorobenzylidene)-5,5-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopen-tan-1,3-trans-diol]"	"Not in list"	"C18H22ClN3O2"	"O[C@H](Cn1cncn1)C3\C(=C\c2ccc(Cl)cc2)[C@H](O)C[C@]3(C)C"	"InChI=1/C18H22ClN3O2/c1-18(2)8-15(23)14(7-12-3-5-13(19)6-4-12)17(18)16(24)9-22-11-20-10-21-22/h3-7,10-11,15-17,23-24H,8-9H2,1-2H3/b14-7+/t15-,16-,17?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Triticonazole"	""	"131983-72-7"	"single chemical entity"	"Component is a metabolite of the substance"	"Triticonazole metabolite RPA406203"	""	""	"(5E)-5-[(4-chlorophenyl)methylidene]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol"	"Not in list"	"C17H20ClN3O"	"Clc1ccc(cc1)\C=C3/CCC(C)(C)C3(O)Cn2cncn2"	"InChI=1/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Triticonazole"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triticonazole"	"38582"	"2005"	"doi:10.2903/j.efsa.2005.33ar"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"11"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is identical to the substance"	"Valiphenal"	""	"283159-90-0"	"Methyl 3-(4-chlorophenyl)-3-[[(2S)-3-methyl-2-(propan-2-yloxycarbonylamino)
+butanoyl]amino]propanoate"	"Valifenalate"	"C19H27ClN2O5"	"CC(C)[C@@H](C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)Cl)NC(=O)OC(C)C"	"InChI=1S/C19H27ClN2O5/c1-11(2)17(22-19(25)27-12(3)4)18(24)21-15(10-16(23)26-5)13-6-8-14(20)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3,(H,21,24)(H,22,25)/t15?,17-/m0/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"11"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Chlorobenzoic acid"	"200-805-9"	"74-11-3"	"4-Chlorobenzoic acid"	"Not in list"	"C7H5ClO2"	"C1=CC(=CC=C1C(=O)O)Cl"	"InChI=1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Chlorobenzoic acid"	"200-805-9"	"74-11-3"	"4-Chlorobenzoic acid"	"Not in list"	"C7H5ClO2"	"C1=CC(=CC=C1C(=O)O)Cl"	"InChI=1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Chlorobenzoic acid"	"200-805-9"	"74-11-3"	"4-Chlorobenzoic acid"	"Not in list"	"C7H5ClO2"	"C1=CC(=CC=C1C(=O)O)Cl"	"InChI=1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Chlorobenzoic acid"	"200-805-9"	"74-11-3"	"4-Chlorobenzoic acid"	"Not in list"	"C7H5ClO2"	"C1=CC(=CC=C1C(=O)O)Cl"	"InChI=1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	""	""	"(3RS)-3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)-L-valyl]amino}propanoic acid"	"Not in list"	"C18H25ClN2O5"	"Clc1ccc(cc1)C(NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)CC(O)=O"	"InChI=1/C18H25ClN2O5/c1-10(2)16(21-18(25)26-11(3)4)17(24)20-14(9-15(22)23)12-5-7-13(19)8-6-12/h5-8,10-11,14,16H,9H2,1-4H3,(H,20,24)(H,21,25)(H,22,23)/t14?,16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Chlorobenzoic acid"	"200-805-9"	"74-11-3"	"4-Chlorobenzoic acid"	"Not in list"	"C7H5ClO2"	"C1=CC(=CC=C1C(=O)O)Cl"	"InChI=1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Valiphenal"	""	"283159-90-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Chlorobenzoic acid"	"200-805-9"	"74-11-3"	"4-Chlorobenzoic acid"	"Not in list"	"C7H5ClO2"	"C1=CC(=CC=C1C(=O)O)Cl"	"InChI=1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Hungary"	"Valifenalate (Formerly Valiphenal) (Final Addendum)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance valifenalate."	"41445"	"2013"	"doi:10.2903/j.efsa.2013.3253"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline required"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"not applicable"	"Positive"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Not reported"	"3"	"Female"	"oral: gavage"	"2"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"5"	"Female"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"4"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	"no evidence"	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Wistar"	"15"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Greece"	"Trifluralin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(-4’-chlorophenyl)-1,4-dihydro-5-(2’’-hydroxy-ethoxy)-4-oxo-cinnoline-3-carboxylate"	""	""	"1-(4-chlorophenyl)-5-(2-hydroxyethoxy)-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid"	"Sintofen metabolite (SC 3095)"	"C17H13ClN2O5"	"OC(=O)C/2=N/N(c1ccc(Cl)cc1)c3cccc(OCCO)c3C\2=O"	"InChI=1/C17H13ClN2O5/c18-10-4-6-11(7-5-10)20-12-2-1-3-13(25-9-8-21)14(12)16(22)15(19-20)17(23)24/h1-7,21H,8-9H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"7"	"Male"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is identical to the substance"	"Triasulfuron"	"617-298-9"	"82097-50-5"	"1-[2-(2-chloroethoxy)phenylsulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea"	"Triasulfuron"	"C14H16ClN5O5S"	"CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl"	"InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"7"	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Triasulfuron"	"617-298-9"	"82097-50-5"	"single chemical entity"	"Component is a metabolite of the substance"	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	""	""	"[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamic acid"	"Not in list"	"C6H9N5O5S"	"Cc1nc(NC(=O)NS(=O)(=O)O)nc(OC)n1"	"InChI=1/C6H9N5O5S/c1-3-7-4(10-6(8-3)16-2)9-5(12)11-17(13,14)15/h1-2H3,(H,13,14,15)(H2,7,8,9,10,11,12)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Triasulfuron (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triasulfuron"	"42013"	"2015"	"doi:10.2903/j.efsa.2015.3958"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Ambiguous"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"12"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is identical to the substance"	"Tralkoxydim"	""	"87820-88-0"	"2-[1-(Ethoxyamino)propylidene]-5-(2,4,6-trimethylphenyl)cyclohexane-1,
+3-dione"	"Tralkoxydim"	"C20H27NO3"	"CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC"	"InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is identical to the substance"	"Rimsulfuron"	""	"122931-48-0"	"N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]-3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Rimsulfuron"	"C14H17N5O7S2"	"O=S(C1=NC=CC=C1S(CC)(=O)=O)(NC(NC2=NC(OC)=CC(OC)=N2)=O)=O"	"InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"large colonies"	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"large colonies"	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Sodium silver thiosulfate"	""	""	"single chemical entity"	"Component is identical to the substance"	"Sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)"	""	""	""	"Not in list"	""	""	""	"inorganic"	"no structure"	""	""	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"6"	"Male"	"oral: gavage"	"3"	"month"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Silver thiosulphate"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sodium silver thiosulfate (in solution with a ratio of at least 1 to 8 silver to thiosulfate ions)."	"41550"	"2013"	"doi:10.2903/j.efsa.2013.3136"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(3-(ethylsulfonyl)-2-pyridinesulfonamide"	""	""	"3-(ethylsulfonyl)pyridine-2-sulfonamide"	"Not in list"	"C7H10N2O4S2"	"O=S(N)(=O)c1ncccc1S(=O)(=O)CC"	"InChI=1/C7H10N2O4S2/c1-2-14(10,11)6-4-3-5-9-7(6)15(8,12)13/h3-5H,2H2,1H3,(H2,8,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Rimsulfuron"	""	"122931-48-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(N-(4,6-dimethoxy-2-pyrimidinyl)-N-((3-ethylsulfonyl)-2-pyridinyl)urea)"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-1-[3-(ethylsulfonyl)pyridin-2-yl]urea"	"Not in list"	"C14H17N5O5S"	"O=C(N)N(c1nc(cc(OC)n1)OC)c2ncccc2S(=O)(=O)CC"	"InChI=1/C14H17N5O5S/c1-4-25(21,22)9-6-5-7-16-12(9)19(13(15)20)14-17-10(23-2)8-11(18-14)24-3/h5-8H,4H2,1-3H3,(H2,15,20)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Rimsulfuron (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer reviewof the pesticide risk assessment of the active substance rimsulfuron"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.45r"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"mixture or formulation"	"Component is identical to the substance"	"Spinetoram"	""	"935545-74-7"	"(3aR,5aR,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl 6-deoxy-3-O-ethyl-2,4-di-O-methyl-a-L-mannopyranoside"	"Spinetoram (XDE-175)"	"C42H69NO10"	"CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@@H]3[C@H](C2CC(=O)O1)CC[C@H]4[C@H]3CC(C4)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OCC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C"	"InChI=1S/C42H69NO10/c1-10-27-13-12-14-35(53-37-18-17-34(43(6)7)24(4)49-37)23(3)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(47-9)40(48-11-2)39(46-8)25(5)50-42/h21,23-32,34-35,37,39-42H,10-20,22H2,1-9H3/t23-,24-,25+,26-,27+,28?,29-,30-,31-,32?,34+,35+,37+,39+,40-,41-,42+/m1/s1"	"organic"	"representative compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-demethyl-175-J"	""	""	"(2R,3aR,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-14-methyl-13-{[(2S,5S,6R)-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-2-yl  6-deoxy-3-O-ethyl-2,4-di-O-methyl-alpha-L-mannopyranoside"	"N-demethyl-175-J"	"C41H67NO10"	"CN[C@H]1CCC(O[C@@H]1C)O[C@H]6CCC[C@H](CC)OC(=O)C[C@@H]5C(=C/[C@@H]2[C@H]5CC[C@@H]3C[C@H](C[C@@H]23)O[C@@H]4O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]4OC)\C(=O)[C@@H]6C"	"InChI=1/C41H67NO10/c1-9-26-12-11-13-34(52-36-17-16-33(42-6)23(4)48-36)22(3)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(46-8)39(47-10-2)38(45-7)24(5)49-41/h20,22-31,33-34,36,38-42H,9-19,21H2,1-8H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36-,38+,39-,40-,41+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-J"	""	""	"N-[(2R,3S,6R)-6-({(2R,3aR,5aR,5bS,9S,14R,16aS,16bR)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-14-methyl-7,15-dioxo-2,3,3a,4,5,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-octadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C41H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3CC[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C41H65NO11/c1-8-26-11-10-12-34(53-36-16-15-33(42-21-43)23(4)49-36)22(3)37(45)32-19-30-28(31(32)20-35(44)51-26)14-13-25-17-27(18-29(25)30)52-41-40(47-7)39(48-9-2)38(46-6)24(5)50-41/h19,21-31,33-34,36,38-41H,8-18,20H2,1-7H3,(H,42,43)/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34?,36+,38+,39-,40-,41?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Spinetoram"	""	"935545-74-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-formyl-175-L"	""	""	"N-[(2R,3S,6R)-6-({(2S,3aR,5aS,5bS,9S,14R,16aS,16bS)-2-[(6-deoxy-3-O-ethyl-2,4-di-O-methyl-L-mannopyranosyl)oxy]-9-ethyl-4,14-dimethyl-7,15-dioxo-2,3,3a,5a,5b,6,7,9,10,11,12,13,14,15,16a,16b-hexadecahydro-1H-as-indaceno[3,2-d]oxacyclododecin-13-yl}oxy)-2-methyloxan-3-yl]formamide"	"Not in list"	"C42H65NO11"	"O=CN[C@H]1CC[C@@H](O[C@@H]1C)OC2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@@H]4[C@H]3C=C(C)[C@@H]5C[C@H](C[C@H]54)OC6O[C@@H](C)[C@H](OC)[C@@H](OCC)[C@H]6OC)C(=O)[C@@H]2C"	"InChI=1S/C42H65NO11/c1-9-26-12-11-13-35(54-37-15-14-34(43-21-44)24(5)50-37)23(4)38(46)33-19-31-29(32(33)20-36(45)52-26)16-22(3)28-17-27(18-30(28)31)53-42-41(48-8)40(49-10-2)39(47-7)25(6)51-42/h16,19,21,23-32,34-35,37,39-42H,9-15,17-18,20H2,1-8H3,(H,43,44)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,34+,35?,37+,39+,40-,41-,42?/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"XDE-175 (spinetoram)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spinetoram."	"41402"	"2013"	"doi:10.2903/j.efsa.2013.3220"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"130"	"Male/Female"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"130"	"Male/Female"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"SwissWebster"	"130"	"Male/Female"	"intraperitoneal"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"48"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Quinoclamine"	"220-529-2"	"2797-51-5"	"single chemical entity"	"Component is identical to the substance"	"Quinoclamine"	"220-529-2"	"2797-51-5"	"2-amino-3-chloro-1,4-naphthoquinone"	"Quinoclamine"	"C10H6ClNO2"	"NC1=C(Cl)C(=O)c2ccccc2C1=O"	"InChI=1/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"48"	"Male"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Sweden"	"Quinoclamine"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quinoclamine"	"39428"	"2007"	"doi:10.2903/j.efsa.2007.117r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"6"	"Male"	"oral: gavage"	"18"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"6"	"Male"	"oral: gavage"	"42"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Syrian"	"44"	"Male/Female"	"oral: feed"	"7"	"week"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No data"	"Acceptable"	"Hamster (as animal)"	"Syrian"	"44"	"Male/Female"	"oral: feed"	"14"	"week"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"6"	"Male"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is identical to the substance"	"Tri-allate"	"218-962-7"	"2303-17-5"	"S-(2,3,3-trichloroprop-2-en-1-yl) diisopropylthiocarbamate"	"Tri-allate"	"C10H16Cl3NOS"	"CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl"	"InChI=1/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"6"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Tri-allate"	"218-962-7"	"2303-17-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2,3,3-trichloroprop-2-ene-sulfonic acid"	""	""	"2,3,3-trichloroprop-2-ene-1-sulfonic acid"	"Not in list"	"C3H3Cl3O3S"	"C(C(=C(Cl)Cl)Cl)S(=O)(=O)O"	"InChI=1S/C3H3Cl3O3S/c4-2(3(5)6)1-10(7,8)9/h1H2,(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Tri-allate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tri-allate"	"40010"	"2009"	"doi:10.2903/j.efsa.2009.181r"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	""	""	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	"Not in list"	"C6H5NO6S2"	"O=S(N)(=O)c1c(scc1C(=O)O)C(O)=O"	"InChI=1/C6H5NO6S2/c7-15(12,13)4-2(5(8)9)1-14-3(4)6(10)11/h1H,(H,8,9)(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	""	""	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	"Not in list"	"C6H5NO6S2"	"O=S(N)(=O)c1c(scc1C(=O)O)C(O)=O"	"InChI=1/C6H5NO6S2/c7-15(12,13)4-2(5(8)9)1-14-3(4)6(10)11/h1H,(H,8,9)(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is identical to the substance"	"Thiencarbazone-methyl"	""	"317815-83-1"	"methyl 4-[(4,5-dihydro-3-methoxy-4-methyl-5-oxo-1H-1,2,4-triazol-1-yl)carboxamidosulfonyl]-5-methylthiophene-3-carboxylate"	"Thiencarbazone-methyl"	"C12H14N4O7S2"	"CC1=C(C(=CS1)C(=O)OC)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C12H14N4O7S2/c1-6-8(7(5-24-6)9(17)22-3)25(20,21)14-10(18)16-12(19)15(2)11(13-16)23-4/h5H,1-4H3,(H,14,18)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	""	""	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	"Not in list"	"C6H5NO6S2"	"O=S(N)(=O)c1c(scc1C(=O)O)C(O)=O"	"InChI=1/C6H5NO6S2/c7-15(12,13)4-2(5(8)9)1-14-3(4)6(10)11/h1H,(H,8,9)(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	""	""	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	"Not in list"	"C6H5NO6S2"	"O=S(N)(=O)c1c(scc1C(=O)O)C(O)=O"	"InChI=1/C6H5NO6S2/c7-15(12,13)4-2(5(8)9)1-14-3(4)6(10)11/h1H,(H,8,9)(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	""	""	"3-sulfamoylthiophene-2,4-dicarboxylic acid"	"Not in list"	"C6H5NO6S2"	"O=S(N)(=O)c1c(scc1C(=O)O)C(O)=O"	"InChI=1/C6H5NO6S2/c7-15(12,13)4-2(5(8)9)1-14-3(4)6(10)11/h1H,(H,8,9)(H,10,11)(H2,7,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-{[(3-methoxy-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylic acid"	""	""	"4-[(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)sulfamoyl]-5-methylthiophene-3-carboxylic acid"	"Not in list"	"C11H12N4O7S2"	"CC1=C(C(=CS1)C(=O)O)S(=O)(=O)NC(=O)N2C(=O)N(C(=N2)OC)C"	"InChI=1S/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)17)24(20,21)13-9(18)15-11(19)14(2)10(12-15)22-3/h4H,1-3H3,(H,13,18)(H,16,17)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	""	""	"methyl 5-methyl-4-sulfamoylthiophene-3-carboxylate"	"Not in list"	"C7H9NO4S2"	"O=S(N)(=O)c1c(C)scc1C(=O)OC"	"InChI=1/C7H9NO4S2/c1-4-6(14(8,10)11)5(3-13-4)7(9)12-2/h3H,1-2H3,(H2,8,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Thiencarbazone-methyl"	""	"317815-83-1"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 4-({[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]amino}sulfonyl)-5-methylthiophene-3-carboxylate"	""	""	"methyl 4-{[(3-methoxy-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)carbonyl]sulfamoyl}-5-methylthiophene-3-carboxylate"	"Not in list"	"C11H12N4O7S2"	"O=S(=O)(NC(=O)N1/N=C(/OC)NC1=O)c2c(C)scc2C(=O)OC"	"InChI=1/C11H12N4O7S2/c1-5-7(6(4-23-5)8(16)21-2)24(19,20)14-11(18)15-10(17)12-9(13-15)22-3/h4H,1-3H3,(H,14,18)(H,12,13,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiencarbazone-methyl (BYH 18636)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiencarbazone-methyl"	"41456"	"2013"	"doi:10.2903/j.efsa.2013.3270"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is identical to the substance"	"Triflumuron"	"264-980-3"	"64628-44-0"	"2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide"	"Triflumuron"	"C15H10ClF3N2O3"	"O=C(C1=CC=CC=C1Cl)NC(NC(C=C2)=CC=C2OC(F)(F)F)=O"	"InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Trifluoro-methoxyaniline"	"207-317-5"	"461-82-5"	"4-(Trifluoromethoxy)aniline"	"4-Trifluoro-methoxyaniline"	"C7H6F3NO"	"C1=CC(=CC=C1N)OC(F)(F)F"	"InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Trifluoro-methoxyaniline"	"207-317-5"	"461-82-5"	"4-(Trifluoromethoxy)aniline"	"4-Trifluoro-methoxyaniline"	"C7H6F3NO"	"C1=CC(=CC=C1N)OC(F)(F)F"	"InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Trifluoro-methoxyaniline"	"207-317-5"	"461-82-5"	"4-(Trifluoromethoxy)aniline"	"4-Trifluoro-methoxyaniline"	"C7H6F3NO"	"C1=CC(=CC=C1N)OC(F)(F)F"	"InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Trifluoro-methoxyaniline"	"207-317-5"	"461-82-5"	"4-(Trifluoromethoxy)aniline"	"4-Trifluoro-methoxyaniline"	"C7H6F3NO"	"C1=CC(=CC=C1N)OC(F)(F)F"	"InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Trifluoro-methoxyaniline"	"207-317-5"	"461-82-5"	"4-(Trifluoromethoxy)aniline"	"4-Trifluoro-methoxyaniline"	"C7H6F3NO"	"C1=CC(=CC=C1N)OC(F)(F)F"	"InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Trifluoro-methoxyaniline"	"207-317-5"	"461-82-5"	"4-(Trifluoromethoxy)aniline"	"4-Trifluoro-methoxyaniline"	"C7H6F3NO"	"C1=CC(=CC=C1N)OC(F)(F)F"	"InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Trifluoro-methoxyaniline"	"207-317-5"	"461-82-5"	"4-(Trifluoromethoxy)aniline"	"4-Trifluoro-methoxyaniline"	"C7H6F3NO"	"C1=CC(=CC=C1N)OC(F)(F)F"	"InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Triflumuron"	"264-980-3"	"64628-44-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Trifluoro-methoxyaniline"	"207-317-5"	"461-82-5"	"4-(Trifluoromethoxy)aniline"	"4-Trifluoro-methoxyaniline"	"C7H6F3NO"	"C1=CC(=CC=C1N)OC(F)(F)F"	"InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Triflumuron (Addendum 2 )"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance triflumuron"	"40546"	"2011"	"doi:10.2903/j.efsa.2011.1941"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"No data"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"No data"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"No data"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: gavage"	"18"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"Male"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Famoxadone"	"603-520-1"	"131807-57-3"	"single chemical entity"	"Component is identical to the substance"	"Famoxadone"	"603-520-1"	"131807-57-3"	"3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione"	"Famoxadone"	"C22H18N2O4"	"CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4"	"InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Famoxadone  (Renewal Assessment Report)"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance famoxadone"	"42201"	"2015"	"doi:10.2903/j.efsa.2015.4194"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-ethyl"	"600-119-3"	"100646-51-3"	"Ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Quizalofop-P-ethyl"	"C19H17ClN2O4"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl"	"InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"18"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-ethyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	"large colonies"	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	"small colonies"	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl (Final addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Quizalofop-p-tefuryl (Final addendum)"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"single chemical entity"	"Component is identical to the substance"	"Quizalofop-P-tefuryl"	"601-628-3"	"119738-06-6"	"Oxolan-2-ylmethyl 2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate"	"Not in list"	"C22H21ClN2O5"	"CC(C(=O)OCC1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl"	"InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Finland"	"Quizalofop-p-tefuryl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance quizalofop-P (considered variants quizalofop-P-ethyl and quizalofop-P-tefuryl)."	"40008"	"2009"	"doi:10.2903/j.efsa.2009.205r"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"8"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Foramsulfuron"	"605-666-1"	"173159-57-4"	"single chemical entity"	"Component is identical to the substance"	"Foramsulfuron"	"605-666-1
+	605-666-1"	"173159-57-4"	"1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-dimethylaminocarbonyl-5-formamidophenylsulfonyl)urea"	"Foramsulfuron"	"C17H20N6O7S"	"CN(C)C(=O)C1=C(C=C(C=C1)NC=O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC"	"InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"8"	"Male"	"oral: gavage"	"14"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Foramsulfuron (revised Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance foramsulfuron"	"42439"	"2016"	"doi:10.2903/j.efsa.2016.4421"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	"no information"	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is identical to the substance"	"Tau-fluvalinate"	""	"102851-06-9"	"[cyano-(3-phenoxyphenyl)methyl](2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate"	"tau-Fluvalinate"	"C26H22ClF3N2O3"	"CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl"	"InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-4-(trifluoromethyl)aniline"	""	""	"2-chloro-4-(trifluoromethyl)aniline"	"Not in list"	"C7H5ClF3N"	"c1cc(c(cc1C(F)(F)F)Cl)N"	"InChI=1S/C7H5ClF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	""	""	"N-[2-chloro-4-(trifluoromethyl)phenyl]-D-valine"	"Not in list"	"C12H13ClF3NO2"	"Clc1cc(ccc1NC(C(O)=O)C(C)C)C(F)(F)F"	"InChI=1/C12H13ClF3NO2/c1-6(2)10(11(18)19)17-9-4-3-7(5-8(9)13)12(14,15)16/h3-6,10,17H,1-2H3,(H,18,19)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Tau-fluvalinate"	""	"102851-06-9"	"single chemical entity"	"Component is a metabolite of the substance"	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	""	""	"3-{[2-chloro-4-(trifluoromethyl)phenyl]amino}-4-methyl-2-(3-phenoxyphenyl)pentanenitrile"	"Not in list"	"C25H22ClF3N2O"	"Clc3cc(ccc3NC(C(C#N)c2cccc(Oc1ccccc1)c2)C(C)C)C(F)(F)F"	"InChI=1/C25H22ClF3N2O/c1-16(2)24(31-23-12-11-18(14-22(23)26)25(27,28)29)21(15-30)17-7-6-10-20(13-17)32-19-8-4-3-5-9-19/h3-14,16,21,24,31H,1-2H3/t21?,24-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Tau-fluvalinate"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tau-fluvalinate"	"40366"	"2010"	"doi:10.2903/j.efsa.2010.1645"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"single chemical entity"	"Component is identical to the substance"	"Sodium 5-nitroguaiacolate"	""	"67233-85-6"	"Sodium;2-methoxy-5-nitrophenolate"	"Not in list"	"C7H6NNaO4"	"COC1=C(C=C(C=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C7H7NO4.Na/c1-12-7-3-2-5(8(10)11)4-6(7)9;/h2-4,9H,1H3;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"single chemical entity"	"Component is identical to the substance"	"Sodium o-nitrophenolate"	"212-527-5"	"824-39-5"	"Sodium;2-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"small colonies"	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"single chemical entity"	"Component is identical to the substance"	"Sodium p-nitrophenolate"	"212-536-4"	"824-78-2"	"Sodium;4-nitrophenolate"	"Not in list"	"C6H4NNaO3"	"C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]"	"InChI=1S/C6H5NO3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H;/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Sodium 5-nitroguaiacolate Sodium o-nitrophenolate and Sodium p-nitrophenolate"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substances sodium 5-nitroguaiacolate, sodium o-nitrophenolate and sodium p-nitrophenolate."	"39904"	"2009"	"doi:10.2903/j.efsa.2009.191r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Spirodiclofen"	""	"148477-71-8"	"single chemical entity"	"Component is identical to the substance"	"Spirodiclofen"	""	"148477-71-8"	"3-(3,5-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate"	"Spirodiclofen"	"C21H24Cl2O4"	"O=C2OC1(C(OC(C(CC)(C)C)=O)=C2C3=CC(Cl)=CC(Cl)=C3)CCCCC1"	"InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(13-10-14(22)12-15(23)11-13)18(24)27-21(17)8-6-5-7-9-21/h10-12H,4-9H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The Netherlands"	"Spirodiclofen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance spirodiclofen"	"40031"	"2009"	"doi:10.2903/j.efsa.2009.339r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"S211α"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"S138"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"S211α"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"S138"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Ambiguous"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"6"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"20"	"Male/Female"	"oral: unspecified"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"20"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Not reported"	"8"	"Male"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male"	"oral: unspecified"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"15"	"Male"	"oral: unspecified"	"48"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mouse spot test"	"in vivo"	"According to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male/Female"	"oral: gavage"	"12"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mouse spot test"	"in vivo"	"According to"	"OECD Guideline 484 (Genetic Toxicology: Mouse Spot Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male/Female"	"oral: gavage"	"35"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: feed"	"12"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: feed"	"12"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline followed"	"Not reported"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"Wistar"	""	"No data"	"oral: feed"	"12"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST"	""	""	"N'-[4-(hydroxymethyl)phenyl]-N,N-dimethylsulfamide"	"Not in list"	"C9H14N2O3S"	"O=S(=O)(Nc1ccc(cc1)CO)N(C)C"	"InChI=1/C9H14N2O3S/c1-11(2)15(13,14)10-9-5-3-8(7-12)4-6-9/h3-6,10,12H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST"	""	""	"N'-[4-(hydroxymethyl)phenyl]-N,N-dimethylsulfamide"	"Not in list"	"C9H14N2O3S"	"O=S(=O)(Nc1ccc(cc1)CO)N(C)C"	"InChI=1/C9H14N2O3S/c1-11(2)15(13,14)10-9-5-3-8(7-12)4-6-9/h3-6,10,12H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST"	""	""	"N'-[4-(hydroxymethyl)phenyl]-N,N-dimethylsulfamide"	"Not in list"	"C9H14N2O3S"	"O=S(=O)(Nc1ccc(cc1)CO)N(C)C"	"InChI=1/C9H14N2O3S/c1-11(2)15(13,14)10-9-5-3-8(7-12)4-6-9/h3-6,10,12H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST"	""	""	"N'-[4-(hydroxymethyl)phenyl]-N,N-dimethylsulfamide"	"Not in list"	"C9H14N2O3S"	"O=S(=O)(Nc1ccc(cc1)CO)N(C)C"	"InChI=1/C9H14N2O3S/c1-11(2)15(13,14)10-9-5-3-8(7-12)4-6-9/h3-6,10,12H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST"	""	""	"N'-[4-(hydroxymethyl)phenyl]-N,N-dimethylsulfamide"	"Not in list"	"C9H14N2O3S"	"O=S(=O)(Nc1ccc(cc1)CO)N(C)C"	"InChI=1/C9H14N2O3S/c1-11(2)15(13,14)10-9-5-3-8(7-12)4-6-9/h3-6,10,12H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST"	""	""	"N'-[4-(hydroxymethyl)phenyl]-N,N-dimethylsulfamide"	"Not in list"	"C9H14N2O3S"	"O=S(=O)(Nc1ccc(cc1)CO)N(C)C"	"InChI=1/C9H14N2O3S/c1-11(2)15(13,14)10-9-5-3-8(7-12)4-6-9/h3-6,10,12H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST"	""	""	"N'-[4-(hydroxymethyl)phenyl]-N,N-dimethylsulfamide"	"Not in list"	"C9H14N2O3S"	"O=S(=O)(Nc1ccc(cc1)CO)N(C)C"	"InChI=1/C9H14N2O3S/c1-11(2)15(13,14)10-9-5-3-8(7-12)4-6-9/h3-6,10,12H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST"	""	""	"N'-[4-(hydroxymethyl)phenyl]-N,N-dimethylsulfamide"	"Not in list"	"C9H14N2O3S"	"O=S(=O)(Nc1ccc(cc1)CO)N(C)C"	"InChI=1/C9H14N2O3S/c1-11(2)15(13,14)10-9-5-3-8(7-12)4-6-9/h3-6,10,12H,7H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"4-Hydroxymethyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[(4-(ß-D-glucopyranosyl)-methylphenyl]sulfamide"	"Not in list"	"C16H26N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(CO[C@H]1C[C@H](O)[C@H](O)[C@H](O)[C@@H](CO)O1)cc2"	"InChI=1/C16H26N2O8S/c1-18(2)27(23,24)17-11-5-3-10(4-6-11)9-25-14-7-12(20)15(21)16(22)13(8-19)26-14/h3-6,12-17,19-22H,7-9H2,1-2H3/t12-,13+,14+,15-,16+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[[2-(ß-D-glucopyranosyl)-4-methyl]phenyl]sulfamide"	"Not in list"	"C15H24N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(C)cc2OC1OC(CO)C(O)C(O)C1O"	"InChI=1/C15H24N2O8S/c1-8-4-5-9(16-26(22,23)17(2)3)10(6-8)24-15-14(21)13(20)12(19)11(7-18)25-15/h4-6,11-16,18-21H,7H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[[2-(ß-D-glucopyranosyl)-4-methyl]phenyl]sulfamide"	"Not in list"	"C15H24N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(C)cc2OC1OC(CO)C(O)C(O)C1O"	"InChI=1/C15H24N2O8S/c1-8-4-5-9(16-26(22,23)17(2)3)10(6-8)24-15-14(21)13(20)12(19)11(7-18)25-15/h4-6,11-16,18-21H,7H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[[2-(ß-D-glucopyranosyl)-4-methyl]phenyl]sulfamide"	"Not in list"	"C15H24N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(C)cc2OC1OC(CO)C(O)C(O)C1O"	"InChI=1/C15H24N2O8S/c1-8-4-5-9(16-26(22,23)17(2)3)10(6-8)24-15-14(21)13(20)12(19)11(7-18)25-15/h4-6,11-16,18-21H,7H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[[2-(ß-D-glucopyranosyl)-4-methyl]phenyl]sulfamide"	"Not in list"	"C15H24N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(C)cc2OC1OC(CO)C(O)C(O)C1O"	"InChI=1/C15H24N2O8S/c1-8-4-5-9(16-26(22,23)17(2)3)10(6-8)24-15-14(21)13(20)12(19)11(7-18)25-15/h4-6,11-16,18-21H,7H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[[2-(ß-D-glucopyranosyl)-4-methyl]phenyl]sulfamide"	"Not in list"	"C15H24N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(C)cc2OC1OC(CO)C(O)C(O)C1O"	"InChI=1/C15H24N2O8S/c1-8-4-5-9(16-26(22,23)17(2)3)10(6-8)24-15-14(21)13(20)12(19)11(7-18)25-15/h4-6,11-16,18-21H,7H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[[2-(ß-D-glucopyranosyl)-4-methyl]phenyl]sulfamide"	"Not in list"	"C15H24N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(C)cc2OC1OC(CO)C(O)C(O)C1O"	"InChI=1/C15H24N2O8S/c1-8-4-5-9(16-26(22,23)17(2)3)10(6-8)24-15-14(21)13(20)12(19)11(7-18)25-15/h4-6,11-16,18-21H,7H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[[2-(ß-D-glucopyranosyl)-4-methyl]phenyl]sulfamide"	"Not in list"	"C15H24N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(C)cc2OC1OC(CO)C(O)C(O)C1O"	"InChI=1/C15H24N2O8S/c1-8-4-5-9(16-26(22,23)17(2)3)10(6-8)24-15-14(21)13(20)12(19)11(7-18)25-15/h4-6,11-16,18-21H,7H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST-glucoside"	""	""	"N,N-dimethyl-N´-[[2-(ß-D-glucopyranosyl)-4-methyl]phenyl]sulfamide"	"Not in list"	"C15H24N2O8S"	"CN(C)S(=O)(=O)Nc2ccc(C)cc2OC1OC(CO)C(O)C(O)C1O"	"InChI=1/C15H24N2O8S/c1-8-4-5-9(16-26(22,23)17(2)3)10(6-8)24-15-14(21)13(20)12(19)11(7-18)25-15/h4-6,11-16,18-21H,7H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is a metabolite of the substance"	"2-Hydroxyphenyl-DMST"	""	""	"N,N-dimethyl-N´-[(2-hydroxy-4-methyl)-phenyl]sulfamide"	"Not in list"	"C9H14N2O3S"	"Oc1cc(C)ccc1NS(=O)(=O)N(C)C"	"InChI=1/C9H14N2O3S/c1-7-4-5-8(9(12)6-7)10-15(13,14)11(2)3/h4-6,10,12H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Finland"	"Tolylfluanid"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiromesifen"	""	"283594-90-1"	"single chemical entity"	"Component is identical to the substance"	"Spiromesifen"	""	"283594-90-1"	"2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate"	"Spiromesifen"	"C23H30O4"	"O=C(CC(C)(C)C)OC1=C(C3=C(C)C=C(C)C=C3C)C(OC21CCCC2)=O"	"InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Spiromesifen"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiromesifen"	"41194"	"2012"	"doi:10.2903/j.efsa.2012.2879"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is identical to the substance"	"Spiroxamine"	""	"118134-30-8"	"N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine"	"Spiroxamine (sum of isomers)"	"C18H35NO2"	"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C"	"InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Spiroxamine"	""	"118134-30-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	""	""	"[(8-tert-butyl-1,4-dioxaspiro[4.5]dec-2-yl)methyl]ethyl(propyl)amine oxide"	"Not in list"	"C18H35NO3"	"CC(C)(C)C1CCC2(CC1)OCC(C[N+]([O-])(CC)CCC)O2"	"InChI=1/C18H35NO3/c1-6-12-19(20,7-2)13-16-14-21-18(22-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Spiroxamine"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spiroxamine."	"40473"	"2010"	"doi:10.2903/j.efsa.2010.1719"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male/Female"	"intraperitoneal"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Fenhexamid"	"422-530-5"	"126833-17-8"	"single chemical entity"	"Component is identical to the substance"	"Fenhexamid"	"422-530-5"	"126833-17-8"	"N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide"	"Fenhexamid"	"C14H17Cl2NO2"	"CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl"	"InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: The United Kingdom"	"Fenhexamid (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenhexamid"	"41827"	"2014"	"doi:10.2903/j.efsa.2014.3744"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: unspecified"	"4"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is identical to the substance"	"Spirotetramat"	""	"203313-25-1"	"[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl]
+ethyl carbonate"	"Not in list"	"C21H27NO5"	"CCOC(=O)OC1=C(C(=O)NC12CCC(CC2)OC)C3=C(C=CC(=C3)C)C"	"InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: unspecified"	"16"	"h"	"no"	"not applicable"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3-hydroxy-8-methoxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C18H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(CC2)OC)NC3=O"	"InChI=1/C18H23NO4/c1-11-4-5-12(2)14(10-11)18(22)15(20)17(19-16(18)21)8-6-13(23-3)7-9-17/h4-5,10,13,22H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	""	""	"3-(2,5-dimethylphenyl)-3,8-dihydroxy-1-azaspiro[4.5]decane-2,4-dione"	"Not in list"	"C17H21NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)C2(CCC(O)CC2)NC3=O"	"InChI=1/C17H21NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,19,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-3,4,8-trihydroxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C17H23NO4"	"Cc1cc(c(C)cc1)C3(O)C(=O)NC2(CCC(O)CC2)C3O"	"InChI=1/C17H23NO4/c1-10-3-4-11(2)13(9-10)17(22)14(20)16(18-15(17)21)7-5-12(19)6-8-16/h3-4,9,12,14,19-20,22H,5-8H2,1-2H3,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Spirotetramat"	""	"203313-25-1"	"single chemical entity"	"Component is a metabolite of the substance"	"(5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	""	""	"3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]decan-2-one"	"Not in list"	"C18H25NO3"	"Cc3cc(C2C(=O)NC1(CCC(CC1)OC)C2O)c(C)cc3"	"InChI=1/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Spirotetramat"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance spirotetramat."	"41432"	"2013"	"doi:10.2903/j.efsa.2013.3243"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is identical to the substance"	"Fluazinam"	""	"79622-59-6"	"3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine"	"Fluazinam"	"C13H4Cl2F6N4O4"	"C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F"	"InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"2-chloro-6-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-5-nitro-m-toluidine"	""	""	"3-chloro-N1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-6-nitro-4-(trifluoromethyl)benzene-1,2-diamine"	"Not in list"	"C13H6Cl2F6N4O2"	"[O-][N+](=O)c2cc(c(Cl)c(N)c2Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F"	"InChI=1/C13H6Cl2F6N4O2/c14-6-1-4(12(16,17)18)3-23-11(6)24-10-7(25(26)27)2-5(13(19,20)21)8(15)9(10)22/h1-3H,22H2,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Male"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Male"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Male"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fluazinam"	""	"79622-59-6"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(3-chloro-5-trifluoromethyl-2-pyridylamino)-α,α,α-trifluoro-4,6-dinitro-o-cresol"	""	""	"3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-2,4-dinitro-6-(trifluoromethyl)phenol"	"Not in list"	"C13H5ClF6N4O5"	"[O-][N+](=O)c2cc(c(O)c(c2Nc1ncc(cc1Cl)C(F)(F)F)[N+]([O-])=O)C(F)(F)F"	"InChI=1/C13H5ClF6N4O5/c14-6-1-4(12(15,16)17)3-21-11(6)22-8-7(23(26)27)2-5(13(18,19)20)10(25)9(8)24(28)29/h1-3,25H,(H,21,22)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"6"	"Female"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fluazinam"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluazinam"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.137r"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"large colonies"	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"small colonies"	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: unspecified"	"18"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is identical to the substance"	"Fenamidone"	"605-252-0"	"161326-34-7"	"(S)-5-methyl-2-methylthio-5-phenyl-3-phenylamino-3,5-dihydroimidazol-4-one"	"Fenamidone"	"C17H17N3OS"	"CC1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3"	"InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"5"	"Male"	"oral: unspecified"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	""	""	"(5S)-5-methyl-5-phenylimidazolidine-2,4-dione"	"Not in list"	"C10H10N2O2"	"C[C@]1(NC(=O)NC1=O)c2ccccc2"	"InChI=1/C10H10N2O2/c1-10(7-5-3-2-4-6-7)8(13)11-9(14)12-10/h2-6H,1H3,(H2,11,12,13,14)/t10-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(S)-5-Methyl-5-phenyl-3-(phenylamino)- 2,4-imidazolidine-dione"	""	""	"(5S)-5-methyl-5-phenyl-3-(phenylamino)imidazolidine-2,4-dione"	"Not in list"	"C16H15N3O2"	"O=C2N(Nc1ccccc1)C(=O)N[C@@]2(C)c3ccccc3"	"InChI=1/C16H15N3O2/c1-16(12-8-4-2-5-9-12)14(20)19(15(21)17-16)18-13-10-6-3-7-11-13/h2-11,18H,1H3,(H,17,21)/t16-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"8"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenoxycarb"	"276-696-7"	"72490-01-8"	"single chemical entity"	"Component is identical to the substance"	"Fenoxycarb"	"276-696-7"	"72490-01-8"	"ethyl [2-(4-phenoxyphenoxy)ethyl]carbamate"	"Fenoxycarb"	"C17H19NO4"	"O=C(NCCOC1=CC=C(OC2=CC=CC=C2)C=C1)OCC"	"InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: unspecified"	""	"h"	"yes"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The Netherlands"	"Fenoxycarb (Final Addendum)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenoxycarb"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1779"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"50"	"Male"	"oral: unspecified"	"20"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"Male/Female"	"intraperitoneal"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is identical to the substance"	"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"ethyl 3-methyl-4-(methylthio)phenyl isopropylamidophosphate"	"Fenamiphos"	"C13H22NO3PS"	"Cc1cc(ccc1SC)OP(=O)(NC(C)C)OCC"	"InChI=1S/C13H22NO3PS/c1-6-16-18(15,14-10(2)3)17-12-7-8-13(19-5)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"5"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenamiphos (aka phenamiphos)"	"244-848-1"	"22224-92-6"	"single chemical entity"	"Component is a metabolite of the substance"	"des-isopropylamino fenamiphos sulfoxide"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The Netherlands"	"Fenamiphos (Final Addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenamiphos"	"38783"	"2006"	"doi:10.2903/j.efsa.2006.62r"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Alpha 742 S. marcescens"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Alpha 21 S. marcescens"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Other"	"Alpha 13 S. marcescens"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"4"	"Male/Female"	"intraperitoneal"	"8"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"4"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbutatin oxide"	"236-407-7"	"13356-08-6"	"hexakis(2-methyl-2-phenylpropyl)distannoxane"	"Fenbutatin oxide"	"C60H78OSn2"	"CC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6"	"InChI=1/6C10H13.O.2Sn/c6*1-10(2,3)9-7-5-4-6-8-9;;;/h6*4-8H,1H2,2-3H3;;;/rC60H78OSn2/c1-55(2,49-31-19-13-20-32-49)43-62(44-56(3,4)50-33-21-14-22-34-50,45-57(5,6)51-35-23-15-24-36-51)61-63(46-58(7,8)52-37-25-16-26-38-52,47-59(9,10)53-39-27-17-28-40-53)48-60"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CF-1"	"8"	"Male"	"oral: gavage"	"7"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Belgium"	"Fenbutatin oxide"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbutatin oxide."	"40422"	"2010"	"doi:10.2903/j.efsa.2010.1711"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"W3102 E.coli"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"G46"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"W3102 E.coli"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"6"	"Male"	"oral: unspecified"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"6"	"Male"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"6"	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"ICR"	"6"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"3"	"Male"	"Not reported"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"3"	"Male"	"Not reported"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"3"	"Male"	"Not reported"	"3"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"12"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenitrothion"	"204-524-2"	"122-14-5"	"single chemical entity"	"Component is identical to the substance"	"Fenitrothion"	"204-524-2"	"122-14-5"	"O,O-dimethyl O-(3-methyl-4-nitrophenyl) thiophosphate"	"Fenitrothion"	"C9H12NO5PS"	"COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-]"	"InChI=1/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"11"	"Male"	"oral: gavage"	"5"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenitrothion"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenitrothion"	"38770"	"2006"	"doi:10.2903/j.efsa.2006.59r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Ambiguous"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Fenpropimorph"	"266-719-9"	"67564-91-4"	"single chemical entity"	"Component is identical to the substance"	"Fenpropimorph"	"266-719-9"	"67564-91-4"	"(2R,6S)-4-[3-(4-tert-butylphenyl)-2-methylpropyl]-2,6-dimethylmorpholine"	"Fenpropimorph"	"C20H33NO"	"CC(C)(C)C(C=C2)=CC=C2CC(C)CN1C[C@@H](C)O[C@@H](C)C1"	"InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"40"	"Male"	"intraperitoneal"	"18"	"D"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Fenpropimorph"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropimorph"	"39658"	"2008"	"doi:10.2903/j.efsa.2008.144r"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is identical to the substance"	"Flubendiamide"	""	"272451-65-7"	"3-iodo-N'-(2-mesyl-1,1-dimethylethyl)-N-(4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)phthalamide"	"Flubendiamide"	"C23H22F7IN2O4S"	"CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C"	"InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity$indirect evidence-systemic toxicity"	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-N'-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O4S"	"Cc2cc(ccc2NC(=O)c1ccccc1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O4S/c1-13-11-14(21(24,22(25,26)27)23(28,29)30)9-10-17(13)31-18(33)15-7-5-6-8-16(15)19(34)32-20(2,3)12-37(4,35)36/h5-11H,12H2,1-4H3,(H,31,33)(H,32,34)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flubendiamide"	""	"272451-65-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	""	""	"N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-hydroxy-N2-[2-methyl-1-(methylsulfonyl)propan-2-yl]phthalamide"	"Not in list"	"C23H23F7N2O5S"	"O=C(NC(C)(C)CS(C)(=O)=O)c1c(cccc1O)C(=O)Nc2ccc(cc2C)C(F)(C(F)(F)F)C(F)(F)F"	"InChI=1/C23H23F7N2O5S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-15(12)31-18(34)14-6-5-7-16(33)17(14)19(35)32-20(2,3)11-38(4,36)37/h5-10,33H,11H2,1-4H3,(H,31,34)(H,32,35)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Greece"	"Flubendiamide"	"2008"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flubendiamide."	"41526"	"2013"	"doi:10.2903/j.efsa.2013.3298"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"14"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"House mouse (as animal)"	"ddy mouse"	"3"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"House mouse (as animal)"	"ddy mouse"	"3"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"House mouse (as animal)"	"ddy mouse"	"3"	"Male"	"oral: unspecified"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"House mouse (as animal)"	"ddy mouse"	"3"	"Male"	"oral: unspecified"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"House mouse (as animal)"	"ddy mouse"	"3"	"Male"	"oral: unspecified"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is identical to the substance"	"Flonicamid"	""	"158062-67-0"	"N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Flonicamid"	"C9H6F3N3O"	"O=C(NCC#N)c1cnccc1C(F)(F)F"	"InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"According to"	"OECD Guideline 489"	"No"	"Acceptable"	"House mouse (as animal)"	"ddy mouse"	"3"	"Male"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinic acid"	"623-902-1"	"158063-66-2"	"4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO2"	"C1=CN=CC(=C1C(F)(F)F)C(=O)O"	"InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-2-11-3-4(5)6(12)13/h1-3H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"4-trifluoromethylnicotinamide"	""	""	"4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C7H5F3N2O"	"C1=CN=CC(=C1C(F)(F)F)C(=O)N"	"InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycine"	""	""	"N-{[4-(trifluoromethyl)pyridin-3-yl]carbonyl}glycine"	"Not in list"	"C9H7F3N2O3"	"C1=CN=CC(=C1C(F)(F)F)C(=O)NCC(=O)O"	"InChI=1S/C9H7F3N2O3/c10-9(11,12)6-1-2-13-3-5(6)8(17)14-4-7(15)16/h1-3H,4H2,(H,14,17)(H,15,16)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"N-(4-trifluoromethylnicotinoyl)glycinamide"	""	""	"N-(2-amino-2-oxoethyl)-4-(trifluoromethyl)pyridine-3-carboxamide"	"Not in list"	"C9H8F3N3O2"	"O=C(NCC(N)=O)c1cnccc1C(F)(F)F"	"InChI=1/C9H8F3N3O2/c10-9(11,12)6-1-2-14-3-5(6)8(17)15-4-7(13)16/h1-3H,4H2,(H2,13,16)(H,15,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Flonicamid"	"605-127-0"	"158062-67-0"	"single chemical entity"	"Component is a metabolite of the substance"	"6-hydroxy-4-trifluoromethylnicotinic acid"	""	""	"6-hydroxy-4-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H4F3NO3"	"FC(F)(F)c1cc(O)ncc1C(O)=O"	"InChI=1/C7H4F3NO3/c8-7(9,10)4-1-5(12)11-2-3(4)6(13)14/h1-2H,(H,11,12)(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flonicamid"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flonicamid"	"40305"	"2010"	"doi:10.2903/j.efsa.2010.1445"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is identical to the substance"	"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"(E)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-methoxymethanimine"	"Fluoxastrobin"	"Fluoxastrobin"	"CO/N=C(\C1=CC=CC=C1OC2=C(C(=NC=N2)OC3=CC=CC=C3Cl)F)/C4=NOCCO4"	"InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: The United Kingdom"	"Fluoxastrobin"	"2003"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fluoxastrobin"	"609-207-6"	"361377-29-9"	"single chemical entity"	"Component is a metabolite of the substance"	"HEC5725-E-des-chlorophenyl"	""	""	"(E)-5,6-dihydro-1,4,2-dioxazin-3-yl{2-[(5-fluoro-6-hydroxypyrimidin-4-yl)oxy]phenyl}methanone O-methyloxime"	"Not in list"	"C15H13FN4O5"	"Fc3c(O)ncnc3Oc2ccccc2C(=N\OC)/C=1OCCON=1"	"InChI=1/C15H13FN4O5/c1-22-19-12(15-20-24-7-6-23-15)9-4-2-3-5-10(9)25-14-11(16)13(21)17-8-18-14/h2-5,8H,6-7H2,1H3,(H,17,18,21)/b19-12+"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fluoxastrobin (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fluoxastrobin"	"38595"	"2005"	"doi:10.2903/j.efsa.2005.102r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is identical to the substance"	"Fenpropidin"	""	"67306-00-7"	"1-[3-(4-Tert-butylphenyl)-2-methylpropyl]piperidine"	"Fenpropidin (sum of fenpropidin and its salts, expressed as fenpropidin)"	"C19H31N"	"CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2"	"InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Tif:MAGf(SPF)"	"10"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Sweden"	"Fenpropidin"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fenpropidin"	""	"67306-00-7"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	""	""	"1-[3-(4-tert-butyl-phenyl)-2-methyl-propyl]-piperidine-1-oxide"	"Not in list"	"C19H31NO"	"[O-][N+]2(CC(C)Cc1ccc(cc1)C(C)(C)C)CCCCC2"	"InChI=1/C19H31NO/c1-16(15-20(21)12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Sweden"	"Fenpropidin (Addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenpropidin"	"39477"	"2008"	"doi:10.2903/j.efsa.2008.124r"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"3"	"Male"	"oral: gavage"	"14"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is identical to the substance"	"Fluquinconazole"	"411-960-9"	"136426-54-5"	"3-(2,4-dichlorophenyl)-6-fluoro-2-(1H-1,2,4-triazol-1-yl)quinazolin-4(3H)-one"	"Fluquinconazole"	"C16H8Cl2FN5O"	"Clc4ccc(N1C(=O)c3cc(F)ccc3N=C1n2cncn2)c(Cl)c4"	"InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"3"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Fluquinconazole"	"411-960-9"	"136426-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	""	""	"3-(2,4-dichlorophenyl)-6-fluoro-2,4(1H,3H)-quinazolinedione"	"Not in list"	"C14H7Cl2FN2O2"	"Clc1ccc(c(Cl)c1)N2C(=O)c3cc(F)ccc3NC2=O"	"InChI=1S/C14H7Cl2FN2O2/c15-7-1-4-12(10(16)5-7)19-13(20)9-6-8(17)2-3-11(9)18-14(19)21/h1-6H,(H,18,21)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Fluquinconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluquinconazole"	"40674"	"2011"	"doi:10.2903/j.efsa.2011.2096"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"No data"	"oral: gavage"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Flumioxazin"	""	"103361-09-7"	"single chemical entity"	"Component is identical to the substance"	"Flumioxazin"	""	"103361-09-7"	"N-(7-fluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)cyclohex-1-ene-1,2-dicarboxamide"	"Flumioxazine"	"C19H15FN2O4"	"C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F"	"InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"No data"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Flumioxazin  (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flumioxazin"	"41802"	"2014"	"doi:10.2903/j.efsa.2014.3736"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"10"	"Male/Female"	"oral: gavage"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"10"	"Male/Female"	"oral: gavage"	"18"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is identical to the substance"	"Quinmerac"	""	"90717-03-6"	"7-chloro-3-methylquinoline-8-carboxylic acid"	"Quinmerac"	"C11H8ClNO2"	"O=C(O)C1=C(Cl)C=CC2=C1N=CC(C)=C2"	"InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Inconclusive"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	""	""	"7-chloro-2-hydroxy-3-methylquinoline-8-carboxylic acid"	"Not in list"	"C11H8ClNO3"	"OC(=O)c1c(Cl)ccc2cc(C)c(O)nc12"	"InChI=1/C11H8ClNO3/c1-5-4-6-2-3-7(12)8(11(15)16)9(6)13-10(5)14/h2-4H,1H3,(H,13,14)(H,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect-toxicokinetic investigations"	"RMS: The United Kingdom"	"Quinmerac"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Quinmerac"	""	"90717-03-6"	"single chemical entity"	"Component is a metabolite of the substance"	"7-chloroquinoline-3,8-dicarboxylic acid"	""	""	"7-chloroquinoline-3,8-dicarboxylic acid"	"Not in list"	"C11H6ClNO4"	"OC(=O)c1c(Cl)ccc2cc(cnc12)C(O)=O"	"InChI=1/C11H6ClNO4/c12-7-2-1-5-3-6(10(14)15)4-13-9(5)8(7)11(16)17/h1-4H,(H,14,15)(H,16,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Quinmerac (Additional report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance quinmerac"	"40266"	"2010"	"doi:10.2903/j.efsa.2010.1523"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is identical to the substance"	"Sulfoxaflor"	""	"946578-00-3"	"[methyl-oxo-[1-[6(trifluoromethyl)pyridin-3-yl]ethyl]-λ{6}-sulfanylidene]cyanamide"	"Not in list"	"C10H10F3N3OS"	"CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C"	"InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	""	""	"1-[methyl(oxido){(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl}-(RS)λ6-sulfanylidene]urea"	"Not in list"	"C10H12F3N3O2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=NC(N)=O"	"InChI=1/C10H12F3N3O2S/c1-6(19(2,18)16-9(14)17)7-3-4-8(15-5-7)10(11,12)13/h3-6H,1-2H3,(H2,14,17)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	""	""	"(1RS)-1-[6-(trifluoromethyl)-3-pyridinyl]ethanol"	"Not in list"	"C8H8F3NO"	"FC(F)(F)c1ccc(cn1)C(C)O"	"InChI=1/C8H8F3NO/c1-5(13)6-2-3-7(12-4-6)8(9,10)11/h2-5,13H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-ethyl-2-(trifluoromethyl)pyridine"	""	""	"5-ethyl-2-(trifluoromethyl)pyridine"	"Not in list"	"C8H8F3N"	"FC(F)(F)c1ccc(CC)cn1"	"InChI=1/C8H8F3N/c1-2-6-3-4-7(12-5-6)8(9,10)11/h3-5H,2H2,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(S-methylsulfonimidoyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H11F3N2OS"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=N)=O"	"InChI=1/C9H11F3N2OS/c1-6(16(2,13)15)7-3-4-8(14-5-7)9(10,11)12/h3-6,13H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Sulfoxaflor"	""	"946578-00-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	""	""	"5-[(1RS)-1-(methylsulfonyl)ethyl]-2-(trifluoromethyl)pyridine"	"Not in list"	"C9H10F3NO2S"	"FC(F)(F)c1ccc(cn1)C(C)S(C)(=O)=O"	"InChI=1/C9H10F3NO2S/c1-6(16(2,14)15)7-3-4-8(13-5-7)9(10,11)12/h3-6H,1-2H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Ireland"	"Sulfoxaflor"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sulfoxaflor"	"41780"	"2014"	"doi:10.2903/j.efsa.2014.3692"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Spain"	"Flurochloridone"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Flurochloridone"	"262-661-3"	"61213-25-0"	"single chemical entity"	"Component is identical to the substance"	"Flurochloridone"	"262-661-3"	"61213-25-0"	"3-chloro-4-(chloromethyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one"	"Flurochloridone"	"C12H10Cl2F3NO"	"C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl"	"InChI=1S/C12H10Cl2F3NO/c13-5-7-6-18(11(19)10(7)14)9-3-1-2-8(4-9)12(15,16)17/h1-4,7,10H,5-6H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Flurochloridone (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active Substance Flurochloridone (notified active substance) (However this ISO name refers to a 3:1 ratio of trans to cis isomers. As the compound considered in this conclusion is not a"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1869"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity"	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: gavage"	"14"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"No guideline followed"	"Not reported"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"No guideline followed"	"Not reported"	"No data"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D3"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"single chemical entity"	"Component is identical to the substance"	"Formetanate hydrochloride"	"245-656-0"	"23422-53-9"	"[3-(Dimethylaminomethylideneamino)phenyl] N-methylcarbamate;hydrochloride"	"Formetanate hydrochloride"	"C11H16ClN3O2"	"CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl"	"InChI=1S/C11H15N3O2.ClH/c1-12-11(15)16-10-6-4-5-9(7-10)13-8-14(2)3;/h4-8H,1-3H3,(H,12,15);1H"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Italy"	"Formetanate"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance formetanate"	"38881"	"2006"	"doi:10.2903/j.efsa.2006.69r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"20"	"Male"	"oral: unspecified"	"8"	"week"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"intraperitoneal"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"intraperitoneal"	""	""	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: The United Kingdom"	"Fuberidazole (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Fuberidazole (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"6"	"Male"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fuberidazole"	"223-404-0"	"3878-19-1"	"single chemical entity"	"Component is identical to the substance"	"Fuberidazole"	"223-404-0"	"3878-19-1"	"2-(2-furyl)-1H-benzimidazole"	"Fuberidazole"	"C11H8N2O"	"o1cccc1c2nc3ccccc3[nH]2"	"InChI=1/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	"6"	"Male"	"oral: gavage"	"42"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fuberidazole (Final addendum)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fuberidazole"	"39456"	"2008"	"doi:10.2903/j.efsa.2008.118r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Human (as organism)"	"alveolar basal epithelial cells (A549)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is identical to the substance"	"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"Ethyl (2R)-2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-P-Ethyl"	"C18H16ClNO5"	"CCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3/t11-/m1/s1"	"organic"	"compound"	"PubChem isomeric SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Schizosaccharomyces pombe (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D4"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"HeLa cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fenoxaprop-P-ethyl"	""	"71283-80-2"	"single chemical entity"	"Component is part of a group assessment"	"Fenoxaprop-ethyl"	"266-362-9"	"66441-23-4"	"Ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate"	"Fenoxaprop-ethyl"	"C18H16ClNO5"	"CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl"	"InChI=1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Austria"	"Fenoxaprop-P-ethyl"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance fenoxaprop-P"	"39429"	"2007"	"doi:10.2903/j.efsa.2007.121r"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	"no information"	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	"no information"	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fluroxypyr-meptyl"	"279-752-9"	"81406-37-3"	"Octan-2-yl 2-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxyacetate"	"Fluroxypyr-Meptyl"	"C15H21Cl2FN2O3"	"CCCCCCC(C)OC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F"	"InChI=1S/C15H21Cl2FN2O3/c1-3-4-5-6-7-9(2)23-10(21)8-22-15-12(17)13(19)11(16)14(18)20-15/h9H,3-8H2,1-2H3,(H2,19,20)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Fluroxypyr"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluroxypyr (evaluated variant fluroxypyr-meptyl)"	"40610"	"2011"	"doi:10.2903/j.efsa.2011.2091"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Ferric phosphate"	"233-149-7"	"10045-86-0"	"single chemical entity"	"Component is identical to the substance"	"Ferric phosphate"	"233-149-7"	"10045-86-0"	"iron(3+);phosphate"	"Not in list"	"FePO4"	"[O-]P(=O)([O-])[O-].[Fe+3]"	"InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3"	"inorganic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany - CoRMS: Poland"	"Ferric phosphate (Final addendum to Renewal Assessment Report)"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance ferric phosphate"	"42033"	"2015"	"doi:10.2903/j.efsa.2015.3973"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	"small colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	"small colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Ambiguous"	"large colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	"large colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"4"	"Male"	"oral: unspecified"	"16"	"h"	"yes"	"not applicable"	"Ambiguous"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"mixture or formulation"	"Component is part of a mixture or forumlation"	"Sedaxane"	""	"874967-67-6"	"N-{2-[1,1'-bi(cyclopropyl)-2-yl]phenyl}-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide"	"Not in list"	"C18H19F2N3O"	"FC(F)c4nn(C)cc4C(=O)Nc3ccccc3C2CC2C1CC1"	"InChI=1S/C18H19F2N3O/c1-23-9-14(16(22-23)17(19)20)18(24)21-15-5-3-2-4-11(15)13-8-12(13)10-6-7-10/h2-5,9-10,12-13,17H,6-8H2,1H3,(H,21,24)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male/Female"	"oral: gavage"	"4"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	""	""	"3-(Difluoromethyl)-1H-pyrazole-4-carboxylic acid"	"Not in list"	"C5H4F2N2O2"	"FC(F)c1nncc1C(=O)O"	"InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Sedaxane"	""	"874967-67-6"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid"	""	"176969-34-9"	"3-(Difluoromethyl)-1-methylpyrazole-4-carboxylic acid"	"Not in list"	"C6H6F2N2O2"	"CN1C=C(C(=N1)C(F)F)C(=O)O"	"InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Sedaxane"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sedaxane"	"41304"	"2013"	"doi:10.2903/j.efsa.2013.3057"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	""	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	""	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: unspecified"	"48"	""	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: unspecified"	"12"	""	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: unspecified"	"72"	""	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Flutolanil"	""	"66332-96-5"	"single chemical entity"	"Component is identical to the substance"	"Flutolanil"	""	"66332-96-5"	"N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide"	"Flutolanil"	"C17H16F3NO2"	"CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F"	"InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"BDF1 mouse"	"12"	"Male/Female"	"oral: unspecified"	"24"	""	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Flutolanil"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance flutolanil"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.126r"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is identical to the substance"	"Fluopyram"	""	"658066-35-4"	"N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-2-(trifluoromethyl)benzamide"	"Fluopyram"	"C16H11ClF6N2O"	"C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F"	"InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-chloro-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C7H3ClF3NO2"	"Clc1cc(cnc1C(=O)O)C(F)(F)F"	"InChI=1/C7H3ClF3NO2/c8-4-1-3(7(9,10)11)2-12-5(4)6(13)14/h1-2H,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Fluopyram"	""	"658066-35-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	""	""	"3-(methylsulfinyl)-5-(trifluoromethyl)-2-pyridinecarboxylic acid"	"Not in list"	"C8H6F3NO3S"	"O=C(O)c1ncc(cc1S(C)=O)C(F)(F)F"	"InChI=1/C8H6F3NO3S/c1-16(15)5-2-4(8(9,10)11)3-12-6(5)7(13)14/h2-3H,1H3,(H,13,14)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Fluopyram (Final addendum)"	"2012"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fluopyram"	"41372"	"2013"	"doi:10.2903/j.efsa.2013.3052"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is identical to the substance"	"Hexythiazox"	""	"78587-05-0"	"(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Hexythiazox"	"C17H21ClN2O2S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)NC1CCCCC1)c3ccc(Cl)cc3"	"InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-(cis-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@@H]1CC[C@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14+,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-4-methyl-2-oxo-N-(3-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"O=C1CC(CCC1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13,15H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"5-(4-chlorophenyl)-N-(3-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"OC1CCCC(C1)NC(=O)N3C(=O)SC(c2ccc(Cl)cc2)C3C"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-5-7-12(18)8-6-11)24-17(23)20(10)16(22)19-13-3-2-4-14(21)9-13/h5-8,10,13-15,21H,2-4,9H2,1H3,(H,19,22)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-1,3-thiazolidin-2-one"	"Not in list"	"C10H10ClNOS"	"C[C@@H]2NC(=O)S[C@H]2c1ccc(Cl)cc1"	"InChI=1/C10H10ClNOS/c1-6-9(14-10(13)12-6)7-2-4-8(11)5-3-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(4-oxocyclohexyl)-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H19ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)NC1CCC(=O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H19ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13,15H,6-9H2,1H3,(H,19,22)/t10-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@H]2[C@@H](SC(=O)N2C(=O)N[C@H]1CCCC[C@@H]1O)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-6-8-12(18)9-7-11)24-17(23)20(10)16(22)19-13-4-2-3-5-14(13)21/h6-10,13-15,21H,2-5H2,1H3,(H,19,22)/t10-,13-,14-,15+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4R,5R)-5-(4-chlorophenyl)-N-(trans-4-hydroxycyclohexyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C17H21ClN2O3S"	"C[C@@H]2[C@H](SC(=O)N2C(=O)N[C@@H]1CC[C@@H](O)CC1)c3ccc(Cl)cc3"	"InChI=1/C17H21ClN2O3S/c1-10-15(11-2-4-12(18)5-3-11)24-17(23)20(10)16(22)19-13-6-8-14(21)9-7-13/h2-5,10,13-15,21H,6-9H2,1H3,(H,19,22)/t10-,13-,14-,15+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Hexythiazox"	""	"78587-05-0"	"single chemical entity"	"Component is a metabolite of the substance"	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	""	""	"(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"	"Not in list"	"C11H11ClN2O2S"	"C[C@H]1[C@@H](SC(=O)N1C(=O)N)c2ccc(Cl)cc2"	"InChI=1/C11H11ClN2O2S/c1-6-9(7-2-4-8(12)5-3-7)17-11(16)14(6)10(13)15/h2-6,9H,1H3,(H2,13,15)/t6-,9+/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Finland"	"Hexythiazox"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hexythiazox"	"40465"	"2010"	"doi:10.2903/j.efsa.2010.1722"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is identical to the substance"	"Fenbuconazole"	""	"114369-43-6"	"4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile"	"Fenbuconazole"	"C19H17ClN4"	"ClC1=CC=C(CCC(C#N)(CN3N=CN=C3)C2=CC=CC=C2)C=C1"	"InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"kidney cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"in vitro mammalian cell transformation assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Hamster (as animal)"	"kidney cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Ambiguous"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"B6C3F1"	"5"	"Male"	"intraperitoneal"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"no data"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"no data"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5S)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Fenbuconazole"	"601-308-3"	"114369-43-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	""	""	"(3R,5R)-5-(4-chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-ylmethyl)dihydrofuran-2(3H)-one"	"Not in list"	"C19H16ClN3O2"	"O=C2O[C@H](C[C@]2(Cn1ncnc1)c3ccccc3)c4ccc(Cl)cc4"	"InChI=1/C19H16ClN3O2/c20-16-8-6-14(7-9-16)17-10-19(18(24)25-17,11-23-13-21-12-22-23)15-4-2-1-3-5-15/h1-9,12-13,17H,10-11H2/t17-,19+/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Fenbuconazole"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenbuconazole"	"40281"	"2010"	"doi:10.2903/j.efsa.2010.1558"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is identical to the substance"	"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"sodium (4,6-dimethoxypyrimidin-2-yl)[({[3-(methoxycarbonyl)-6-(trifluoromethyl)pyridin-2-yl]sulfonyl}amino)carbonyl]azanide"	"Not in list"	"C15H13F3N5O7SNa"	"COC1=CC(=NC(=N1)[N-]C(=O)NS(=O)(=O)C2=C(C=CC(=N2)C(F)(F)F)C(=O)OC)OC.[Na+]"	"InChI=1S/C15H14F3N5O7S.Na/c1-28-9-6-10(29-2)21-13(20-9)22-14(25)23-31(26,27)11-7(12(24)30-3)4-5-8(19-11)15(16,17)18;/h4-6H,1-3H3,(H2,20,21,22,23,25);/q;+1/p-1"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Flupyrsulfuron-methyl (DPX-KE459)"	"1997"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4,6-dimethoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C14H10F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(OC)cc(OC)n3"	"InChI=1/C14H10F3N5O4/c1-25-8-5-9(26-2)20-12(19-8)22-10-6(11(23)21-13(22)24)3-4-7(18-10)14(15,16)17/h3-5H,1-2H3,(H,21,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	""	""	"1-(4-hydroxy-6-methoxypyrimidin-2-yl)-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione"	"Not in list"	"C13H8F3N5O4"	"FC(F)(F)c1ccc2c(n1)N(C(=O)NC2=O)c3nc(O)cc(OC)n3"	"InChI=1/C13H8F3N5O4/c1-25-8-4-7(22)18-11(19-8)21-9-5(10(23)20-12(21)24)2-3-6(17-9)13(14,15)16/h2-4H,1H3,(H,18,19,22)(H,20,23,24)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"2-sulfamoyl-6-(trifluoromethyl)nicotinic acid"	""	""	"2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylic acid"	"Not in list"	"C7H5F3N2O4S"	"FC(F)(F)c1ccc(C(O)=O)c(n1)S(N)(=O)=O"	"InChI=1/C7H5F3N2O4S/c8-7(9,10)4-2-1-3(6(13)14)5(12-4)17(11,15)16/h1-2H,(H,13,14)(H2,11,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Positive"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Flupyrsulfuron-methyl-sodium"	""	"144740-54-5"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 2-sulfamoyl-6-(trifluoromethyl)nicotinate"	""	""	"methyl 2-sulfamoyl-6-(trifluoromethyl)pyridine-3-carboxylate"	"Not in list"	"C8H7F3N2O4S"	"FC(F)(F)c1ccc(C(=O)OC)c(n1)S(N)(=O)=O"	"InChI=1/C8H7F3N2O4S/c1-17-7(14)4-2-3-5(8(9,10)11)13-6(4)18(12,15)16/h2-3H,1H3,(H2,12,15,16)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France - CoRMS: Denmark"	"Flupyrsulfuron-methyl"	"2014"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flupyrsulfuron (variant evaluated flupyrsulfuron-methyl-sodium)"	"41949"	"2014"	"doi:10.2903/j.efsa.2014.3881"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Thiophanate-methyl"	"245-740-7"	"23564-05-8"	"methyl N-[[2-(methoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate"	"Thiophanate-methyl"	"C12H14N4O4S2"	"COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC"	"InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Carbendazim, Benomyl, Thiophanate-methyl (Addendum)"	"2002"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Thiophanate-methyl"	"245-740-7"	"23564-05-8"	"methyl N-[[2-(methoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate"	"Thiophanate-methyl"	"C12H14N4O4S2"	"COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC"	"InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Germany"	"Carbendazim, Benomyl, Thiophanate-methyl (Addendum)"	"2002"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Carbendazim"	"234-232-0"	"10605-21-7"	"single chemical entity"	"Component is part of a group but not included in the group assessment"	"Thiophanate-methyl"	"245-740-7"	"23564-05-8"	"methyl N-[[2-(methoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate"	"Thiophanate-methyl"	"C12H14N4O4S2"	"COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC"	"InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany"	"Carbendazim, Benomyl, Thiophanate-methyl (Addendum)"	"2002"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance carbendazim"	"40310"	"2010"	"doi:10.2903/j.efsa.2010.1598"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is identical to the substance"	"Tebufenozide"	""	"112410-23-8"	"N-tert-butyl-N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide"	"Tebufenozide"	"C22H28N2O2"	"O=C(N(C(C)(C)C)NC(C2=CC=C(CC)C=C2)=O)C1=CC(C)=CC(C)=C1"	"InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	""	""	"N'-[(4-acetylphenyl)carbonyl]-N-tert-butyl-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	""	""	"4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)benzoic acid"	"Not in list"	"C21H24N2O4"	"Cc1cc(cc(C)c1)C(=O)N(NC(=O)c2ccc(cc2)C(O)=O)C(C)(C)C"	"InChI=1/C21H24N2O4/c1-13-10-14(2)12-17(11-13)19(25)23(21(3,4)5)22-18(24)15-6-8-16(9-7-15)20(26)27/h6-12H,1-5H3,(H,22,24)(H,26,27)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent no treatment"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-(hydroxymethyl)-5-methylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"Cc1cc(cc(CO)c1)C(=O)N(NC(=O)c2ccc(CC)cc2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-13,25H,6,14H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3-(hydroxymethyl)-5-methylbenzohydrazide conjugates"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	""	""	"5-({2-[(4-acetylphenyl)carbonyl]-1-tert-butylhydrazinyl}carbonyl)benzene-1,3-dicarboxylic acid"	"Not in list"	"C22H22N2O7"	"O=C(O)c1cc(cc(c1)C(=O)N(NC(=O)c2ccc(cc2)C(C)=O)C(C)(C)C)C(O)=O"	"InChI=1/C22H22N2O7/c1-12(25)13-5-7-14(8-6-13)18(26)23-24(22(2,3)4)19(27)15-9-16(20(28)29)11-17(10-15)21(30)31/h5-11H,1-4H3,(H,23,26)(H,28,29)(H,30,31)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	""	""	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	"Not in list"	"C22H26N2O4"	"O=C(O)Cc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H26N2O4/c1-14-10-15(2)12-18(11-14)21(28)24(22(3,4)5)23-20(27)17-8-6-16(7-9-17)13-19(25)26/h6-12H,13H2,1-5H3,(H,23,27)(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	""	""	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	"Not in list"	"C22H26N2O4"	"O=C(O)Cc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H26N2O4/c1-14-10-15(2)12-18(11-14)21(28)24(22(3,4)5)23-20(27)17-8-6-16(7-9-17)13-19(25)26/h6-12H,13H2,1-5H3,(H,23,27)(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	""	""	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	"Not in list"	"C22H26N2O4"	"O=C(O)Cc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H26N2O4/c1-14-10-15(2)12-18(11-14)21(28)24(22(3,4)5)23-20(27)17-8-6-16(7-9-17)13-19(25)26/h6-12H,13H2,1-5H3,(H,23,27)(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	""	""	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	"Not in list"	"C22H26N2O4"	"O=C(O)Cc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H26N2O4/c1-14-10-15(2)12-18(11-14)21(28)24(22(3,4)5)23-20(27)17-8-6-16(7-9-17)13-19(25)26/h6-12H,13H2,1-5H3,(H,23,27)(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	""	""	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	"Not in list"	"C22H26N2O4"	"O=C(O)Cc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H26N2O4/c1-14-10-15(2)12-18(11-14)21(28)24(22(3,4)5)23-20(27)17-8-6-16(7-9-17)13-19(25)26/h6-12H,13H2,1-5H3,(H,23,27)(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	""	""	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	"Not in list"	"C22H26N2O4"	"O=C(O)Cc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H26N2O4/c1-14-10-15(2)12-18(11-14)21(28)24(22(3,4)5)23-20(27)17-8-6-16(7-9-17)13-19(25)26/h6-12H,13H2,1-5H3,(H,23,27)(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	""	""	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	"Not in list"	"C22H26N2O4"	"O=C(O)Cc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H26N2O4/c1-14-10-15(2)12-18(11-14)21(28)24(22(3,4)5)23-20(27)17-8-6-16(7-9-17)13-19(25)26/h6-12H,13H2,1-5H3,(H,23,27)(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	""	""	"[4-({2-tert-butyl-2-[(3,5-dimethylphenyl)carbonyl]hydrazinyl}carbonyl)phenyl]acetic acid"	"Not in list"	"C22H26N2O4"	"O=C(O)Cc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H26N2O4/c1-14-10-15(2)12-18(11-14)21(28)24(22(3,4)5)23-20(27)17-8-6-16(7-9-17)13-19(25)26/h6-12H,13H2,1-5H3,(H,23,27)(H,25,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	""	""	"N-tert-butyl-N'-{[4-(1-hydroxyethyl)phenyl]carbonyl}-3,5-dimethylbenzohydrazide"	"Not in list"	"C22H28N2O3"	"OC(C)c1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C)c2)C(C)(C)C"	"InChI=1/C22H28N2O3/c1-14-11-15(2)13-19(12-14)21(27)24(22(4,5)6)23-20(26)18-9-7-17(8-10-18)16(3)25/h7-13,16,25H,1-6H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tebufenozide"	""	"112410-23-8"	"single chemical entity"	"Component is a metabolite of the substance"	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	""	""	"N-tert-butyl-N'-[(4-ethylphenyl)carbonyl]-3-formyl-5-methylbenzohydrazide"	"Not in list"	"C22H26N2O3"	"CCc1ccc(cc1)C(=O)NN(C(=O)c2cc(C)cc(C=O)c2)C(C)(C)C"	"InChI=1/C22H26N2O3/c1-6-16-7-9-18(10-8-16)20(26)23-24(22(3,4)5)21(27)19-12-15(2)11-17(13-19)14-25/h7-14H,6H2,1-5H3,(H,23,26)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tebufenozide"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tebufenozide"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1871"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"Male/Female"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male/Female"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male/Female"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: Germany"	"Tefluthrin"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Tefluthrin"	""	"79538-32-2"	"single chemical entity"	"Component is identical to the substance"	"Tefluthrin"	""	"79538-32-2"	"2,3,5,6-tetrafluoro-4-methylbenzyl 3-[(1Z)-2-chloro-3,3,3-trifluoroprop-1-en-1-yl]-2,2-dimethylcyclopropanecarboxylate"	"Tefluthrin"	"C17H14ClF7O2"	"O=C(OCC2=C(F)C(F)=C(C)C(F)=C2F)C1C(C)(C)C1/C=C(Cl)/C(F)(F)F"	"InChI=1S/C17H14ClF7O2/c1-6-11(19)13(21)7(14(22)12(6)20)5-27-15(26)10-8(16(10,2)3)4-9(18)17(23,24)25/h4,8,10H,5H2,1-3H3/b9-4-"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany"	"Tefluthrin (Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance tefluthrin"	"40521"	"2010"	"doi:10.2903/j.efsa.2010.1709"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Inconclusive"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Inconclusive"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil (Final addendum)"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil (Final addendum)"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"14"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Fipronil (Final addendum)"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is identical to the substance"	"Fipronil"	""	"120068-37-3"	"5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)
+pyrazole-3-carbonitrile"	"Fipronil"	"C12H4Cl2F6N4OS"	"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"3"	"Male"	"oral: gavage"	"3"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: France"	"Fipronil (Final addendum)"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	""	""	"5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylthio-1-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2"	"InChI=1/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylsulfonylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4O2S"	"FC(F)(F)S(=O)(=O)c1c(N)n(nc1C#N)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoro-methylpyrazole-3-carbonitrile"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethyl)-1H-pyrazole-3-carbonitrile"	"Not in list"	"C12H4Cl2F6N4"	"FC(F)(F)c1cc(Cl)c(c(Cl)c1)n2nc(C#N)c(c2N)C(F)(F)F"	"InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid, potassium salt"	""	""	"5-amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl) pyrazole-4-sulfonic acid"	"Not in list"	"C11H5Cl2F3N4O3S"	"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(c1N)S(O)(=O)=O)c(Cl)c2"	"InChI=1/C11H5Cl2F3N4O3S/c12-5-1-4(11(14,15)16)2-6(13)8(5)20-10(18)9(24(21,22)23)7(3-17)19-20/h1-2H,18H2,(H,21,22,23)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-4-trifluoromethylsulfonylpyrazole-3-carboxylic acid"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]-1H-pyrazole-3-carboxylic acid"	"Not in list"	"C12H5Cl2F6N3O3S"	"FC(F)(F)S(=O)c2c(nn(c1c(Cl)cc(cc1Cl)C(F)(F)F)c2N)C(O)=O"	"InChI=1S/C12H5Cl2F6N3O4S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)28(26,27)12(18,19)20/h1-2H,21H2,(H,24,25)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	""	""	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"14"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Fipronil"	""	"120068-37-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-trifluoromethylsulfonyl-1H-pyrazole-3-carboxamide"	""	""	"5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethanesulfinyl)-1H-pyrazole-3-carboxamide"	"Not in list"	"C12H6Cl2F6N4O2S"	"FC(F)(F)S(=O)c1c(N)n(nc1C(N)=O)c2c(Cl)cc(cc2Cl)C(F)(F)F"	"InChI=1/C12H6Cl2F6N4O2S/c13-4-1-3(11(15,16)17)2-5(14)7(4)24-9(21)8(6(23-24)10(22)25)27(26)12(18,19)20/h1-2H,21H2,(H2,22,25)/t27?"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"14"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Fipronil"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment for bees for the active substance fipronil."	"41421"	"2013"	"doi:10.2903/j.efsa.2013.3158"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"genome mutation"	"Drosophila SLRL test"	"in vivo"	"According to"	"OECD Guideline 477 (Genetic Toxicology: Sex-linked Recessive Lethal Test in Drosophila melanogaster)"	"No"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Oregon-R"	"75"	"Male"	"oral: feed"	"3"	"D"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"5"	"Male"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Hymexazol"	"233-000-6"	"10004-44-1"	"single chemical entity"	"Component is identical to the substance"	"Hymexazol"	"233-000-6"	"10004-44-1"	"5-methylisoxazol-3(2H)-one"	"Hymexazol"	"C4H5NO2"	"O=C1C=C(C)ON1"	"InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Positive"	""	""	"RMS: Finland"	"Hymexazol (Revised/Additional Report)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance hymexazol"	"40403"	"2010"	"doi:10.2903/j.efsa.2010.1653"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is identical to the substance"	"Triadimenol"	"259-537-6"	"55219-65-3"	"1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol"	"Triadimenol"	"C14H18ClN3O2"	"OC(C(C)(C)C)C(N2N=CN=C2)OC1=CC=C(Cl)C=C1"	"InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"50"	"Male"	"oral: gavage"	"48"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"1,2,4-Triazole"	"206-022-9"	"288-88-0"	"1H-1,2,4-triazole"	"Triazole, 1,2,4-"	"C2H3N3"	"C1=NC=NN1"	"InChI=1S/C2H3N3/c1-3-2-5-4-1/h1-2H,(H,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole acetic acid"	""	"28711-29-7"	"2-(1,2,4-Triazol-1-yl)acetic acid"	"Triazole acetic acid"	"C4H5N3O2"	"C1=NN(C=N1)CC(=O)O"	"InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"Chinese"	"16"	"Male/Female"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CBA"	"5"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CBA"	"5"	"Male"	"intraperitoneal"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CBA"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Triadimenol"	"259-537-6"	"55219-65-3"	"single chemical entity"	"Component is a metabolite of the substance"	"Triazole alanine"	"233-301-2"	"10109-05-4"	"2-amino-3-(1H-1,2,4-triazol-1-yl)propanoic acid"	"Triazole alanine"	"C5H8N4O2"	"C1=NNC(=N1)CC(C(=O)O)N"	"InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Ambiguous"	""	"no evidence"	"RMS: The United Kingdom"	"Triadimenol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triadimenol"	"39738"	"2008"	"doi:10.2903/j.efsa.2008.177r"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"no information"	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"no information"	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"5"	"Male"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Alderly Park Rat"	"5"	"Male"	"oral: gavage"	"6"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"C57BL"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"5"	"Male"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"15"	"Male"	"oral: gavage"	"7"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol"	"2006"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Flutriafol"	"616-367-0"	"76674-21-0"	"single chemical entity"	"Component is identical to the substance"	"Flutriafol"	"616-367-0"	"76674-21-0"	"1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol"	"Flutriafol"	"C16H13F2N3O"	"OC(CN1N=CN=C1)(C(C=C2)=CC=C2F)C(C=CC=C3)=C3F"	"InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Flutriafol (Additional report)"	"2010"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance flutriafol"	"40472"	"2010"	"doi:10.2903/j.efsa.2010.1868"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is identical to the substance"	"Fenpyrazamine"	""	"473798-59-3"	"S-allyl 5-amino-2,3-dihydro-2-isopropyl-3-oxo-4-(o-tolyl)pyrazole-1-carbothioate"	"Fenpyrazamine"	"C17H21N3O2S"	"n1(c(c(c(=O)n1C(C)C)c1ccccc1C)N)C(=O)SCC=C"	"InChI=1S/C17H21N3O2S/c1-5-10-23-17(22)20-15(18)14(16(21)19(20)11(2)3)13-9-7-6-8-12(13)4/h5-9,11H,1,10,18H2,2-4H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"indirect evidence-systemic toxicity$indirect-toxicokinetic investigations"	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Fenpyrazamine"	""	"473798-59-3"	"single chemical entity"	"Component is a metabolite of the substance"	"5-Amino-1,2-dihydro-2-isopropyl-4-(otolyl) pyrazol-3-one"	""	""	"5-amino-4-(2-methylphenyl)-2-(propan-2-yl)-1,2-dihydro-3H-pyrazol-3-one"	"Not in list"	"C13H17N3O"	"O=C2C(c1ccccc1C)=C(N)NN2C(C)C"	"InChI=1S/C13H17N3O/c1-8(2)16-13(17)11(12(14)15-16)10-7-5-4-6-9(10)3/h4-8,15H,14H2,1-3H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Austria"	"Fenpyrazamine (S-2188)"	"2011"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance fenpyrazamine"	"40935"	"2012"	"doi:10.2903/j.efsa.2012.2496"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Ambiguous"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is identical to the substance"	"Haloxyfop-P"	""	"95977-29-0"	"(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid"	"Haloxyfop-P"	"C15H11ClF3NO4"	"O=C(O)[C@@H](C)Oc1ccc(cc1)Oc2ncc(cc2Cl)C(F)(F)F"	"InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a group assessment"	"Haloxyfop-P-methyl ester"	"406-250-0"	"72619-32-0"	"Methyl 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate"	"Not in list"	"C16H13ClF3NO4"	"CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl"	"InChI=1S/C16H13ClF3NO4/c1-9(15(22)23-2)24-11-3-5-12(6-4-11)25-14-13(17)7-10(8-21-14)16(18,19)20/h3-9H,1-2H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: feed"	"42"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is part of a mixture or forumlation"	"Racemic Haloxyfop"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"10"	"Male/Female"	"oral: feed"	"30"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R"	"2004"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	""	""	"3-chloro-1-methyl-5-(trifluoromethyl)-2(1H)-pyridinone"	"Not in list"	"C7H5ClF3NO"	"ClC1=CC(=CN(C)C1=O)C(F)(F)F"	"InChI=1/C7H5ClF3NO/c1-12-3-4(7(9,10)11)2-5(8)6(12)13/h2-3H,1H3"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	""	"Male/Female"	"oral: gavage"	"16"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Fischer344"	""	"Male/Female"	"oral: gavage"	"4"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Haloxyfop-P"	""	"95977-29-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-chloro-5-(trifluoromethyl)pyridin-2-ol"	""	"76041-71-9"	"3-chloro-5-(trifluoromethyl)-1H-pyridin-2-one"	"Not in list"	"C6H3ClF3NO"	"C1=C(C(=O)NC=C1C(F)(F)F)Cl"	"InChI=1S/C6H3ClF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Rat (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Denmark"	"Haloxyfop-R (Addendum )"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of confirmatory data submitted for the active substance haloxyfop-P"	"41985"	"2014"	"doi:10.2903/j.efsa.2014.3931"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Positive"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Positive"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"20"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"20"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"5"	"Male"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is identical to the substance"	"Triflusulfuron-methyl"	""	"126535-15-7"	"Methyl 2-[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,
+5-triazin-2-yl]carbamoylsulfamoyl]-3-methylbenzoate"	"Triflusulfuron-Methyl"	"C17H19F3N6O6S"	"CC1=CC=CC(=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OCC(F)(F)F)N(C)C)C(=O)OC"	"InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"According to"	"OECD Guideline 483 (Mammalian Spermatogonial Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"ICR"	"5"	"Male"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"415-500-8"	"145963-84-4"	"2-N,2-N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C7H10F3N5O"	"CN(C)C1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C7H10F3N5O/c1-15(2)5-12-4(11)13-6(14-5)16-3-7(8,9)10/h3H2,1-2H3,(H2,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"415-500-8"	"145963-84-4"	"2-N,2-N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C7H10F3N5O"	"CN(C)C1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C7H10F3N5O/c1-15(2)5-12-4(11)13-6(14-5)16-3-7(8,9)10/h3H2,1-2H3,(H2,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"415-500-8"	"145963-84-4"	"2-N,2-N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C7H10F3N5O"	"CN(C)C1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C7H10F3N5O/c1-15(2)5-12-4(11)13-6(14-5)16-3-7(8,9)10/h3H2,1-2H3,(H2,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"415-500-8"	"145963-84-4"	"2-N,2-N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C7H10F3N5O"	"CN(C)C1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C7H10F3N5O/c1-15(2)5-12-4(11)13-6(14-5)16-3-7(8,9)10/h3H2,1-2H3,(H2,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"415-500-8"	"145963-84-4"	"2-N,2-N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C7H10F3N5O"	"CN(C)C1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C7H10F3N5O/c1-15(2)5-12-4(11)13-6(14-5)16-3-7(8,9)10/h3H2,1-2H3,(H2,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"415-500-8"	"145963-84-4"	"2-N,2-N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C7H10F3N5O"	"CN(C)C1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C7H10F3N5O/c1-15(2)5-12-4(11)13-6(14-5)16-3-7(8,9)10/h3H2,1-2H3,(H2,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"415-500-8"	"145963-84-4"	"2-N,2-N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C7H10F3N5O"	"CN(C)C1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C7H10F3N5O/c1-15(2)5-12-4(11)13-6(14-5)16-3-7(8,9)10/h3H2,1-2H3,(H2,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"415-500-8"	"145963-84-4"	"2-N,2-N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C7H10F3N5O"	"CN(C)C1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C7H10F3N5O/c1-15(2)5-12-4(11)13-6(14-5)16-3-7(8,9)10/h3H2,1-2H3,(H2,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"2-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H8F3N5O"	"CNC1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C6H8F3N5O/c1-11-4-12-3(10)13-5(14-4)15-2-6(7,8)9/h2H2,1H3,(H3,10,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"2-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H8F3N5O"	"CNC1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C6H8F3N5O/c1-11-4-12-3(10)13-5(14-4)15-2-6(7,8)9/h2H2,1H3,(H3,10,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"2-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H8F3N5O"	"CNC1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C6H8F3N5O/c1-11-4-12-3(10)13-5(14-4)15-2-6(7,8)9/h2H2,1H3,(H3,10,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"2-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H8F3N5O"	"CNC1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C6H8F3N5O/c1-11-4-12-3(10)13-5(14-4)15-2-6(7,8)9/h2H2,1H3,(H3,10,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"2-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H8F3N5O"	"CNC1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C6H8F3N5O/c1-11-4-12-3(10)13-5(14-4)15-2-6(7,8)9/h2H2,1H3,(H3,10,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"2-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H8F3N5O"	"CNC1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C6H8F3N5O/c1-11-4-12-3(10)13-5(14-4)15-2-6(7,8)9/h2H2,1H3,(H3,10,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"2-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H8F3N5O"	"CNC1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C6H8F3N5O/c1-11-4-12-3(10)13-5(14-4)15-2-6(7,8)9/h2H2,1H3,(H3,10,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"2-N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C6H8F3N5O"	"CNC1=NC(=NC(=N1)N)OCC(F)(F)F"	"InChI=1S/C6H8F3N5O/c1-11-4-12-3(10)13-5(14-4)15-2-6(7,8)9/h2H2,1H3,(H3,10,11,12,13,14)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	""	""	"6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine"	"Not in list"	"C5H6F3N5O"	"FC(F)(F)COc1nc(N)nc(N)n1"	"InChI=1/C5H6F3N5O/c6-5(7,8)1-14-4-12-2(9)11-3(10)13-4/h1H2,(H4,9,10,11,12,13)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Triflusulfuron-methyl"	""	"126535-15-7"	"single chemical entity"	"Component is a metabolite of the substance"	"7-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide"	""	""	"7-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide"	"Not in list"	"C8H7NO3S"	"Cc1cccc2c1S(=O)(=O)NC2=O"	"InChI=1S/C8H7NO3S/c1-5-3-2-4-6-7(5)13(11,12)9-8(6)10/h2-4H,1H3,(H,9,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: France"	"Triflusulfuron-methyl"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance triflusulfuron (considered variant triflusulfuron-methyl)."	"39920"	"2009"	"doi:10.2903/j.efsa.2009.195r"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"large colonies"	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"small colonies"	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"large colonies"	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"small colonies"	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Yes"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Inconclusive"	""	"no evidence"	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: unspecified"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"No data"	"oral: unspecified"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"No data"	"intraperitoneal"	"12"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	""	"No data"	"intraperitoneal"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"30"	"Male"	"oral: gavage"	"1"	"week"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: unspecified"	"8"	"week"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany"	"Glyphosate"	"1998"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"small colonies"	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"small colonies"	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"large colonies"	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"large colonies"	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"Yes"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"77"	"Male"	"intraperitoneal"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"7"	"Male"	"intraperitoneal"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male"	"oral: unspecified"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"12"	"Male"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: unspecified"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"Rat (as animal)"	"Crj:CD(SD)"	"10"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"no information"	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"no information"	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	""	"Male/Female"	"oral: unspecified"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is a metabolite of the substance"	"(aminomethyl)phosphonic acid"	"623-325-5"	"1066-51-9"	"aminomethylphosphonic acid"	"Not in list"	"CH6NO3P"	"C(N)P(=O)(O)O"	"InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 2139)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 2139)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 2139)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 2139)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 2139)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 2139)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 2139)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 2139)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Glifos)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Glifos)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Glifos)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Glifos)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Glifos)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Glifos)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Glifos)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Glifos)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Rodeo)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (MON 14445t)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Glifos)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 8080"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 8080"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 8080"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 8080"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 8080"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 8080"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 8080"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 8080"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Dodigen 4022"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"MON 0818"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male/Female"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	"direct evidence-cytotoxicity"	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"4"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"4"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"6"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"4"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"6"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"4"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"hepatocytes"	""	""	"intraperitoneal"	""	""	"no data"	"not applicable"	"Ambiguous"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"kidney cells"	""	""	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"hepatocytes"	""	""	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"kidney cells"	""	""	"intraperitoneal"	""	""	"no data"	"not applicable"	"Ambiguous"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 489"	"No data"	"Acceptable"	"Other"	"Not reported"	""	"No data"	"Not reported"	"24"	"h"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	"Male"	"oral: feed"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"72"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Percozyd 10 SL)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"48"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Percozyd 10 SL)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Percozyd 10 SL)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"no data"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Drosophila melanogaster (as animal)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Inconclusive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Herbazed)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"1"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Herbazed)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"spleen cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Herbazed)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"House mouse (as animal)"	"spleen cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Herbazed)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"21"	"D"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Herbazed)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"14"	"D"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Herbazed)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"7"	"D"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Herbazed)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	"1"	"D"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Herbazed)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"3"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Herbazed)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	"5"	"D"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is part of a group assessment"	"Glyphosate isopropyl amine salt"	"254-056-8"	"38641-94-0"	"N-(phosphonomethyl)glycine - isopropylamine (1:1)"	"Not in list"	"C6H17N2O5P"	"CC(C)[NH3+].CC(C)[NH3+].CC(C)[NH3+].C(C(=O)[O-])NCP(=O)([O-])[O-]"	"InChI=1S/C3H8NO5P.3C3H9N/c5-3(6)1-4-2-10(7,8)9;3*1-3(2)4/h4H,1-2H2,(H,5,6)(H2,7,8,9);3*3H,4H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Bovinae (bovines = Tribe bovini) (as animal)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"single cell gel/comet assay in mammalian cells for detection of DNA damage"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Human (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian cell micronucleus test"	"in vitro"	"According to"	"OECD Guideline 487 (In Vitro Mammalian Cell Micronucleus Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"Rabbit (as animal)"	"Not reported"	""	"No data"	"oral: feed"	"60"	"D"	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"oral: unspecified"	""	""	"no data"	"not applicable"	"Negative"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is the active ingredient of the mixture or formulation"	"Glyphosate formulation (Roundup)"	""	""	""	"Not in list"	""	""	""	"organic"	"no structure"	""	""	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Not reported"	""	"No data"	"intraperitoneal"	""	""	"no data"	"not applicable"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Glyphosate"	"213-997-4"	"1071-83-6"	"single chemical entity"	"Component is identical to the substance"	"Glyphosate"	"213-997-4"	"1071-83-6"	"2-(phosphonomethylamino)acetic acid"	"Glyphosate"	"C3H8NO5P"	"C(C(=O)O)NCP(=O)(O)O"	"InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"sister chromatid exchange assay in mammalian cells"	"in vitro"	"According to"	"OECD Guideline 479 (Genetic Toxicology: In Vitro Sister Chromatid Exchange Assay in Mammalian Cells)"	"No"	"Acceptable"	"Human (as organism)"	"fibroblast"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Germany - CoRMS: Slovakia"	"Glyphosate (Renewal Assessment Report)"	"2013"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance glyphosate"	"42307"	"2015"	"doi:10.2903/j.efsa.2015.4302"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Tolylfluanid"	"211-986-9"	"731-27-1"	"single chemical entity"	"Component is identical to the substance"	"Tolylfluanid"	"211-986-9"	"731-27-1"	"N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)-4-methylaniline"	"Tolylfluanid"	"C10H13Cl2FN2O2S2"	"CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C"	"InChI=1S/C10H13Cl2FN2O2S2/c1-8-4-6-9(7-5-8)15(18-10(11,12)13)19(16,17)14(2)3/h4-7H,1-3H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"NMRI"	"5"	"Male"	"intraperitoneal"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Finland"	"Tolylfluanid (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tolylfluanid"	"38463"	"2005"	"doi:10.2903/j.efsa.2005.29r"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 97"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"yeast cytogenetic assay"	"in vitro"	"According to"	"OECD Guideline 480 (Genetic Toxicology: Saccharomyces cerevisiae, Gene Mutation Assay)"	"No"	"Acceptable"	"Aspergillus nidulans (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"no data"	"Positive"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"embryo cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"M45"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"Bacillus subtilis recombination assay"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Bacillus subtilis (as organism)"	"H17"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"Not applicable"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"no data"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"chromosome aberration assay"	"in vivo"	"According to"	"OECD Guideline 475 (Mammalian Bone Marrow Chromosome Aberration Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"Male"	"oral: gavage"	"24"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"other"	"in vivo"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"House mouse (as animal)"	"ICR"	""	"No data"	"intraperitoneal"	"3"	"h"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"C3H"	"15"	"Male"	"oral: unspecified"	"6"	"week"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Thiabendazole"	"205-725-8"	"148-79-8"	"single chemical entity"	"Component is identical to the substance"	"Thiabendazole"	"205-725-8"	"148-79-8"	"2-(thiazol-4-yl)benzimidazole"	"Thiabendazole"	"C10H7N3S"	"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3"	"InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"dominant lethal assay"	"in vivo"	"According to"	"OECD Guideline 478 (Genetic Toxicology: Rodent Dominant Lethal Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	""	"No data"	"oral: gavage"	"8"	"week"	"no data"	"not applicable"	"Negative"	""	""	"RMS: Spain"	"Thiabendazole"	"1996"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thiabendazole"	"41947"	"2014"	"doi:10.2903/j.efsa.2014.3880"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"No guideline followed"	"Not reported"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male/Female"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"No guideline followed"	"Not reported"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"mammalian germ cell cytogenetic assay"	"in vivo"	"No guideline followed"	"Not reported"	"No"	"Acceptable"	"Rat (as animal)"	"Sprague-Dawley"	"30"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"mixture or formulation"	"Component is identical to the substance"	"Flurtamone"	"619-224-0"	"96525-23-4"	"(RS)-5-methylamino-2-phenyl-4-(α,α,α-trifluoro-m-tolyl)furan-3(2H)-one"	"Flurtamone"	"C18H14F3NO2"	"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F"	"InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"Equivalent or similar to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"Yes"	"Acceptable"	"House mouse (as animal)"	"Not reported"	"12"	"Male/Female"	"oral: unspecified"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	"no information"	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	"no information"	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"Trifluoroacetic acid"	"200-929-3"	"76-05-1"	"2,2,2-trifluoroacetic acid"	"Not in list"	"C2HF3O2"	"C(=O)(C(F)(F)F)O"	"InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"small colonies"	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"small colonies"	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	"large colonies"	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"yes"	"with"	"Positive"	"large colonies"	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"6"	"Male"	"oral: gavage"	"24"	"h"	"yes, concurrent vehicle"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"12"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Flurtamone"	"619-224-0"	"96525-23-4"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(trifluoromethyl)benzoic acid"	"207-230-2"	"454-92-2"	"3-(trifluoromethyl)benzoic acid"	"Not in list"	"C8H5F3O2"	"FC(F)(F)c1cccc(c1)C(=O)O"	"InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"unscheduled DNA synthesis"	"in vivo"	"According to"	"OECD Guideline 486 (Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo)"	"No"	"Acceptable"	"Rat (as animal)"	"Wistar"	"4"	"Male"	"oral: gavage"	"2"	"h"	"yes"	"not applicable"	"Negative"	""	""	"RMS: Czech Republic - CoRMS: Ireland"	"Flurtamone Active substance data"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance flurtamone"	"42527"	"2016"	"doi: 10.2903/j.efsa.2016.4498"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1538"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 98"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 100"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1537"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"Equivalent or similar to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"Yes"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 1535"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"(k12)p3478"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"other"	"in vitro"	"No guideline available"	"Not reported"	"Not applicable"	"Acceptable"	"Escherichia coli (as organism)"	"W3110"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"No guideline followed"	"Not reported"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"According to"	"OECD Guideline 481 (Genetic Toxicology: Saccharomyces cerevisiae, Mitotic Recombination Assay)"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"genome mutation"	"mitotic recombination in Saccharomyces cerevisiae"	"in vitro"	"No guideline followed"	"Not reported"	"No"	"Acceptable"	"Saccharomyces cerevisiae (as organism)"	"D7"	""	""	"Not reported"	""	""	"no data"	"without"	"Positive"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"DNA damage and/or repair"	"DNA damage and repair assay, unscheduled DNA synthesis in mammalian cells in vitro"	"in vitro"	"According to"	"OECD Guideline 482 (Genetic Toxicology: DNA Damage and Repair, Unscheduled DNA Synthesis in Mammalian Cells In Vitro)"	"No"	"Acceptable"	"Rat (as animal)"	"hepatocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Thiodicarb"	"261-848-7"	"59669-26-0"	"single chemical entity"	"Component is identical to the substance"	"Thiodicarb"	"261-848-7"	"59669-26-0"	"Methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]
+sulfanylcarbamoyl]oxyethanimidothioate"	"Thiodicarb"	"C10H18N4O4S3"	"CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC"	"InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3"	"organic"	"compound"	"PubChem canonical SMILES"	"PubChem InChI"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thiodicarb (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance thiodicarb"	"38747"	"2006"	"doi:10.2903/j.efsa.2006.55r"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"TA 102"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Sintofen (aka cintofen)"	""	"130561-48-7"	"single chemical entity"	"Component is identical to the substance"	"Sintofen (aka cintofen)"	""	"130561-48-7"	"1-(4-Chlorophenyl)-5-(2-methoxyethoxy)-4-oxo-1,4-dihydro-3-cinnolinecarboxylic acid"	"Sintofen (aka cintofen)"	"C18H15ClN2O5"	"O=C(O)C2=NN(c1ccc(Cl)cc1)c3cccc(OCCOC)c3C2=O"	"InChI=1S/C18H15ClN2O5/c1-25-9-10-26-14-4-2-3-13-15(14)17(22)16(18(23)24)20-21(13)12-7-5-11(19)6-8-12/h2-8H,9-10H2,1H3,(H,23,24)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"WP2 uvr A pKM 101"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: France"	"Sintofen (revised DAR)"	"2009"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance sintofen"	"40526"	"2010"	"doi:10.2903/j.efsa.2010.1931"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Escherichia coli (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"bacterial reverse mutation assay"	"in vitro"	"According to"	"OECD Guideline 471 (Bacterial Reverse Mutation Assay)"	"No"	"Acceptable"	"Salmonella typhimurium (as organism)"	"Not reported"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"large colonies"	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"lymphoma L5178Y cells"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	"small colonies"	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Tralkoxydim"	""	"87820-88-0"	"single chemical entity"	"Component is a metabolite of the substance"	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	""	""	"3-(2,4,6-trimethylphenyl)pentanedioic acid"	"Not in list"	"C14H18O4"	"OC(=O)CC(CC(O)=O)c1c(C)cc(C)cc1C"	"InChI=1/C14H18O4/c1-8-4-9(2)14(10(3)5-8)11(6-12(15)16)7-13(17)18/h4-5,11H,6-7H2,1-3H3,(H,15,16)(H,17,18)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"in vitro mammalian chromosome aberration test"	"in vitro"	"According to"	"OECD Guideline 473 (In vitro Mammalian Chromosome Aberration Test)"	"No"	"Acceptable"	"Human (as organism)"	"lymphocytes"	""	""	"Not reported"	""	""	"no data"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Tralkoxydim (Addendum 1)"	"2007"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion regarding the peer review of the pesticide risk assessment of the active substance tralkoxydim"	"39657"	"2008"	"doi:10.2903/j.efsa.2008.139r"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"with"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Fenamidone"	"605-252-0"	"161326-34-7"	"single chemical entity"	"Component is a metabolite of the substance"	"(5S)-5-methyl-2-(methylthio)-5-phenyl-3,5-dihydro- 4H-imidazol-4-one"	""	""	"(5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3,5-dihydro-4H-imidazol-4-one"	"Not in list"	"C11H12N2OS"	"C[C@]1(N=C(SC)NC1=O)c2ccccc2"	"InChI=1/C11H12N2OS/c1-11(8-6-4-3-5-7-8)9(14)12-10(13-11)15-2/h3-7H,1-2H3,(H,12,13,14)/t11-/m0/s1"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"lung fibroblasts (V79)"	""	""	"Not reported"	""	""	"yes"	"without"	"Negative"	""	""	"RMS: Czech republic - CoRMS: France"	"Fenamidone (Renewal Assessment Report)"	"2016"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance fenamidone"	"42422"	"2016"	"doi:10.2903/j.efsa.2016.4406"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Trifluralin (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Trifluralin"	"216-428-8"	"1582-09-8"	"single chemical entity"	"Component is identical to the substance"	"Trifluralin"	"216-428-8"	"1582-09-8"	"2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline"	"Trifluralin"	"C13H16F3N3O4"	"CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]"	"InChI=1/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"CD-1"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: Greece"	"Trifluralin (Final addendum)"	"2005"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Peer review of the pesticide risk assessment of the active substance trifluralin"	"40030"	"2009"	"doi:10.2903/j.efsa.2009.327r"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"with"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"gene mutation"	"mammalian cell gene mutation assay"	"in vitro"	"According to"	"OECD Guideline 476 (In vitro Mammalian Cell Gene Mutation Test)"	"No"	"Acceptable"	"Hamster (as animal)"	"CHO"	""	""	"Not reported"	""	""	"yes, concurrent vehicle"	"without"	"Negative"	""	""	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"24"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"48"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Thifensulfuron-methyl"	"616-673-4"	"79277-27-3"	"single chemical entity"	"Component is a metabolite of the substance"	"methyl 3-sulfamoylthiophene-2-carboxylate"	""	""	"methyl 3-sulfamoylthiophene-2-carboxylate"	"Not in list"	"C6H7NO4S2"	"O=S(N)(=O)c1ccsc1C(=O)OC"	"InChI=1/C6H7NO4S2/c1-11-6(8)5-4(2-3-12-5)13(7,9)10/h2-3H,1H3,(H2,7,9,10)"	"organic"	"compound"	"Other"	"Other"	"chromosome aberration"	"Mammalian erythrocyte micronucleus test"	"in vivo"	"According to"	"OECD Guideline 474 (Mammalian Erythrocyte Micronucleus Test)"	"No"	"Acceptable"	"House mouse (as animal)"	"Swiss"	"10"	"Male/Female"	"oral: gavage"	"72"	"h"	"yes"	"not applicable"	"Negative"	""	"no evidence"	"RMS: The United Kingdom"	"Thifensulfuron-methyl"	"2015"	"Conclusion on Pesticides Peer Review"	"EFSA"	"Conclusion on the peer review of the pesticide risk assessment of the active substance thifensulfuron-methyl"	"42208"	"2015"	"doi:10.2903/j.efsa.2015.4201"
+"Name"	"Type"	"Description"	"isNullable"	"isRecordUniqueIdentifier"	"Catalogue Code"	"Last update"
+"GUIDELINE_QUALIFIER"	"Character"	"Indicates how strict the guideline given in the subsequent field 'Guideline' was followed or whether no guideline was used or available/required"		"FALSE"		"26/10/2015"
+"GENOTOXGUIDELINEFULLTXT"	"Character"	"Full description for the guideline followed"		"FALSE"		"10-27-19"
+"DEVIATION"	"Character"	"Indicates whether a genotoxicity study contains deviations from the standard test protocol"		"FALSE"		"26/10/2015"
+"GLP_COMPL"	"Character"	"Indicates whether a GLP certificate or compliance statement is available"		"FALSE"		"26/10/2015"
+"TESTTYPE"	"Character"	"Description of the type of test"				"10-27-19"
+"METHOD_TYPE"	"Character"	"Description of the method of test"				"26/10/2015"
+"SPECIES"	"Character"	"Description of the  organism/cell culture tested"		"FALSE"		"10-27-19"
+"STRAIN"	"Character"	"Description of the  strain/subtype tested"		"FALSE"		"26/10/2015"
+"SEX"	"Character"	"Indicates the sex of the tested animals in vivo genotoxicity study"		"FALSE"		"26/10/2015"
+"MET_INDICATOR"	"Character"	"Indicates whether exogenous metabolic activation was applied or not (In vitro studies only)"		"FALSE"		"10-27-19"
+"ROUTE"	"Character"	"Description of the route of administration"		"FALSE"		"26/10/2015"
+"EXP_PERIOD"	"Numeric"	"Exposure duration for in vivo genotoxicity studies"		"FALSE"		"10-27-19"
+"EXPPERIODUNIT"	"Character"	"Short description of the exposure duration for in vivo genotoxicity studies"		"FALSE"		"26/10/2015"
+"NUMBER_INDIVIDUALS"	"Numeric"	"Number of organisms dosed at each dose level of the in vivo genotoxicty study"		"FALSE"		"26/10/2015"
+"CONTROL"	"Character"	"Indicates whether and what type of concurrent control groups were used in in vivo genotoxicity study"		"FALSE"		"26/10/2015"
+"GENOTOX_ENDPOINT"	"Character"	"Enumeration type of genotoxicity endpoint"				"10-27-19"
+"RESULTS"	"Character"	"Indicates whether the test has positive or negative result"		"FALSE"		"26/10/2015"
+"ACCEPTABILITY"	"Character"	"Indicates whether the result is accettable or not"				"26/10/2015"
+"MOUSELYMPHTEST"	"Character"	"Description of colony size for mouse lymphoma test"				"10-27-19"
+"INVIVOTISSUEEXP"	"Character"	"Evidence of tissue exposure for in vivo test"				"10-27-19"
+"SUB_NAME"	"Character"	"Substance name as defined in the opinions. If multiple names for the same substances are reported, the most specific (or more common) is reported. No synonyms are foreseen for substance name"	"FALSE"			"01/06/2015"
+"SUB_ECSUBINVENTENTRYREF"	"Character"	"Indicates the EC reference number as defined by ECHA"	"TRUE"			"01/06/2015"
+"SUB_CASNUMBER"	"Character"	"Chemical Abstracts Service number"	"TRUE"			"01/06/2015"
+"SUB_TYPE"	"Character"	"Enumerated list to describe components comprising the substance"	"FALSE"			"01/06/2015"
+"QUALIFIER"	"Character"	"Description of the composition of the substance"				"01/06/2015"
+"COM_NAME"	"Character"	"Component name as derived in the opinions used for the genotoxicity test. If more than one name is reported in the opinion (excluding IUPAC name), then the most common/most specific name is reported as component name"	"FALSE"			"01/06/2015"
+"COM_ECSUBINVENTENTRYREF"	"Character"	"Indicates the EC reference number as defined by ECHA"	"TRUE"			"01/06/2015"
+"COM_CASNUMBER"	"Character"	"Chemical Abstracts Service number"	"TRUE"			"01/06/2015"
+"IUPACNAME"	"Character"	"International Union of Pure and Applied Chemistry name"	"TRUE"			"01/06/2015"
+"COMPARAMNAME"	"Character"	"Description of the component  EFSA PARAM catalogue"	"FALSE"			"01/06/2015"
+"MOLECULARFORMULA"	"Character"	"Molecular formula "	"TRUE"			"01/06/2015"
+"SMILESNOTATION"	"Character"	"Simplified molecular input line entry specification"	"TRUE"			"01/06/2015"
+"INCHI"	"Character"	"International Chemical Identifier"	"TRUE"			"01/06/2015"
+"COM_TYPE"	"Character"	"High level classfication of component type"	"FALSE"			"01/06/2015"
+"COM_STRUCTURESHOWN"	"Character"	"Indicates what type of structure (either SMILES or InChI) is reported"	"FALSE"			"01/06/2015"
+"SMILESNOTATIONSOURCE"	"Character"	"Source of the SMILES notation"	"TRUE"			"01/06/2015"
+"INCHI_NOTATIONSOURCE"	"Character"	"Source of the Inchi notation"	"TRUE"			"01/06/2015"
+"OpinionType"	"Character"	"Description of the type of reference"	"FALSE"			"01/06/2015"
+"OpinionAuthor"	"Character"	"Indicates the author/s of the publication"	"TRUE"			"01/06/2015"
+"OpinionTitle"	"Character"	"Indicates the title of the publication"	"FALSE"			"01/06/2015"
+"PUBLICATIONDATE"	"Date"	"Complete date of the publication of the document in the format yyyymmdd"				"01/06/2015"
+"OpinionPubYear"	"Numeric"	"Year of the publication"				"01/06/2015"
+"DOI"	"Character"	"Digital Object Identifier: the DOI is a permanent character string (a ""digital identifier"") used to uniquely identify an object such as an electronic document, source the study report or publication, URL or EFSA Journal"	"TRUE"			"01/06/2015"
+"DARAuthor"	"Character"	"Member state author of the Draft Assessment Report"				"01/06/2015"
+"DARTitle"	"Character"	"Title of the of the Draft Assessment Report"				"01/06/2015"
+"DARYear"	"Character"	"Year of the of the Draft Assessment Report"				"01/06/2015"
+
\ No newline at end of file
diff --git a/data/parts/efsa.xls b/data/parts/efsa.xls
new file mode 100644
index 0000000..1372372
--- /dev/null
+++ b/data/parts/efsa.xls
diff --git a/data/parts/hansen-original.csv b/data/parts/hansen-original.csv
new file mode 100644
index 0000000..85f86a5
--- /dev/null
+++ b/data/parts/hansen-original.csv
@@ -0,0 +1,6513 @@
+CAS_NO,Source,Activity,Steroid,WDI,Canonical_Smiles,REFERENCE
+2475-33-4,VITIC,0,-1,,O=C1c2ccccc2C(=O)c3c1ccc4c3[nH]c5c6C(=O)c7ccccc7C(=O)c6c8[nH]c9c%10C(=O)c%11ccccc%11C(=O)c%10ccc9c8c45,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+820-75-7,CCRIS,1,-1,,NNC(=O)CNC(=O)\C=N\#N,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+2435-76-9,CCRIS,1,-1,,O=C1NC(=O)\C(=N/#N)\C=N1,"HIRAMOTO,K, KATO,T AND KIKUGAWA,K, MECHANISMS OF THE DNA BREAKINGACTIVITY OF MUTAGENIC 5-DIAZOURACIL, MUTAT. RES. 306(2):153-163, 1994"
+817-99-2,CCRIS,1,-1,,NC(=O)CNC(=O)\C=N\#N,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+116539-70-9,CCRIS,1,-1,,CCCCN(CC(O)C1=C\C(=N/#N)\C(=O)C=C1)N=O,"KIKUGAWA,K, KATO,T AND TAKEDA,Y, FORMATION OF A HIGHLY MUTAGENIC DIAZOCOMPOUND FROM THE BAMETHAN-NITRITE REACTION, MUTAT. RES. 177(1):35-43,1987"
+115-02-6,CCRIS,1,-1,,NC(COC(=O)\C=N/#N)C(=O)O,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+122341-55-3,CCRIS,1,-1,,CCN(CC(O)C1=CC(=O)\C(=N\#N)\C=C1)N=O,"KIKUGAWA,K, KATO,T AND TAKEDA,Y, FORMATION OF A DIRECT MUTAGEN,DIAZO-N-NITROSOETILEFRIN BY INTERACTION OF ETILEFRIN WITH NITRITE, CHEM. PHARM.BULL. 37(6):1600-1603, 1989"
+105149-00-6,CCRIS,0,-1,,CC(=O)OC1(CCC2C3C=C(Cl)C4=CC(=O)OCC4(C)C3CCC12C)C(=O)C,"TANIFUJI,H, HISADA,S, MORIHIRA,M, EGUCHI,K, KUWAYAMA,N, HORIUCHI,T,SUZUKI,MR, SUZUKI,O, KAMOGAWA,S AND TERASOMA,M, MUTAGENICITY STUDIES OF A POTENTANTIANDROGEN, OSATERONE ACETATE (TZP-4238), ON BACTERIA, CULTURED MAMMALIANCELLS AND MOUSE BONE MARROW, OYO YAKURI 47(3):297-302, 1994"
+108-78-1,VITIC,0,-1,"MELAMINE",Nc1nc(N)nc(N)n1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2425-85-6,EPA2,1,-1,"DR0034231",Cc1ccc(N=Nc2c(O)ccc3ccccc23)c(c1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+67019-24-3,CCRIS,0,-1,,CC(C)CC(=O)Nc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+83-41-0,VITIC,1,-1,,Cc1cccc(c1C)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3836-23-5,CCRIS,0,1,,CCCCCCC(=O)OC1(CCC2C3CCC4=CC(=O)CCC4C3CCC12C)C#C,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+108-03-2,EPA2,0,-1,"NITROPR-1",CCC[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+70585-52-3,CCRIS,1,-1,,OC(=O)c1cc(cc2cccnc12)[N+](=O)[O-],"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+87425-68-1,CCRIS,1,-1,,OC1C=Cc2c(ccc3c(Br)c4ccccc4cc23)C1O,"FU,PP, VON TUNGELN,LS, UNRUH,LE, NI,Y AND CHOU,MW, COMPARATIVEREGIOSELECTIVE AND STEREOSELECTIVE METABOLISM OF 7-CHLOROBENZ[A]ANTHRACENE AND7-BROMOBENZ[A]-ANTHRACENE BY MOUSE AND RAT LIVER MICROSOMES, CARCINOGENESIS12(3):371-378, 1991"
+24370-25-0,VITIC,1,-1,"BENZIMUR2",NC(=O)Nc1nc2ccccc2[nH]1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M453,EPA1,0,-1,,C[C@@H](O)CCC(=O)c1cocc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4106-66-5,EPA1,1,-1,,Nc1ccc2c(oc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1576-67-6,EPA1,1,-1,,Cc1ccc2ccc3ccc(C)cc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+146177-65-3,EPA1,1,-1,,Cc1cc2c(nc(N)n2C)c3ncc(nc13)c4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112380-29-7,CCRIS,1,-1,,CCN(N=O)\C(=N\O)\C=O,"SUZUKI,E, OSABE,M, MOCHIZUKI,M, WAKABAYASHI,Y AND OKADA,M,CHARACTERIZATION OF DIRECTLY ACTING MUTAGENS PRODUCED FROMN-NITROSO-N-(FORMYLMETHYL)ALKYLAMINES. THEIR POSSIBLE INVOLVEMENT IN THECARCINOGENESIS OF N-NITROSAMINES HAVING A 2-HYDROXYETHYL GROUP,CHEM. PHARM.BULL. 35(10):4022-4030, 1987"
+484-23-1,EPA1,1,-1,"DIHYDRALA,DIHYDRMES,DIHYDRALS",NNc1nnc(NN)c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-26-9,VITIC,1,-1,,C=CC(=O)NCNC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+88020-91-1,EPA1,0,-1,,OCc1cc2c3ccccc3c4cccc(c1)c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+28652-72-4,VITIC,0,-1,,Cc1ccccc1c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+67278-88-0,CCRIS,0,-1,,CC1C2C3C(C)C4C(=O)C56C(=O)c7c(O)cc(C)cc7C(=O)C35C1C(=O)C68C(=O)c9c(O)cc(C)cc9C(=O)C248,"KRIVOBOK,S, SEIGLE-MURANDI,F, STEIMAN,R, MARZIN,DR AND BETINA,V,MUTAGENICITY OF SUBSTITUTED ANTHRAQUINONES IN THE AMES/SALMONELLA MICROSOMESYSTEM, MUTAT. RES. 279(1):1-8, 1992"
+542-02-9,CCRIS,0,-1,,Cc1nc(N)nc(N)n1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+1007-28-9,EPA1,0,-1,,CCNc1nc(N)nc(Cl)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64188-65-4,CCRIS,1,-1,,C1CCC(CC1)N2C3C2c4ccccc4c5ccccc35,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+122-56-5,CCRIS,1,-1,,CCCCB(CCCC)CCCC,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y92"
+111348-61-9,CCRIS,1,-1,,CC(=O)NC(CSC(=C(Cl)Cl)Cl)C(=O)O,"VAMVAKAS,S, DEKANT,W, BERTHOLD,K, SCHMIDT,S, WILD,D AND HENSCHLER,D,ENZYMATIC TRANSFORMATION OF MERCAPTURIC ACIDS DERIVED FROM HALOGENATED ALKENESTO REACTIVE AND MUTAGENIC INTERMEDIATES, BIOCHEM. PHARMACOL. 36(17):2741-2748,1987"
+29350-73-0,VITIC,1,-1,,CC(C)[C@@H]1CC[C@H](C)[C@@H]2CC[C@H](C)C[C@@H]12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+63980-20-1,EPA1,1,-1,,CCNN=NCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+554-84-7,CCRIS,1,-1,"NITROPHOM",Oc1cccc(c1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+13177-32-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(c1)c3cccc4cccc2c34,"VANCE,WA AND LEVIN,DE, STRUCTURAL FEATURES OF NITROAROMATICS THATDETERMINE MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM, ENVIRON. MUTAGEN.6(6):797-811, 1984"
+98-00-0,VITIC,0,-1,,OCc1occc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M204,EPA1,1,-1,,C(Cc1ccc(cc1)c2ccccc2)[C@H]3CO3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+37515-51-8,EPA1,1,-1,,Oc1cc2c3ccccc3ccc2c4ccccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+842-07-9,VITIC,1,-1,"SUDAN-1",Oc1ccc2ccccc2c1N=Nc3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M566,EPA1,0,-1,,N[C@@H]1CC[C@@H](C[C@@H]2CC[C@@H](N)CC2)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2213-00-5,CCRIS,1,-1,,COC(=O)C12CC1(C=O)C(=CC3CC(C)(C)CC23)C=O,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+535-11-5,CCRIS,1,-1,,CCOC(=O)C(C)Br,"DOLZANI,L, TAMARO,M, LAGATOLLA,C, MONTI-BRAGADIN,C, CAVICCHIONI,G,MARCHETTI,P AND D'ANGELI,F, STRUCTURE-ACTIVITY RELATIONSHIP IN THE MUTAGENICEFFECT OF CHIRAL OR RACEMIC 2-BROMOPROPANAMIDES ON SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 19(4):311-315, 1992"
+21362-69-6,CCRIS,0,1,,COC1(CCCC1)OC2CCC3C4CCC5CC6SC6CC5(C)C4CCC23C,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+92280-01-8,CCRIS,1,-1,,CCN(CCCl)CCCNc1c2CCCCc2nc3ccccc13,"DEMARINI,DM, PHAM,HN, KATZ,AJ AND BROCKMAN,HE, RELATIONSHIPS BETWEENSTRUCTURES AND MUTAGENIC POTENCIES OF 16 HETEROCYCLIC NITROGEN MUSTARDS (ICRCOMPOUNDS) IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 136(3):185-199,1984"
+145763-35-5,CCRIS,1,-1,,C\C(=C/C(=C/C1=CCOC1=O)/C)\C=C\C=C(/C)\C(=O)C23OC2C(O)(CCO)NC3=O,"ZHU,B AND JEFFREY,AM, FUSARIN C: ISOLATION AND IDENTIFICATION OF TWOMICROSOMAL METABOLITES, CHEM. RES. TOXICOL. 6(1):97-101, 1993"
+944-22-9,EPA3,0,-1,,CCO[P@](=S)(CC)Sc1ccccc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+5131-58-8,VITIC,1,-1,,Nc1ccc(c(N)c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+919-86-8,CCRIS,0,-1,,CCSCCSP(=O)(OC)OC,"GROVER,IS, DHINGRA,AK, ADHIKARI,N AND LADHAR,SS, GENOTOXICITY OFPESTICIDES AND PLANT SYSTEMS, PROG. CLIN. BIOL. RES. 340E(MUTAT. ENVIRON.,PT.E):91-106, 1990"
+118-90-1,VITIC,0,-1,"TOLUATEOR",Cc1ccccc1C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+26002-80-2,CCRIS,1,-1,"PHENOTHRI",CC(=CC1C(C(=O)OCc2cccc(Oc3ccccc3)c2)C1(C)C)C,"NISHI,K, TATSUO,N AND NISHIOKA,H, DNA DAMAGING CAPACITY ANDMUTAGENICITY OF PYRETHROID COMPOUNDS IN E. COLI DNA REPAIR ANDSALMONELLA/MICROSOME TESTS, SCI. ENG. REV. DOSHISHA UNIV. 26(2):93-99,1985"
+108-86-1,VITIC,0,-1,"BROMOBENZ",Brc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+88-53-9,EPA1,0,-1,,Cc1cc(N)c(cc1Cl)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6088-51-3,VITIC,0,-1,,Oc1ccc2cc(SSc3ccc4cc(O)ccc4c3)ccc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+112022-06-7,EPA1,1,-1,,CN(C)CCNC(=O)c1cccc2C(=O)c3ccccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60877-79-4,CCRIS,1,-1,,Nc1snc2c(Cl)cc(Cl)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+154159-06-5,CCRIS,0,-1,,ClCC1(C(Cl)Cl)C2CC(Cl)(Cl)C1(CC2(Cl)Cl)C(Cl)Cl,"STEINBERG,M, KINOSHITA,FK AND BALLANTYNE,M,MUTAGENICITY STUDIES WITHTOXAPHENE CONGENERS, ORGANOHALOGEN COMPD. 35(ANALYSIS, CHLORINATED BORNANES,CHIRAL CONTAMINANTS, POLYMER ADDITIVES AND MONOMERS):243-246, 1998"
+602-06-2,EPA1,0,-1,"SKYRIN",Cc1cc(O)c2C(=O)c3c(O)cc(O)c(c3C(=O)c2c1)c4c(O)cc(O)c5C(=O)c6c(O)cc(C)cc6C(=O)c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-30-2,EPA2,0,-1,,COCCl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+59-89-2,VITIC,1,-1,,O=NN1CCOCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2479-46-1,EPA1,1,-1,,Nc1ccc(Oc2cccc(Oc3ccc(N)cc3)c2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-54-2,VITIC,0,-1,,Nc1ccc(Nc2ccccc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2849-98-1,EPA1,0,-1,,CCCCCOC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+65-85-0,VITIC,0,-1,"AMMONBENZ,BENZDIOLA,BENZOATE,BENZOATCA,JM-244,JM-2644,LITHIUMBZ,BENZOATEK,BENZOATNA",OC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5134-49-6,CCRIS,1,-1,,Nc1ncnc2c1ncn2Cc3ccc(cc3)[N+](=O)[O-],"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+203-64-5,VITIC,1,-1,,C1c2cccc3ccc4cccc1c4c23,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+321-60-8,EPA1,0,-1,,Fc1ccccc1c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+11097-69-1,EPA3,0,-1,,Clc1ccc(cc1Cl)c2ccc(Cl)c(Cl)c2Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+58775-50-1,CCRIS,1,-1,,CC(=CCc1ccc(O)c2C(=O)c3c(O)c4c(OC5OC=CC45O)cc3Oc12)C,"KFIR,R, JOHANNSEN,E AND VLEGGAAR,R, MUTAGENIC ACTIVITY OF AUSTOCYSTINS- SECONDARY METABOLITES OF ASPERGILLUS USTUS,BULL. ENVIRON. CONTAM. TOXICOL.37(5):643-650, 1986"
+1222-05-5,CCRIS,0,-1,,CC1COCc2cc3c(cc12)C(C)(C)C(C)C3(C)C,"API,AM AND SAN,RHC, GENOTOXICITY TESTS WITH6-ACETYL-1,1,2,4,4,7-HEXAMETHYLTETRALINE AND1,3,4,6,7,8-HEXAHYDRO-4,6,6,7,8,8-HEXAMETHYLCYCLOPENTA-GAMMA-2-BENZOPYRAN,MUTAT. RES. 446(1):67-81, 1999"
+50892-23-4,EPA1,0,-1,"PIRINIXAT",Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3025-77-2,VITIC,1,-1,,Nc1ccc2ccccc2c1N=Nc3ccc(cc3)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+25316-40-9,CCRIS,1,-1,,COc1cccc2C(=O)c3c(O)c4CC(O)(CC(OC5CC(N)C(O)C(C)O5)c4c(O)c3C(=O)c12)C(=O)CO,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+2467-03-0,CCRIS,0,-1,,Oc1ccc(Cc2ccccc2O)cc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+2517-43-3,CCRIS,0,-1,,COC(C)CCO,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+71708-92-4,EPA1,1,-1,,CC(=O)N(O)c1ccc(Oc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25058-17-7,CCRIS,0,-1,,CC(C)(c1ccc(OP(O)O)cc1)c2ccc(OP(O)O)cc2,"HACHIYA,N AND TAKIZAWA,Y, MUTAGENICITY OF PLASTIC ADDITIVES,HEN'IGENSEI SHIKEN 3(3):147-154, 1994"
+111-64-8,VITIC,1,-1,,CCCCCCCC(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5344-87-6,CCRIS,0,-1,,CC(C)(C)C(Br)C(=O)Nc1ccccc1,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+138154-40-2,CCRIS,1,-1,"DR9602746",CCN(CC)CCNc1ccc2nc(C)n3c4ccc(O)cc4C(=O)c1c23,"BERGER,B, MARQUARDT,H AND WESTENDORF,J, PHARMACOLOGICAL ANDTOXICOLOGICAL ASPECTS OF NEW IMIDAZOACRIDINONE ANTITUMOR AGENTS, CANCER RES.56(9):2094-2104, 1996"
+139-94-6,EPA2,1,-1,"NITHIAZID",CCNC(=O)Nc1ncc(s1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+22897-08-1,EPA1,1,-1,,COc1ccc(O)c2C(=O)c3c(OC)cc4O[C@@H]5OC=C[C@H]5c4c3Oc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71712-70-4,CCRIS,1,-1,,[O-][N+](=O)c1cc2Oc3cc(Cl)c(Cl)cc3Oc2cc1Cl,"DONNELLY,KC, JONES,DH AND SAFE,S, THE BACTERIAL MUTAGENICITY OFNITROPOLYCHLORINATED DIBENZO-P-DIOXINS, MUTAT. RES. 169(1-2):17-22,1986"
+80-62-6,EPA2,0,-1,"EUDISPERT,EUDRAGIT,DR0015989,DR9801958",COC(=O)C(=C)C,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+102694-32-6,CCRIS,1,-1,"STEMPHYL3",Oc1ccc2c3ccc(O)c4C(=O)C=C[C@@](O)([C@@H]5[C@H]6O[C@H]6C(=O)c1c25)c34,"DAVIS,VM AND STACK,ME, MUTAGENICITY OF STEMPHYLTOXIN III, A METABOLITEOF ALTERNARIA ALTERNATA, APPL. ENVIRON. MICROBIOL. 57(1):180-182,1991"
+598-55-0,VITIC,0,-1,,COC(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+135561-93-2,CCRIS,0,-1,"DF-100",Cc1cc(C)n(n1)c2[nH]nc(NN)c3c4ccccc4nc23,"LOPEZ-DE CERAIN,A, GARCIA,E, GULLON,A, ALVAREZ,T, LOSA,MJ AND MONGE,A,EVALUATION OF THE MUTAGENICITY OF 1-HYDRAZINO-4-(3,5-DIMETHYL-1-PYRAZOLYL)PYRIDAZINO[4,5-B]INDOLE, ARZNEIM.-FORSCH. 44(3):310-312, 1994"
+191861-17-3,CCRIS,1,-1,,Fc1cnc2ccc3cccnc3c2c1,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+64216-20-2,VITIC,1,-1,,SC(NC(=O)NC(S)c1nc2ccccc2s1)c3nc4ccccc4s3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+34331-95-8,EPA1,1,-1,,Cc1c2ccccc2c(CBr)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3198-41-2,EPA1,1,-1,,Nc1cccc2cc3CCCCc3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96-33-3,VITIC,0,-1,"EUDRAGITS",COC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+192705-52-5,CCRIS,1,-1,,CC(=O)Nc1c(O)cc2c3ccccc3c4cccc1c24,"SANGAIAH,R, RAMACHANDRAN,P, ZHANG,J AND BALL,LM, SYNTHESIS ANDBIOLOGICAL ACTIVITY OF METABOLITES OF ENVIRONMENTAL NITROARENES, POLYCYCLICAROMAT. COMPD. 11(1-4):283-290, 1996"
+94339-56-7,CCRIS,1,-1,,OC1Cc2cc3ccc4cccc5ccc(c2C=C1)c3c45,"CHIU,PL AND YANG,SK, METABOLISM OF 7,8-DIHYDROBENZO[A]PYRENE BY RATLIVER MICROSOMAL ENZYMES AND MUTAGENICITY OF METABOLITES, CANCER RES. 46(10):5084-5094, 1986"
+115664-59-0,CCRIS,1,-1,,Oc1ccc2c(c1)c3ccc(c4cccc2c34)[N+](=O)[O-],"CONSOLO,MC, ANDERS,M AND HOWARD,PC, MUTAGENICITY OF THE PHENOLICMICROSOMAL METABOLITES OF 3-NITROFLUORANTHENE AND 1-NITROPYRENE IN STRAINS OFSALMONELLA TYPHIMURIUM, MUTAT. RES. 210(2):263-269, 1989"
+97509-29-0,CCRIS,0,-1,,OC1C=Cc2cc3ccccc3c(c2C1O)[N+](=O)[O-],"FU,PP, VON TUNGELN,LS AND CHOU,MW, METABOLISM OF 9-NITROANTHRACENE BYRAT LIVER MICROSOMES: IDENTIFICATION AND MUTAGENICITY OF METABOLITES,CARCINOGENESIS 6(5):753-757, 1985"
+5858-81-1,EPA1,0,-1,"LITHOLRUB",Cc1ccc(N=Nc2c(O)c(cc3ccccc23)C(=O)O)c(c1)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1733-13-7,CCRIS,0,-1,,CN=C1C=CC(=C(c2ccc(cc2)N(C)C)c3ccc(cc3)N(C)C)C=C1,"AIDOO,A, GAO,N, NEFT,RE, SCHOL,HM, HASS,BS, MINOR,TY AND HEFLICH,RH,EVALUATION OF THE GENOTOXICITY OF GENTIAN VIOLET IN BACTERIAL AND MAMMALIAN CELLSYSTEMS, TERATOG., CARCINOG., MUTAGEN. 10(6):449-462, 1990"
+56986-36-8,EPA3,1,-1,,CCCCN(COC(=O)C)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+93285-74-6,EPA1,1,-1,,C1CCC2=C(C1)c3cc4ccccc4c5cc6ccccc6c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22788-18-7,CCRIS,1,-1,"CARBOXYPH",NP(=O)(OCCC(=O)O)N(CCCl)CCCl,"WINCKLER,K, OBE,G, MADLE,S AND NAU,H, MUTAGENIC ACTIVITIES OFCYCLOPHOSPHAMIDE (NSC-26271) AND ITS MAIN METABOLITES IN SALMONELLA TYPHIMURIUM,HUMAN PERIPHERAL LYMPHOCYTES AND CHINESE HAMSTER OVARY CELLS, MUTAT. RES.129(1):47-55, 1984"
+94887-71-5,CCRIS,0,-1,,Nc1c(O)cc(Cc2cc(Cl)c(N)c(OS(=O)(=O)O)c2)cc1Cl,"MANIS,MO AND BRASELTON,WE JR, STRUCTURE ELUCIDATION AND IN VITROREACTIVITY OF THE MAJOR METABOLITE OF 4,4'-METHYLENEBIS(2-CHLOROANILINE)(MBOCA)IN CANINE URINE, FUNDAM. APPL. TOXICOL. 4(6):1000-1008, 1984"
+15980-15-1,EPA1,0,-1,,C1CSCCO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+636-21-5,VITIC,1,-1,,Cc1ccccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+486-25-9,EPA1,0,-1,,O=C1c2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+286-62-4,CCRIS,0,-1,,C1CCCC2OC2CC1,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+106589-50-8,EPA1,1,-1,,C1Cc2c(C=C1)ccc3nc4ccc5ccccc5c4cc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110004-96-1,CCRIS,0,-1,,CS(=O)(=O)Nc1ccc(Nc2c3ccc(cc3nc4ccc(cc24)N=N#N)N=N#N)cc1,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+154-69-8,VITIC,0,-1,"TRIPELENN,TRIPELCIT,TRIPELHCL",CN(C)CCN(Cc1ccccc1)c2ccccn2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+64356-85-0,CCRIS,1,-1,,C\C=C(/Cl)\C1=CC(=O)C23CC2C(C)(C)OC3(O)C1=O,"STADLER,M, ANKE,H AND STERNER,O, METABOLITES WITH NEMATICIDAL ANDANTIMICROBIAL ACTIVITIES FROM THE ASCOMYCETE LACHNUM PAPYRACEUM (KARST.) KARST.V. PRODUCTION, ISOLATION AND BIOLOGICAL ACTIVITIES OF BROMINE-CONTAININGMYCORRHIZIN AND LACHNUMON DERIVATIVES AND FOUR ADDITIONAL NEW BIOACTIVEMETABOLITES, J. ANTIBIOT. 48(2):149-153, 1995"
+59-05-2,EPA2,0,-1,,CN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)NC(CCC(=O)O)C(=O)O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+103-69-5,VITIC,0,-1,,CCNc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+52411-33-3,EPA1,1,-1,,Nc1ccccc1SCCSc2ccccc2N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89-73-6,EPA3,1,-1,"SALHYXATE",ONC(=O)c1ccccc1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+603-85-0,CCRIS,0,-1,,Nc1c(O)cccc1[N+](=O)[O-],"SHAHIN,MM, MUTAGENICITY EVALUATION OF NITROANILINES ANDNITROAMINOPHENOLS IN SALMONELLA TYPHIMURIUM, INT. J. COSMET. SCI. 7(6):277-289,1985"
+74518-99-3,CCRIS,0,-1,,CC(C)(C)c1ccc(\C=C\c2ccc(N)cc2)cc1,"LUDOLPH,B KLEIN,M ERDINGER,L AND BOCHE,G, THE EFFECTS OF 4'-ALKYLSUBSTITUENTS ON THE MUTAGENIC ACTIVITY OF 4-AMINO- AND 4-NITROSTILBENES INSALMONELLA TYPHIMURIUM, MUTAT. RES. 491(1-2):195-209, 2001"
+1703-58-8,EPA3,1,-1,,OC(=O)C[C@H]([C@H](CC(=O)O)C(=O)O)C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+83-32-9,VITIC,0,-1,,C1Cc2cccc3cccc1c23,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107210-40-2,CCRIS,1,-1,,CN(C)CCCNc1c2ccccc2nc3c(ccc(c13)[N+](=O)[O-])N(CCO)CCO,"FERGUSON,LR, DENNY,WA AND O'ROURKE,SM, MUTAGENIC ACTIVITY OFNITRACRINE DERIVATIVES IN SALMONELLA TYPHIMURIUM: RELATIONSHIP TO DRUGPHYSICOCHEMICAL PARAMETERS, AND TO BACTERIAL UVRB AND RECA GENES AND PLASMIDPKM101, MUTAT. RES. 223(1):13-22, 1989"
+7696-62-0,EPA1,1,-1,,CCCCOc1ccc(cc1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88-51-7,EPA1,1,-1,,Cc1cc(c(N)cc1Cl)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63-75-2,EPA1,1,-1,"ARECOLINE,ARECOLHBR",COC(=O)C1=CCCN(C)C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+27108-42-5,EPA1,1,-1,,CNC(=O)ON,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+79-10-7,VITIC,0,-1,"ACRYLATE,FERACRYL,HIVISW105,SUMIKAGEL",OC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+141-82-2,VITIC,0,-1,"DR9803837,JM-40,MALONATCA,MALONATE,NSC146067",OC(=O)CC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+110-62-3,VITIC,0,-1,,CCCCC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+21711-71-7,EPA1,1,-1,,O=Nc1ccccc1c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108612-45-9,EPA1,0,-1,,CN(C1CCN(CC1)c2nc3ccccc3n2Cc4ccc(F)cc4)c5nccc(O)n5,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+74407-29-7,CCRIS,0,-1,"SA-679",CSC(C)(C)C(=O)NC(CS)C(=O)O,"MORIKAWA,K, YAMAUCHI,H AND ISO,T, MUTAGENICITY TESTS ON N-(2-MERCAPTO-2-METHYLPROPIONYL)-L-CYSTEINE (SA96), IYAKUHIN KENKYU 16(4):784-792,1985"
+4685-14-7,EPA1,0,-1,"PARAQUAT,PARAQUDCL",C[n+]1ccc(cc1)c2cc[n+](C)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+66927-03-5,CCRIS,1,-1,,OC(CN=N#N)C(O)C(O)C(O)C=O,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+149862-56-6,CCRIS,0,-1,,CCCCCNc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+105-74-8,EPA1,0,-1,,CCCCCCCCCCCC(=O)OOC(=O)CCCCCCCCCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1325-37-7,VITIC,0,-1,,Cc1ccc(cc1S(=O)(=O)O)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98-47-5,CCRIS,0,-1,,OS(=O)(=O)c1cccc(c1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+121-00-6,EPA1,0,-1,"BHA-3",COc1ccc(O)c(c1)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54455-37-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2C(=O)N(CCl)C(=O)c2c1,"AZUMA,S, KISHINO,S, KATAYAMA,S, AKAHORI,Y AND MATSUSHITA,H,MUTAGENICITY OF 12 HPLC LABELING REAGENTS FOR ANALYZING CARBOXYL COMPOUNDS,KANKYO KAGAKU 7(2):249-255, 1997"
+21145-77-7,CCRIS,0,-1,,CC1CC(C)(C)c2cc(C(=O)C)c(C)cc2C1(C)C,"API,AM AND SAN,RHC, GENOTOXICITY TESTS WITH6-ACETYL-1,1,2,4,4,7-HEXAMETHYLTETRALINE AND1,3,4,6,7,8-HEXAHYDRO-4,6,6,7,8,8-HEXAMETHYLCYCLOPENTA-GAMMA-2-BENZOPYRAN,MUTAT. RES. 446(1):67-81, 1999"
+24471-48-5,EPA1,1,-1,,OCc1cc2ccc3cccc4ccc(c1)c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+145142-70-7,CCRIS,1,-1,,CCCCON(OC(=O)C)C(=O)c1ccc(cc1)c2ccccc2,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+68-23-5,EPA1,0,1,,C[C@]12CC[C@H]3[C@@H](CCC4=C3CCC(=O)C4)[C@H]1CC[C@@]2(O)C#C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91-15-6,CCRIS,0,-1,,N#Cc1ccccc1C#N,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+142783-37-7,CCRIS,0,-1,,CC(=O)Nc1cc(ccc1C)N=[N+]([O-])c2ccc(C)c(NC(=O)C)c2,"SAYAMA,M, MORI,M, NAKADA,Y, KAGAMIMORI,S AND KOZUKA,H, METABOLISM OF2,4-DINITROTOLUENE BY SALMONELLA TYPHIMURIUM STRAINS TA98, TA98NR ANDTA98/1,8-DNP6, AND MUTAGENICITY OF THE METABOLITES OF 2,4-DINITROTOLUENE ANDRELATED COMPOUNDS TO STRAINS TA98 AND TA100, MUTAT. RES. 264(3):147-153,1991"
+123524-52-7,CCRIS,0,-1,,CC(C)OC(=O)C1=C(C)N=C(N)C(=C(O)OC2CN(C2)C(c3ccccc3)c4ccccc4)C1c5cccc(c5)[N+](=O)[O-],"HIRANO,K, HAGIWARA,T, UCHIDA,T AND KAWAGUCHI,A, GENOTOXICITY TEST ONAZELNIDIPINE, YAKURI TO CHIRYO 25(SUPPL. 5):1101-1111, 1997"
+64431-93-2,EPA1,0,-1,"DIPI",C1CN=C(N1)c2ccc(cc2)c3cc4ccc(cc4[nH]3)C5=NCCN5,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+569-26-6,CCRIS,1,-1,,CC1CC2C(Cc3c[nH]c4cccc2c34)N(C)C1,"GLATT,H, PERTZ,H, KASPER,R AND EICH,E, CLAVINE ALKALOIDS ANDDERIVATIVES AS MUTAGENS DETECTED IN THE AMES TEST, ANTI-CANCER DRUGS3(6):609-614, 1992"
+2499-95-8,EPA1,0,-1,,CCCCCCOC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70055-49-1,EPA1,0,-1,"CB-10-277,DM-COOK",CN(C)N=Nc1ccc(cc1)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-07-7,VITIC,1,-1,,ClC(Cl)(Cl)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+10094-45-8,CCRIS,0,-1,,CCCCCCCCCCCCCCCCCCNC(=O)CCCCCCCCCCC\C=C\CCCCCCCC,"HACHIYA,N AND TAKIZAWA,Y, MUTAGENICITY OF PLASTIC ADDITIVES,HEN'IGENSEI SHIKEN 3(3):147-154, 1994"
+2880-49-1,CCRIS,0,-1,"DR0008902",CC1(C)OC1COc2c3OC(=O)C=Cc3cc4ccoc24,"UWAIFO,AO, THE MUTAGENICITIES OF SEVEN COUMARIN DERIVATIVES AND AFURAN DERIVATIVE (NIMBOLIDE) ISOLATED FROM THREE MEDICINAL PLANTS, J. TOXICOL.ENVIRON. HEALTH 13(4-6):521-530, 1984"
+551-88-2,CCRIS,0,-1,,CCC(CC)[N+](=O)[O-],"CONAWAY,CC, HUSSAIN,NS, WAY,BM AND FIALA,ES, EVALUATION OF SECONDARYNITROALKANES, THEIR NITRONATES, PRIMARY NITROALKANES, NITROCARBINOLS, AND OTHERALIPHATIC NITRO COMPOUNDS IN THE AMES SALMONELLA ASSAY, MUTAT. RES.261(3):197-207, 1991"
+106532-63-2,CCRIS,1,-1,,CCCC(=O)\N=C\1/SN(C(=O)CCC)c2ccc(cc12)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+104-85-8,VITIC,0,-1,,Cc1ccc(cc1)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120812-49-9,CCRIS,0,-1,,[O-][N+](=O)c1ccc2ccc3ccc(c4c5ccccc5c1c2c34)[N+](=O)[O-],"FU,PP, NI,YC, ZHANG,YM, HEFLICH,RH, WANG,YK AND LAI,JS, EFFECT OF THEORIENTATION OF NITRO SUBSTITUENT ON THE BACTERIAL MUTAGENICITY OFDINITROBENZO[E]PYRENES, MUTAT. RES. 225(3):121-125, 1989"
+148193-35-5,CCRIS,1,-1,,COc1nsc2cc(OCC3CO3)ccc12,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+21811-73-4,CCRIS,0,-1,,OC(=O)c1c(Cl)c(Cl)c(Cl)c2Oc3c(Br)c(O)c(Br)cc3C(=O)c12,"AOKI,H OGAWA,Y YUKAWA,C NAKAMURA,M AND NAKAZAWA,H, LACK OFMUTAGENICITY OF A RED FOOD COLOUR IMPURITY(1-CARBOXYL-5,7-DIBROMO-6-HYDROXY-2,3,4-TRICHLOROXANTHONE) IN PHLOXINE B, FOODADD. CONTAM. 19(4):350-356, 2003"
+13010-08-7,CCRIS,1,-1,,CCCCN(N=O)C(=N)N[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+543-67-9,EPA1,1,-1,,CCCON=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1085-98-9,EPA1,0,-1,"DICHLOFLU",CN(C)S(=O)(=O)N(SC(F)(Cl)Cl)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+151378-33-5,CCRIS,1,-1,,OC1C2OC2C3=C(C=CC4C3c5cccc6cccc4c56)C1O,"MARSHALL,MV, HE,ZM, WEYAND,EH, RICE,JE AND LAVOIE,EJ, MUTAGENICACTIVITY OF THE 4,5- AND 9,10-DIHYDRODIOLS OF BENZO[J]FLUORANTHENE AND THEIRSYN- AND ANTI-DIHYDRODIOL EPOXIDES IN SALMONELLA TYPHIMURIUM, ENVIRON. MOL.MUTAGEN. 22(1):34-45, 1993"
+117-08-8,VITIC,0,-1,,Clc1c(Cl)c(Cl)c2C(=O)OC(=O)c2c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7258-52-8,EPA1,1,-1,,C1Cc2ccc3ccc4ccccc4c3c2C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+151-18-8,EPA1,0,-1,"AMINOPRON",NCCC#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84761-86-4,CCRIS,0,-1,,Clc1cccc2oc3ccccc3c12,"MATSUMOTO,M, ANDO,M AND OHTA,Y, MUTAGENICITY OFMONOCHLORODIBENZOFURANS DETECTED IN THE ENVIRONMENT, TOXICOL. LETT. 40(1):21-28,1988"
+3353-08-0,EPA3,1,-1,,C[C@@H]1C=Cc2c1ccc3c2ccc4ccccc34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+109-66-0,VITIC,0,-1,"PENTANE",CCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+108-39-4,VITIC,0,-1,"CRESOL-M",Cc1cccc(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+119979-38-3,CCRIS,0,-1,,CCCC(=O)OCc1ccccc1[N+](=O)[O-],"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+100-39-0,VITIC,1,-1,,BrCc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120042-14-0,CCRIS,1,-1,,NC(CCN=N#N)C(=O)O,"MANGOLD,JB, MISCHKE,MR AND LAVELLE,JM, AZIDOALANINE MUTAGENICITY INSALMONELLA: EFFECT OF HOMOLOGATION AND ALPHA-METHYL SUBSTITUTION, MUTAT. RES.216(1):27-33, 1989"
+109143-19-3,CCRIS,1,-1,,COc1ccc2oc(cc2c1N(CCCl)CCCl)[N+](=O)[O-],"CASTELAIN,P, HENDRICKX,B, TROMELIN,A, DEMERSEMAN,P AND MOENS,W,MUTAGENIC ACTIVITY OF DICHLOROETHYLAMINO DERIVATIVES OF NITRONAPHTHOFURAN ANDSOME NITROBENZOFURANS IN THE SALMONELLA/MICROSOME ASSAY, MUTAT. RES.280(1):9-15, 1992"
+7779-65-9,EPA3,0,-1,,CC(C)CCOC(=O)\C=C/c1ccccc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+88-16-4,VITIC,0,-1,,FC(F)(F)c1ccccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1576-35-8,EPA1,1,-1,,Cc1ccc(cc1)S(=O)(=O)NN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+354-33-6,EPA1,0,-1,,FC(F)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88-19-7,EPA2,0,-1,,Cc1ccccc1S(=O)(=O)N,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+636-26-0,EPA3,0,-1,,Cc1cnc(S)nc1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+97-00-7,VITIC,1,-1,"DINITROCH",[O-][N+](=O)c1ccc(Cl)c(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+193-98-6,EPA1,1,-1,,c1cc2ccc3cncc4ccc(c1)c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+165606-93-9,CCRIS,1,-1,,ClC(=C1C(=O)NC(=O)C1(Cl)Cl)Cl,"HADDON,WF, BINDER,RG, WONG,RY, HARDEN,LA, WILSON,RE, BENSON,M ANDSTEVENS KL, POTENT BACTERIAL MUTAGENS PRODUCED BY CHLORINATION OF SIMULATEDPOULTRY CHILLER WATER, J. AGRIC. FOOD CHEM. 44(1):256-263, 1996"
+84-56-0,EPA1,1,-1,,c1ccc2cc3c(ccc4cccnc34)cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2303-17-5,EPA1,1,-1,"TRIALLATE",CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-68-1,VITIC,1,-1,,Cc1ccc(N)c(C)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M243,EPA1,1,-1,,CN(C[C@H](O)CO)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56341-08-3,CCRIS,0,-1,"MABUTEROL,MABUTEHCL",CC(C)(C)NCC(O)c1cc(Cl)c(N)c(c1)C(F)(F)F,"AMEMIYA,K, ASANO,T, ARIKA,T, NAKAMURA,M AND KUDOH,M, SPECIALTOXICOLOGY-PHYSICAL DEPENDENCE POTENTIAL, ANTIGENICITY AND MUTAGENICITY - OFMABUTEROL, ARZNEIM.-FORSCH. 34(11A):1685-1686, 1984"
+118-75-2,VITIC,1,-1,"CHLORANIL",ClC1=C(Cl)C(=O)C(=C(Cl)C1=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+15625-89-5,EPA1,1,-1,,CCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+114488-79-8,CCRIS,0,-1,,CC12CCCC(C)(C1CCC34CC(O)(CCC23)C5(CO5)C4)C(=O)O,"PEZZUTO,JM, COMPADRE,CM, SWANSON,SM, NANAYAKKARA,NPD AND KINGHORN,AD,METABOLICALLY ACTIVATED STEVIOL, THE AGLYCONE OF STEVIOSIDE, IS MUTAGENIC, PROC.NATL. ACAD. SCI. U. S. A. 82(8):2478-2482, 1985"
+NOCAS_M25,EPA1,1,-1,,O[C@H]1C=Cc2c(ccc3c4cccc5cccc(c23)c45)[C@@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125157-96-2,CCRIS,1,-1,,CC1C2C(=Nc3ccccc23)N(C)c4ccc(C)cc14,"RAHDEN-STARON,I, PECZYNSKA-CZOCH,W AND KACZMAREK,L, MUTAGENICITY OFCARBOLINE METHYL DERIVATIVES IN SALMONELLA, ACTA MICROBIOL. POL. 43(2):247-250,1994"
+1615-02-7,CCRIS,0,-1,,OC(=O)\C=C\c1ccc(Cl)cc1,"EDER,E, DEININGER,C AND MUTH,D, GENOTOXICITY OF P-NITROCINNAMALDEHYDEAND RELATED ALPHA,BETA-UNSATURATED CARBONYL COMPOUNDS IN TWO BACTERIAL ASSAYS,MUTAGENESIS 6(4):261-269, 1991"
+100-12-9,CCRIS,0,-1,,CCc1ccc(cc1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+628-94-4,VITIC,0,-1,,NC(=O)CCCCC(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+159092-66-7,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c1ccc3cccc(c23)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+84-74-2,VITIC,0,-1,"BUPHTHALA",CCCCOC(=O)c1ccccc1C(=O)OCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6052-68-2,CCRIS,0,-1,,OC(=O)C1Cc2c(CN1)[nH]c3ccccc23,"PAPAVERGOU,E, IOANNIDES,C AND CLIFFORD,MN, THE EVALUATION IN THE AMESTEST OF THE MUTAGENICITY OF TETRAHYDRO-BETA-CARBOLINE-3-CARBOXYLIC ACIDS FROMSMOKED FOODS, FOOD ADDIT. CONTAM. 9(2):183-187, 1992"
+60254-83-3,CCRIS,0,-1,,CC(C)CC(NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)CN)C(=O)O,"ALLEN,JS AND PANFILI,J, AMES SALMONELLA/MAMMALIAN-MICROSOME TESTING OFPEPTIDES AND PEPTIDE SYNTHESIS REAGENTS, MUTAT. RES. 170(1-2):23-29,1986"
+115453-72-0,CCRIS,1,-1,,NC(CS\C(=C(/Cl)\C(Cl)(Cl)Cl)\Cl)C(=O)O,"VAMVAKAS,S, BERTHOLD,K, DEKANT,W AND HENSCHLER,D, BACTERIAL CYSTEINECONJUGATE BETA-LYASE AND THE METABOLISM OF CYSTEINE S-CONJUGATES. STRUCTURALREQUIREMENTS FOR THE CLEAVAGE OF S-CONJUGATES AND THE FORMATION OF REACTIVEINTERMEDIATES, CHEM.-BIOL. INTERACT. 65(1):59-71, 1988"
+220168-55-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+536-90-3,VITIC,1,-1,,COc1cccc(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+90147-31-2,CCRIS,1,-1,,CCCNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+4081-23-6,CCRIS,1,-1,,O=P1(Oc2ccccc2)OCc3ccccc3O1,"MENTZSCHEL,A, SCHMUCK,G, DEKANT,W AND HENSCHLER,D, GENOTOXICITY OFNEUROTOXIC TRIARYL PHOSPHATES: IDENTIFICATION OF DNA ADDUCTS OF THE ULTIMATEMETABOLITES, SALIGENIN PHOSPHATES, CHEM. RES. TOXICOL. 6(3):294-301,1993"
+2150-54-1,EPA1,0,-1,,Cc1cc(ccc1N=Nc2c(O)c3c(O)cc(cc3cc2S(=O)(=O)O)S(=O)(=O)O)c4ccc(N=Nc5c(O)c6c(O)cc(cc6cc5S(=O)(=O)O)S(=O)(=O)O)c(C)c4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+138-89-6,VITIC,1,-1,,CN(C)c1ccc(cc1)N=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7239-21-6,EPA1,1,-1,,CN(C)N=Nc1ccc(Br)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+585-07-9,EPA1,0,-1,,CC(=C)C(=O)OC(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-41-4,VITIC,0,-1,,CCc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3868-31-3,CCRIS,0,-1,,Nc1nc(O)c2nc(O)n(C3OC(CO)C(O)C3O)c2n1,"ARASHIDANI,K, IWAMOTO-TANAKA,N, MURAOKA,M AND KASAI,H, GENOTOXICITY OFRIBO- AND DEOXYRIBONUCLEOSIDES OF 8-HYDROXYGUANINE, 5-HYDROXYCYTOSINE, AND2-HYDROXYADENINE: INDUCTION OF SCE IN HUMAN LYMPHOCYTES AND MUTAGENICITY INSALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 403(1-2):223-227, 1998"
+2693-46-1,EPA1,1,-1,,Nc1ccc2c3ccccc3c4cccc1c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M387,EPA1,0,-1,,CNCc1oc(CSCCN=C(NC[C@H](O)c2ccc(O)cc2)NS(=O)(=O)C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17420-30-3,CCRIS,1,-1,,Nc1ccc(cc1C#N)[N+](=O)[O-],"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION  CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING  CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF  THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL),1997"
+2687-25-4,EPA1,1,-1,,Cc1cccc(N)c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M514,EPA1,0,-1,,CCOC(=O)C[C@H](SP(=S)(OC)OC)C(=O)OCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+578-66-5,EPA1,1,-1,"AMINOQUI8",Nc1cccc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5102-83-0,VITIC,0,-1,,CC(=O)C(N=Nc1ccc(cc1Cl)c2ccc(N=NC(C(=O)C)C(=O)Nc3ccc(C)cc3C)c(Cl)c2)C(=O)Nc4ccc(C)cc4C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111-94-4,EPA1,0,-1,"IMINDIPRN",N#CCCNCCC#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78-84-2,EPA1,0,-1,,CC(C)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24072-75-1,VITIC,0,-1,,Nc1nc2cc(Cl)c(Cl)cc2s1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+637-69-4,EPA1,0,-1,,COc1ccc(C=C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+66734-13-2,CCRIS,0,1,,CCC(=O)OCC(=O)C1(OC(=O)CC)C(C)CC2C3C(Cl)CC4=CC(=O)C=CC4(C)C3C(O)CC12C,"WAKISAKA,Y AND NISHIMOTO,Y, MUTAGENICITY STUDY ON A NEW SYNTHETICCORTICOSTEROID, ALCLOMETASONE DIPROPIONATE, IN BACTERIA, IYAKUHIN KENKYU18(1):8-11, 1987"
+611-35-8,EPA1,1,-1,,Clc1ccnc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126983-60-6,EPA1,1,-1,,COC1=CC(=O)c2c([nH]cc3c4cnccc4nc23)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+199536-84-0,CCRIS,1,-1,,ClCC1=C(Br)C(=O)OC1,"LALONDE,RT, BU,L, HENWOOD,A, FIUMANO,J AND ZHANG,L, BROMINE-,CHLORINE-, AND MIXED HALOGEN-SUBSTITUTED 4-METHYL-2(5H)-FURANONES: SYNTHESIS ANDMUTAGENIC EFFECTS OF HALOGEN AND HYDROXYL GROUP REPLACEMENTS,CHEM. RES. TOXICOL.10(12):1427-1436, 1997"
+27833-64-3,EPA1,0,-1,"LOXAPINE,LOXAPIHCL,LOXAPISUC",CN1CCN(CC1)C2=Nc3ccccc3Oc4ccc(Cl)cc24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+518-34-3,EPA1,1,-1,,COc1cc2CCN(C)[C@H]3Cc4ccc(Oc5cc(C[C@@H]6N(C)CCc7cc(OC)c(OC)c(Oc(c1)c23)c67)ccc5OC)cc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23491-44-3,EPA1,0,-1,"HOE-258V,HOE-33258,PIBENZIMO",CN1CCN(CC1)c2ccc3[nH]c(nc3c2)c4ccc5[nH]c(nc5c4)c6ccc(O)cc6,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5908-27-0,EPA1,1,-1,,OS(=O)(=O)C1=CC(=O)C(=O)c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92569-06-7,CCRIS,0,-1,"BA-32641",Cc1ccc(cc1)S(=O)(=O)NC(=O)Nc2ncc(s2)[N+](=O)[O-],"HOF,H, MUTAGENIC ACTIVITIES OF NITROTHIAZOLE DERIVATIVES, ZENTRALBL.BAKTERIOL., MIKROBIOL. HYG., ABT. 1, ORIG. B 181(1-2):64-70, 1985"
+1758-73-2,VITIC,0,-1,,NC(=N)S(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+63017-87-8,CCRIS,1,-1,,Cc1c(ccc2ccccc12)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+139259-97-5,CCRIS,1,-1,,CC(=O)ON(OCc1ccc(Br)cc1)C(=O)c2ccccc2,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+6607-30-3,CCRIS,0,-1,,CP1(C)NP(C)(C)NP(C)(C)N1,"ALLCOCK,HR, PUCHER,SR, FITZPATRICK,RJ AND RASHID,K, ANTIBACTERIALACTIVITY AND MUTAGENICITY STUDIES OF WATER-SOLUBLE PHOSPHAZENE HIGH POLYMERS,BIOMATERIALS 13(12):857-862, 1992"
+67634-00-8,VITIC,0,-1,,CC(C)CCOCC(=O)OCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M498,EPA1,0,-1,,Cl[C@@H]1[C@H](Cl)[C@@H](Cl)[C@@H](Cl)[C@@H](Cl)[C@@H]1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+93780-95-1,CCRIS,1,-1,,OC1C2OC2c3c(ccc4cc5ccc6ccccc6c5nc34)C1O,"WOOD,AW, CHANG,RL, LEVIN,W, KUMAR,S, SHIRAI,N, JERINA,DM, LEHR,RE ANDCONNEY,AH,BACTERIAL AND MAMMALIAN CELL MUTAGENICITY OF FOUR OPTICALLY ACTIVEBAY-REGION 3,4-DIOL-1,2-EPOXIDES AND OTHER DERIVATIVES OF THE NITROGENHETEROCYCLE DIBENZ[C,H]ACRIDINE, CANCER RES. 46(6):2760-2766, 1986"
+50-28-2,EPA1,0,1,,C[C@]12CC[C@@H]3[C@@H](CCc4cc(O)ccc34)[C@H]1CC[C@@H]2O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139-40-2,EPA1,0,-1,,CC(C)Nc1nc(Cl)nc(NC(C)C)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60-51-5,VITIC,1,-1,"DIMETHOAT",CNC(=O)CSP(=S)(OC)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+54484-90-1,EPA3,1,-1,,CC[N+]([O-])(CC)CCNc1ccc(CO)c2Sc3ccccc3C(=O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+30835-61-1,EPA3,1,-1,,COc1cc2C(=O)CCc2c3c(C)cc4ccccc4c13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+938-73-8,VITIC,0,-1,"ETHENZAMI",CCOc1ccccc1C(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+61551-82-4,CCRIS,0,-1,,OS(=O)(=O)c1ccc2cc(Oc3ccc4cc(ccc4c3)S(=O)(=O)O)ccc2c1,"YAMADA,M, KATO,Y, NAKAMURA,M AND ITO,Y, MUTAGENICITY STUDY OF SUNSETYELLOW FCF AND IT'S IMPURITY, FOODS FOOD INGREDIENTS J. JPN. 164:93-99,1995"
+934-73-6,EPA1,0,-1,,CS(=O)c1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99400-75-6,EPA1,1,-1,"DR0008755",CCCCCCCC\C=C/CCCCCCCCN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56-18-8,VITIC,0,-1,"NORSPERMI",NCCCNCCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111-41-1,EPA1,1,-1,,NCCNCCO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M134,EPA1,1,-1,,COC(=O)[C@]12O[C@@]1(C)[C@@](O)(NC2=O)C(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64-67-5,EPA1,1,-1,"DIETSULFA",CCOS(=O)(=O)OCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3571-31-1,EPA1,1,-1,,COc1cc(O)c2C(=O)c3c(O)cc(C)cc3Cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M488,EPA1,0,1,,CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@]2(O)C#C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M133,EPA1,1,-1,,Cc1ccc(OC[C@H]2CO2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+159092-71-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c3ccccc3cc(c2c1)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+58-27-5,EPA1,1,-1,"MENADIONE,MENADIBSK",CC1=CC(=O)c2ccccc2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-67-7,VITIC,0,-1,,CCCCCCCCc1ccc(Nc2ccc(CCCCCCCC)cc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+89-59-8,CCRIS,0,-1,,Cc1ccc(Cl)cc1[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+59901-89-2,EPA3,1,-1,,O=C([C@@H]1CO1)c2ccc3OCOc3c2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1551-44-6,EPA1,0,-1,,CCCC(=O)OC1CCCCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71424-66-3,CCRIS,0,-1,"JATROPHOA",CC1Cc2c(O)c(C)c3C4C(CCC(=C)c3c2C1=O)C4(C)C,"ROJANAPO,W, PIMBUA,J, GLINSUKON,T, NAENGCHOMNONG,W ANDTHEBTARANONTH,Y, FAILURE OF DITERPENES FROM JATROPHA CURCAS TO INDUCE MUTATIONIN SALMONELLA TYPHIMURIUM TA98 AND TA100, RES. COMMUN. CHEM. PATHOL. PHARMACOL.58(3):397-400, 1987"
+63710-09-8,CCRIS,1,-1,,CCC1(O)CC(OC2CC(C(OC3CC(O)C(O)C(C)O3)C(C)O2)N(C)C)c4c(O)c5C(=O)c6c(O)ccc(O)c6C(=O)c5cc4C1C(=O)OC,"THOMAS,HF, MUTAGENIC AND CYTOTOXIC POTENCIES OF A SERIES OFANTHRACYCLINE DERIVATIVES AS MEASURED BY HIS+ REVERSION, 8-AZAGUANINE RESISTANCEAND DIRECT PLATING CYTOTOXICITY TESTS IN SALMONELLA TYPHIMURIUM, TERATOG.,CARCINOG., MUTAGEN. 6(3):219-235, 1986"
+124-19-6,VITIC,0,-1,,CCCCCCCCC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1982-67-8,CCRIS,0,-1,,CS(=N)(=O)CCC(N)C(=O)O,"WUERGLER,FE, FRIEDERICH,U AND SCHLATTER,J, LACK OF MUTAGENICITY OFOCHRATOXIN A AND B, CITRININ, PATULIN AND CNESTINE IN SALMONELLA TYPHIMURIUMTA102, MUTAT. RES. 261(3):209-216, 1991"
+98499-60-6,CCRIS,1,-1,,COc1ccccc1NCSC,"VITO,M, ESPOSITO,G, VICARI,L, LEMBO,S, IMPERATRICE,ML AND DEMARINIS,E,MUTAGENIC ACTIVITY OF CHLORODIMETHYL SULFIDE AND SOME OF ITS ANILINEDERIVATIVES, BOLL.- SOC. ITAL. BIOL. SPER. 61(6):917-923, 1985"
+587-04-2,EPA1,0,-1,,Clc1cccc(C=O)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115217-02-2,CCRIS,0,-1,"INDENES-A",CCC1=C(C(C)c2cc(O)ccc12)c3ccc(O)cc3,"ISHIKAWA,S, ODA,T, SATO,Y AND MOCHIZUKI,M, LACK OF MUTAGENICITY OFDIETHYLSTILBESTROL METABOLITE AND ANALOG, (+/-)-INDENESTROLS A AND B, INBACTERIAL ASSAYS, MUTAT. RES. 368(3-4):261-265, 1996"
+26530-20-1,VITIC,0,-1,"OCTHILINO",CCCCCCCCN1SC=CC1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+58-95-7,EPA2,0,-1,,CC(C)CCCC(C)CCCC(C)CCCC1(C)CCc2c(C)c(OC(=O)C)c(C)c(C)c2O1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+20702-77-6,EPA1,0,-1,"NEOHEDIHC",COc1ccc(CCC(=O)c2c(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc2O)cc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+253-52-1,EPA1,0,-1,"PHTHALAZN",c1ccc2cnncc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68041-18-9,EPA1,1,-1,,OS(=O)(=O)OCc1c2ccccc2c3ccc4cccc5ccc1c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1074-12-0,VITIC,1,-1,"PHEGLYOXA",O=CC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+66041-61-0,CCRIS,0,-1,,Oc1ccc(cc1[N+](=O)[O-])c2ccc(O)c(c2)[N+](=O)[O-],"SUZUKI,J, SATO,T AND SUZUKI,S, HYDROXYNITROBIPHENYLS PRODUCED BYPHOTOCHEMICAL REACTION OF BIPHENYL IN AQUEOUS NITRATE SOLUTION AND THEIRMUTAGENICITIES, CHEM. PHARM. BULL. 33(6):2507-2515, 1985"
+38612-16-7,CCRIS,0,-1,,[O-][N+](=O)c1cccc(COC(=O)c2ccccc2)c1,"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+109460-96-0,CCRIS,0,-1,,COC(=O)\C(=C\c1ccccc1Br)\C#N,"RIETVELD,EC, GARNAAT,MA AND SEUTTER-BERLAGE,F, BACTERIAL MUTAGENICITYOF SOME METHYL 2-CYANOACRYLATES AND METHYL 2-CYANO-3-PHENYLACRYLATES, MUTAT.RES. 188(2):97-104, 1987"
+5408-55-9,EPA1,1,-1,,[O-][N+](=O)c1ccc2c(oc3ccc(cc23)[N+](=O)[O-])c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35212-01-2,CCRIS,1,-1,,Cc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])N=[N+]([O-])c2cc(cc(c2C)[N+](=O)[O-])[N+](=O)[O-],"GEORGE,SE HUGGINS-CLARK,G AND BROOKS,LR, USE OF A SALMONELLAMICROSUSPENSION BIOASSAY TO DETECT THE MUTAGENICITY OF MUNITIONS COMPOUNDS ATLOW CONCENTRATIONS, MUTAT. RES. 490(1):45-56, 2001"
+504-78-9,EPA1,1,-1,,C1CSCN1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120314-14-9,EPA1,1,-1,,OCCc1cn(N=O)c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+62783-49-7,EPA1,1,-1,,CN(Cc1cccc(C)c1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126-30-7,CCRIS,0,-1,,CC(C)(CO)CO,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+2893-78-9,EPA1,0,-1,"TROCLOSNA,TROCLOSEN,TROCLOSEK",ClN1C(=O)NC(=O)N(Cl)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3695-86-1,CCRIS,0,-1,,COC(=O)\C(=C\c1occc1)\C#N,"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+14078-41-2,CCRIS,0,-1,,COc1cc(c(O)c(c1)C(C)(C)C)c2cc(OC)cc(c2O)C(C)(C)C,"MATSUOKA,A, MATSUI,M, MIYATA,N, SOFUNI,T, ISHIDATE,M, MUTAGENICITY OF3-TERT- BUTYL-4-HYDROXYANISOLE (BHA) AND ITS METABOLITES IN SHORT-TERM TESTS INVITRO, MUTAT. RES. 241(2):125-32, 1990"
+150-13-0,VITIC,0,-1,"PABA-K,PABA,PABA-CA,PABADIETH,PABA-MG,PABAPIPER,PABA-NA",Nc1ccc(cc1)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13684-63-4,VITIC,1,-1,,COC(=O)Nc1cccc(OC(=O)Nc2cccc(C)c2)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+140-10-3,CCRIS,0,-1,"CINNAMANA,CINNAMATE",OC(=O)\C=C\c1ccccc1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+619-24-9,EPA1,1,-1,,[O-][N+](=O)c1cccc(c1)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55898-15-2,CCRIS,0,-1,,COc1cc2CCN(C)c3cc4cc5OCOc5cc4c(c1OC)c23,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+51630-58-1,CCRIS,0,-1,"FENVALERA",CC(C)C(C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1)c3ccc(Cl)cc3,"HERRERA,A AND LABORDA,E, MUTAGENIC ACTIVITY IN SYNTHETIC PYRETHROIDSIN SALMONELLA TYPHIMURIUM, MUTAGENESIS 3(6):509-514, 1988"
+2216-15-1,VITIC,1,-1,,CCN(CC)c1ccc(cc1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+145142-71-8,CCRIS,1,-1,,CCCCON(OC(=O)C)C(=O)c1ccc(cc1)C(C)(C)C,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+13417-43-1,CCRIS,1,-1,,C\C=C(/C)\CCl,"WAALKES,MP, KOVATCH,R AND REHM,S, EFFECT OF CHRONIC DIETARY ZINCDEFICIENCY ON CADMIUM TOXICITY AND CARCINOGENESIS IN THE MALE WISTAR [HSD:(WI)BR] RAT TOXICOL. APPL. PHARMACOL. 108:448-456, 1991"
+53940-49-1,CCRIS,1,-1,,COc1cc(CC2CO2)ccc1O,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+64625-66-7,CCRIS,1,-1,,Cc1c2ccccc2cc3c4C5OC5C(O)C(O)c4ccc13,"GLATT,H, HARVEY,RG, PHILLIPS,DH, HEWER,A AND GROVER,PL, INFLUENCE OFTHE ALKYL SUBSTITUENT ON MUTAGENICITY AND COVALENT DNA BINDING OF BAY REGIONDIOL-EPOXIDES OF 7-METHYL- AND 7-ETHYLBENZ[A]ANTHRACENE IN SALMONELLA AND V79CHINESE HAMSTER CELLS, CANCER RES. 49(7):1778-1782, 1989"
+109-86-4,VITIC,0,-1,"ETGLYCOME",COCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+163275-58-9,CCRIS,1,-1,,Fc1cc2ccccc2c3ncccc13,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+56-49-5,VITIC,1,-1,"MECHOLANT",Cc1ccc2cc3c(ccc4ccccc34)c5CCc1c25,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+104953-00-6,CCRIS,1,-1,,CC1(CO1)c2ccc(cc2)C#N,"ROSMAN,LB, BEYLIN,VG, GADDAMIDI,V, HOOBERMAN,BH AND SINSHEIMER,JE,MUTAGENICITY OF PARA-SUBSTITUTED ALPHA-METHYLSTYRENE OXIDE DERIVATIVES WITHSALMONELLA, MUTAT. RES. 171(2-3):63-70, 1986"
+55302-96-0,EPA1,0,-1,,Cc1ccc(NCCO)cc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+496-14-0,EPA1,1,-1,,C1OCc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125369-82-6,CCRIS,1,-1,,Fc1ccc(cc1)\C(=C\C=C\c2ccccc2)\C#N,"MASLAT,AO AND AL-ARAB,M, MUTAGENIC ACTIVITY OF THREE PENTADIENENITRILEDERIVATIVES OF SUSPECTED HERBICIDAL ACTION,TOXICOL. ENVIRON. CHEM.30(1-2):95-99, 1991"
+133762-82-0,CCRIS,1,-1,,COC1=NC(=O)N(CC(O)CN=N#N)C=C1,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+19881-18-6,CCRIS,1,-1,"NITROSCAN",[O-][N+](=O)c1ccc(Oc2ccc(cc2)N=C=S)cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, GENOTOXICITY OF POTENTIAL METABOLITESOF NITROSCANATE- AN ANTISCHISTOSOMAL DRUG, MUTAT. RES. 335(3):235-243,1995"
+79-29-8,VITIC,0,-1,,CC(C)C(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+215-62-3,EPA1,1,-1,,c1ccc2nc3c4ccccc4c5ccccc5c3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70-00-8,EPA1,1,-1,"DR9803210,TRIFLURID",OC[C@H]1O[C@H](C[C@@H]1O)N2C=C(C(=O)NC2=O)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-61-8,VITIC,0,-1,,CNc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+473-90-5,EPA1,0,-1,"MESOXALCA,MESOXALAT",OC(=O)C(=O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+202-98-2,EPA1,1,-1,,C1c2cccc3ccc4c5ccccc5cc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128753-90-2,CCRIS,1,-1,,CC(=O)Oc1ccc2c(OC3(C)OOC23C)c1,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+1777-84-0,EPA2,1,-1,,CCOc1ccc(NC(=O)C)cc1[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+16219-75-3,EPA1,0,-1,,C\C=C\1/C[C@H]2C[C@@H]1C=C2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132742-01-9,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3c4CCC=Cc4cc5ccc1c2c35,"FU,PP, JUNG,H, VON TUNGELN,LS AND HEFLICH,RH, MUTAGENICITY OFMONONITRODIHYDROBENZO[A]PYRENES, MUTAT. RES. 245(4):277-285, 1990"
+136112-71-5,CCRIS,1,-1,,Nc1ncnc2c1nc(c3ccc(cc3)[N+](=O)[O-])n2c4ccc(cc4)[N+](=O)[O-],"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+100-64-1,EPA1,1,-1,,ON=C1CCCCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+113124-70-2,CCRIS,1,-1,,COC1=CC(=O)c2c([nH]cc3c4ccccc4nc23)C1=O,"CALLAIS,F, HELISSEY,P, MIN,S, FESTY,B AND GIORGI-RENAULT,S,STRUCTURE-MUTAGENICITY RELATIONSHIPS IN SERIES OF11H-INDOLO[3,2-C]QUINOLINE-1,4-DIONES,TETRAHYDRO-11H-INDOLO[3,2-C]QUINOLINE-1,4-DIONES AND 11H-PYRIDO[3',4':4,5]PYRROLO[3,2-C]QUINOLINE-1,4-DIONES WITH LEUKEMIA CYTOTOXIC PROPERTIES.RELATIONS WITH TOPOISOMERASE I INHIBITING PROPERTIES, MUTAT. RES.311(1):149-156, 1994"
+539-21-9,EPA1,1,-1,"AMBAZONE,ERGAMBUR",NC(=N)NNc1ccc(cc1)N=NC(=S)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3697-30-1,EPA1,1,-1,,CCc1c2ccccc2cc3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78411-56-0,EPA1,1,-1,,Cc1cnc2c(ccc3c2nc(N)n3C)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14925-39-4,EPA1,1,-1,,BrC(=C)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3741-15-9,CCRIS,1,-1,,[O-][N+](=O)c1ccnc2ccccc12,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+166664-83-1,EPA1,0,-1,,Cn1c(N)nc2nc3ncccc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57-27-2,CCRIS,0,-1,,CN1CCC23C4Oc5c(O)ccc(CC1C2C=CC4O)c35,"FRIESEN,M, O'NEILL,IK, MALAVEILLE,C, GARREN,L, HAUTEFEUILLE,A,CABRAL,JRP, GALENDO,D, LASNE,C, SALA,M, CHOUROULINKOV,I, MOHR,U, TURUSOV,V,DAY,NE AND BARTSCH,H, CHARACTERIZATION AND IDENTIFICATION OF 6 MUTAGENS IN OPIUMPYROLYSATES IMPLICATED IN OESOPHAGEAL CANCER IN IRAN, MUTAT. RES. 150(1-2):177-191, 1985"
+78448-08-5,EPA1,1,-1,,Oc1ccc2ccc3[nH]c4ccc5ccccc5c4c3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-30-1,CCRIS,0,-1,"DECANOL",CCCCCCCCCCO,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION  CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING  CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF  THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL),1997"
+36712-35-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc(c2ccccc2[N+](=O)[O-])c(c1)[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K"
+1711-06-4,EPA1,1,-1,,Cc1cccc(c1)C(=O)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90301-59-0,CCRIS,1,-1,,OCC1OC(CC1O)N2C=C(CCCl)C(=O)NC2=O,"SUTER,W PLAPPERT-HELBIG,U GLOWIENKE,S POETTER-LOCHER,F STAEDTLER,FRACINE,R MARTUS,H-J, INDUCTION OF GENE MUTATIONS BY5-(2-CHLORO-ETHYL)-2'-DEOXYURIDINE (CEDU), AN ANTIVIRAL PYRIMIDINE NUCLEOSIDEANALOGUE, MUTAT. RES. 568(2):195-209, 2004"
+89795-79-9,EPA1,1,-1,,Nc1cccc2cnsc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+226237-61-2,CCRIS,0,-1,,COc1c2ccoc2[n+]([O-])c3ccccc13,"KLIER,B AND SCHIMMER,O, MICROSOMAL METABOLISM OF DICTAMNINE:IDENTIFICATION OF METABOLITES AND EVALUATION OF THEIR MUTAGENICITY IN SALMONELLATYPHIMURIUM: MUTAGENESIS 14(2):181-185, 1999"
+NOCAS_M104,EPA1,1,-1,,COc1cc2O[C@@H]3OC=C[C@H]3c2c4Oc5cccc(O)c5C(=O)c14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-64-2,VITIC,0,-1,"DIMDIODAB",CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+49792-23-6,CCRIS,0,-1,,CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(C5CCC34C)C(=O)O)C2C1)C(=O)O,"CZECZOT,H, RAHDEN-STARON,I, OLESZEK,W AND JURZYSTA,M, ISOLATION ANDSTUDY OF THE MUTAGENIC ACTIVITY OF SAPONINS IN THE AMES TEST, ACTA POL. PHARM.51(2): 133-136, 1994"
+17722-52-0,EPA1,0,-1,,OC(=O)CCC(=O)Nc1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+73931-96-1,CCRIS,0,-1,"DENZIMOL",OC(Cn1ccnc1)c2ccc(CCc3ccccc3)cc2,"VERONESE,M, BARZAGHI,D, BERTONCINI,A AND ZADRO,M, MUTAGENICITY STUDIESON DENZIMOL A NEW ANTICONVULSANT DRUG, ARZNEIM.-FORSCH. 35(5):793-796,1985"
+126-73-8,VITIC,0,-1,"TRIBUPHOS",CCCCOP(=O)(OCCCC)OCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+56656-97-4,CCRIS,0,-1,,COC(=O)\C(=C\c1oc(Br)cc1)\C#N,"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+137-08-6,CCRIS,0,-1,"CARBACHPA,CHOLINEPA,DEANOLPTE",CC(C)(CO)C(O)C(=O)NCCC(=O)O,"FUJITA,H AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVES WITHSALMONELLA TYPHIMURIUM TA97 AND TA102. II., KENKYU NENPO - TOKYO-TORITSU EISEIKENKYUSHO 38:423-430, 1987"
+1086-00-6,EPA1,1,-1,,ClCc1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97576-08-4,EPA1,1,-1,,O[C@@H]1C=Cc2c(cc3ccc4c(ccc5ccc2c3c45)[N+](=O)[O-])[C@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91-19-0,EPA1,1,-1,"FG-9067",c1ccc2nccnc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39653-72-0,EPA1,1,-1,,N#CC1=Cc2cccc3cccc1c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+548-08-3,CCRIS,1,-1,,CN1CCc2cc3OCOc3c4c5ccccc5CC1c24,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+18172-67-3,CCRIS,0,-1,,CC1(C)C2CCC(=C)C1C2,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+57-67-0,EPA3,0,-1,"SULGUANID",NC(=N)NS(=O)(=O)c1ccc(N)cc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+6257-64-3,EPA1,0,-1,,CN(C)c1ccc(cc1)N=Nc2ccc(cc2)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1250-95-9,CCRIS,1,1,,CC(C)CCCC(C)C1CCC2C3CC4OC45CC(O)CCC5(C)C3CCC12C,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+136861-00-2,CCRIS,1,-1,,Nc1cc(c(c2ccccc2)c(c1)[N+](=O)[O-])[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K, YAMANAKA,Y, ISHIHARA,M, SHINYA,M, TAKAHASHI,KAND WATANABE,T, STUDIES ON THE STRUCTURE ELUCIDATION OF MUTAGENIC METABOLITES OF2,4-DINITROBIPHENYL DERIVATIVES AGAINST SALMONELLA TYPHIMURIUM TA98, EISEIKAGAKU 37(3):229-238, 1991"
+540-51-2,VITIC,1,-1,,OCCBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2846-29-9,CCRIS,1,1,,CC(C)CCCC(C)C1CCC2C3C(OO)C=C4CC(O)CCC4(C)C3CCC12C,"SMITH,LL, SMART,VB AND GOWDA,NMM, MUTAGENIC STEROL HYDROPEROXIDES,MUTAT. RES. 161(1):39-48, 1986"
+NOCAS_M36,EPA1,1,-1,,C[C@@H](O)CN(C)c1ccc(NN)nn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92-69-3,EPA1,1,-1,"PHPHENOL4",Oc1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14901-07-6,EPA3,0,-1,,CC(=O)\C=C/C1=C(C)CCCC1(C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+67508-87-6,EPA1,1,-1,,COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@@H]([C@@H](O)[C@H](C)O5)N(C)C)c4c(O)c3C(=O)c12)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97-52-9,CCRIS,1,-1,,COc1cc(ccc1N)[N+](=O)[O-],"KOOVI,DG, MAMANE,R, CALLAIS,F, FESTY,B AND LICH,NP, STUDY ON THEGENOTOXICITY OF 2-AMINO-5-NITROANISOLE (ANA) AND ITS METABOLITES, ANN. FALSIF.EXPERT. CHIM. TOXICOL. 80(854):25-39, 1987"
+NOCAS_M411,EPA1,0,-1,,C\C=C/1\C[C@H](C)[C@](O)(CO)C(=O)OCC2=CC[N@@+]3([O-])CC[C@@H](OC1=O)[C@@H]23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84305-41-9,CCRIS,0,-1,,COC1(NC(=O)CSCC(N)C(=O)O)C2SCC(=C(N2C1=O)C(=O)O)CSc3nnnn3C,"HIRANO,F, SHINDO,Y, MIFUNE,Y, MAEDA,H AND MURATA,S, MUTAGENICITYEVALUATION OF MT-141, A NEW CEPHAMYCIN, JPN. J. ANTIBIOT. 37(5):918-926,1984"
+131206-89-8,CCRIS,0,-1,,CN(C)CCCN1C=CN(C)C1\C=N\O,"ORNER,G, NIEDING,WJ AND KORTE,DW, MUTAGENIC POTENTIAL OF 1-[3-(N,N-DIMETHYLAMINO)PROPYL]-2-HYDROXYIMINOMETHYL-3-METHYLIMIDAZOLIUM DICHLORIDEQUADRAHYDRATE IN THE AMES SALMONELLA/MAMMALIAN MICROSOME MUTAGENICITY TEST, U.S.ARMY MEDICAL RESEARCH AND DEVELOPMENT COMMAND, NTIS AD-A214318, 1989"
+129812-29-9,CCRIS,0,-1,,CC12OOC1(C)c3c(O2)ccc4ccccc34,"ADAM,W, HAUER,H, MOSANDL,T, SAHA-MOELLER,CR, WAGNER,W AND WILD,D,FUROCOUMARIN-, NAPHTHOFURAN-, AND FUROQUINOLINE-ANNULATED 1,2-DIOXETANES:SYNTHESIS, THERMOLYSIS, AND MUTAGENICITY, LIEBIGS ANN. CHEM. (12):1227-1236,1990"
+131862-19-6,CCRIS,0,-1,,CN(C)CCNC(=O)c1cccc2nc(oc12)c3ccccc3,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+627-30-5,VITIC,1,-1,,OCCCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+40180-04-9,EPA1,0,-1,"TIENILATE",OC(=O)COc1ccc(C(=O)c2cccs2)c(Cl)c1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26446-35-5,VITIC,1,-1,"MONACETIN",CC(=O)OC[C@H](O)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+625-45-6,EPA1,0,-1,"MEOACETA2",COCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131-91-9,EPA1,0,-1,,Oc1ccc2ccccc2c1N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+143922-97-8,CCRIS,1,-1,,Cc1c(N)cccc1N=Nc2cccc(N)c2C,"SAYAMA,M, INOUE,M, MORI,MA, MARUYAMA,Y AND KOZUKA,H, BACTERIALMETABOLISM OF 2,6-DINITROTOLUENE WITH SALMONELLA TYPHIMURIUM AND MUTAGENICITY OFTHE METABOLITES OF 2,6-DINITROTOLUENE AND RELATED COMPOUNDS, XENOBIOTICA 22(6):633-640, 1992"
+51-28-5,EPA2,0,-1,"DINITROPH",Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+5216-25-1,CCRIS,1,-1,,Clc1ccc(cc1)C(Cl)(Cl)Cl,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+32116-25-9,EPA3,1,-1,,CC(=O)c1ccc([nH]1)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+133762-78-4,CCRIS,1,-1,,Nc1ncnc2c1cnn2CC(O)CN=N#N,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+98-96-4,VITIC,0,-1,"PYRAZINAM",NC(=O)c1cnccn1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+67737-62-6,CCRIS,1,-1,,OC1C2OC2c3c(ccc4ccccc34)C1O,"GLATT,H, PIEE,A, PAULY,K, STEINBRECHER,T, SCHRODE,R, OESCH,F ANDSEIDEL,A, FJORD- AND BAY-REGION DIOL-EPOXIDES INVESTIGATED FOR STABILITY, SOSINDUCTION IN ESCHERICHIA COLI, AND MUTAGENICITY IN SALMONELLA TYPHIMURIUM ANDMAMMALIAN CELLS,CANCER RES. 51(6):1659-1667, 1991"
+17831-71-9,VITIC,0,-1,,C=CC(=O)OCCOCCOCCOCCOC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+27746-63-0,CCRIS,0,-1,,Clc1cc(cc(Cl)c1Cl)N2C(=O)CCC2=O,"RASHID,KA, ARJMAND,M, SANDERMANN,H AND MUMMA,RO, MUTAGENICITY OFCHLOROANILINE/LIGNIN METABOLITES IN THE SALMONELLA/MICROSOME ASSAY, J. ENVIRON.SCI. HEALTH, PART B B22(6):721-729, 1987"
+106264-79-3,EPA1,1,-1,,CSc1cc(SC)c(N)c(C)c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+644-21-3,EPA1,1,-1,,CCN(N)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-36-7,VITIC,0,-1,,CCOCCOCCOCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99675-03-3,CCRIS,0,-1,,COP(=S)(NC(C)C)Oc1ccccc1C(=O)OC(C)C,"WU,H, LAI,Z, XU,H, SONG,R, MA,T, SHI,N, LIU,R AND LIU,Y, TOXICOLOGICALSTUDIES ON THE ORGANOPHOSPHOROUS INSECTICIDE METHYL-ISP, J. TONGJI MED. UNIV.9(1):58-64, 1989"
+110-05-4,VITIC,0,-1,,CC(C)(C)OOC(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+77-46-3,EPA1,0,-1,"ACEDAPSON",CC(=O)Nc1ccc(cc1)S(=O)(=O)c2ccc(NC(=O)C)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117760-93-7,EPA1,1,-1,,Nc1cc2c3C=C[C@@H](O)[C@H](O)c3ccc2c4ccccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+332397-22-5,CCRIS,0,-1,,N\C(=N/OS(=O)(=O)O)\c1ccccc1,"CLEMENT,B CHRISTIANSEN,K AND GIRRESER,U, PHASE 2 METABOLITES OFN-HYDROXYLATED AMIDINES (AMIDOXIMES): SYNTHESIS, IN VITRO FORMATION BY PIGHEPATOCYTES, AND MUTAGENICITY TESTING, CHEM. RES. TOXICOL. 14(3):319-326,2000"
+29852-26-4,EPA1,1,-1,,ClCc1cc2cccc3ccc4c5ccccc5cc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+138-59-0,EPA3,0,-1,,O[C@H]1CC(=C[C@@H](O)[C@@H]1O)C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+96563-09-6,CCRIS,0,-1,,CC1c2cc(C)ccc2c3ccc(C)cc13,"LAVOIE,EJ, COLEMAN,DT, GEDDIE,NG AND RICE,JE, STUDIES ON THEMUTAGENICITY AND TUMOR-INITIATING ACTIVITY OF METHYLATED FLUORENES, CHEM.-BIOL.INTERACT. 52(3):301-309, 1985"
+105708-68-7,CCRIS,1,-1,,CC(=O)OC1Cc2ccc3ccc4cccc5cc1c2c3c45,"ROGAN,EG, CAVALIERI,EL, WALKER,BA, BALASUBRAMANIAN,R, WISLOCKI,PG,ROTH,RW AND SAUGIER,RK, MUTAGENICITY OF BENZYLIC ACETATES, SULFATES AND BROMIDESOF POLYCYCLIC AROMATIC HYDROCARBONS, CHEM.-BIOL. INTERACT. 58(3):253-275,1986"
+2832-40-8,VITIC,1,-1,,CC(=O)Nc1ccc(cc1)N=Nc2cc(C)ccc2O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4543-63-9,EPA1,1,-1,,CNC(=O)NOC(=O)NC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1120-71-4,EPA1,1,-1,,O=S1(=O)CCCO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+147293-14-9,EPA1,1,-1,,Cn1c(N)nc2c3cnccc3ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132059-51-9,CCRIS,1,-1,,OC1OC(=O)C(=C1C(Cl)Br)Cl,"RAMOS,I LLOVERAS,M SOLANS,X HUICI,A AND MESSEGUER,A, BROMINATEDANALOGS OF 3-CHLORO-4-(DICHLORO-METHYL)-5-HYDROXY-2(5H)-FURANONE: PREPARATIONSOF 3-CHLORO-4-(BROMOCHLOROMETHYL)-5-HYDROXY-2(5H)-FURANONE AND MUTAGENICITYSTUDIES, ENVIRON. TOXICOL. CHEM. 19(11):2631-2636, 2000"
+126420-94-8,CCRIS,1,-1,,Cc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,"ROLL,M, SHTELZER,S, STARK,AA AND BLUM,J, STRUCTURE-ACTIVITYRELATIONSHIPS IN MUTAGENICITY AND IN NUCLEOPHILIC RING OPENING OFN-(ARYLMETHYL)PHENANTHRENE 9,10-IMINES, MUTAGENESIS 5(1):25-30, 1990"
+1135-14-4,EPA1,1,-1,,Nc1ccc(Sc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2508-23-8,EPA1,1,-1,,CC(=O)N(O)c1ccc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14308-65-7,CCRIS,1,-1,,CNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+128714-76-1,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3c4ccccc4c(c5ccc1c2c35)[N+](=O)[O-],"FUKUHARA,K, HAKURA,A, SERA,N, TOKIWA,H AND MIYATA,N, 1- AND 3-NITRO-6-AZABENZO[A]PYRENES AND THEIR N-OXIDES: HIGHLY MUTAGENIC NITRATED AZAARENES,CHEM. RES. TOXICOL. 5(2):149-153, 1992"
+5410-97-9,EPA1,1,-1,,[O-][N+](=O)c1ccc2c(oc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+628-02-4,VITIC,0,-1,"POLICAPRA",CCCCCC(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+161696-98-6,EPA1,1,-1,,CNc1ccc2nccnc2c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2403-28-3,CCRIS,0,-1,,O=C(\C=C\c1ccc(cc1)c2ccccc2)c3ccccc3,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+56961-79-6,CCRIS,0,-1,,Cc1c(Cl)cnc2ccccc12,"SAEKI,K, TAKAHASHI,K AND KAWAZOE,Y, POTENT MUTAGENIC POTENTIAL OF4-METHYLQUINOLINE: METABOLIC AND MECHANISTIC CONSIDERATIONS, BIOL. PHARM. BULL.19(4):541-546, 1996"
+42011-48-3,EPA3,1,-1,,[O-][N+](=O)c1oc(cc1)c2csc(NC(=O)C(F)(F)F)n2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+55-98-1,VITIC,1,-1,"BUSULFAN",CS(=O)(=O)OCCCCOS(=O)(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+39965-42-9,CCRIS,1,-1,,CC(C)(C)NC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+NOCAS_M229,EPA1,1,-1,,CCOC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+36504-65-1,EPA3,1,-1,,O1[C@@H]2C=Cc3c(cc4ccc5cccc6ccc3c4c56)[C@H]12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+80-07-9,VITIC,0,-1,,Clc1ccc(cc1)S(=O)(=O)c2ccc(Cl)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+512-56-1,VITIC,1,-1,"TRIMEPHOS",COP(=O)(OC)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3308-64-3,GENETOX,0,-1,,Cc1ccc2cc3c(ccc4ccccc34)c5CC(O)c1c25,"MUTAT RES 168:69-240,1986"
+99523-58-7,CCRIS,1,-1,,Cc1ccc2nsc(NC(=O)C(Cl)Cl)c2c1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+626-16-4,EPA1,0,-1,,ClCc1cccc(CCl)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67019-29-8,CCRIS,0,-1,,O=C(Nc1ccccc1)Nc2snc3ccccc23,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+25973-55-1,CCRIS,0,-1,,CCC(C)(C)c1cc(c(O)c(c1)C(C)(C)CC)n2nc3ccccc3n2,"HACHIYA,N AND TAKIZAWA,Y, MUTAGENICITY OF PLASTIC ADDITIVES,HEN'IGENSEI SHIKEN 3(3):147-154, 1994"
+17455-26-4,CCRIS,0,-1,,C1CCC2OCCOCCOCCOCCOC3CCCCC3OCCOCCOCCOCCOC2C1,"ARENAZ,P, BITTICKS,L, PANNELL,K AND GARCIA,S, GENOTOXIC POTENTIAL OFCROWN ETHERS IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 4(6), 437-8, 1989"
+19785-01-4,CCRIS,0,-1,,COc1ccc(OC)c(\C=C\C)c1,"RAMOS-OCAMPO,VE AND HSIA,MTS, MUTAGENICITY AND DNA-DAMAGING ACTIVITYOF CALAMUS OIL, ASARONE ISOMERS, AND DIMETHOXYPROPENYLBENZENE ANALOGUES,PHILLIP. ENTOMOL. 7(3):275-291, 1988"
+599-79-1,VITIC,0,-1,"SAZOSUFAP",OC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)S(=O)(=O)Nc3ccccn3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+253-53-2,EPA1,0,-1,,c1cc2cnncc2cn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25377-72-4,VITIC,0,-1,,CC\C=C\C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13345-23-8,EPA1,1,-1,,Oc1ccc2ccc3cc4ccccc4c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6606-59-3,EPA1,0,-1,,CC(=C)C(=O)OCCCCCCOC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+93-08-3,EPA1,0,-1,,CC(=O)c1ccc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+532-27-4,VITIC,0,-1,,ClCC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105735-71-5,EPA1,1,-1,,[O-][N+](=O)c1cccc2c3ccc(c4cccc(c12)c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115340-67-5,CCRIS,1,-1,,OC(=O)\C(=C(/C=O)\C(Cl)Cl)\Cl,"TIKKANEN,L AND KRONBERG,L, GENOTOXIC EFFECTS OF VARIOUS CHLORINATEDBUTENOIC ACIDS IDENTIFIED IN CHLORINATED DRINKING WATER, MUTAT. RES.240(2):109-16, 1990"
+521-31-3,EPA3,0,-1,,Nc1cccc2c(O)nnc(O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+99523-60-1,CCRIS,0,-1,,CCC(=O)Nc1snc2ccc(C)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+39638-73-8,CCRIS,0,-1,,NC1=NC(=O)N(C=C1O)C2OC(CO)C(O)C2O,"ARASHIDANI,K, IWAMOTO-TANAKA,N, MURAOKA,M AND KASAI,H, GENOTOXICITY OFRIBO- AND DEOXYRIBONUCLEOSIDES OF 8-HYDROXYGUANINE, 5-HYDROXYCYTOSINE, AND2-HYDROXYADENINE: INDUCTION OF SCE IN HUMAN LYMPHOCYTES AND MUTAGENICITY INSALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 403(1-2):223-227, 1998"
+81-11-8,EPA3,0,-1,,Nc1ccc(\C=C/c2ccc(N)cc2S(=O)(=O)O)c(c1)S(=O)(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+569-57-3,VITIC,0,-1,"CHLOROTRI",COc1ccc(cc1)C(=C(c2ccc(OC)cc2)c3ccc(OC)cc3)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+38777-13-8,EPA2,1,-1,,CC(C)Oc1ccccc1OC(=O)N(C)N=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+115664-55-6,CCRIS,1,-1,,Oc1ccc2c(ccc3c4ccccc4c1c23)[N+](=O)[O-],"CONSOLO,MC, ANDERS,M AND HOWARD,PC, MUTAGENICITY OF THE PHENOLICMICROSOMAL METABOLITES OF 3-NITROFLUORANTHENE AND 1-NITROPYRENE IN STRAINS OFSALMONELLA TYPHIMURIUM, MUTAT. RES. 210(2):263-269, 1989"
+NOCAS_M493,EPA1,0,-1,,CC(C)[C@@H]1CC=C(C)[C@H]2CC=C(C)C[C@H]12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+614-00-6,EPA1,1,-1,,CN(N=O)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131862-20-9,CCRIS,0,-1,,CN(C)CCNC(=O)c1cccc2oc(nc12)c3ccccc3,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+NOCAS_M103,EPA1,1,-1,,CCCC[C@@H](CC)COC(=O)c1ccc(N(C)C)c(c1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35367-38-5,EPA3,0,-1,"DIFLUBENZ",Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+38134-58-6,CCRIS,1,-1,,NC(CCC(=O)NC(CSC(=O)NCCCl)C(=O)NCC(=O)O)C(=O)O,"STAHL,W, DENKEL,E AND EISENBRAND,G, INFLUENCE OF GLUTATHIONE ON THEMUTAGENICITY OF 2-CHLOROETHYLNITROSOUREAS. MUTAGENIC POTENTIAL OF GLUTATHIONEDERIVATIVES FORMED FROM 2-CHLOROETHYLNITROSOUREAS AND GLUTATHIONE, MUTAT. RES.206(4): 459-465, 1988"
+96918-15-9,EPA1,1,-1,,o1ccc2cc3ccc4cccc5ccc(c12)c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3365-85-3,EPA1,1,-1,,Nc1ccc(cc1)c2ccc(cc2)c3ccc(N)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+480-19-3,EPA1,0,-1,"ISORHAMNE",COc1cc(ccc1O)C2=C(O)C(=O)c3c(O)cc(O)cc3O2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-46-0,CCRIS,0,-1,"SIMETHICO",C[Si](C)(C)O[Si](C)(C)C,"ISQUITH,A, MATHESON,D AND SLESINSKI,R, GENOTOXICITY STUDIES ONSELECTED ORGANOSILICON COMPOUNDS. IN VITRO ASSAYS, FOOD CHEM. TOXICOL.26(3):255-261, 1988"
+124-26-5,CCRIS,0,-1,,CCCCCCCCCCCCCCCCCC(=O)N,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+115781-42-5,CCRIS,0,-1,,Cc1cnc2ccc3c(nc(NC4OC(C(O)C(O)C4O)C(=O)O)n3C)c2n1,"TURESKY,RJ, AESCHBACHER,HU, WUERZNER,HP, SKIPPER,PL ANDTANNENEBAUM,SR, MAJOR ROUTES OF METABOLISM OF THE FOOD-BORNE CARCINOGEN2-AMINO-3,8-DIMETHYLIMIDAZO [4,5-F]QUINOXALINE IN THE RAT CARCINOGENESIS9(6):1043-1048, 1988"
+1719-53-5,VITIC,0,-1,,CC[Si](Cl)(Cl)CC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1024-41-5,CCRIS,0,-1,,Cc1ccc(cc1)S(=O)(=O)OCc2ccccc2,"BALL,JC, FOXALL-VANAKEN,S AND JENSEN,TE, MUTAGENICITY STUDIES OFP-SUBSTITUTED BENZYL DERIVATIVES IN THE AMES SALMONELLA PLATE-INCORPORATIONASSAY, MUTAT. RES. 138(2-3):145-151, 1984"
+497-56-3,CCRIS,0,-1,,Cc1c(O)cc(cc1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+5003-48-5,EPA1,0,-1,"BENORILAT",CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(=O)C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1165-39-5,CCRIS,1,-1,"AFLATOXG1",COc1cc2OC3OC=CC3c2c4OC(=O)C5=C(CCOC5=O)c14,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+118517-21-8,CCRIS,0,1,,CC(C)CCCC(C)C1CCC2C3CC4N(N5C(=O)c6ccccc6C5=O)C47CC(Cl)CCC7(C)C3CCC12C,"ISLAM,S AND AHMAD,M, MUTAGENIC ACTIVITY OF AZIRIDINYL STEROIDS ANDTHEIR MECHANISM OF ACTION IN BIOLOGICAL SYSTEMS, MUTAGENESIS 6(4):271-278,1991"
+111017-06-2,CCRIS,1,-1,,COc1cc2CCN(C=O)c3cc4ccccc4c(c1OC)c23,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+286-99-7,CCRIS,0,-1,,C1CCCCCC2OC2CCCC1,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+50438-75-0,EPA1,1,-1,,CN(C)c1ccc(CCO)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101489-26-3,CCRIS,0,-1,,Oc1cccc2Oc3cc4OC5OCCC5c4c(O)c3C(=O)c12,"MORI,H, SUGIE,S, YOSHIMI,N, KITAMURA,J, NIWA,M, HAMASAKI,T ANDKAWAI,K, GENOTOXIC EFFECTS OF A VARIETY OF STERIGMATOCYSTIN-RELATED COMPOUNDS INTHE HEPATOCYTE/DNA-REPAIR TEST AND THE SALMONELLA MICROSOME ASSAY, MUTAT. RES.173(3):217-222, 1986"
+155798-37-1,EPA1,1,-1,,CCN(CCCl)c1ccc(OCCCCCNc2c3ccccc3nc4ccccc24)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17526-33-9,EPA1,1,-1,,CC(=O)OCc1c2ccccc2cc3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59-00-7,EPA1,0,-1,"XANTHUREN",OC(=O)c1cc(O)c2cccc(O)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+872-50-4,VITIC,0,-1,"MEPYRRONE",CN1CCCC1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+573-56-8,CCRIS,0,-1,"DR0001212",Oc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+75-86-5,VITIC,0,-1,,CC(C)(O)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M481,EPA1,0,-1,,CC(C)C[C@@H](C)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51-45-6,CCRIS,0,-1,"HISTAMINE,HISTADHCL,HISTAMDPH",NCCc1c[nH]cn1,"FORSTER,R, BLOWERS,SD, CINELLI,S, MARQUARDT,H AND WESTENDORF,J,MUTAGENICITY TESTING OF IMIDAZOLE AND RELATED COMPOUNDS,MUTAT. RES.298(2):71-79, 1992"
+1596-84-5,VITIC,0,-1,"AMINOZIDE",CN(C)NC(=O)CCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+575-44-0,EPA1,1,-1,,Oc1ccc2c(O)cccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+314-13-6,EPA1,1,-1,"EVANSBLUE,NSC-65849",Cc1cc(ccc1N=Nc2ccc3c(cc(c(N)c3c2O)S(=O)(=O)O)S(=O)(=O)O)c4ccc(N=Nc5ccc6c(cc(c(N)c6c5O)S(=O)(=O)O)S(=O)(=O)O)c(C)c4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+151751-83-6,CCRIS,1,-1,,CCOC(=O)N(CCC=O)N=O,"CHUNG,FL, KRZEMINSKI,J, WANG,M, CHEN,HJC AND PROKOPCZYK,B, FORMATIONOF THE ACROLEIN-DERIVED 1,N2-PROPANODEOXYGUANOSINE ADDUCTS IN DNA UPON REACTIONWITH 3-(N-CARBETHOXY-N-NITROSAMINO)PROPIONALDEHYDE, CHEM. RES. TOXICOL.7(1):62-67, 1994"
+27762-78-3,CCRIS,1,-1,"KETOXAL",CCOC(C)C(=O)C(O)O,"MARNETT,LJ, HURD,HK, HOLLSTEIN,MC, LEVIN,DE, ESTERBAUER,H AND AMES,BN,NATURALLY OCCURRING CARBONYL COMPOUNDS ARE MUTAGENS IN SALMONELLA TESTER STRAINTA104,MUTAT. RES. 148(1-2):25-34, 1985"
+25584-83-2,CCRIS,0,-1,,CC(O)COC(=O)C=C,"WATANABE,K, SAKAMOTO,K AND SASAKI,T, COMPARISONS ON CHEMICALLY-INDUCEDMUTAGENICITY AMONG FOUR BACTERIAL STRAINS, SALMONELLA TYPHIMURIUM TA102 ANDTA2638, AND ESCHERICHIA COLI WP2/PKM101 AND WP2 UVRA/PKM101: COLLABORATIVE STUDY1, MUTAT. RES. 361(2-3):143-155, 1996"
+87436-71-3,CCRIS,0,-1,,OC1C=Cc2c(Br)c3ccc4ccccc4c3cc2C1O,"FU,PP, VON TUNGELN,LS, UNRUH,LE, NI,Y AND CHOU,MW, COMPARATIVEREGIOSELECTIVE AND STEREOSELECTIVE METABOLISM OF 7-CHLOROBENZ[A]ANTHRACENE AND7-BROMOBENZ[A]-ANTHRACENE BY MOUSE AND RAT LIVER MICROSOMES, CARCINOGENESIS12(3):371-378, 1991"
+93-45-8,VITIC,0,-1,,Oc1ccc(Nc2ccc3ccccc3c2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6358-53-8,VITIC,1,-1,,COc1ccc(OC)c(c1)N=Nc2c(O)ccc3ccccc23,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+26538-44-3,EPA3,0,-1,"TALERANOL",C[C@H]1CCC[C@@H](O)CCCCCc2cc(O)cc(O)c2C(=O)O1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+602-38-0,VITIC,1,-1,,[O-][N+](=O)c1cccc2cccc(c12)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+309-36-4,EPA3,0,-1,,CCC#C[C@@H](C)[C@@]1(CC=C)C(=O)NC(=O)N(C)C1=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+139259-94-2,CCRIS,1,-1,,CC(=O)ON(OCc1ccc(C)cc1)C(=O)c2ccccc2,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+114451-08-0,CCRIS,1,-1,,Cn1c(nc2c3cccnc3ccc12)[N+](=O)[O-],"WILD,D, WATKINS,BE AND VANDERLAAN,M, AZIDO-AND NITRO-PHIP, RELATIVESOF THE HETEROCYCLIC ARYLAMINE AND FOOD MUTAGEN PHIP - MECHANISM OF THEIRMUTAGENICITY IN SALMONELLA, CARCINOGENESIS 12(6):1091-1096, 1991"
+2784-86-3,EPA1,0,-1,,CC(=O)Nc1ccc2c(Cc3ccccc23)c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50834-39-4,CCRIS,0,-1,,CSCCC(NC(=O)COc1ccc(Cl)cc1Cl)C(=O)O,"RASHID,KA, BABISH,JG AND MUMMA,RO, POTENTIAL OF2,4-DICHLOROPHENOXYACETIC ACID COJUGATES AS PROMUTAGENS IN THESALMONELLA/MICROSOME MUTAGENICITY TEST, J. ENVIRON. SCI. HEALTH. PART BB19(8-9):689-701, 1984"
+111753-73-2,CCRIS,0,-1,"E-5510",COc1ccc(cc1)C(=C(CCC(=O)O)C#N)c2ccc(OC)cc2,"MOCHIDA,H, MUTAGENICITY STUDIES OF E5510 (1): REVERSION TEST INBACTERIA, YAKURI TO CHIRYO 22(12):4893-4897, 1994"
+27602-80-8,CCRIS,1,-1,,COc1ccc(CC2CO2)cc1OC,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+117760-95-9,EPA1,1,-1,,[O-][N+](=O)c1ccccc1SS\C(=C(/Cl)\C(=C(Cl)Cl)Cl)\Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+173428-76-7,CCRIS,1,-1,,CC(=O)c1ccc2N=C3N(Cc2c1)C(=O)c4ccccc34,"STEVENS,GJ, LAVOIE,EJ AND MCQUEEN,CA, THE ROLE OF ACETYLATION IN THEMUTAGENICITY OF THE ANTITUMOR AGENT, BATRACYLIN, CARCINOGENESIS 17(1):115-119,1996"
+NOCAS_M528,EPA1,0,-1,,O=C(C1CCCCC1)N2C[C@H]3N(CCc4ccccc34)C(=O)C2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96563-10-9,EPA1,1,-1,,CC1c2cc(F)ccc2c3ccc(F)cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1892-54-2,EPA1,1,-1,,Nc1ccc2ccc3ccccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139259-95-3,CCRIS,1,-1,,CC(=O)ON(OCc1ccc(cc1)c2ccccc2)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+1174-72-7,VITIC,0,-1,,O(c1ccccc1)[Si](Oc2ccccc2)(Oc3ccccc3)Oc4ccccc4,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+187585-43-9,CCRIS,1,-1,,COc1ccc(cc1[N+](=O)[O-])C2=C(C(=O)c3ccccc3O2)[N+](=O)[O-],"BEUDOT,C, DE MEO,MP, DAUZONNE,D, ELIAS,R, LAGET,M, GUIRAUD,H,BALANSARD,G AND DUMENIL,G, EVALUATION OF THE MUTAGENICITY AND ANTIMUTAGENICITYOF FORTY-TWO 3-SUBSTITUTED FLAVONES IN THE AMES TEST, MUTAT. RES.417(2-3):141-153, 1998"
+1912-31-8,CCRIS,1,-1,,CCCOS(=O)(=O)C,"GLOWIENKE,S, FRIAUFF,W, ALLMENDINGER,T, MARTUS,HJ, SUTER,W ANDMUELLER,L, STRUCTURE-ACTIVITY CONSIDERATIONS AND IN VITRO APPROACHES TO ASSESSTHE GENOTOXICTY OF 19 METHANE-, BENZENE- AND TOLUENESULFONIC ACID ESTERS, MUTAT.RES. 581(1-2):23-34, 2005"
+603-83-8,VITIC,1,-1,,Cc1c(N)cccc1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+580-17-6,EPA1,1,-1,,Nc1cnc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+58-85-5,CCRIS,0,-1,,OC(=O)CCCCC1SCC2NC(=O)NC12,"PRIVAL,MJ, SIMMON,VF AND MORTELMANS,KE, BACTERIAL MUTAGENICITY TESTINGOF 49 FOOD INGREDIENTS GIVES VERY FEW POSITIVE RESULTS, MUTAT. RES.260(4):321-329, 1991"
+614-45-9,VITIC,1,-1,,CC(C)(C)OOC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+34798-80-6,EPA1,0,-1,,CC(=O)C1(CCNCC1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38579-27-0,CCRIS,0,-1,,NCCCCC(N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(CCCCN)C(=O)O,"ALLEN,JS AND PANFILI,J, AMES SALMONELLA/MAMMALIAN-MICROSOME TESTING OFPEPTIDES AND PEPTIDE SYNTHESIS REAGENTS, MUTAT. RES. 170(1-2):23-29,1986"
+87-90-1,EPA1,0,-1,"SYMCLOSEN",ClN1C(=O)N(Cl)C(=O)N(Cl)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+122367-97-9,CCRIS,0,-1,,CC1CC2C(Cc3cn(CC4CC4)c5cc(Br)cc2c35)N(C)C1,"GLATT,H, PERTZ,H, KASPER,R AND EICH,E, CLAVINE ALKALOIDS ANDDERIVATIVES AS MUTAGENS DETECTED IN THE AMES TEST, ANTI-CANCER DRUGS3(6):609-614, 1992"
+14692-41-2,EPA1,1,-1,,Cn1cnc2c3cccnc3ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126370-96-5,CCRIS,1,-1,,Clc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,"ROLL,M, SHTELZER,S, STARK,AA AND BLUM,J, STRUCTURE-ACTIVITYRELATIONSHIPS IN MUTAGENICITY AND IN NUCLEOPHILIC RING OPENING OFN-(ARYLMETHYL)PHENANTHRENE 9,10-IMINES, MUTAGENESIS 5(1):25-30, 1990"
+51787-75-8,CCRIS,1,-1,,Nc1cc(ccc1c2ccc(cc2)[N+](=O)[O-])[N+](=O)[O-],"CHEN,SC, YEE WONG,T AND CHUNG,KT, BASE-PAIR MUTATION CAUSED BY FOURNITRO-GROUP CONTAINING AROMATIC AMINES IN SALMONELLA TYPHIMURIUM TA100, TA104,TA4001 AND TA4006, MUTAT. RES. 395(2,3):223-227, 1997"
+74-85-1,VITIC,0,-1,"ETHENE",C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+130-17-6,VITIC,1,-1,,Cc1ccc2nc(sc2c1S(=O)(=O)O)c3ccc(N)cc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M137,EPA1,1,-1,,OCN1[C@H](O)[C@@H](O)N(CO)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97851-14-4,CCRIS,1,-1,,Oc1ccc(cc1[N+](=O)[O-])c2cccc(c2)[N+](=O)[O-],"SUZUKI,J, SATO,T AND SUZUKI,S, HYDROXYNITROBIPHENYLS PRODUCED BYPHOTOCHEMICAL REACTION OF BIPHENYL IN AQUEOUS NITRATE SOLUTION AND THEIRMUTAGENICITIES, CHEM. PHARM. BULL. 33(6):2507-2515, 1985"
+102000-59-9,EPA1,1,-1,,Nc1cccc(N)c1C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+113058-38-1,EPA1,1,-1,,Oc1ccc2c3ccccc3c4cc5ccccc5cc4c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106-38-7,VITIC,0,-1,,Cc1ccc(Br)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3375-84-6,CCRIS,0,-1,,CC(O)CN1CC(C)OC1=O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y90"
+8047-99-2,EPA3,1,-1,,CCNS(=O)(=O)c1ccccc1C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+85-84-7,EPA1,0,-1,,Nc1ccc2ccccc2c1N=Nc3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+612-57-7,EPA1,1,-1,,Clc1ccc2ncccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59901-90-5,EPA3,1,-1,,CC(=O)O[C@H]([C@@H]1CO1)c2ccc3OCOc3c2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+141-32-2,EPA1,0,-1,"BUTACRYLA",CCCCOC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2921-88-2,VITIC,0,-1,"CHLORPYRI",CCOP(=S)(OCC)Oc1nc(Cl)c(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2107-76-8,VITIC,0,-1,,CC1=CC(=O)Oc2cc(O)cc(O)c12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+117-02-2,CCRIS,1,-1,"DR9800045",Cc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+122365-36-0,CCRIS,1,-1,,Nc1c2ncn(c2nc[n+]1[O-])C(c3ccccc3)(c4ccccc4)c5ccccc5,"GORROD,JW, IOANNIDES,C, LAM,SP AND NEVILLE,S, MUTAGENICITY TESTING OF9-N-SUBSTITUTED ADENINES AND THEIR N-OXIDATION PRODUCTS, ENVIRON. HEALTHPERSPECT. 101(SUPPL. 3):21-26, 1993"
+1672-88-4,CCRIS,1,-1,"AKRITOIN,AKRITOINK",[O-][N+](=O)c1oc(\C=C\C=N\N2CC(=O)NC2=O)cc1,"SLAPSYTE,G, LAZUTKA,JR AND LEKEVICIUS,RK, GENOTOXIC ACTIVITY OF TWOUROANTISEPTIC NITROFURANS IN A BATTERY OF SHORT-TERM TESTS, BIOLOGIJA 2:78-82,1996"
+21229-99-2,EPA1,1,-1,,ONc1ccc(Sc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+294-93-9,EPA1,0,-1,"12CROWN4",C1COCCOCCOCCO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2417-77-8,EPA1,1,-1,,BrCc1c2ccccc2cc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+42397-65-9,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3ccc(c4ccc1c2c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3845-76-9,VITIC,0,-1,,CN(C)CCCNC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+23043-60-9,EPA1,1,-1,,Nc1cccc2nc3ccccc3c(N)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101043-65-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3c(ccc4ccc1c2c34)N=O,"FIFER,EK, HEFLICH,RH, DJURIC,Z, HOWARD,PC AND BELAND,FA, SYNTHESIS ANDMUTAGENICITY OF 1-NITRO-6-NITROSOPYRENE  AND 1-NITRO-8-NITROSOPYRENE, POTENTIALINTERMEDIATES IN"
+100-01-6,EPA2,1,-1,"NOANILINP",Nc1ccc(cc1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+4531-49-1,CCRIS,0,-1,,COc1ccccc1NC(=O)C(N=Nc2ccc(cc2Cl)c3ccc(N=NC(C(=O)C)C(=O)Nc4ccccc4OC)c(Cl)c3)C(=O)C,"ZHOU,Y, YOU,X AND YE,X, MUTAGENICITY OF BENZIDINES AND THEIR CONGENERDERIVATIVE DYES, HUANJING KEXUE 8(2):31-34, 1987"
+541-73-1,VITIC,0,-1,,Clc1cccc(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+18868-66-1,EPA1,0,-1,,CCc1c2ccccc2cc3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60687-93-6,CCRIS,0,-1,,CC(=O)NCCc1ccc(O)c(c1)c2c(O)c(O)c3C(=O)c4cc(O)c(C(=O)O)c(C(=O)O)c4C(=O)c3c2O,"BANERJEE,TS, BHAUMIK,G, YU,CL, SWAMINATHAN,B, GIRI,AK, SRIVASTAVA,SAND BHATTACHARJEE,SB, EVALUATION OF THE GENOTOXICITY OF LAC DYE, FOOD CHEM.TOXICOL. 22(8):677-679, 1984"
+2373-98-0,VITIC,1,-1,,Nc1ccc(cc1O)c2ccc(N)c(O)c2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+33301-41-6,VITIC,1,-1,,CS(=O)(=O)OC1CN(C1)C(c2ccccc2)c3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60-23-1,EPA1,0,-1,"CYSTEAMIN,MERCAPHCL",NCCS,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35077-51-1,EPA1,0,-1,,CN(C(=O)C)c1ccc(cc1)N=Nc2ccc(cc2)N(C)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+299-11-6,EPA1,1,-1,"MEPHENAZI",C[n+]1c2ccccc2nc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5275-46-7,EPA1,1,-1,,CC(C)(N=O)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-49-9,CCRIS,0,-1,,C1CCCNCC1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+591-17-3,VITIC,0,-1,,Cc1cccc(Br)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120-32-1,VITIC,0,-1,"CLOROFENE,MEDOL",Oc1ccc(Cl)cc1Cc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+104-94-9,VITIC,1,-1,,COc1ccc(N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M122,EPA1,1,-1,,CCOP(=O)(OCC)[C@@H](C)NC(=O)N(CCCl)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3062-57-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2[nH]c3c(cccc3c2c1)[N+](=O)[O-],"HOLLOWAY,TC AND BALL,LM, SYNTHESIS AND MUTAGENICITY OF A SERIES OFNITRATED CARBAZOLES AND HYDROXYCARBAZOLES, MUTAGENESIS 8(4):321-327,1993"
+NOCAS_M440,EPA1,0,-1,,C[C@@H](O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139953-77-8,EPA1,1,-1,,OC(=O)c1ccc(\C=N\n2nnc3c4ccccc4nc3c2O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-19-2,VITIC,0,-1,,CCCCCCCCCCCCCCCCCC1=NCCN1CCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2243-47-2,EPA1,1,-1,,Nc1cccc(c1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+495-18-1,VITIC,1,-1,"BENZHYDRO",ONC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+140-31-8,EPA1,0,-1,,NCCN1CCNCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1204-68-8,EPA1,0,-1,,Cc1ccc(cc1)N(CCCl)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132172-58-8,CCRIS,1,-1,,OC1C=Cc2c(C1O)c3ccccc3c4cc5ccccc5cc24,"KUMAR,S, KOLE,PL AND SIKKA,HC, MUTAGENICITY OF DIBENZ[A,C]ANTHRACENEAND ITS DERIVATIVES IN SALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 242(4):337-343,1990"
+146724-32-5,CCRIS,0,-1,,COC(=O)c1cc2ccc3cccnc3c2[nH]1,"FERLIN,MG, CHIARELOTTO,G, BACCICHETTI,F, CARLASSARE,F, TONIOLO,L ANDBORDIN,F, 2-SUBSTITUTED 1H-PYRROLO[3,2-H]QUINOLINE DERIVATIVES: SYNTHESIS ANDASPECTS OF THEIR BIOLOGICAL ACTIVITY, FARMACO 47(12):1513-1528, 1992"
+120812-46-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3cccc4c5CCCCc5c1c2c34,"FU,PP, NI,YC, ZHANG,YM, HEFLICH,RH, WANG,YK AND LAI,JS, EFFECT OF THEORIENTATION OF NITRO SUBSTITUENT ON THE BACTERIAL MUTAGENICITY OFDINITROBENZO[E]PYRENES, MUTAT. RES. 225(3):121-125, 1989"
+608-93-5,VITIC,0,-1,"PENTACLBE",Clc1cc(Cl)c(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+965-52-6,CCRIS,1,-1,,Oc1ccc(cc1)C(=O)N\N=C\c2oc(cc2)[N+](=O)[O-],"DAYAN,J, DEGUINGAND,S AND TRUZMAN,C, STUDY OF THE MUTAGENIC ACTIVITYOF 6 HEPATOTOXIC PHARMACEUTICAL DRUGS IN THE SALMONELLA TYPHIMURIUM MICROSOMETEST, AND THE HGPRT AND SODIUM-POTASSIUM ATPASE SYSTEM IN CULTURED MAMMALIANCELLS, MUTAT. RES. 157(1):1-12, 1985"
+138805-32-0,CCRIS,0,-1,,CC(=O)Nc1ccc(C)c(c1)N=[N+]([O-])c2cc(NC(=O)C)ccc2C,"SAYAMA,M, MORI,M, NAKADA,Y, KAGAMIMORI,S AND KOZUKA,H, METABOLISM OF2,4-DINITROTOLUENE BY SALMONELLA TYPHIMURIUM STRAINS TA98, TA98NR ANDTA98/1,8-DNP6, AND MUTAGENICITY OF THE METABOLITES OF 2,4-DINITROTOLUENE ANDRELATED COMPOUNDS TO STRAINS TA98 AND TA100, MUTAT. RES. 264(3):147-153,1991"
+315-22-0,EPA1,0,-1,,C[C@H]1C(=O)O[C@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+135673-14-2,CCRIS,1,-1,,CC(=O)Nc1ccc(Oc2ccc(cc2)N=O)cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, GENOTOXICITY OF POTENTIAL METABOLITESOF NITROSCANATE- AN ANTISCHISTOSOMAL DRUG, MUTAT. RES. 335(3):235-243,1995"
+302-70-5,EPA1,1,-1,"CHLNOXHCL,MECLAMIOX",C[N+]([O-])(CCCl)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+136-85-6,EPA1,0,-1,,Cc1ccc2[nH]nnc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+185376-54-9,CCRIS,1,-1,,Cc1c(NO)cc(NO)cc1[N+](=O)[O-],"PADDA,RS WANG,CY HUGHES,JB AND BENNETT,GN, MUTAGENICITY OFTRINITROTOLUENE AND METABOLITES FORMED DURING ANAEROBIC DEGRADATION BYCLOSTRIDIUM ACETOBUTYLICUM ATCC 824, ENVIRON. TOXICOL. CHEM. 19(12):2871-2875,2000"
+143603-81-0,CCRIS,0,-1,,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3ccc(C)cc3,"LOPEZ DE CERAIN,A, GARCIA,E, BEORLEGUI,JJ, GULLON,A, ARRARAS,JA ANDMONGE,A, MUTAGENIC EVALUATION OF 3-(4'-BENZYLIDENEAMINO)INDOLE-2-ETHYLCARBOXYLATE IN HIS- SALMONELLA TYPHIMURIUM STRAINS, REV. TOXICOL. 10(3):151-154,1993"
+71382-49-5,CCRIS,1,-1,,N1C2C1c3cc4c(ccc5ccccc45)cc3c6ccccc26,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+19190-80-8,CCRIS,1,-1,,COC(=O)C1OC1c2ccccc2,"RIETVELD,EC, VAN GASTEL,FJC, SEUTTER-BERLAGE,F AND ZWANENBURG,B,GLUTATHIONE CONJUGATION AND BACTERIAL MUTAGENICITY OF RACEMIC ANDENANTIOMERICALLY PURE CIS- AND TRANS- METHYL EPOXYCINNAMATES, ARCH. TOXICOL.61(5):366-372, 1988"
+98-94-2,VITIC,0,-1,,CN(C)C1CCCCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+42308-20-3,CCRIS,1,-1,,CC(Br)C(=O)Nc1ccccc1,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+96687-77-3,CCRIS,0,-1,"SA-687",OC(=O)C1CSC(N1C(=O)CCSSCCC(=O)N2C(CSC2c3ccccc3O)C(=O)O)c4ccccc4O,"MORIKAWA,K, YAMAUCHI,H AND ISO,T, MUTAGENICITY TESTS ON(2R,4R)-2-(O-HYDROXYPHENYL)-3-(3-MERCAPTOPROPIONYL)-4-THIAZOLIDINECARBOXYLICACID (SA 446), IYAKUHIN KENKYU 17(1):43-50, 1986"
+NOCAS_M314,EPA1,0,-1,,CN1C[C@@H](C=C2[C@@H]1Cc3c[nH]c4cccc2c34)C(=O)N[C@@]5(C)O[C@]6(O)[C@H]7CCCN7C(=O)[C@@H](Cc8ccccc8)N6C5=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+607-57-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(Cc3ccccc23)c1,"WATANABE,T, KAJI,H, TAKASHIMA,M, KASAI,T, LEWTAS,J AND HIRAYAMA,T,METABOLIC ACTIVATION"
+34834-67-8,CCRIS,0,-1,,CN1C(CC(O)C1=O)c2cccnc2,"DOOLITTLE,DJ, WINEGAR,R, LEE,CK, CALDWELL,WS, HAYES,AW ANDDEBETHIZY,JD, THE GENOTOXIC POTENTIAL OF NICOTINE AND ITS MAJOR METABOLITES,MUTAT. RES. 344(3,4):95-102, 1995"
+19337-19-0,CCRIS,0,-1,,CC(=O)Nc1ccc(cc1)C(=O)\C=C\c2ccccc2,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+892-21-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c3ccccc3c4cccc1c24,"WATANABE,T, TAKASHIMA,M, KASAI,T AND HIRAYAMA,T, COMPARISON OF THEMUTATIONAL SPECIFICITY INDUCED BY ENVIRONMENTAL GENOTOXIN NITRATED POLYCYCLICAROMATIC HYDROCARBONS IN SALMONELLA TYPHIMURIUM HIS GENES, MUTAT. RES.394(1-3):103-112, 1997"
+111-84-2,VITIC,0,-1,"NONANE",CCCCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+128531-59-9,CCRIS,0,-1,,CCN(CC)C(=S)SSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O,"LEE,BH, LEE,S, KIM,YS, BERTRAM,B AND WIESSLER,M, MIXED DISULFIDES FROMDISULFIRAM INHIBIT THE BENZO[A]PYRENE INDUCED MUTAGENESIS, MUTAT. RES.371(3-4):215-220, 1996"
+603-50-9,VITIC,0,-1,"BISACODYL",CC(=O)Oc1ccc(cc1)C(c2ccc(OC(=O)C)cc2)c3ccccn3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5850-89-5,CCRIS,0,-1,,Cc1ccc(N=Nc2c(O)ccc3ccccc23)c(c1)S(=O)(=O)O,"MIYAGOSHI,M, HAYAKAWA,Y, NAGATA,M AND NAGAYAMA,T, ANALYSIS OF THESUBSIDIARY DYES OF LITHOL RUBINE B AND THEIR MUTAGENICITIES, EISEI KAGAKU36(2):133-138, 1990"
+104499-47-0,CCRIS,0,-1,,CNCCN(Cc1ccc(OC)cc1)c2ccccn2,"HANSEN,EB, CERNIGLIA,CE, KORFMACHER,WA, MILLER,DW AND HEFLICH,RH,MICROBIAL TRANSFORMATION OF THE ANTIHISTAMINE PYRILAMINE MALEATE. FORMATION OFPOTENTIAL MAMMALIAN METABOLITES, DRUG METAB. DISPOS. 15(1):97:106,1987"
+139953-95-0,CCRIS,1,-1,,CCCO\C=C\C=C\C=C\C=C\C=C\CC,"VERTEGAAL,LBJ, VOOGD,CE, MOHN,GR AND VAN DER GEN,A, FURTHER STUDIES ONTHE MUTAGENIC ACTIVITY OF FECAPENTAENE-12 ANALOGS AND CONCLUSIONS ABOUT THEIRMOLECULAR MODE OF ACTION, MUTAT. RES. 281(2):93-98, 1992"
+13551-87-6,EPA3,1,-1,,COC[C@H](O)Cn1ccnc1[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+3648-20-2,VITIC,0,-1,,CCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+89300-15-2,CCRIS,1,-1,,CC\C=C\C=C\C=C\C=C\C=C\OCC(O)CO,"GOVINDAN,SV, KINGSTON,DGI, GUNATILAKA,AAL, VAN TASSELL,RL, WILKINS,TD,DE WIT,PP, VAN DER STEEG,M AND VAN DER GEN,A, SYNTHESIS AND BIOLOGICAL ACTIVITYOF ANALOGS OF FECAPENTAENE-12, J. NAT. PROD. 50(1):75-83, 1987"
+5166-35-8,CCRIS,1,-1,,CC(Cl)C(=C)C,"WAALKES,MP, KOVATCH,R AND REHM,S, EFFECT OF CHRONIC DIETARY ZINCDEFICIENCY ON CADMIUM TOXICITY AND CARCINOGENESIS IN THE MALE WISTAR [HSD:(WI)BR] RAT TOXICOL. APPL. PHARMACOL. 108:448-456, 1991 & EDER,E, NEUDECKER,T,LUTZ,D AND HENSCHLER,D, CORRELATION OF ALKYLATING AND MUTAGENIC ACTIVITIES OFALLYL AND ALLYLIC COMPOUNDS: STANDARD OF ALKYLATION TEST VS. KINETICINVESTIGATION, CHEM. BIOL. INTERACT. 38:303-315, 1982"
+523-61-5,CCRIS,0,-1,,COc1c(C(=O)O)c(O)nc2ccccc12,"KLIER,B AND SCHIMMER,O, MICROSOMAL METABOLISM OF DICTAMNINE:IDENTIFICATION OF METABOLITES AND EVALUATION OF THEIR MUTAGENICITY IN SALMONELLATYPHIMURIUM: MUTAGENESIS 14(2):181-185, 1999"
+60-13-9,CCRIS,0,-1,"AMPHETAMI,AMPHETASP,AMPHETAMP,AMPHETAMS,DEXAMPHTA,LEVAMPSUC",CC(N)Cc1ccccc1,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T, MORTELMANS,K AND SPECK,W,SALMONELLA MUTAGENICITY TESTS: III. RESULTS FROM THE TESTING OF 255 CHEMICALS,ENVIRON. MOL. MUTAGEN. 9(SUPPL.9):1-110, 1987"
+108-30-5,VITIC,0,-1,"GAN-119,MVE-1,SUCCINICA",O=C1CCC(=O)O1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+495-48-7,EPA3,1,-1,"AZOXYBENZ",[O-][N+](=Nc1ccccc1)c2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+69245-38-1,EPA1,1,-1,,CC[C@@]1(O)C[C@H](O[C@H]2C[C@@H]([C@H](O[C@H]3C[C@H](O)[C@H](O[C@@H]4O[C@@H](C)C(=CC4=N)O)[C@H](C)O3)[C@H](C)O2)N(C)C)c5c(O)c6C(=O)c7c(O)ccc(O)c7C(=O)c6cc5[C@H]1C(=O)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97461-41-1,CCRIS,1,-1,,CC(C)(C)CNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+90-12-0,VITIC,0,-1,,Cc1cccc2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3411-58-3,CCRIS,1,-1,"CYSTEINET",CCOC(=O)C(N)CS,"STARK,AA, ARAD,A, SISKINDOVICH,S, PAGANO,DA AND ZEIGER,E, EFFECT OF PHON MUTAGENESIS BY THIOLS IN SALMONELLA TYPHIMURIUM TA102, MUTAT. RES.224(1):89-94, 1989"
+53737-95-4,EPA3,1,-1,,O1C=C[C@H]2[C@@H]1Oc3ccccc23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+50-29-3,VITIC,0,-1,"DDT",Clc1ccc(cc1)C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+53478-38-9,EPA1,1,-1,"AMSA",CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+62-56-6,VITIC,0,-1,"THIOUREA",NC(=S)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95-83-0,VITIC,1,-1,,Nc1ccc(Cl)cc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+77784-22-6,EPA1,1,-1,"DR0015287",COc1ccc2c(cc3N(C)CCc4cc5OCOc5c2c34)c1OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23077-88-5,CCRIS,0,-1,,OCCOc1cc(O)c2C(=O)C(=C(Oc2c1)c3ccc(OCCO)c(OCCO)c3)O,"MARZIN,D, VO PHI,H, OLIVIER,P AND SAUZIERES,J, STUDY OF MUTAGENICACTIVITY OF TROXERUTIN, A FLAVONOID DERIVATIVE, TOXICOL. LETT. 35(2-3):297-305,1987"
+10125-76-5,EPA1,1,-1,,O=Nc1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+102-70-5,VITIC,0,-1,,C=CCN(CC=C)CC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+79-36-7,VITIC,1,-1,,ClC(Cl)C(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3722-54-1,EPA1,1,-1,,COc1ccc2Oc3cc(OC)cc(OC)c3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1122-62-9,VITIC,0,-1,,CC(=O)c1ccccn1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+139259-98-6,CCRIS,1,-1,,CC(=O)ON(OCc1ccc(cc1)[N+](=O)[O-])C(=O)c2ccccc2,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+8062-14-4,EPA3,1,-1,,Nc1cc(N)c(cc1N=Nc2ccc(cc2)S(=O)(=O)N)N=Nc3ccc(cc3)S(=O)(=O)N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+84506-41-2,CCRIS,1,-1,,COC(=O)C(C)CN=N#N,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+66842-41-9,EPA3,1,-1,,C1O[C@@H]1c2cc3c4ccccc4ccc3c5ccccc25,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+100-75-4,VITIC,1,-1,,O=NN1CCCCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+83473-93-2,CCRIS,0,-1,"SA-738",CSCCC(=O)N1C(CSC1c2ccccc2O)C(=O)O,"MORIKAWA,K, YAMAUCHI,H AND ISO,T, MUTAGENICITY TESTS ON(2R,4R)-2-(O-HYDROXYPHENYL)-3-(3-MERCAPTOPROPIONYL)-4-THIAZOLIDINECARBOXYLICACID (SA 446), IYAKUHIN KENKYU 17(1):43-50, 1986"
+101688-02-2,CCRIS,1,-1,,[O-][N+](=O)c1oc2ccc3cc(ccc3c2c1)N(CCCl)CCCl,"CASTELAIN,P, HENDRICKX,B, TROMELIN,A, DEMERSEMAN,P AND MOENS,W,MUTAGENIC ACTIVITY OF DICHLOROETHYLAMINO DERIVATIVES OF NITRONAPHTHOFURAN ANDSOME NITROBENZOFURANS IN THE SALMONELLA/MICROSOME ASSAY, MUTAT. RES.280(1):9-15, 1992"
+138331-98-3,CCRIS,1,-1,,OC1OC(CN=N#N)C(O)C(O)C1O,"JURICEK,M, GRUZ,P, VELEMINSKY,J, STANEK,J, KEFURT,K, MORAVCOVA,J ANDJARY,J, MUTAGENIC ACTIVITY OF 6-AZIDO DEOXYHEXOSES AND AZIDO ALCOHOLS INSALMONELLA TYPHIMURIUM AND ITS INHIBITION BY A STRUCTURE-SIMILAR CARBON SOURCEIN THE MEDIUM, MUTAT. RES. 251(1):13-20, 1991"
+26675-46-7,EPA2,0,-1,"ISOFLURAN",FC(F)OC(Cl)C(F)(F)F,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+121-57-3,VITIC,0,-1,"CERANIL,SULFANIFE,SULFANILT,SULFANALU,SUNILATEZ",Nc1ccc(cc1)S(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+155164-60-6,CCRIS,0,-1,,ClC1=C(Cl)C(=O)N(N=C1)S(=O)(=O)c2ccc(Cl)cc2,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+104-40-5,EPA1,0,-1,,CCCCCCCCCc1ccc(O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+37597-20-9,CCRIS,1,-1,,COc1cc2CCN(Cc2cc1OC)N=O,"SENG,D, MCCONNELL,B AND MOWER,HF, SYNTHESIS, CHARACTERIZATION ANDMUTAGENICITY OF 2-NITROSO-6,7-DIMETHOXYTETRAHYDROISOQUINOLINE, CANCER LETT.49(1):1-7, 1990"
+6379-69-7,CCRIS,0,-1,,C\C=C\C(=O)OC1CC2OC3C=C(C)C(=O)CC3(C)C1(C)C24CO4,"HENGSTLER,JG, LOEFFLER,S, SCHAEFER,M, GLATT,HR, FUCHS,J, FLESCH,P ANDOESCH,F, DNA STRAND BREAK INDUCTION, MUTAGENICITY, AND CYTOTOXICITY OF THEMYCOTOXINS 11BETA-HYDROXY-7-DEOXYROSENONOLACTONE, ROSENONOLACTONE, ANDTRICHOTHECIN, MYCOTOXIN RES. 8(2):77-83, 1992"
+52101-49-2,CCRIS,1,-1,,CC(=O)c1oc(c(c2ccccc2)c1c3ccccc3)[N+](=O)[O-],"ICHIKAWA,M, YAMAMOTO,K, TANAKA,A, SWAMINATHAN,S, HATCHER,JF, ERTURK,EAND BRYAN,GT, MUTAGENICITY OF 3,4-DIPHENYL-5-NITROFURAN ANALOGS IN SALMONELLATYPHIMURIUM, CARCINOGENESIS 7(8):1339-1344, 1986"
+599-07-5,CCRIS,0,-1,,CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C5CCC34C)C(=O)O)C2C1)C(=O)O,"CZECZOT,H, RAHDEN-STARON,I, OLESZEK,W AND JURZYSTA,M, LACK OFMUTAGENIC ACTIVITY OF SAPONINS IN THE AMES TEST, ACTA BIOCHIM. POL. 40(1):74-76,1993"
+491-64-5,EPA1,1,-1,,COc1ccc2Oc3cc(O)cc(O)c3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+130-80-3,CCRIS,0,-1,"DIETHYLSD",CCC(=O)Oc1ccc(cc1)\C(=C(/CC)\c2ccc(OC(=O)CC)cc2)\CC,"INGEROWSKI,GH, SCHEUTWINKEL-REICH,M AND STAN,HJ, MUTAGENICITY STUDIESON VETERINARY ANABOLIC DRUGS WITH THE SALMONELLA/MICROSOME TEST, MUTAT. RES.91(2):93-98, 1981"
+710-25-8,EPA1,1,-1,,NC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+124858-35-1,CCRIS,0,-1,"OPC-7251",CC1CCc2c(N3CCC(O)CC3)c(F)cc4C(=O)C(=CN1c24)C(=O)O,"AWOGI,T, ITOH,T, SHIBAHARA,T, KANEKO,E AND TSUSHIMOTO,G, GENOTOXICITYSTUDIES OF(+/-)-9-FLUORO-6,7-DIHYDRO-8-(4-HYDROXY-1-PIPERIDYL)-5-METHYL-1-OXO-1H,5H-BENZO[I,J]QUINOLIZINE-2-CARBOXYLIC ACID (OPC-7251), A SYNTHETIC ANTIBACTERIALAGENT, IYAKUHIN KENKYU 21(4):626-635, 1990"
+111-02-4,EPA3,0,-1,,CC(=CCC\C(=C/CC\C(=C/CC\C=C(\C)/CC\C=C(\C)/CCC=C(C)C)\C)\C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+58-15-1,EPA3,1,-1,"ALLOPYRAB,AMINOPHEN,AMINOPASC,AMINOPHBU,AMINOPCIT,AMINOPHEC,AMINOPGEN,AMINOPGLU,AMINOPGUA,AMINOPHYD,AMPHYDSUL,AMINOPIBU,AMINOPLAC,AMINOPOXO,AMINOPPAC,AMINOPSAL,AMINOSBEN,AMINOPTHI,AMINOPHVA,CAUSYTH",CN(C)C1=C(C)N(C)N(C1=O)c2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+96-29-7,EPA3,1,-1,,CC\C(=N/O)\C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+136-95-8,VITIC,0,-1,,Nc1nc2ccccc2s1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4813-50-7,CCRIS,1,-1,,CCCCOO,"BALL,JC, YOUNG,WC, WALLINGTON,TJ AND JAPAR,SM, MUTAGENIC PROPERTIES OFA SERIES OF ALKYL HYDROPEROXIDES, ENVIRON. SCI. TECHNOL. 26(2):397-399,1992"
+24777-14-8,EPA1,1,-1,,COc1cc(ccc1O)c2nc(c3ccccc3)c([nH]2)c4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+396-01-0,VITIC,0,-1,"TRIAMTERE,TRIAMTHCL",Nc1nc(N)c2nc(c(N)nc2n1)c3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+585-08-0,CCRIS,1,-1,,O1C2C1c3ccccc3c4ccccc24,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+NOCAS_M94,EPA1,1,-1,,C[C@@H]1[C@H](O)CCC2=CC(=O)[C@]3(O[C@H]3[C@@]12C)[C@H]4O[C@H]4CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89415-69-0,EPA1,1,-1,,BrCCOC(=O)C(=O)OCCBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+30461-65-5,EPA1,1,-1,,Oc1cccc2Oc3c4[C@@H]5C=CO[C@H]5Oc4cc(O)c3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+48134-75-4,EPA1,0,-1,"MPP",C[n+]1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+118-79-6,VITIC,0,-1,"BITRIBROM,TRIBRPHEN",Oc1c(Br)cc(Br)cc1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+73536-69-3,EPA1,0,-1,,COC(=O)c1cc(OC)c2OCOc2c1c3c4OCOc4c(OC)cc3C(=O)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+150446-00-7,CCRIS,1,-1,,Cc1c(\C=N\OCc2cccc(c2)[N+](=O)[O-])c3cc(ccc3n1Cc4ccccc4)[N+](=O)[O-],"HRELIA,P, MOROTTI,M, VIGAGNI,F, BURNELLI,S, GARUTI,L, SABATINO,P ANDCANTELLI-FORTI,G, SYNTHESIS OF A SERIES OF 5-NITRO-(BENZIMIDAZOLES AND INDOLES)AS NOVEL ANTIMYCOTICS AND EVALUATION AS GENOTOXINS IN THE AMES TEST, MUTAGENESIS8(3):183-188, 1993"
+4514-19-6,EPA1,1,-1,,Cc1cc2c3ccccc3cc4ccc5cccc1c5c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+280-57-9,EPA1,0,-1,"DR9503295",C1CN2CCN1CC2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+458-37-7,EPA1,0,-1,"CURCUMIN",COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7576-88-7,EPA1,1,-1,,Cc1nc2ccc(N)cc2nc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M376,EPA1,0,-1,,Cl[C@H]1C=C[C@@H]2[C@@H]1[C@@]3(Cl)C(=C(Cl)[C@]2(Cl)C3(Cl)Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106532-77-8,CCRIS,1,-1,,[O-][N+](=O)c1cccc(c1)C(=O)\N=C\2/SN(C(=O)c3cccc(c3)[N+](=O)[O-])c4ccc(cc24)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+532-82-1,VITIC,1,-1,"CHRYSOIDI,CHRYSODCI,CHRYSOIHI,CHRYSOTCY",Nc1ccc(N=Nc2ccccc2)c(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M326,EPA1,0,-1,,C[C@@H](O)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+40809-41-4,CCRIS,0,-1,,CCC(CCCC(=O)O)COC(=O)c1ccccc1C(=O)O,"DIRVEN,HAAM, THEUWS,JLG, JONGENEELEN,FJ AND BOS,RP, NON-MUTAGENICITYOF 4 METABOLITES OF DI(2-ETHYLHEXYL)PHTHALATE (DEHP) AND 3 STRUCTURALLY RELATEDDERIVATIVES OF DI(2-ETHYLHEXYL)ADIPATE (DEHA) IN THE SALMONELLA MUTAGENICITYASSAY, MUTAT. RES. 260(1):121-130, 1991"
+2148-31-4,CCRIS,1,-1,,CC(=O)NC(CS\C(=C\Cl)\Cl)C(=O)O,"VAMVAKAS,S, DEKANT,W, BERTHOLD,K, SCHMIDT,S, WILD,D AND HENSCHLER,D,ENZYMATIC TRANSFORMATION OF MERCAPTURIC ACIDS DERIVED FROM HALOGENATED ALKENESTO REACTIVE AND MUTAGENIC INTERMEDIATES, BIOCHEM. PHARMACOL. 36(17):2741-2748,1987"
+106-63-8,VITIC,0,-1,,CC(C)COC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+345667-60-9,CCRIS,1,-1,,CCc1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,"LUDOLPH,B KLEIN,M ERDINGER,L AND BOCHE,G, THE EFFECTS OF 4'-ALKYLSUBSTITUENTS ON THE MUTAGENIC ACTIVITY OF 4-AMINO- AND 4-NITROSTILBENES INSALMONELLA TYPHIMURIUM, MUTAT. RES. 491(1-2):195-209, 2001"
+606-22-4,CCRIS,1,-1,,Nc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+75-99-0,EPA1,0,-1,"DALAPON",CC(Cl)(Cl)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133-07-3,EPA1,1,-1,"FOLPET",ClC(Cl)(Cl)SN1C(=O)c2ccccc2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+147-24-0,VITIC,0,-1,"BIETANAUT,DIMENHYDR,DIPHENHYD,DIPHENACF,DIPHENHYA,DIPHENCAR,DIPHENHCI,DIPHHYHCL,DIPHENHLS,DIPHENHSA",CN(C)CCOC(c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+219-08-9,EPA3,1,-1,,C1C=Cc2c1ccc3c2ccc4ccccc34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+16430-32-3,EPA1,1,-1,,CC(=O)OCc1c2ccccc2cc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3121-61-7,VITIC,0,-1,,COCCOC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+35282-68-9,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2ccccc2CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-18-6,VITIC,0,-1,"ALLYALCO",OCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4901-51-3,VITIC,0,-1,,Oc1cc(Cl)c(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+121-60-8,CCRIS,0,-1,,CC(=O)Nc1ccc(cc1)S(=O)(=O)Cl,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+84434-42-4,EPA1,1,-1,,Cc1c(N)ccc(N=Nc2ccccc2)c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-24-0,CCRIS,1,-1,,BrCCCCCBr,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+75-04-7,VITIC,0,-1,"ETHYLAMIN,JM-64",CCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107-07-3,VITIC,1,-1,"CLETHANO2",OCCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+112-53-8,EPA1,0,-1,"DODECANOL",CCCCCCCCCCCCO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1785-51-9,EPA1,1,-1,,O=C1C=Cc2ccc3C(=O)C=Cc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+149418-41-7,CCRIS,1,-1,,BrC1=C(Br)C(=O)OC1,"LALONDE,RT AND LEO,HR, INTERACTIVE CHLORINE-BY-BROMINE ANDHYDROGEN-BY-HYDROXYL GROUP REPLACEMENT EFFECTS IN 2(5H)-FURANONE MUTAGENICITY,CHEM. RES. TOXICOL. 7(6):779-783, 1994"
+634-93-5,VITIC,0,-1,,Nc1c(Cl)cc(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+191-30-0,EPA1,1,-1,,c1ccc2c(c1)cc3ccc4cccc5c6ccccc6c2c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-96-3,VITIC,0,-1,,CC(C)CNCC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+88741-67-7,EPA1,1,-1,,COc1ccc2C(=O)c3c(O)c(OC)cc4ccnc(c2c1)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61-82-5,EPA1,0,-1,"AMITROLE",Nc1nc[nH]n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25413-02-9,CCRIS,1,-1,,CCOC(=O)CNC(=O)C(C)Br,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+145531-22-2,CCRIS,1,-1,,NCCCS(=O)(=O)Nc1ccc(Nc2c3ccc(cc3nc4ccc(cc24)N=N#N)N=N#N)cc1,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+74367-78-5,CCRIS,1,-1,,[O-][N+](=O)c1cc(CCl)cc(c1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+NOCAS_M188,EPA1,1,-1,,C[C@@H](O)[C@H](NC(=O)[C@H](C)[C@H](O)[C@H](C)NC(=O)[C@@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@H](N)C(=O)N)[C@@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCN[C@H](C)c7ccccc7,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7756-96-9,VITIC,0,-1,,CCCCOC(=O)c1ccccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16354-50-0,EPA1,0,-1,,CCc1c2ccccc2c(C)c3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+93673-32-6,CCRIS,1,-1,,C1C2=C3C=CC=CC3=CC4=C5OC5=C(C24)c6ccccc16,"BARTCZAK,AW, SANGAIAH,R, BALL,LM, WARREN,SH AND GOLD,A, SYNTHESIS ANDBACTERIAL MUTAGENICITY OF THE CYCLOPENTA OXIDES OF THE FOUR CYCLOPENTA-FUSEDISOMERS OF BENZANTHRACENE, MUTAGENESIS 2(2):101-105, 1987"
+2998-23-4,EPA1,0,-1,,CCCCCOC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+926-06-7,EPA1,1,-1,,CC(C)OS(=O)(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2422-79-9,EPA1,1,-1,,Cc1c2ccccc2cc3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86853-97-6,EPA1,1,-1,,O=C1c2ccc3ccccc3c2c4c1ccc5ccccc45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59405-31-1,CCRIS,0,-1,,OS(=O)(=O)CNc1ccc(cc1)N=Nc2cccnc2,"SHAHIN,MM, MUTAGENICITY OF STRUCTURALLY RELATED PHENYLAZO-3-PYRIDINESIN SALMONELLA TYPHIMURIUM, CELL BIOL. TOXICOL. 9(1):33-47, 1993"
+477-73-6,EPA1,1,-1,"SAFRANINO",Cc1cc2nc3cc(C)c(N)cc3[n+](c4ccccc4)c2cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+69-09-0,VITIC,0,-1,"CHLORPROM,CHLPROHIB,CHLOPRHCL,CHLORPMAL",CN(C)CCCN1c2ccccc2Sc3ccc(Cl)cc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M393,EPA1,0,-1,,COC(=C1[C@@H](C(=C(COC(=O)N)N=C1C)C(=O)OC(C)C)c2cccc(Cl)c2Cl)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16238-56-5,VITIC,1,-1,,Cc1c2ccccc2c(CBr)c3ccc4ccccc4c13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+61788-44-1,CCRIS,0,-1,,C(=C\c1cccc(\C=C\c2ccccc2)c1)/c3ccccc3,"YAMAGUCHI,T, YAMAUCHI,A, YAMAZAKI,H AND KAKIUCHI,Y, MUTAGENICITY OFRUBBER ADDITIVES IN TIRE, EISEI KAGAKU 37(1):6-13, 1991"
+17024-19-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3ccccc3c2c1,"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+96287-03-5,EPA1,1,-1,,Cc1cccn2c1nc3c(C)c(N)cnc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71422-67-8,EPA1,0,-1,"CGA112913",Fc1cccc(F)c1C(=O)NC(=O)Nc2cc(Cl)c(Oc3ncc(cc3Cl)C(F)(F)F)c(Cl)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M419,EPA1,0,-1,,CCCCCCCCCCCCOC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+114414-79-8,CCRIS,1,-1,,CC1C2C(=Nc3ccccc23)N(C)c4ccccc14,"RAHDEN-STARON,I, PECZYNSKA-CZOCH,W AND KACZMAREK,L, MUTAGENICITY OFCARBOLINE METHYL DERIVATIVES IN SALMONELLA, ACTA MICROBIOL. POL. 43(2):247-250,1994"
+3697-24-3,EPA1,1,-1,,Cc1cc2ccccc2c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+844-26-8,EPA1,1,-1,"BITHIONOL",Oc1c(Cl)cc(Cl)cc1S(=O)c2cc(Cl)cc(Cl)c2O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14160-38-4,EPA1,1,-1,,CC(C)(C)C1=CC(=O)C=C(C1=O)C2=CC(=O)C=C(C2=O)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2444-36-2,EPA1,0,-1,,OC(=O)Cc1ccccc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26266-68-2,VITIC,0,-1,,CCC(CCC=C)C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1698-60-8,VITIC,0,-1,,NC1=C(Cl)C(=O)N(N=C1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+20830-81-3,CCRIS,1,-1,,COc1cccc2C(=O)c3c(O)c4CC(O)(CC(OC5CC(N)C(O)C(C)O5)c4c(O)c3C(=O)c12)C(=O)C,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+67464-46-4,CCRIS,1,-1,,N1C2C1c3ccccc3c4ccccc24,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+NOCAS_M125,EPA1,1,-1,,O1[C@@H]2[C@H]1c3c4ccccc4cc5c6ccccc6cc2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60-93-5,EPA1,0,-1,"BENZYLPQU,QUININE,QUININCS3,QUININASP,QUININCIN,QUININEHI,QUININFOR,QUININGEN,QUININGLP,QUININGSA,QUININHBR,QUININHCL,QUININOXC,QUININSAL,QUINSALSA,QUININSMA,QUININIBI,QUININSUL",COc1ccc2nccc([C@@H](O)[C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91687-67-1,CCRIS,1,-1,,CC(Br)C(=O)NCc1ccc(Cl)cc1,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+70955-02-1,CCRIS,0,-1,,NNC(=O)CNc1ccc2ccccc2c1,"RAMAMURTHY,B, PAI,SB AND RAMAKRISHNAN,T, EVALUATION OF MUTAGENICITY OFTHE ANTITUBERCULAR NAPHTHYLGLYCINE HYDRAZIDES IN SALMONELLA TYPHIMURIUM, J.BIOSCI. 9(1-2):47-52, 1985"
+138542-40-2,CCRIS,1,-1,,[O-][N+](=O)c1cc2ccc3cc4ccccc4c5ccc(c1)c2c35,"YU,S, HERRENO-SAENZ,D, MILLER,DW, KADLUBAR,FF AND FU,PP, MUTAGENICITYOF NITRO- POLYCYCLIC AROMATIC HYDROCARBONS WITH THE NITRO SUBSTITUENT SITUATEDAT THE LONGEST MOLECULAR AXIS, MUTAT. RES. 283(1):45-52, 1992"
+105427-01-8,CCRIS,1,-1,,CC1(CO1)C(=O)Nc2ccccc2,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+66-22-8,EPA2,0,-1,"URACIL",Oc1ccnc(O)n1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+162050-11-5,CCRIS,0,-1,,COC(=O)C1O\C(=N/O)\C(=C1Cl)Cl,"HATCHER,JF, YAMAMOTO,K, ICHIKAWA,M, BRYAN,GT AND SWAMINATHAN,S,METABOLIC REDUCTION OF NOVEL 3,4-DICHLORO-5-NITROFURANS IN SALMONELLATYPHIMURIUM, ENVIRON. MOL. MUTAGEN. 25(1):58-66, 1995"
+97546-74-2,CCRIS,0,-1,,CC1(C)CC(C(=O)NC(CO)C(O)CO)C(C)(C)[N+]1=O,"SOSNOVSKY,G, A CRITICAL EVALUATION OF THE PRESENT STATUS OF TOXICITYOF AMINOXYL RADICALS, J. PHARM. SCI. 81(6):496-499, 1992"
+88492-34-6,CCRIS,1,-1,,Nc1ncnc2c1ncn2CC(O)CN=N#N,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+17528-53-9,EPA1,1,-1,,OC(=O)COc1ccc(cc1)N(CCCl)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103616-17-7,CCRIS,0,-1,,OC(=O)C1=C(O)C(=O)C=CO1,"GAVA,C, PERAZZOLO,M, ZENTILIN,L, LEVIS,AG, CORAIN,B, BOMBI,GG,PALUMBO,M AND ZATTA,P, GENOTOXIC POTENTIALITY AND DNA-BINDING PROPERTIES OFACETYLACETONE, MALTOL, AND THEIR ALUMINUM(III) ADN CHROMIUM(III) NEUTRALCOMPLEXES, TOXICOL. ENVIRON. CHEM. 22(1-4):149-57, 1989"
+602-01-7,CCRIS,1,-1,,Cc1cccc(c1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+128753-91-3,CCRIS,1,-1,,CC(=O)Oc1ccc2OC3(C)OOC3(C)c2c1,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+107097-80-3,CCRIS,0,-1,"LOXIGLUMI",CCCCCN(CCCOC)C(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1,"BABA,K, DAIGO,H AND SATO,Y, MUTAGENICITY STUDY ON CR1505, YAKURI TOCHIRYO 25(11):2665-2676, 1997"
+30418-53-2,EPA2,0,-1,,C=CC(=O)c1ccc2OCOc2c1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+469-83-0,CCRIS,0,-1,,C[C@@]12CCc3occc3C1CC[C@@]45CC(CCC24)C(O)(CO)C5,"PEZZUTO,JM, NANAYAKKARA,NPD, COMPADRE,CM, SWANSON,SM, KINGHORN,AD,GUENTHNER,TM, SPARNINS,VL AND LAM,LKT, CHARACTERIZATION OF BACTERIALMUTAGENICITY MEDIATED BY 13-HYDROXY-ENT-KAURENOIC ACID (STEVIOL) AND SEVERALSTRUCTURALLY-RELATED DERIVATIVES AND EVALUATION OF POTENTIAL TO INDUCEGLUTATHIONE S-TRANSFERASE IN MICE, MUTAT. RES. 169(3):93-103, 1986"
+65847-03-2,EPA1,0,-1,,COc1c2ccoc2nc3c(O)c4OCOc4c(CC=C(C)C)c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+696-54-8,CCRIS,0,-1,,O\N=C\c1ccncc1,"WATANABE,K, SAKAMOTO,K AND SASAKI,T, COMPARISONS ON CHEMICALLY-INDUCEDMUTAGENICITY AMONG FOUR BACTERIAL STRAINS, SALMONELLA TYPHIMURIUM TA102 ANDTA2638, AND ESCHERICHIA COLI WP2/PKM101 AND WP2 UVRA/PKM101: COLLABORATIVE STUDY1, MUTAT. RES. 361(2-3):143-155, 1996"
+33979-15-6,CCRIS,1,-1,,CC1\C=C(\C=C)/C(=O)OC2CC[N+]3(C)CC=C(COC(=O)C1(C)OC(=O)C)C23O,"YAMANAKA,H NAGAO,M AND SUGIMURA,T, MUTAGENICITY OF PYRROLIZIDINEALKALOIDS IN THE SALMONELLA/MAMMALIAN-MICROSOME TEST, MUTAT. RES. 68(3):211-216,1979"
+142-84-7,VITIC,0,-1,,CCCNCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M37,EPA1,1,-1,,N[C@H](CCC(=O)N[C@H](CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)NCC(=O)O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+33203-82-6,EPA1,1,-1,,CCN(CC)c1ccc2nc3ccc(cc3[o+]c2c1)N(CC)CC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109143-20-6,CCRIS,1,-1,,COc1ccc(N(CCCl)CCCl)c2cc(oc12)[N+](=O)[O-],"CASTELAIN,P, HENDRICKX,B, TROMELIN,A, DEMERSEMAN,P AND MOENS,W,MUTAGENIC ACTIVITY OF DICHLOROETHYLAMINO DERIVATIVES OF NITRONAPHTHOFURAN ANDSOME NITROBENZOFURANS IN THE SALMONELLA/MICROSOME ASSAY, MUTAT. RES.280(1):9-15, 1992"
+124617-85-2,CCRIS,1,-1,,CCCCCCCCON(OC(=O)C)C(=O)c1ccccc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+6795-16-0,CCRIS,0,-1,,COc1cc2OC3OCCC3c2c4Oc5cccc(O)c5C(=O)c14,"MORI,H, SUGIE,S, YOSHIMI,N, KITAMURA,J, NIWA,M, HAMASAKI,T ANDKAWAI,K, GENOTOXIC EFFECTS OF A VARIETY OF STERIGMATOCYSTIN-RELATED COMPOUNDS INTHE HEPATOCYTE/DNA-REPAIR TEST AND THE SALMONELLA MICROSOME ASSAY, MUTAT. RES.173(3):217-222, 1986"
+531-85-1,VITIC,1,-1,"BENZIDINE",Nc1ccc(cc1)c2ccc(N)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+625-86-5,VITIC,0,-1,,Cc1oc(C)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16339-05-2,EPA3,1,-1,,CCCCCN(CCCC)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+98046-72-1,EPA1,1,-1,,Cc1cccn2c1nc3c(C)c(NO)cnc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+303-47-9,EPA3,0,-1,,C[C@H]1Cc2c(Cl)cc(C(=O)N[C@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+97606-15-0,CCRIS,1,-1,,N1C2C1c3cscc3c4cscc24,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+NOCAS_M191,EPA1,1,-1,,Clc1ccc(CC[C@H]2CO2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134959-60-7,CCRIS,0,-1,,Cc1ccc(\N=C\c2cccc3cccnc23)c(c1)C(=O)O,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+121-69-7,VITIC,0,-1,,CN(C)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+253-73-6,CCRIS,0,-1,,c1cnc2cnncc2c1,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+96-26-4,VITIC,1,-1,"DIOHACETO",OCC(=O)CO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100-21-0,VITIC,0,-1,"TEREPHTHA",OC(=O)c1ccc(cc1)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+20927-95-1,EPA1,1,-1,,[O-][N+](=O)c1ccc2oc3ccccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+553-24-2,EPA3,1,-1,"NEUTRALRE",CN(C)c1ccc2nc3cc(C)c(N)cc3nc2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+114020-51-8,CCRIS,1,-1,,COc1cccc2c1CC(c3ccc4OCOc4c23)[N+](=O)[O-],"CHAKRABARTY,SN, PAKRASHI,A AND SIDDIQUI,KAI, ARISTOLIC ACID ANANTIFERTILITY AGENT IS NON-MUTAGENIC TO BACTERIAL SYSTEM, INDIAN J. PHARMACOL.19(1):26-31, 1987"
+528-75-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc(C=O)c(c1)[N+](=O)[O-],"MORI,M, MIYAHARA,T, MOTO-O,K, FUKUKAWA,M, KOZUKA,H, MIYAGOSHI,M ANDNAGAYAMA,T, MUTAGENICITY OF URINARY METABOLITES OF 2,4-DINITROTOLUENE TOSALMONELLA TYPHIMURIUM, CHEM. PHARM. BULL. 33(10):4556-4563, 1985"
+6217-19-2,VITIC,1,-1,,CCN(CC)c1ccc(cc1)[N+]#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+121-14-2,EPA2,1,-1,,Cc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+1912-24-9,VITIC,0,-1,"ATRAZINE",CCNc1nc(Cl)nc(NC(C)C)n1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+162022-91-5,CCRIS,0,-1,,COc1nncc2ccncc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+NOCAS_M308,EPA1,0,-1,,N[C@@H](Cc1ccc(O)c(c1)[N+](=O)[O-])C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+69658-91-9,EPA2,0,-1,,CN(N=O)c1cccnc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+101-72-4,VITIC,0,-1,,CC(C)Nc1ccc(Nc2ccccc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+151910-75-7,CCRIS,0,-1,,OC1C=Cc2c(ccc3cc4c(cc23)C(O)C(O)c5ccccc45)C1O,"PLATT,KL AND SCHOLLMEIER,M, BISDIHYDRODIOLS, RATHER THAN DIHYDRODIOLOXIDES, ARE THE PRINCIPAL MICROSOMAL METABOLITES OF TUMORIGENICTRANS-3,4-DIHYDROXY-3,4-DIHYDRODIBENZ[A,H]ANTHRACENE,CHEM. RES. TOXICOL.7(1):89-97, 1994"
+4399-80-8,CCRIS,0,-1,,CC1(C)CC(C(=O)N)C(C)(C)N1O,"GALLEZ,B, DE MEESTER,C, DEBUYST,R, DEJEHET,F AND DUMONT,P,MUTAGENICITY OF NITROXYL COMPOUNDS: STRUCTURE-ACTIVITY RELATIONSHIPS, TOXICOL.LETT. 63(1): 35-45, 1992"
+159092-69-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(ccc3ccc(cc23)[N+](=O)[O-])c1,"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+127-90-2,CCRIS,1,-1,,ClC(COCC(Cl)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,"MORI,Y, HASEGAWA,K, UTSUNOMIYA,A, SETSUDA,S, GOTO,S, ONODERA,S ANDMATSUSHITA,H, AMES MUTAGENICITY OF PYRETHROID PESTICIDES (TETRAMETHRIN,PERMETHRIN, EMPENTHRIN, AND ALLETHRIN) AND1,1'-OXYBIS[2,3,3,3-TETRACHLOROPROPANE] AS A SYNERGIST, KANKYO HEN'IGEN KENKYU20(1):29-33, 1998"
+1222-98-6,EPA1,1,-1,,[O-][N+](=O)c1ccc(\C=C\C(=O)c2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+194-03-6,EPA1,1,-1,,c1cc2ccc3cccc4ncc(c1)c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67411-86-3,EPA1,1,-1,,OCc1cc2ccccc2c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+150446-03-0,CCRIS,1,-1,,Cc1c(\C=N\OCc2ccccc2)c3cc(ccc3n1Cc4cccc(c4)[N+](=O)[O-])[N+](=O)[O-],"HRELIA,P, MOROTTI,M, VIGAGNI,F, BURNELLI,S, GARUTI,L, SABATINO,P ANDCANTELLI-FORTI,G, SYNTHESIS OF A SERIES OF 5-NITRO-(BENZIMIDAZOLES AND INDOLES)AS NOVEL ANTIMYCOTICS AND EVALUATION AS GENOTOXINS IN THE AMES TEST, MUTAGENESIS8(3):183-188, 1993"
+92-06-8,EPA1,0,-1,,c1ccc(cc1)c2cccc(c2)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-72-5,CCRIS,0,-1,,CCNCCN,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+130942-88-0,CCRIS,1,-1,,Cc1c2ccccc2c(COS(=O)(=O)O)c3ccccc13,"SURH,YJ, BLOMQUIST,JC,"
+113163-24-9,CCRIS,1,-1,,C1Cc2ccc3cccnc3c2C4OC14,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+2045-52-5,VITIC,0,-1,"PHENBENZA",CN(C)CCN(Cc1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+112-92-5,VITIC,0,-1,"CETOSTEAR,STEARYLOL",CCCCCCCCCCCCCCCCCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+187585-11-1,CCRIS,1,-1,,COc1ccc(cc1N)C2=C(N)C(=O)c3ccccc3O2,"BEUDOT,C, DE MEO,MP, DAUZONNE,D, ELIAS,R, LAGET,M, GUIRAUD,H,BALANSARD,G AND DUMENIL,G, EVALUATION OF THE MUTAGENICITY AND ANTIMUTAGENICITYOF FORTY-TWO 3-SUBSTITUTED FLAVONES IN THE AMES TEST, MUTAT. RES.417(2-3):141-153, 1998"
+6807-96-1,EPA3,1,-1,,Oc1cc(O)c2C(=O)c3c(O)c4[C@@H]5C=CO[C@@H]5Oc4cc3C(=O)c2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+98499-61-7,CCRIS,0,-1,,CSCNc1ccccc1C(=O)C,"VITO,M, ESPOSITO,G, VICARI,L, LEMBO,S, IMPERATRICE,ML AND DEMARINIS,E,MUTAGENIC ACTIVITY OF CHLORODIMETHYL SULFIDE AND SOME OF ITS ANILINEDERIVATIVES, BOLL.- SOC. ITAL. BIOL. SPER. 61(6):917-923, 1985"
+531-75-9,CCRIS,0,-1,"ESCULIN",OC[C@H]1O[C@@H](Oc2cc3C=CC(=O)Oc3cc2O)[C@H](O)[C@@H](O)[C@@H]1O,"UWAIFO,AO, THE MUTAGENICITIES OF SEVEN COUMARIN DERIVATIVES AND AFURAN DERIVATIVE (NIMBOLIDE) ISOLATED FROM THREE MEDICINAL PLANTS, J. TOXICOL.ENVIRON. HEALTH 13(4-6):521-530, 1984"
+117-79-3,VITIC,1,-1,"DR0038062",Nc1ccc2C(=O)c3ccccc3C(=O)c2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98-30-6,VITIC,0,-1,,CS(=O)(=O)c1ccc(O)c(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+118244-44-3,CCRIS,0,1,,CC(=CCC\C(=C\CC\C(=C\C(=O)OCC(=O)C1(O)CCC2C3CCC4=CC(=O)C=CC4(C)C3C(O)CC12C)\C)\C)C,"OTSUKA,M, AJIMI,S, KAJIWARA,Y, OGURA,S, KAKIMOTO,K, INAI,T, TANAKA,HAND OHUCHIDA,A, MUTAGENICITY STUDIES OF PREDNISOLONE FARNESYLATE (PNF), J.TOXICOL. SCI. 17(3):269-281, 1992"
+27729-95-9,EPA1,1,-1,,COc1ccc(cc1)[C@H]2O[C@@H]2C(=O)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+384-22-5,VITIC,0,-1,,[O-][N+](=O)c1ccccc1C(F)(F)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16650-32-1,EPA1,1,-1,,Fc1ccc(F)c2ncccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24167-40-6,EPA3,1,-1,"IA-4",CCN(CC)CCn1nc2c3ccc(Cl)cc3Sc4c(CO)ccc1c24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+129665-16-3,CCRIS,1,-1,,[O-][n+]1c2ccccc2c3ccc4cccc5ccc1c3c45,"FUKUHARA,K, HAKURA,A, SERA,N, TOKIWA,H AND MIYATA,N, 1- AND 3-NITRO-6-AZABENZO[A]PYRENES AND THEIR N-OXIDES: HIGHLY MUTAGENIC NITRATED AZAARENES,CHEM. RES. TOXICOL. 5(2):149-153, 1992"
+128669-18-1,CCRIS,0,-1,,CN1C=CN(CCOCC#C)C1\C=N\O,"ORNER,G, SEEWALD,JB, NIEDING,WJ AND KORTE,DW, MUTAGENIC POTENTIAL OF2-HYDROXYIMINOMETHYL-3-METHYL-1-(2'-PROPARGYLOXYMETHYL)IMIDAZOLIUM CHLORIDE INTHE AMES SALMONELLA/MAMMALIAN MICROSOME MUTAGENICITY TEST, LETTERMAN ARMYINSTITUTE OF RESEARCH, LAIR-IR-381:TOXICOLOGYSER-237, JULY 1989"
+105708-73-4,CCRIS,1,-1,,CC(=O)OCc1c2cccc3ccc4cc5cccc6ccc1c(c56)c4c23,"ROGAN,EG, CAVALIERI,EL, WALKER,BA, BALASUBRAMANIAN,R, WISLOCKI,PG,ROTH,RW AND SAUGIER,RK, MUTAGENICITY OF BENZYLIC ACETATES, SULFATES AND BROMIDESOF POLYCYCLIC AROMATIC HYDROCARBONS, CHEM.-BIOL. INTERACT. 58(3):253-275,1986"
+6795-27-3,CCRIS,1,-1,,CC(=O)N\N=C\C1=CN(O)c2ccccc2N1O,"NUNOSHIBA,T AND NISHIOKA,H, GENOTOXICITY OF QUINOXALINE 1,4-DIOXIDEDERIVATIVES IN ESCHERICHIA COLI AND SALMONELLA TYPHIMURIUM, MUTAT. RES.217(3):203-209, 1989"
+NOCAS_M153,EPA1,1,-1,,Cl[C@@H]1CN(C[C@H]1Cl)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2243-62-1,VITIC,1,-1,,Nc1cccc2c(N)cccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+14919-77-8,CCRIS,1,-1,"BENSERAZI,BENSERHCL",NC(CO)C(=O)NNCc1ccc(O)c(O)c1O,"KITAMURA,J, MORI,H, SUGIE,S AND KAWAI,K, GENETIC TOXICITY OF SEVERALANTIHYPERTENSIVE DRUGS POSSESSING A HYDRAZINE GROUP, RES. COMMUN. CHEM. PATHOL.PHARMACOL. 49(3):415-422, 1985"
+611-23-4,EPA1,1,-1,,Cc1ccccc1N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60877-91-0,CCRIS,1,-1,,Oc1cccc(\C=N\c2snc3ccccc23)c1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+835-71-2,EPA1,0,-1,,Cc1ccc(cc1)c2oc3ccccc3n2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14204-98-9,CCRIS,0,-1,,CNc1ccc2ncccc2c1N,"GRIVAS,S AND JAEGERSTAD,M, MUTAGENICITY OF SOME SYNTHETIC QUINOLINESAND QUINOXALINES RELATED TO IQ, MEIQ OR MEIQX IN AMES TEST, MUTAT. RES. 137(1):29-32, 1984"
+16169-16-7,CCRIS,1,-1,,ONc1ccc(cc1)[N+](=O)[O-],"CORBETT,MD, WEI,CI AND CORBETT,BR, NITROREDUCTASE-DEPENDENTMUTAGENICITY OF P-NITROPHENYLHYDROXYLAMINE AND ITS N-ACETYL AND N-FORMYLHYDROXAMIC ACIDS, CARCINOGENESIS 6(5):727-732, 1985"
+122-80-5,VITIC,1,-1,,CC(=O)Nc1ccc(N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+716-53-0,EPA1,1,-1,,Clc1c2ccccc2cc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M295,EPA1,1,-1,,CCCCOC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+85-98-3,VITIC,0,-1,,CCN(C(=O)N(CC)c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+128-37-0,VITIC,0,-1,"BHT",Cc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+58-19-5,CCRIS,0,1,,CC1CC2(C)C(CCC3C4CCC(O)C4(C)CCC23)CC1=O,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+NOCAS_M559,EPA1,0,-1,,CC[C@@H](C)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+62573-57-3,EPA3,1,-1,,CCC(CC)c1cccc(OC(=O)N(C)N=O)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+147974-61-6,CCRIS,1,-1,,CC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)C)ccc1N,"TAKAGI,Y, ENDOH,O, GOTO,S, KOHZAKI,K AND MATSUSHITA,H, MUTAGENICITY OFDIAMINODIPHENYLMETHANE AND RELATED COMPOUNDS, KANKYO KAGAKU 5(4):841-845,1995"
+97-18-7,VITIC,0,-1,"BITHIONO,BITIONOLA",Oc1c(Cl)cc(Cl)cc1Sc2cc(Cl)cc(Cl)c2O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+25413-64-3,EPA3,1,-1,,CCCCN(CCC)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+116169-87-0,EPA1,1,-1,,Cn1ccnc1N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+130536-37-7,CCRIS,0,-1,,O1C2C=Cc3ncccc3C12,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+3688-79-7,EPA3,1,-1,,COc1ccc2c3ccccc3C(=O)c4cccc1c24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+35945-34-7,CCRIS,1,-1,,CCN(CC)c1ccc(cc1)N=Nc2ccc(cc2C#N)[N+](=O)[O-],"ELLIOTT,BM, JACKH,R AND JUNG,R, EVALUATION OF THE GENOTOXICITY OF4-DIETHYLAMINO-4'-NITROAZOBENZENE AND SEVEN ANALOGUES, MUTAGENESIS 9(6):517-521, 1994"
+57-92-1,CCRIS,1,-1,,CNC1C(O)C(O)C(CO)OC1OC2C(OC3C(O)C(O)C(N=C(N)N)C(O)C3N=C(N)N)OC(C)C2(O)C=O,"DEFLORA,S, CAMOIRANO,A, ZANACCHI,P AND BENNICELLI,C, MUTAGENICITYTESTING WITH SALMONELLA TYPHIMURIUM STRAINS TA97 AND TA102 OF 30 DNA-DAMAGINGCOMPOUNDS, NEGATIVE WITH OTHER SALMONELLA STRAINS, MUTAT. RES. 134(2-3):159-165,1984"
+26093-31-2,EPA1,0,-1,,CC1=CC(=O)Oc2cc(N)ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95331-48-9,EPA1,1,-1,,CC(=O)N(O)c1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90243-66-6,CCRIS,0,-1,,CC1SCC(NC1=O)C(=O)NC(Cc2c[nH]cn2)C(=O)N3CCCC3C(=O)N,"IWAKURA,K, TAMURA,H, YAMASHITA,Y, KITAYAMA,E, HAMASU,Y, NAGASAWA,H,WATANABE,M AND SUMI,N, MUTAGENICITY STUDIES OF MONTIRELIN HYDRATE (NS-3), J.TOXICOL. SCI. 20(SUPPL. 2):325-334, 1995"
+3366-61-8,EPA1,1,-1,,CC(=O)Nc1ccc(cc1)c2ccc(N)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+834-28-6,VITIC,0,-1,,NC(=N)N=C(N)NCCc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1155-38-0,CCRIS,1,-1,,Cc1c2C3OC3c4ccccc4c2cc5ccccc15,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+132172-57-7,CCRIS,1,-1,,OC1C=Cc2c(C1O)c3cc4ccccc4cc3c5ccccc25,"KUMAR,S, KOLE,PL AND SIKKA,HC, MUTAGENICITY OF DIBENZ[A,C]ANTHRACENEAND ITS DERIVATIVES IN SALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 242(4):337-343,1990"
+NOCAS_M486,EPA1,0,-1,,CCCC[C@@H](CC)COC(=O)CCCCCCCCC(=O)OC[C@H](CC)CCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18024-11-8,EPA1,1,-1,,Cc1ccc(C)c2c1c3ccccc3n2C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+36099-26-0,EPA3,1,-1,,C1O[C@@H]1c2ccc(cc2)c3ccccc3,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+527-17-3,EPA1,0,-1,"DUROQUINO",CC1=C(C)C(=O)C(=C(C)C1=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106-42-3,VITIC,0,-1,"POLYXYLEN.XYLENE",Cc1ccc(C)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+146-22-5,CCRIS,0,-1,"NITRAZPAM",[O-][N+](=O)c1ccc2NC(=O)CN=C(c3ccccc3)c2c1,"WAKISAKA,Y AND NISHIMOTO,Y, MUTAGENICITY STUDY ON A NEW SLEEP INDUCER,A 1H-1,2,4-TRIAZOLYLBENZOPHENONE DERIVATIVE (450191-S), AND ITS METABOLITE INBACTERIA, IYAKUHIN KENKYU 18(1):12-20, 1987"
+6325-54-8,EPA1,1,-1,,ClCc1c2ccccc2cc3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+498-02-2,EPA1,0,-1,"ACETOVANI",COc1cc(ccc1O)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-87-4,VITIC,0,-1,,Cc1ccc(C)c(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13345-62-5,EPA1,1,-1,,Cc1c2ccccc2c(CCl)c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+314084-63-4,CCRIS,0,-1,,CCc1cc(cc(CC)c1N)c2ccccc2,"GLENDE,C SCHMITT,H ERDINGER,L ENGELHARDT,G AND BOCHE,G, TRANSFORMATIONOF MUTAGENIC AROMATIC AMINES INTO NON-MUTAGENIC SPECIES BY ALKYL SUBSTITUENTS.PART I. ALKYLATION ORTHO TO THE AMINO FUNCTION. MUTAT. RES. 498(1-2):19-37,2001"
+121625-58-9,CCRIS,1,-1,,CC1=CC2CCCCC2c3ccccc13,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+110044-40-1,CCRIS,0,-1,,Cc1cc2c3C4OC4C(O)C(O)c3ccc2c5ccccc15,"AMIN,S, HUIE,K, HECHT,SS AND HARVEY,RG, SYNTHESIS OF6-METHYLCHRYSENE-1,2-DIOL-3,4-EPOXIDES AND COMPARISON OF THEIR MUTAGENICITY TO5-METHYLCHRYSENE-1,2-DIOL-3,4-EPOXIDES, CARCINOGENESIS 7(12):2067-2070,1986"
+71-23-8,EPA1,0,-1,"DR9500408,PROPANOL,PROALCHCL",CCCO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2798-25-6,EPA1,1,-1,"BELLIDIFO",COc1cc(O)c2C(=O)c3c(O)ccc(O)c3Oc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99-09-2,VITIC,1,-1,,Nc1cccc(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16757-81-6,EPA1,1,-1,,Cc1ccc2ccc3c4ccccc4cc5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+11042-64-1,CCRIS,0,1,,COc1cc(\C=C\C(=O)OC2CCC34CC35CCC6(C)C(CCC6(C)C5CCC4C2(C)C)C(C)CCC=C(C)C)ccc1O,"TSUSHIMOTO,G, SHIBAHARA,T, AWOGI,T, KANEKO,E, SUTOU,S, YAMAMOTO,K ANDSHIRAKAWA, H, DNA-DAMAGING, MUTAGENIC, CLASTOGENIC AND CELL-CELL COMMUNICATIONINHIBITORY PROPERTIES OF GAMMA-ORYZANOL, J. TOXICOL. SCI. 16(4):191-202,1991"
+7319-59-7,CCRIS,1,-1,,CC(=O)OC1Cc2c(C)ccc3cc4c(ccc5ccccc45)c1c23,"ROGAN,EG, CAVALIERI,EL, WALKER,BA, BALASUBRAMANIAN,R, WISLOCKI,PG,ROTH,RW AND SAUGIER,RK, MUTAGENICITY OF BENZYLIC ACETATES, SULFATES AND BROMIDESOF POLYCYCLIC AROMATIC HYDROCARBONS, CHEM.-BIOL. INTERACT. 58(3):253-275,1986"
+NOCAS_M186,EPA1,1,-1,,C[C@@H](O)[C@H](NC(=O)[C@@H](C)[C@@H](O)[C@@H](C)NC(=O)[C@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@@H](N)C(=O)N)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCCN=C(N)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22181-94-8,EPA1,0,-1,"BUTOCIN",CCOC(=O)CNC(=O)CCCCSc1[nH]cnc2ncnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M412,EPA1,0,-1,,CCCCCCCCCCCCCC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70-34-8,VITIC,1,-1,"FDNB",[O-][N+](=O)c1ccc(F)c(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5381-79-3,CCRIS,1,-1,,Cn1cnc2ccc(cc12)[N+](=O)[O-],"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+57541-73-8,EPA3,1,-1,,Br[C@H]1CCN(C[C@@H]1Br)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+67019-20-9,CCRIS,0,-1,,CCC(=O)Nc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+86-42-0,EPA1,0,-1,"AMODIAQUI,AMODIAHCL",CCN(CC)Cc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+69686-05-1,EPA3,1,-1,,C[C@H]1O[C@@H](Oc2cc(O)c3C(=O)c4c(O)cc(C)cc4C(=O)c3c2)[C@H](O)[C@@H](O)[C@@H]1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+67-66-3,VITIC,0,-1,"CHLOROFOR",ClC(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+142713-63-1,CCRIS,1,-1,,COc1ccc(CNC(=O)C(C)Br)cc1,"DOLZANI,L, TAMARO,M, LAGATOLLA,C, MONTI-BRAGADIN,C, CAVICCHIONI,G,MARCHETTI,P AND D'ANGELI,F, STRUCTURE-ACTIVITY RELATIONSHIP IN THE MUTAGENICEFFECT OF CHIRAL OR RACEMIC 2-BROMOPROPANAMIDES ON SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 19(4):311-315, 1992"
+477-30-5,CCRIS,0,-1,"DEMECOLCI,DEMECOHCL",CNC1CCc2cc(OC)c(OC)c(OC)c2C3=CC=C(OC)C(=O)C=C13,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+118-74-1,VITIC,0,-1,"HEXACLBEN",Clc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+67587-52-4,CCRIS,1,-1,,OC1CN(CCO1)N=O,"HECHT,SS, N-NITROSO-2-HYDROXYMORPHOLINE, A MUTAGENIC METABOLITE OF N-NITROSODIETHANOLAMINE, CARCINOGENESIS 5(12):1745-1747, 1984"
+6943-00-6,EPA1,0,-1,,Clc1ccc(cc1)N2C(=O)CCC2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+220168-45-6,CCRIS,1,-1,,Clc1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+6483-86-9,EPA1,1,-1,,OS(=O)(=O)c1ccc2C(=O)c3c(cccc3[N+](=O)[O-])C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10087-89-5,EPA1,1,-1,"ENPROMATE",O=C(NC1CCCCC1)OC(C#C)(c2ccccc2)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10387-13-0,EPA1,1,-1,,ClCc1c2ccccc2c(CCl)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55380-34-2,EPA3,1,-1,,C[C@@H]1CN(C[C@H](C)N1N=O)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+98-46-4,VITIC,0,-1,,[O-][N+](=O)c1cccc(c1)C(F)(F)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111955-22-7,CCRIS,1,-1,,OC1COC(NCCc2c[nH]c3ccccc23)C(O)C1O,"MERSCH-SUNDERMANN,V AND KRAEMER,H, THE INFLUENCE OF CULTURE CONDITIONSON THE SUSCEPTIBILITY OF SALMONELLA TYPHIMURIUM IN THE SALMONELLA MUTAGENICITYTEST, ZENTRALBL. HYG. UMWELTMED. 193(5):471-480, 1993"
+327-97-9,EPA3,0,-1,,O[C@H]1C[C@](O)(C[C@@H](OC(=O)\C=C/c2ccc(O)c(O)c2)[C@@H]1O)C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+116-66-5,EPA1,0,-1,,Cc1c(cc2c(c1[N+](=O)[O-])C(C)(C)CC2(C)C)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133960-22-2,CCRIS,0,-1,,COC(=O)c1oc(N(O)C(=O)C)c(c2ccccc2)c1c3ccccc3,"SWAMINATHAN,S, HATCHER,JF, YAMAMOTO,K, TANAKA,A, ICHIKAWA,M ANDBRYAN,GT, MUTAGENICITY OF N- AND O-ACETYL DERIVATIVES OF METHYL 3,4-DIPHENYL-5-HYDROXYLAMINO-2-FUROATE AND N-HYDROXY-4-AMINOBIPHENYL IN SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 17(2):84-92, 1991"
+NOCAS_M235,EPA1,1,-1,,O[C@H]1CO[C@H]([C@H](O)[C@@H]1O)N(N=O)c2ccc(cc2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+484-78-6,CCRIS,0,-1,"HOKYNURE3",NC(CC(=O)c1cccc(O)c1N)C(=O)O,"HASHIZUME,T, SANTO,H, TSUJISAWA,H, KOSAKA,K, OZAWA,T, YAMASHITA,M ANDKINAE,N,MUTAGENIC ACTIVITIES OF TRYPTOPHAN METABOLITES BEFORE AND AFTER NITRITETREATMENT, FOOD CHEM. TOXICOL. 29(12):839-844, 1991"
+50-00-0,VITIC,1,-1,"FORMALDEH",C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+56222-35-6,EPA3,1,-1,,O[C@@H]1CCN(C1)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+132-27-4,EPA2,0,-1,"PHPHENOL,LYSOVET",Oc1ccccc1c2ccccc2,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+18172-33-3,GENETOX,1,-1,,CC(=O)C1=C(O)C2C3C(Cc4cccc5[nH]cc3c45)C(C)(C)N2C1=O,"MUTAT RES 25:187-196,1974"
+107673-65-4,EPA1,1,-1,,[O-][N+](=O)C1=Cc2c3c1cccc3cc4ccc5ccccc5c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24930-41-4,CCRIS,1,-1,,c1ccc2c(c1)nc3ccc4cccc5ccc2c3c45,"FUKUHARA,K, HAKURA,A, SERA,N, TOKIWA,H AND MIYATA,N, 1- AND 3-NITRO-6-AZABENZO[A]PYRENES AND THEIR N-OXIDES: HIGHLY MUTAGENIC NITRATED AZAARENES,CHEM. RES. TOXICOL. 5(2):149-153, 1992"
+52021-61-1,EPA3,1,-1,,CC(=O)OCC[C@@H](C=O)c1c(O)cc2C(=O)c3cc(O)cc(O)c3C(=O)c2c1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+146795-26-8,CCRIS,1,-1,,COc1ccc(NC(=O)c2csc(c2)[N+](=O)[O-])cc1,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+116-31-4,EPA3,1,-1,,C\C(=C\C=O)\C=C/C=C(/C)\C=C/C1=C(C)CCCC1(C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+115655-93-1,CCRIS,1,-1,,CC(=CCC[C@@](C)(O)[C@H]1CCC=CC1=O)C,"COMPADRE,CM, HUSSAIN,RA, LOPEZ DE COMPADRE,RL, PEZZUTO,JM ANDKINGHORN,AD, POTENTIAL SWEETENING AGENTS OF PLANT ORIGIN. 14. ANALYSIS OFSTRUCTURAL FEATURES RESPONSIBLE FOR THE SWEETNESS OF THE SESQUITERPENE,HERNANDULCIN, EXPERIENTIA 44(5):447-449, 1988"
+43047-59-2,EPA3,1,-1,,CCN(CC)CCn1nc2ccc(CO)c3c4ccc(Cl)cc4Sc1c23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+94-45-1,VITIC,1,-1,,CCOc1ccc2nc(N)sc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1260-17-9,EPA3,1,-1,,Cc1c(C(=O)O)c(O)cc2C(=O)c3c(O)c(O)c([C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)c(O)c3C(=O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1918-00-9,EPA1,0,-1,"DICAMBA",COc1c(Cl)ccc(Cl)c1C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56980-94-0,CCRIS,0,-1,,CC(=O)c1cc(N)ccc1OCC(O)CNC(C)(C)C,"IWAKURA,K, TAMURA,H, SUMI,N AND NOMURA,A, MUTAGENICITY STUDIES OFMETABOLITES, DEGRADATION PRODUCTS AND IMPURITIES OF CELIPROLOL, OYO YAKURI38(4):305-312, 1989"
+16423-68-0,EPA1,0,-1,,Oc1c(I)cc2c(Oc3c(I)c(O)c(I)cc3C24OC(=O)c5ccccc45)c1I,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1468-95-7,EPA1,1,-1,,OCc1c2ccccc2cc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-75-2,EPA1,0,-1,,CS(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2050-92-2,VITIC,0,-1,,CCCCCNCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+146-56-5,EPA1,0,-1,"FLUPHENAZ,FLUPHEHCL,FLUPHEMAL",OCCN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23043-62-1,EPA1,1,-1,,Nc1ccc2nc3ccccc3c(N)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7790-98-9,VITIC,0,-1,,[O-]Cl(=O)(=O)=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98-55-5,CCRIS,0,-1,"TERPINEOA",CC1=CCC(CC1)C(C)(C)O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+2226-96-2,EPA1,1,-1,,CC1(C)CC(O)CC(C)(C)N1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126370-99-8,CCRIS,1,-1,,COc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,"ROLL,M, SHTELZER,S, STARK,AA AND BLUM,J, STRUCTURE-ACTIVITYRELATIONSHIPS IN MUTAGENICITY AND IN NUCLEOPHILIC RING OPENING OFN-(ARYLMETHYL)PHENANTHRENE 9,10-IMINES, MUTAGENESIS 5(1):25-30, 1990"
+154-41-6,VITIC,0,-1,"NORPSEPHE",C[C@@H](N)[C@@H](O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106-23-0,CCRIS,0,-1,"CITRONEAL",CC(CCC=C(C)C)CC=O,"GOMES-CARNEIRO,MR, FELZENSZWALB,I AND PAUMGARTTEN,FJR, MUTAGENICITYTESTING OF (+/-)-CAMPHOR, 1,8-CINEOLE, CITRAL, CITRONELLAL, (-)-MENTHOL ANDTERPINEOL WITH THE SALMONELLA/MICROSOME ASSAY, MUTAT. RES. 416(1,2):129-136,1998"
+6850-22-2,CCRIS,1,-1,,Cn1cc2ccc(cc2n1)[N+](=O)[O-],"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+73936-27-3,EPA1,1,-1,,Fc1ccc(cc1)C(=O)[C@H]2O[C@@H]2c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117-84-0,VITIC,0,-1,,CCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+17924-92-4,EPA3,0,-1,,C[C@H]1CCCC(=O)CCC\C=C/c2cc(O)cc(O)c2C(=O)O1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+135-51-3,EPA1,0,-1,,Oc1cc2ccc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89641-97-4,CCRIS,1,-1,,[O-][N+](=O)c1cccc2cnsc12,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+852-20-0,CCRIS,0,-1,"OXINIDE",Oc1c(Sc2cc(Cl)cc(c2O)[N+](=O)[O-])cc(Cl)cc1[N+](=O)[O-],"YOSHIMURA,H, NAKAMURA,M AND KOEDA,T, LACK OF MUTAGENICITY OFFASCIOLICIDES, VET. RES. COMMUN. 9(2):147-152, 1985"
+70021-99-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3cc4ccccc4c5ccc1c2c35,"JUNG,H, SHAIKH,AU, HEFLICH,RH AND FU,PP, NITRO GROUP ORIENTATION,REDUCTION POTENTIAL, AND DIRECT-ACTING MUTAGENICITY OF NITRO-POLYCYCLIC AROMATICHYDRO- CARBONS, ENVIRON. MOL. MUTAGEN. 17(3):169-180, 1991"
+139953-78-9,EPA1,1,-1,,COC(=O)c1ccc(\C=N\n2nnc3c4ccccc4nc3c2O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2746-81-8,EPA1,0,-1,"FLUPHEENA",CCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96918-27-3,CCRIS,1,-1,,[O-][N+](=O)c1oc2cc3ccc4cccc5ccc(c2c1)c3c45,"QUILLARDET,P, JENEK,J, DEMERSEMAN,P, ROYER,R AND HOFNUNG,M, GENOTOXICACTIVITY OF TWO FURAN ANALOGS OF BENZO[A]PYRENE AND THEIR 2-NITRO DERIVATIVES,MUTAT. RES. 172(3):223-230, 1986"
+86831-65-4,EPA1,1,-1,,CCN(CC)N(O)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6287-38-3,VITIC,0,-1,,Clc1ccc(C=O)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+75965-74-1,CCRIS,1,-1,"R-7000",COc1ccc2c(ccc3oc(cc23)[N+](=O)[O-])c1,"CASTELAIN,P, HENDRICKX,B, TROMELIN,A, DEMERSEMAN,P AND MOENS,W,MUTAGENIC ACTIVITY OF DICHLOROETHYLAMINO DERIVATIVES OF NITRONAPHTHOFURAN ANDSOME NITROBENZOFURANS IN THE SALMONELLA/MICROSOME ASSAY, MUTAT. RES.280(1):9-15, 1992"
+16339-07-4,GENETOX,1,-1,,CN1CCN(CC1)N=O,"MUTAT RES 48:121-130,1977"
+34049-50-8,CCRIS,0,-1,,CNc1ccc(cc1)N=Nc2ccc(NC)cc2,"MORI,H, MORI,Y, SUGIE,S, YOSHIMI,N, TAKAHASHI,M, NII,H, YAMAZAKI,H,TOYOSHI,K AND WILLIAMS,GM, GENOTOXICITY OF A VARIETY OF AZOBENZENE ANDAMINOAZOBENZENE COMPOUNDS IN THE HEPATOCYTE/DNA REPAIR TEST AND THESALMONELLA/MUTAGENICITY TEST, CANCER RES. 46(4, PT. 1):1654-1658,1986"
+6149-34-4,CCRIS,1,-1,,Nc1ccc(Nc2ccc(cc2)[N+](=O)[O-])cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, MUTAGENICITY OF THE ANTISCHISTOSOMALAGENT AMOSCANATE AND ITS HYDROLYTIC AND RELATED PARA SUBSTITUTED4-NITRODIPHENYLAMINE PRODUCTS, MED. SCI. RES. 20(10):365-368, 1992"
+94-81-5,EPA1,0,-1,,Cc1cc(Cl)ccc1OCCCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-80-5,VITIC,0,-1,"ETGLYETHY",CCOCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+632-79-1,VITIC,0,-1,,Brc1c(Br)c(Br)c2C(=O)OC(=O)c2c1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+94-52-0,EPA2,1,-1,,[O-][N+](=O)c1ccc2[nH]cnc2c1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+552-89-6,GENETOX,1,-1,,[O-][N+](=O)c1ccccc1C=O,"MUTAT RES 168:69-240,1986"
+99-96-7,CCRIS,0,-1,"PARABEN",OC(=O)c1ccc(O)cc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+68-22-4,CCRIS,0,1,,CC12CCC3C(CCC4=CC(=O)CCC34)C1CCC2(O)C#C,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+99-34-3,CCRIS,1,-1,,OC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+24938-64-5,CCRIS,0,-1,,Nc1ccc(NC(=O)c2ccc(cc2)C(=O)O)cc1,"WENING,JV, MARQUARDT,H, KATZER,A, JUNGBLUTH,KH AND MARQUARDT,H,CYTOTOXICITY AND MUTAGENICITY OF KEVLAR: AN IN VITRO EVALUATION, BIOMATERIALS16(4):337-340, 1995"
+6029-82-9,CCRIS,0,-1,,C\C=C(/C)\C(=O)OC1CCN2CC=C(CO)C12,"WEINER,ML, BATT,KJ, PUTMAN,DL, CURREN,RD AND YANG,LL, GENOTOXICITYEVALUATION OF LITHIUM HYPOCHLORITE, TOXICOLGY, 65(1-2):1-22, 1990"
+79-01-6,VITIC,0,-1,"TRICLOROE",ClC=C(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+23245-64-9,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c(cccc12)C#N,"MORIYA,M OHTA,T WATANABE,K MIYAZAWA,T KATO,K AND SHIRASU,Y, FURTHERMUTAGENICITY STUDIES ON PESTICIDES IN BACTERIAL REVERSION ASSAY SYSTEMS, MUTAT.RES. 116(3-4):185-216,1982"
+41069-00-5,EPA1,1,-1,,[O-][N+](=O)c1ccc(cc1)C(=O)[C@H]2O[C@@H]2c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67-48-1,EPA2,0,-1,"CHOLINE,CHOLINECL,CHOLINEIO,CHOLINESE",C[N+](C)(C)CCO,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+130796-74-6,CCRIS,0,-1,,OCC1OC(C(O)C1O)n2cnc3c(NCC(O)COc4cccc5ccccc45)ncnc23,"GUZZIE,PJ, OSHIRO,Y, SOELTER,S, BALWIERZ,PS, YOUNG,RR, GAD,SC ANDPIPER,CE,SELECTION AND EVALUATION OF AN APPROPRIATE MODEL FOR SCREENINGADENOSINE ANALOGS FOR CHROMOSOME ABERRATIONS, TOXICOL. METHODS 1(3):172-187,1991"
+58430-01-6,EPA1,1,-1,,Cc1cc2nc3c(ccc4ccccc34)c(C)c2cc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-86-8,VITIC,0,-1,,CC(=CC=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2648-51-3,EPA1,1,-1,,ClC(=CC=O)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23703-14-2,CCRIS,1,-1,,C(C1CO1)c2ccc(cc2)c3ccccc3,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+NOCAS_M539,EPA1,0,-1,,CCCCCCCCCCCCCCCC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+11012-59-2,EPA1,0,-1,,C\C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)\C=C\C=C(\C)/C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+118517-20-7,EPA1,1,1,,CC(C)CCC[C@@H](C)[C@@H]1CC[C@H]2[C@@H]3C[C@@H]4N(N5C(=O)c6ccccc6C5=O)[C@@]47C[C@H](CC[C@]7(C)[C@H]3CC[C@]12C)OC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89-57-6,VITIC,0,-1,"MESALAZIN",Nc1ccc(O)c(c1)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+603-34-9,VITIC,0,-1,,c1ccc(cc1)N(c2ccccc2)c3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+57333-96-7,CCRIS,0,-1,,CC(C)C(O)CCC(C)C1CCC2\C(=C\C=C\3/CC(O)CC(O)C3=C)\CCCC12C,"KASAHARA,Y, SHINOMIYA,J, NAKAI,Y, KANESAKI,M, YAGI,K, SUZUKI,Y ANDMAKITA,T, TOXICITY STUDIES OF TV-02. 7. MUTAGENICITY STUDIES, YAKURI TO CHIRYO17(10):4773-4780, 1989"
+824-69-1,EPA1,0,-1,,Oc1cc(Cl)c(O)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+77-99-6,VITIC,0,-1,,CCC(CO)(CO)CO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4861-85-2,VITIC,0,-1,,CC(C)OC(=O)Cc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+104010-37-9,CCRIS,0,-1,,CO\N=C(/C(=O)NC1C2SCC(=C(N2C1=O)C(=O)O)CSC(=O)c3occc3)\c4csc(N)n4,"AARON,CS, YU,RL, HARBACH,PR, MAZUREK,JM, SWENSON,DH, KIRKLAND,D,MARSHALL,R AND MCENANEY,S, COMPARATIVE MUTAGENICITY TESTING OF CETIOFUR SODIUM:I. POSITIVE RESULTS IN IN VIVO CYTOGENETICS, MUTAT. RES. 345(1,2):27-35,1995"
+7119-89-3,CCRIS,1,-1,,[O-][N+](=O)C(Cl)Cl,"SCHNEIDER,M, QUISTAD,GB AND CASIDA,JE, GLUTATHIONE ACTIVATION OFCHLOROPICRIN IN THE SALMONELLA MUTAGENICITY TEST, MUTAT. RES. 439(2):233-238,1999"
+87-25-2,VITIC,0,-1,,CCOC(=O)c1ccccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+38915-58-1,EPA1,1,-1,,ClCCNCCCNc1c2ccccc2nc3c1ccc4cccnc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+123442-39-7,CCRIS,0,-1,"HORTENSIN",COc1cc2OC(=C(O)C(=O)c2cc1OC)c3ccc(O)cc3,"CHULASIRI,M, BUNYAPRAPHATSARA,N AND MOONGKARNDI,P, MUTAGENICITY ANDANTIMUTAGENICITY OF FLAVONOIDS EXTRACTED FROM MILLINGTONIA HORTENSIS L., J.TOXICOL. SCI. 23(SUPPL. 2):224-228, 1998"
+120-66-1,EPA3,1,-1,"ACETOLUIO",CC(=O)Nc1ccccc1C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+143-67-9,CCRIS,0,-1,,CCC1(O)CC2CN(CCc3c([nH]c4ccccc34)C(C2)(C(=O)OC)c5cc6c(cc5OC)N(C)C7C(O)(C(OC(=O)C)C8(CC)C=CCN9CCC67C89)C(=O)OC)C1,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+110004-69-8,CCRIS,1,-1,,COc1cc(NS(=O)(=O)C)ccc1Nc2c3ccc(cc3nc4c(C)cccc24)N=N#N,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+17902-23-7,CCRIS,0,-1,"TEGAFUR,TEGAFURNA,TEGAFURUR",FC1=CN(C2CCCO2)C(=O)NC1=O,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+151-56-4,VITIC,1,-1,"AZIRIDINE",C1CN1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+116355-84-1,CCRIS,0,-1,,CCCCC(C)C(OC(=O)CC(CC(=O)O)C(=O)O)C(CC(C)CCCCCCC(O)CC(O)C(C)N)OC(=O)CC(CC(=O)O)C(=O)O,"GELDERBLOM,WC AND SNYMAN,SD, MUTAGENICITY OF POTENTIALLY CARCINOGENICMYCOTOXINS PRODUCED BY FUSARIUM MONILIFORME, MYCOTOXIN RES. 7(2):46-52,1991"
+92116-66-0,CCRIS,0,-1,,Cc1cnc2ccc3c(ncn3C)c2n1,"GRIVAS,S AND JAEGERSTAD,M, MUTAGENICITY OF SOME SYNTHETIC QUINOLINESAND QUINOXALINES RELATED TO IQ, MEIQ OR MEIQX IN AMES TEST, MUTAT. RES. 137(1):29-32, 1984"
+134109-02-7,CCRIS,0,-1,,OC1C=Cc2cc3c(ccc4ccccc34)c(Cl)c2C1O,"FU,PP, VON TUNGELN,LS, UNRUH,LE, NI,Y AND CHOU,MW, COMPARATIVEREGIOSELECTIVE AND STEREOSELECTIVE METABOLISM OF 7-CHLOROBENZ[A]ANTHRACENE AND7-BROMOBENZ[A]-ANTHRACENE BY MOUSE AND RAT LIVER MICROSOMES, CARCINOGENESIS12(3):371-378, 1991"
+132-64-9,VITIC,0,-1,,o1c2ccccc2c3ccccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+874-60-2,EPA1,1,-1,,Cc1ccc(cc1)C(=O)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+123-75-1,EPA1,0,-1,"PYRROLIDI",C1CCNC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4075-79-0,EPA1,1,-1,,CC(=O)Nc1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2085-88-3,CCRIS,1,-1,,CC1(CO1)c2ccccc2,"ROSMAN,LB, BEYLIN,VG, GADDAMIDI,V, HOOBERMAN,BH AND SINSHEIMER,JE,MUTAGENICITY OF PARA-SUBSTITUTED ALPHA-METHYLSTYRENE OXIDE DERIVATIVES WITHSALMONELLA, MUTAT. RES. 171(2-3):63-70, 1986"
+1516-71-8,CCRIS,1,-1,,Cn1c(N=N#N)nc2c3ccccc3ccc12,"WILD,D, AND DIRR,A, MUTAGENIC NITRENES/NITRENIUM IONS FROMAZIDO-IMIDAZOARENES AND THEIR STRUCTURE-ACTIVITY RELATIONSHIP, MUTAGENESIS4(6):446-52, 1989"
+101821-43-6,CCRIS,0,-1,"313-40",NC(=N)c1ccc2c(N)c([nH]c2c1)C(=N)N,"STAUFFERT,I, PAULINI,H, STEINMANN,U, SIPPEL,H AND ESTLER,CJ,INVESTIGATIONS ON MUTAGENICITY AND GENOTOXICITY OF PENTAMIDINE AND SOME RELATEDTRYPANOCIDAL DIAMIDINES, MUTAT. RES. 245(2):93-98, 1990"
+NOCAS_M475,EPA1,0,-1,,O[C@H]1N=C(c2ccccc2)c3cc(Cl)ccc3NC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64099-27-0,EPA1,1,-1,,COc1nsc2c(N)cccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+592-62-1,EPA3,0,-1,,CC(=O)OCN=[N+](C)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+187537-22-0,CCRIS,0,-1,,CC(=O)NCC(O)COc1cccc2ccccc12,"ONO,Y, WU,X, NODA,A, NODA,H, TAKEO,S, NASA,Y, ISAYAMA,Y, IMAI,M ANDSERA,N, BETA-ADRENOCEPTOR ANTAGONISTIC ACTIONS AND MUTAGENICITIES OF R(+)- ANDS(-)-ENANTIOMERS OF N-DESISOPROPYLPROPRANOLOL AND ITS N-ACETYL CONJUGATE, BIOL.PHARM. BULL. 20(1):61-65, 1997"
+17075-03-5,EPA1,1,-1,,Nc1cc2cccc3ccc4cccc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+463-04-7,VITIC,1,-1,,CCCCCON=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+109-21-7,EPA1,0,-1,,CCCCOC(=O)CCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25013-16-5,VITIC,0,-1,,COc1ccc(O)cc1C(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+87185-24-8,CCRIS,1,-1,,[O-][N+](=O)c1cc2cccc(c2cc1[N+](=O)[O-])[N+](=O)[O-],"WHONG,WZ AND EDWARDS,GS, GENOTOXIC ACTIVITY OF NITROAROMATICEXPLOSIVES AND RELATED COMPOUNDS IN SALMONELLA TYPHIMURIUM, MUTAT. RES.136(3):209-215, 1984"
+57409-54-8,CCRIS,0,-1,,CC(Br)(CO)CBr,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+3033-77-0,VITIC,1,-1,,C[N+](C)(C)CC1CO1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+128753-99-1,CCRIS,1,-1,,CC12OOC1(COC(=O)Nc3ccc(Cl)cc3)Oc4ccccc24,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+109-02-4,EPA1,0,-1,,CN1CCOCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39781-21-0,CCRIS,0,-1,,Cc1ccc(cc1C)N=Nc2c(O)ccc3ccccc23,"HAYAKAWA,Y, MIYAGOSHI,M AND NAGAYAMA,T, HYGIENIC STUDIES OF COAL TARDYES USED IN DRUGS AND COSMETICS. II. STRUCTURAL ISOMERS OF RED NO. 505, EISEIKAGAKU 30(4):211-215, 1984"
+58336-35-9,EPA1,1,-1,,O=C1Oc2c3CCCN4CCCc(cc2C=C1)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+541-59-3,EPA1,1,-1,,O=C1NC(=O)C=C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103393-70-0,EPA1,1,-1,,ClCc1cc2c3ccccc3c4cccc(c1)c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125369-79-1,CCRIS,1,-1,,Clc1ccc(cc1)\C(=C\C=C\c2ccccc2)\C#N,"MASLAT,AO AND AL-ARAB,M, MUTAGENIC ACTIVITY OF THREE PENTADIENENITRILEDERIVATIVES OF SUSPECTED HERBICIDAL ACTION,TOXICOL. ENVIRON. CHEM.30(1-2):95-99, 1991"
+2586-60-9,EPA1,1,-1,,Nc1ccc2cc(cc(O)c2c1N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5c(N)ccc6cc(cc(O)c56)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+534-07-6,EPA1,1,-1,,ClCC(=O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134308-13-7,CCRIS,0,-1,"TOLCAPONE",Cc1ccc(cc1)C(=O)c2cc(O)c(O)c(c2)[N+](=O)[O-],"GOCKE,E, ALBERTINI,S, STROBEL,R, SHINDOH,H AND HORII,I, MUTAGENICITYSTUDY OF TOLCAPONE, YAKURI TO CHIRYO 24(SUPPL. 10):S1665-S1683, 1996"
+1239-45-8,VITIC,1,-1,"HOMIDIUM,HOMIDCHLO",CC[n+]1c(c2ccccc2)c3cc(N)ccc3c4ccc(N)cc14,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+159092-74-7,CCRIS,1,-1,,[O-][N+](=O)c1cccc2cc(c3ccccc3c12)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+502-65-8,CCRIS,0,-1,,CC(=CCC\C(=C\C=C\C(=C\C=C\C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C=C(/C)\CCC=C(C)C)\C)\C)\C)C,"AIZAWA,K INAKUMA,T AND OSHIMA,S, ASSESSMENT OF THE MUTAGENICITY OFLYCOPENE BY THE AMES TEST, NIPPON NOGEI KAGAKU KAISHI 74(6):679-681,2000"
+64808-48-6,EPA1,0,-1,"LOBENZARI,LOBENZANA",OC(=O)c1ccccc1Nc2cc(Cl)ccc2C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-73-6,EPA1,0,-1,"PHLOROGLU",Oc1cc(O)cc(O)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+72-14-0,VITIC,0,-1,"AGSULFATH,SULFATHIA,SULFATHNA",Nc1ccc(cc1)S(=O)(=O)Nc2nccs2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13164-04-0,CCRIS,1,-1,,CC(C)(O)C1Cc2cc3C=C(C(=O)Oc3cc2O1)C(C)(C)C=C,"UWAIFO,AO, THE MUTAGENICITIES OF SEVEN COUMARIN DERIVATIVES AND AFURAN DERIVATIVE (NIMBOLIDE) ISOLATED FROM THREE MEDICINAL PLANTS, J. TOXICOL.ENVIRON. HEALTH 13(4-6):521-530, 1984"
+2457-47-8,EPA1,0,-1,,Clc1cncc(Cl)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100129-07-5,CCRIS,0,-1,,CC(Br)C(=O)N(C)Cc1ccccc1,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+756-79-6,VITIC,0,-1,,COP(=O)(C)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+67-64-1,VITIC,0,-1,"ACETONE",CC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+31698-14-3,EPA1,0,-1,,OC[C@H]1O[C@H]2[C@@H](OC3=NC(=N)C=CN23)[C@@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60-24-2,EPA1,0,-1,"MERCAPETH",OCCS,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+736-31-2,EPA1,1,-1,,[O-][N+](=O)c1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70786-65-1,EPA1,1,-1,,CC(=O)N(O)c1ccccc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64810-99-7,EPA1,1,-1,,OS(=O)(=O)Oc1ccc2ccc3cc4ccccc4c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M247,EPA1,1,-1,,CC(C)(C)OC(=O)[C@H](N)CN=[N+]=[N-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16452-01-0,VITIC,1,-1,,COc1cc(N)ccc1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+110520-17-7,EPA1,1,-1,,c1ccc2c(c1)c3ccccc3c4cc5cnccc5cc24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132663-51-5,CCRIS,0,-1,,CCC(=O)OCc1ccccc1[N+](=O)[O-],"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+158729-22-7,CCRIS,0,-1,,Clc1ccccc1NS(=O)(=O)c2cccc3cccnc23,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+148193-30-0,EPA1,1,-1,,Nc1ccc2snc(Cl)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26921-17-5,CCRIS,0,-1,"L-714465",CC(C)(C)NCC(O)COc1nsnc1N2CCOCC2,"HUSSAIN,SS, AL-DAKAN,AA, ABOUL-ENEIN,HY AND HANNAN,MA, DNA STRANDBREAKS AND MUTATIONS CAUSED BY PENBUTOLOL, A BETA BLOCKER, MUTAT. RES.204(4):675-682, 1988"
+106671-91-4,EPA1,1,-1,,Clc1ccc(cc1)c2nc3sccn3c2N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128753-94-6,CCRIS,0,-1,,OCC12OOC1(CO)c3ccccc3O2,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+NOCAS_M136,EPA1,1,-1,,CC[C@@H](C)NC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84-65-1,VITIC,1,-1,"ANTHRAQUI",O=C1c2ccccc2C(=O)c3ccccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+64201-63-4,EPA3,1,-1,,O[C@H]1[C@H](O)[C@H](O[C@H]([C@@H]1O)C(=O)O)N(O)c2ccc(cc2)c3ccccc3,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+484-29-7,EPA1,1,-1,"DICTAMNIN",COc1c2ccoc2nc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+121010-10-4,CCRIS,0,-1,,CC(C)(C)NCC(O)COc1ccccc1C2=CCCC2,"HUSSAIN,SS, ABOUL-ENEIN,HY, AL-DAKAN,A AND HANNAN,MA, MUTAGENICITY OFENANTIOMERS OF PENBUTOLOL, DRUG CHEM. TOXICOL. 12(1):77-83, 1989"
+4635-87-4,CCRIS,0,-1,,C\C=C\CC#N,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T AND MORTELMANS,K, SALMONELLAMUTAGENICITY TESTS. V. RESULTS FROM THE TESTING OF 311 CHEMICALS, ENVIRON. MOL.MUTAGEN. 19(SUPPL.21):2-141, 1992"
+41093-60-1,CCRIS,0,-1,,C[C@@]12CCC[C@](C)([C@H]1CC[C@]34CC(=C)[C@](CC[C@@H]23)(C4)O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(=O)O,"PEZZUTO,JM, COMPADRE,CM, SWANSON,SM, NANAYAKKARA,NPD AND KINGHORN,AD,METABOLICALLY ACTIVATED STEVIOL, THE AGLYCONE OF STEVIOSIDE, IS MUTAGENIC, PROC.NATL. ACAD. SCI. U. S. A. 82(8):2478-2482, 1985"
+74-96-4,VITIC,1,-1,"ETHYLBROM",CCBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+10228-40-7,CCRIS,0,-1,,Cc1cc(O)c2C(=O)c3c(O)c(O)c(O)cc3C(=O)c2c1,"MOROOKA,N, NAKANO,S, ITOI,N AND UENO,Y, THE CHEMICAL STRUCTURE AND THEMUTAGENICITY OF EMODIN METABOLITES, AGRIC. BIOL. CHEM. 54(5):1247-1252,1990"
+NOCAS_M168,EPA1,1,-1,,C[C@@H](O)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109875-47-0,CCRIS,1,-1,,Nc1nc(nc2c1ncn2C3OC(CO)C(O)C3O)c4cccc(c4)[N+](=O)[O-],"MATSUDA,A, OHARA,Y, KAKUTANI,T, NEGISHI,K, WATAYA,Y, HAYATSU,H ANDUEDA,T, 2-(P-NITROPHENYL)-2'-DEOXYADENOSINE, A NEW TYPE OF MUTAGENIC NUCLEOSIDE,NUCLEIC ACIDS RES. 18(7):1833-1838, 1990"
+188699-57-2,VITIC,1,-1,,COc1nc2cccc(CBr)c2nc1OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+51938-12-6,EPA3,1,-1,,CCCN(CCCCO)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+32066-79-8,EPA1,1,-1,,Cc1ccc(cc1)[N+]#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23282-20-4,CCRIS,0,-1,,CC1=CC2OC3C(O)C(O)C(C)(C34CO4)C2(CO)C(O)C1=O,"TAKAHASHI,H, OSADA,K, YAZAKI,H AND KIMURA,S, DETECTION OF MUTAGENICACTIVITY OF MYCOTOXINS BY SALMONELLA TYPHIMURIUM/MICROSOME ASSAY AND ULTRA-WEAKCHEMILUMINESCENCE, 45(2):169-173, 1992"
+612-23-7,VITIC,1,-1,,[O-][N+](=O)c1ccccc1CCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24385-10-2,CCRIS,1,-1,,COc1cccc2C(=O)c3c(O)c4CC(O)(CC(O)c4c(O)c3C(=O)c12)C(=O)CO,"VASIL'EVA,SV, MAKHOVA,EV, EFREMENKOVA,OV AND BARTOSHEVICH,YE:GENOTOXIC AND MUTAGENIC EFFECTS OF ANTITUMOR ANTHRACYCLINES AND AGLYCONES:STUDIES WITH"
+166546-20-9,CCRIS,0,-1,,CN1CCN(CC1)c2ccc3[nH]c(Cc4ccc5[nH]c(nc5c4)c6ccc(cc6)N(CCCl)CCCl)nc3c2,"FERGUSON,LR AND DENNY,WA, MICROBIAL MUTAGENIC EFFECTS OF THE DNA MINORGROOVE BINDER PIBENZIMOL (HOECHST 33258) AND A SERIES OF MUSTARD ANALOGS, MUTAT.RES. 329(1):19-27, 1995"
+624-83-9,VITIC,0,-1,"MEISOCYAN",CN=C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+64-69-7,EPA3,1,-1,"IODOACETA",OC(=O)CI,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+13345-21-6,EPA1,1,-1,,Oc1ccc2ccc3c4ccccc4cc5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106-97-8,VITIC,0,-1,"BUTANE",CCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+161696-99-7,EPA1,1,-1,,CNc1ccc2nc(C)cnc2c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1488-21-7,CCRIS,1,-1,,C1CC23OC2(C1)C=CC=C3,"STARK,AA AND RASTETTER,WH, STRUCTURE-ACTIVITY RELATIONSHIPS IN THEMUTAGENICITY AND CYTOTOXICITY OF PUTATIVE METABOLITES AND RELATED ANALOGS OFBENZENE DERIVED FROM THE VALENCE TAUTOMERS BENZENE OXIDE AND OXEPIN, ENVIRON.MOL. MUTAGEN. 28(3):284-293, 1996"
+135086-91-8,EPA1,1,-1,,Oc1c2nc3ccccc3c2nnn1\N=C\c4ccc(cc4)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+83-44-3,CCRIS,1,1,,CC(CCC(=O)O)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(O)C12C,"WATABE,J AND BERNSTEIN,H, THE MUTAGENICITY OF BILE ACIDS USING AFLUCTUATION TEST, MUTAT. RES. 158(1-2):45-51, 1985"
+92-66-0,VITIC,0,-1,,Brc1ccc(cc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+19331-27-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(Cl)nsc2c1,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+4298-16-2,EPA3,0,-1,"METHAMPHE",CN[C@@H](C)Cc1ccccc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+99-99-0,VITIC,0,-1,"NITROTOLU",Cc1ccc(cc1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+173450-39-0,CCRIS,0,-1,,CCOCCOC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OCCOCC)ccc1N,"TAKAGI,Y, ENDOH,O, GOTO,S, KOHZAKI,K AND MATSUSHITA,H, MUTAGENICITY OFDIAMINODIPHENYLMETHANE AND RELATED COMPOUNDS, KANKYO KAGAKU 5(4):841-845,1995"
+25917-90-2,CCRIS,1,-1,,COc1cc(N)c(cc1N)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+2580-78-1,EPA3,1,-1,,Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc4cccc(c4)S(=O)(=O)CCOS(=O)(=O)O)cc1S(=O)(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+78-97-7,CCRIS,0,-1,,CC(O)C#N,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T AND MORTELMANS,K, SALMONELLAMUTAGENICITY TESTS. V. RESULTS FROM THE TESTING OF 311 CHEMICALS, ENVIRON. MOL.MUTAGEN. 19(SUPPL.21):2-141, 1992"
+98931-07-8,CCRIS,1,-1,,CC1CC2C(Cc3cn(CC=C)c4cccc2c34)N(C1)C#N,"GLATT,H, PERTZ,H, KASPER,R AND EICH,E, CLAVINE ALKALOIDS ANDDERIVATIVES AS MUTAGENS DETECTED IN THE AMES TEST, ANTI-CANCER DRUGS3(6):609-614, 1992"
+56183-12-1,CCRIS,0,-1,,OC1C(O)c2cccc3ccc4cccc1c4c23,"EL-BAYOUMY,K AND HECHT,SS, MUTAGENICITY OF K-REGION DERIVATIVES OF1-NITROPYRENE, REMARKABLE ACTIVITY OF 1- AND3-NITRO-5H-PHENANTHRO[4,5-BCD]PYRAN-5-ONE, MUTAT. RES. 170(1-2):31-40,1986"
+3688-53-7,EPA1,1,-1,"FURYLFURA",NC(=O)\C(=C/c1oc(cc1)[N+](=O)[O-])\c2occc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+127923-98-2,CCRIS,1,-1,,OC(C(O)C(=O)OCCBr)C(=O)OCCBr,"MIN,S, CHAIGNEAU,M, CALLAIS,F AND FESTY,B, MUTAGENIC ACTIVITY OFORGANIC ESTERS LIKELY TO BE FORMED FROM THE 2-BROMOETHANOL GENERATED DURINGFUMIGATION WITH ETHYLENE OXIDE, ANN. PHARM. FR. 47(5):266-275, 1990"
+50-70-4,EPA1,0,-1,"SORBITOL",OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119143-43-0,CCRIS,1,-1,,C1Cc2ccc3ncccc3c2C4OC14,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+61203-01-8,EPA1,1,-1,,CC(=O)C(=C)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+538-74-9,VITIC,0,-1,,C(SCc1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+163275-62-5,CCRIS,0,-1,,Fc1cnc2c(c1)cc(F)c3ccccc23,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+34424-65-2,CCRIS,1,-1,"HOPENTAL4",CC(O)\C=C\C=O,"MARNETT,LJ, HURD,HK, HOLLSTEIN,MC, LEVIN,DE, ESTERBAUER,H AND AMES,BN,NATURALLY OCCURRING CARBONYL COMPOUNDS ARE MUTAGENS IN SALMONELLA TESTER STRAINTA104,MUTAT. RES. 148(1-2):25-34, 1985"
+150446-02-9,CCRIS,0,-1,,Cc1c(\C=N\OCc2ccc(Cl)cc2)c3cc(ccc3n1Cc4ccccc4)[N+](=O)[O-],"HRELIA,P, MOROTTI,M, VIGAGNI,F, BURNELLI,S, GARUTI,L, SABATINO,P ANDCANTELLI-FORTI,G, SYNTHESIS OF A SERIES OF 5-NITRO-(BENZIMIDAZOLES AND INDOLES)AS NOVEL ANTIMYCOTICS AND EVALUATION AS GENOTOXINS IN THE AMES TEST, MUTAGENESIS8(3):183-188, 1993"
+63019-40-9,EPA1,1,-1,,Oc1cccc2ccc3c4ccccc4ccc3c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50-18-0,EPA1,1,-1,,ClCCN(CCCl)[P@]1(=O)NCCCO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108670-79-7,CCRIS,0,-1,,CC\C=C\C=C\C=C\C=C\C=O,"GOVINDAN,SV, KINGSTON,DGI, GUNATILAKA,AAL, VAN TASSELL,RL, WILKINS,TD,DE WIT,PP, VAN DER STEEG,M AND VAN DER GEN,A, SYNTHESIS AND BIOLOGICAL ACTIVITYOF ANALOGS OF FECAPENTAENE-12, J. NAT. PROD. 50(1):75-83, 1987"
+134-29-2,VITIC,1,-1,,COc1ccccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M93,EPA1,1,-1,,C[C@H]1CS(=O)(=O)CCN1\N=C\c2oc(cc2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+145-49-3,EPA1,1,-1,,Nc1ccc(O)c2C(=O)c3c(N)ccc(O)c3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+30095-63-7,CCRIS,0,-1,,CCC1(C)CO1,"GERVASI,PG, CITTI,L, DEL MONTE,M, LONGO,V AND BENETTI,D, MUTAGENICITYAND CHEMICAL REACTIVITY OF EPOXIDIC INTERMEDIATES OF THE ISOPRENE METABOLISM ANDOTHER STRUCTURALLY RELATED COMPOUNDS, MUTAT. RES. 156(1-2):77-82,1985"
+922-63-4,EPA1,1,-1,,CCC(=C)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60877-83-0,CCRIS,1,-1,,Oc1ccc(\C=N\c2snc3c(Cl)cc(Cl)cc23)cc1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+87-29-6,EPA2,0,-1,"CINNANTHR",Nc1ccccc1C(=O)OC\C=C\c2ccccc2,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+91-63-4,EPA1,1,-1,"QUINALDIN",Cc1ccc2ccccc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+124-48-1,VITIC,0,-1,,ClC(Br)Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+91137-28-9,CCRIS,1,-1,,Cc1ccc2ccc(cc2c1)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+80909-78-0,CCRIS,0,-1,,CC1(CO1)c2ccc(Br)cc2,"ROSMAN,LB, BEYLIN,VG, GADDAMIDI,V, HOOBERMAN,BH AND SINSHEIMER,JE,MUTAGENICITY OF PARA-SUBSTITUTED ALPHA-METHYLSTYRENE OXIDE DERIVATIVES WITHSALMONELLA, MUTAT. RES. 171(2-3):63-70, 1986"
+548-04-9,EPA1,0,-1,"HYPERICIN",Cc1cc(O)c2C(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6C(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c56,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-18-9,VITIC,0,-1,"DIISOPRAM,DIPA-DCA,DIISPRHCL",CC(C)NC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2016-88-8,VITIC,1,-1,"AMILORIDE,AMILORHCL",NC(=N)NC(=O)c1nc(Cl)c(N)nc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4403-61-6,EPA3,0,-1,,C\C=C(\C)/C#N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+27776-01-8,VITIC,0,-1,,Cc1ccc(Cc2ccccc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98736-47-1,CCRIS,1,-1,,CN(Cc1cccc(Br)c1)N=O,"SINGER,GM, ANDREWS,AW AND GUO,SM, QUANTITATIVE STRUCTURE-ACTIVITYRELATIONSHIP OF THE MUTAGENICITY OF SUBSTITUTED N-NITROSO-N-BENZYLMETHYLAMINES:POSSIBLE IMPLICATIONS FOR CARCINOGENICITY, J. MED. CHEM. 29(1):40-44,1986"
+116505-02-3,EPA1,1,-1,,CC(=O)ON(C(=O)C)c1ccc(Sc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M464,EPA1,0,-1,,CCC[C@@H](O)[C@@H](CC)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13114-72-2,VITIC,0,-1,,CNC(=O)N(c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M139,EPA1,1,-1,,C1C[C@@H]2O[C@@H]2C[C@@H]1[C@H]3CO3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-90-7,VITIC,0,-1,,Clc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+97-32-5,VITIC,1,-1,,COc1ccc(cc1[N+](=O)[O-])C(=O)Nc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+81-20-9,CCRIS,0,-1,,Cc1cccc(C)c1[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+133831-60-4,EPA1,1,-1,,[O-][N+](=O)c1ccccc1SSC(=C(Cl)Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6369-59-1,EPA2,1,-1,,Cc1cc(NOS(=O)(=O)O)ccc1N,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+69-74-9,CCRIS,0,-1,,NC1=NC(=O)N(C=C1)C2OC(CO)C(O)C2O,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T, MORTELMANS,K AND SPECK,W,SALMONELLA MUTAGENICITY TESTS: III. RESULTS FROM THE TESTING OF 255 CHEMICALS,ENVIRON. MOL. MUTAGEN. 9(SUPPL.9):1-110, 1987"
+4873-56-7,CCRIS,0,-1,,CC(C)COS(=O)(=O)c1ccc(C)cc1,"GLOWIENKE,S, FRIAUFF,W, ALLMENDINGER,T, MARTUS,HJ, SUTER,W ANDMUELLER,L, STRUCTURE-ACTIVITY CONSIDERATIONS AND IN VITRO APPROACHES TO ASSESSTHE GENOTOXICTY OF 19 METHANE-, BENZENE- AND TOLUENESULFONIC ACID ESTERS, MUTAT.RES. 581(1-2):23-34, 2005"
+112022-07-8,EPA1,1,-1,,CN(C)CCNC(=O)c1cccc2C(=O)c3ccccc3Sc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55256-53-6,CCRIS,1,-1,,CC(C)(O)CCc1ccc(O)c2C(=O)c3c(O)c4c(OC5OC=CC45O)cc3Oc12,"KFIR,R, JOHANNSEN,E AND VLEGGAAR,R, MUTAGENIC ACTIVITY OF AUSTOCYSTINS- SECONDARY METABOLITES OF ASPERGILLUS USTUS,BULL. ENVIRON. CONTAM. TOXICOL.37(5):643-650, 1986"
+91-13-4,EPA1,0,-1,,BrCc1ccccc1CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119-36-8,EPA1,1,-1,"MESALICYL",COC(=O)c1ccccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-52-1,CCRIS,1,-1,,BrCCCCBr,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+4238-71-5,EPA1,1,-1,"BENZYLIM1",C(c1ccccc1)n2ccnc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1464-53-5,CCRIS,1,-1,,CCC12OC1O2,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+67-03-8,EPA1,0,-1,"IODOTHIAM,THIAMINE,THIAMIHCL,THIAMTHCY,THIAMINMN",Cc1ncc(C[n+]2csc(CCO)c2C)c(N)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50-89-5,CCRIS,0,-1,,CC1=CN(C2CC(O)C(CO)O2)C(=O)NC1=O,"MARQUADT,H, WESTENDORF,J, SCHAEFER,A, BOLDT,J, DE CLERCQ,E ANDMARQUARDT,H, MUTAGENIC AND ANTIMUTAGENIC EFFECTS OF 5-SUBSTITUTED2'-DEOXYURIDINES DEPENDING ON THE NATURE OF THE 5-SUBSTITUENT, ARZNEIM.-FORSCH.38(12):1820-1824, 1988"
+105802-11-7,EPA1,1,-1,,Cc1c(c2ccccc2c3ccc4ccccc4c13)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+494-90-6,VITIC,0,-1,"MENTHOFUR",CC1CCc2c(C)coc2C1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+32828-84-5,EPA1,1,-1,,CN(C)C1Cc2cccc3cccc(C1)c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131841-09-3,CCRIS,0,-1,,COCCOCCOP1(NP(NP(N1)(OCCOCCOC)OCCOCCOC)(OCCOCCOC)OCCOCCOC)OCCOCCOC,"ALLCOCK,HR, PUCHER,SR, FITZPATRICK,RJ AND RASHID,K, ANTIBACTERIALACTIVITY AND MUTAGENICITY STUDIES OF WATER-SOLUBLE PHOSPHAZENE HIGH POLYMERS,BIOMATERIALS 13(12):857-862, 1992"
+99766-47-9,CCRIS,1,-1,,CCc1cccc(CC)c1N=O,"TESSIER,DM AND CLARK,JM, QUANTITATIVE ASSESSMENT OF THE MUTAGENICPOTENTIAL OF ENVIRONMENTAL DEGRADATIVE PRODUCTS OF ALACHLOR, J. AGRIC. FOODCHEM. 43(9): 2504-2512, 1995"
+118-55-8,VITIC,0,-1,"PHENYLSAL",Oc1ccccc1C(=O)Oc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+118354-50-0,CCRIS,0,-1,,COc1ccc2C3OC3C4CCCCC4c2c1,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+NOCAS_M156,EPA1,1,-1,,CC[C@@H](O)\C=C\C=C\C=C\C=C\C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+581-28-2,EPA1,1,-1,,Nc1ccc2nc3ccccc3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10184-51-7,EPA1,1,-1,,Cn1cnc2C(=N)[N+](=O)[CH-]Nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+394-68-3,EPA1,1,-1,,Fc1cccc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142044-41-5,CCRIS,0,-1,,OC1CC=Cc2cccnc12,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+115664-50-1,CCRIS,1,-1,,Oc1ccc2c3ccccc3c4c(ccc5ccc1c2c45)[N+](=O)[O-],"FU,PP, HEFLICH,RH, VON TUNGELN,LS, MIRANDA,HZ AND EVANS,FE, MICROSOMALMETABOLISM OF 1-NITROBENZO[E]PYRENE TO A HIGHLY MUTAGENIC K-REGION DIHYDRODIOL,CARCINOGENESIS 9(6):951-958, 1988"
+119584-53-1,EPA1,0,-1,,O=C(CN1C(=O)Sc2ccccc12)OCc3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1795-83-1,CCRIS,0,-1,,CC(=O)N(O)c1ccccc1,"WEI,CI, COHEN,MD, SWARTZ,DD, FERNANDO,SY AND CORBETT,MD, MUTAGENICITYOF SOME MONOAROMATIC HYDROXAMIC ACIDS, TOXICOL. LETT. 24(1):111-116,1985"
+20020-02-4,VITIC,0,-1,,Clc1c(Cl)c(Cl)c2ccccc2c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1805-02-3,EPA1,1,-1,,COc1ccc2c(c1)nc(N)n2C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110207-65-3,CCRIS,1,-1,,CCOC(=O)c1c2c(nn[n+]1[O-])c3ccccc3n2C,"LOPEZ DE CERAIN,A, GARCIA,E, GULLON,A, IGNACIO,RJ AND MONGE,A,MUTAGENIC EVALUATION OF SOME TRIAZINO INDOLES USING THE SALMONELLA/MAMMALIANMICROSOME ASSAY, MUTAGENESIS 5(4):307-311, 1990"
+64188-64-3,CCRIS,1,-1,,C(N1C2C1c3ccccc3c4ccccc24)c5ccccc5,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+6051-98-5,EPA1,1,-1,,O=C1c2ccccc2c3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1120-21-4,EPA1,0,-1,,CCCCCCCCCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+611-53-0,CCRIS,0,-1,,NC1=NC(=O)N(C=C1I)C2CC(O)C(CO)O2,"MARQUADT,H, WESTENDORF,J, SCHAEFER,A, BOLDT,J, DE CLERCQ,E ANDMARQUARDT,H, MUTAGENIC AND ANTIMUTAGENIC EFFECTS OF 5-SUBSTITUTED2'-DEOXYURIDINES DEPENDING ON THE NATURE OF THE 5-SUBSTITUENT, ARZNEIM.-FORSCH.38(12):1820-1824, 1988"
+56719-24-5,CCRIS,0,-1,,COC(=O)\C(=C(/OP(=O)(OC)OC)\c1cc(Cl)ccc1Cl)\Cl,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+73-03-0,CCRIS,1,-1,,Nc1ncnc2c1ncn2C3OC(CO)CC3O,"INOUE,T, MURAKAMI,K AND FUFII,T, MUTAGENIC POTENTIAL OF CORDYCEPIN(3'-DEOXYADENOSINE) IN SALMONELLA AND SOYBEAN TESTER STRAINS, MUTAT. RES.174(3):179-182, 1986"
+93943-58-9,CCRIS,0,-1,,CC(CC1=C(COC1O)C=O)C2=CCC(C)(C)C2,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+NOCAS_M264,EPA1,1,-1,,OC[C@H](Cl)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1609-47-8,EPA1,0,-1,"BAYCOVIN",CCOC(=O)OC(=O)OCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4816-14-2,CCRIS,0,-1,"98-202,DIAMIDINE",NC(=N)c1ccc(cc1)c2cc3ccc(cc3s2)C(=N)N,"STAUFFERT,I, PAULINI,H, STEINMANN,U, SIPPEL,H AND ESTLER,CJ,INVESTIGATIONS ON MUTAGENICITY AND GENOTOXICITY OF PENTAMIDINE AND SOME RELATEDTRYPANOCIDAL DIAMIDINES, MUTAT. RES. 245(2):93-98, 1990"
+6926-47-2,CCRIS,1,-1,,N#N=NC(c1ccccc1)c2ccccc2,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+108-50-9,EPA1,1,-1,,Cc1cncc(C)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106532-70-1,CCRIS,1,-1,,CCCCCCCCCC(=O)\N=C\1/SN(C(=O)CCCCCCCCC)c2ccc(cc12)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+NOCAS_M294,EPA1,1,-1,,FC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17372-87-1,EPA1,1,-1,,OC(=O)c1ccccc1C2=C3C=C(Br)C(=O)C(=C3Oc4c(Br)c(O)c(Br)cc24)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108319-06-8,CCRIS,1,-1,"TEMAFLOXA,TEMAFLHCL",CC1CN(CCN1)c2cc3N(C=C(C(=O)O)C(=O)c3cc2F)c4ccc(F)cc4F,"MAMBER,SW, KOLEK,B, BROOKSHIRE,KW, BONNER,DP AND FUNG-TOMC,J, ACTIVITYOF QUINOLONES IN THE AMES SALMONELLA TA102 MUTAGENICITY TEST AND OTHER BACTERIALGENOTOXICITY ASSAYS, ANTIMICROB. AGENTS CHEMOTHER. 37(2):213-217,1993"
+163275-66-9,CCRIS,1,-1,,Fc1cccc2c1ccc3ncccc23,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+51-52-5,EPA3,0,-1,"PROPYLTHI",CCCc1cc(O)nc(S)n1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+134998-79-1,CCRIS,1,-1,,[O-][N+](=O)c1cc2cccc3c4CCCCc4c5cccc1c5c23,"JUNG,H, SHAIKH,AU, HEFLICH,RH AND FU,PP, NITRO GROUP ORIENTATION,REDUCTION POTENTIAL, AND DIRECT-ACTING MUTAGENICITY OF NITRO-POLYCYCLIC AROMATICHYDRO- CARBONS, ENVIRON. MOL. MUTAGEN. 17(3):169-180, 1991"
+2416-94-6,VITIC,0,-1,,Cc1ccc(C)c(O)c1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+125701-97-5,CCRIS,1,-1,,COc1ccc(cc1)c2nc([nH]c2c3ccc(OC)cc3)c4ccc(C)cc4C,"MERCANGOZ,A AND TUYLU,BA, DETECTION OF MUTAGENIC EFFECTS OF 2,4,5,TRI(SUBSTITUTE)PHENYL IMIDAZOLE AND ITS DERIVATIVES IN AMES/SALMONELLA/TESTSYSTEM,TURK. J. BIOL. 24(1):57-64, 2000"
+125974-01-8,EPA1,1,-1,,ClCC1=C(Cl)C(=O)OC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2277-92-1,EPA1,0,-1,"OXYCLOZAN",Oc1c(Cl)cc(Cl)cc1NC(=O)c2c(O)c(Cl)cc(Cl)c2Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-92-0,VITIC,0,-1,"COAMIDE,COROAMIDE,FERAMID,NICOTINAM",NC(=O)c1cccnc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+151109-62-5,EPA1,1,-1,,O[C@H]1C=Cc2c(ccc3c4CCC(=O)c4cc(c23)C(F)(F)F)[C@@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+140-03-4,CCRIS,0,-1,,CCCCCCC(C\C=C\CCCCCCCC(=O)OC)OC(=O)C,"FUJITA,H, AOKI,N AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVESWITH SALMONELLA TYPHIMURIUM TA97 AND TA102. IX, TOKYO-TORITSU EISEI KENKYUSHOKENKYU NENPO 45:191-199, 1994"
+563-12-2,EPA3,0,-1,"ETHION",CCOP(=S)(OCC)SCSP(=S)(OCC)OCC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+111-83-1,CCRIS,0,-1,,CCCCCCCCBr,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+57074-49-4,EPA3,1,-1,,CCO[C@@H]1C[C@@H]2[C@@H](C)C[C@H]3OC(=O)C(=C)[C@H]3C[C@@]2(C)[C@H](OCC)O1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+3031-74-1,CCRIS,1,-1,,CCOO,"BALL,JC, YOUNG,WC, WALLINGTON,TJ AND JAPAR,SM, MUTAGENIC PROPERTIES OFA SERIES OF ALKYL HYDROPEROXIDES, ENVIRON. SCI. TECHNOL. 26(2):397-399,1992"
+575-43-9,VITIC,0,-1,,Cc1ccc2c(C)cccc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1152-48-3,EPA1,1,-1,,[O-][N+](=O)c1ccc(cc1)C(=O)\C=C\c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96-64-0,CCRIS,0,-1,"SOMAN",CC(OP(=O)(C)F)C(C)(C)C,"GOLDMAN,M, KLEIN,AK, KAWAKAMI,TG AND ROSENBLATT,LS, TOXICITY STUDIESON AGENTS GB (SARIN (TYPES I AND II) AND GD (SOMAN), GOV. REP. ANNOUNCE. INDEX(U.S.) 88(10):9-80, 1988"
+NOCAS_M345,EPA1,0,-1,,C[C@@H](CN1c2ccccc2Sc3ccccc13)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16306-16-4,EPA3,1,-1,,Oc1ccc2c3ccccc3C(=O)c4cccc1c24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+60991-01-7,CCRIS,1,-1,,[O-][N+](=O)c1cccc(\C=N\c2snc3ccccc23)c1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+139259-92-0,CCRIS,1,-1,,CC(=O)ON(OCc1ccc(Oc2ccccc2)cc1)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+76-15-3,VITIC,0,-1,,FC(F)(F)C(F)(F)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+97389-17-8,EPA1,1,-1,,Cc1cnc2c(cc(C)c3c2nc(N)n3C)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86854-01-5,CCRIS,0,-1,,O=C1c2c(ccc3ccccc23)c4ccc5ccccc5c14,"MOELLER,M, HAGEN,I AND RAMDAHL,T, MUTAGENICITY OF POLYCYCLIC AROMATICCOMPOUNDS (PAC) IDENTIFIED IN SOURCE EMISSIONS AND AMBIENT AIR, MUTAT. RES.157(2-3): 149-156, 1985"
+92279-99-7,EPA1,1,-1,,COc1cccc2c(NCCCNCCCl)c3ccccc3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+480-81-9,EPA1,1,-1,,C\C=C/1\CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3CC[C@H](OC1=O)[C@@H]23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6638-64-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(OC(=O)c3ccccc23)c1,"WATANABE,T, KAJI,H, TAKASHIMA,M, KASAI,T, LEWTAS,J AND HIRAYAMA,T,METABOLIC ACTIVATION"
+298-81-7,VITIC,1,-1,"METHOXSAL,METHOXSBG",COc1c2OC(=O)C=Cc2cc3ccoc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+70-18-8,CCRIS,1,-1,,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O,"GLATT,H, MUTAGENICITY SPECTRA IN SALMONELLA TYPHIMURIUM STRAINS OFGLUTATHIONE, L-CYSTEINE AND ACTIVE OXYGEN SPECIES, MUTAGENESIS 4(3):221-227,1989"
+933-75-5,VITIC,0,-1,,Oc1c(Cl)ccc(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+63785-41-1,CCRIS,0,-1,,OS(=O)(=O)Oc1ccc2cc3ccc4cccc5ccc(c2c1)c3c45,"IRWIN,SE, KWEI,GY, BLACKBURN,GR, THURMAN,R AND KAUFFMAN,FC,MUTAGENICITY OF BENZO[A]PYRENYL-1-SULFATE IN THE AMES TEST,ENVIRON. MOL.MUTAGEN. 19(3):253- 258, 1992"
+NOCAS_M282,EPA1,1,-1,,C(Oc1cccc(OC[C@H]2CO2)c1)[C@H]3CO3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133-49-3,VITIC,0,-1,,Sc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M19,EPA1,1,-1,,O1[C@H]2C=Cc3cccnc3[C@@H]12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+530-75-6,EPA1,0,-1,"ACSALSALI",CC(=O)Oc1ccccc1C(=O)Oc2ccccc2C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78-38-6,VITIC,0,-1,,CCOP(=O)(CC)OCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+140-66-9,CCRIS,0,-1,,CC(C)(C)CC(C)(C)c1ccc(O)cc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+13104-21-7,CCRIS,0,-1,,COP(=O)(OC)O\C(=C/Br)\c1ccc(Cl)cc1Cl,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+137-17-7,VITIC,1,-1,,Cc1cc(C)c(N)cc1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+81-49-2,VITIC,1,-1,,Nc1c(Br)cc(Br)c2C(=O)c3ccccc3C(=O)c12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M500,EPA1,0,-1,,CCCCCCCC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126-33-0,EPA1,0,-1,,O=S1(=O)CCCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119613-62-6,CCRIS,1,-1,,CCc1cc2ccccc2c3ccc4C(O)C(O)C5OC5c4c13,"AMIN,S, HUIE,K, BALANIKAS,G AND HECHT,SS, SYNTHESIS AND MUTAGENICITYOF 5-ALKYL-SUBSTITUTED CHRYSENE-1,2-DIOL-3,4-EPOXIDES,CARCINOGENESIS 9(12):2305-2308, 1988"
+94574-56-8,CCRIS,1,-1,,CC(=O)OCc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+69657-89-2,EPA3,1,-1,,CCc1ccccc1Nc2ccc(Nc3ccccc3CC)c4C(=O)c5c(O)ccc(O)c5C(=O)c24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+28352-32-1,CCRIS,0,-1,,C1CCC2C(C1)C3OC3c4ccccc24,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+522-19-0,EPA1,1,-1,"DR0007562",COc1cc(OC)c2nc3occc3c(OC)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18028-56-3,CCRIS,1,-1,,Cc1ccc2[nH]c3c(C)ccc(C)c3c2c1,"ANDRE,V, BIOSSART,C, SICHEL,F, GAUDUCHON,P, LE TALAER,JY, LANCELOT,JC,MERCIER,C, CHEMTOB,S, RAOULT,E AND TALLEC,A, MUTAGENICITY OF NITRO- ANDAMINO-SUBSTITUTED CARBAZOLES IN SALMONELLA TYPHIMURIUM. III. METHYLATEDDERIVATIVES OF 9H-CARBAZOLE, MUTAT. RES. 389(2-3):247-260, 1997"
+6441-91-4,CCRIS,0,-1,,Nc1ccc2cc(cc(O)c2c1N=Nc3ccc(cc3S(=O)(=O)O)[N+](=O)[O-])S(=O)(=O)O,"KAUR,A, SANDHU,RS AND GROVER,IS, SCREENING OF AZO DYES FORMUTAGENICITY WITH AMES/SALMONELLA ASSAY, ENVIRON. MOL. MUTAGEN. 22(3):188-190,1993"
+3058-37-5,EPA1,1,-1,,CN=NO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+159092-79-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c3cccc(c3cc(c2c1)[N+](=O)[O-])[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+101-77-9,VITIC,1,-1,,Nc1ccc(Cc2ccc(N)cc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+124-09-4,VITIC,0,-1,"DIAMHEX16,DR9803838,DR9701212,DR9702486",NCCCCCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3029-19-4,EPA1,1,-1,,O=Cc1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109-57-9,VITIC,0,-1,"ALLYLTHIO,ALLYLTHIE",NC(=S)NCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+55256-57-0,CCRIS,1,-1,,CC(C)(O)CCc1ccc(O)c2C(=O)c3c(O)c4C5C=COC5Oc4cc3Oc12,"KFIR,R, JOHANNSEN,E AND VLEGGAAR,R, MUTAGENIC ACTIVITY OF AUSTOCYSTINS- SECONDARY METABOLITES OF ASPERGILLUS USTUS,BULL. ENVIRON. CONTAM. TOXICOL.37(5):643-650, 1986"
+1030-27-9,CCRIS,0,-1,,CN(C)c1ccc(\C=C\C(=O)c2ccccc2)cc1,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+17526-17-9,EPA1,1,-1,,CCOCc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M533,EPA1,0,-1,,CCO[P@](=O)(NC(C)C)Oc1ccc(SC)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98601-02-6,CCRIS,1,-1,,Cc1cc2c(O)cccc2c3cc4C(O)C(O)C=Cc4cc13,"MUSHTAQ,M, FU,PP, MILLER,DW AND YANG,SK, METABOLISM OF6-METHYLBENZ[A]ANTHRACENE BY RAT LIVER MICROSOMES AND MUTAGENICITY OFMETABOLITES, CANCER RES. 45(9): 4006-4014, 1985"
+885-11-0,EPA1,1,-1,"NITROSOPH",CN1N(C(=O)C(=C1C)N=O)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5234-68-4,EPA1,0,-1,"CARBOXIN",CC1=C(SCCO1)C(=O)Nc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+823-40-5,VITIC,1,-1,,Cc1c(N)cccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120042-13-9,CCRIS,1,-1,,CC(N)(CN=[N+]=[N-])C(=O)O,"MANGOLD,JB, MISCHKE,MR AND LAVELLE,JM, AZIDOALANINE MUTAGENICITY INSALMONELLA: EFFECT OF HOMOLOGATION AND ALPHA-METHYL SUBSTITUTION, MUTAT. RES.216(1):27-33, 1989"
+66552-77-0,EPA1,1,-1,,Cc1cc2c(C)c3ccccc3c(C)c2cc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5557-27-7,EPA1,1,-1,,COc1cc(OC)c2C(=O)c3c(O)ccc(OC)c3Oc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+434-07-1,EPA1,0,1,,C[C@]1(O)CC[C@@H]2[C@@H]3CC[C@H]4CC(=C(C[C@]4(C)[C@H]3CC[C@]12C)C=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3179-90-6,VITIC,1,-1,,OCCNc1ccc(NCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+117929-14-3,CCRIS,1,-1,,[O-][N+](=O)c1cc2CCc3cccc4ccc(c1)c2c34,"HIRAYAMA,T, WATANABE,T, AKITA,M, SHIMOMURA,S, FUJIOKA,Y, OZASA,S ANDFUKUI,S, RELATIONSHIPS BETWEEN STRUCTURE OF NITRATED ARENES AND THEIRMUTAGENICITY IN SALMONELLA TYPHIMURIUM, 2- AND 2,7-NITRO SUBSTITUTED FLUORENE,PHENANTHRENE AND PYRENE, MUTAT. RES. 209(1-2):67-74, 1988"
+56856-83-8,EPA1,1,-1,,CN(COC(=O)C)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68162-37-8,CCRIS,1,-1,,COC(=O)\C(=C\c1oc(cc1)[N+](=O)[O-])\[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+13810-83-8,EPA3,0,-1,,OC(=O)c1c(Br)c(Br)c(Br)c(Br)c1C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+134959-55-0,CCRIS,0,-1,,O=C(OCc1ccccc1)c2cccc3cccnc23,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+138580-48-0,EPA1,1,-1,,CN1CCN(CC1)C2=CC(=O)c3[nH]c(C)c4c5ccccc5nc4c3C2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M30,EPA1,1,-1,,O1[C@@H]2C=CC=C[C@H]12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2922-83-0,CCRIS,0,-1,"KYNURENIN",NC(CC(=O)c1ccccc1N)C(=O)O,"HASHIZUME,T, SANTO,H, TSUJISAWA,H, KOSAKA,K, OZAWA,T, YAMASHITA,M ANDKINAE,N,MUTAGENIC ACTIVITIES OF TRYPTOPHAN METABOLITES BEFORE AND AFTER NITRITETREATMENT, FOOD CHEM. TOXICOL. 29(12):839-844, 1991"
+57-68-1,VITIC,0,-1,"SULFADIMI,SULFDIMNA",Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+212-54-4,EPA1,1,-1,,C1c2ccccc2c3ccc4ccc5ccccc5c4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91-59-8,VITIC,1,-1,"NAPHTHABE",Nc1ccc2ccccc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+613-47-8,EPA1,1,-1,,ONc1ccc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+199536-82-8,CCRIS,1,-1,,ClC1=C(COC1=O)C(Br)Br,"LALONDE,RT, BU,L, HENWOOD,A, FIUMANO,J AND ZHANG,L, BROMINE-,CHLORINE-, AND MIXED HALOGEN-SUBSTITUTED 4-METHYL-2(5H)-FURANONES: SYNTHESIS ANDMUTAGENIC EFFECTS OF HALOGEN AND HYDROXYL GROUP REPLACEMENTS,CHEM. RES. TOXICOL.10(12):1427-1436, 1997"
+99-76-3,EPA1,0,-1,"MEPARABEN,MEPARABNA",COC(=O)c1ccc(O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+27451-21-4,EPA1,0,-1,,CC(=O)N(O)c1ccc(C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-92-2,VITIC,0,-1,"DIBUTYLAM",CCCCNCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+62641-68-3,EPA3,1,-1,,CCOC(=O)N(CCO)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+173450-36-7,CCRIS,0,-1,,CCCOC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OCCC)ccc1N,"TAKAGI,Y, ENDOH,O, GOTO,S, KOHZAKI,K AND MATSUSHITA,H, MUTAGENICITY OFDIAMINODIPHENYLMETHANE AND RELATED COMPOUNDS, KANKYO KAGAKU 5(4):841-845,1995"
+135-19-3,VITIC,0,-1,"NAPHTHOLB,NAPHTHBBI",Oc1ccc2ccccc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+87-82-1,VITIC,0,-1,,Brc1c(Br)c(Br)c(Br)c(Br)c1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+91549-71-2,CCRIS,0,-1,,CN(C)CCNC(=O)c1ccc2c(N)c3ccccc3nc2c1,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+57471-01-9,CCRIS,0,-1,,CC(=O)c1cc(NC(=O)NC(C)(C)C)ccc1OCC(O)CNC(C)(C)C,"IWAKURA,K, TAMURA,H, SUMI,N AND NOMURA,A, MUTAGENICITY STUDIES OFMETABOLITES, DEGRADATION PRODUCTS AND IMPURITIES OF CELIPROLOL, OYO YAKURI38(4):305-312, 1989"
+19111-89-8,EPA3,0,-1,,CN(C)C(N(C)C)(c1ccccc1)c2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+144-82-1,VITIC,0,-1,"SULFAMETI,SULFAMEOL",Cc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+580-20-1,EPA1,0,-1,,Oc1ccc2cccnc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M467,EPA1,0,-1,,CC(C)(Oc1ccc(cc1)[C@H]2CCCc3ccccc23)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91379-15-6,CCRIS,1,-1,,CCCC\C=C\C=C\C=C\C=C\C=C\OCC(O)CO,"PETERS,JH, RICCIO,ES, STEWART,KR AND REIST,EJ, MUTAGENIC ACTIVITIES OFFECAPENTAENE DERIVATIVES"
+6217-22-7,EPA1,0,-1,,O=C1C(=O)c2cccc3ccc4cccc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55984-51-5,EPA1,1,-1,,CN(CC(=O)C)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26444-49-5,VITIC,0,-1,,Cc1cccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6926-44-9,EPA1,1,-1,,[N-]=[N+]=NCCc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1211-40-1,EPA1,1,-1,,Nc1ccc(cc1)c2ccc(cc2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112022-10-3,EPA1,1,-1,,CN(C)CCNC(=O)c1cccc2Oc3ccccc3Oc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+144-83-2,VITIC,0,-1,"SULFAPYCA,SULPYRIDI,SULFAPYAL,SULFAPYNA",Nc1ccc(cc1)S(=O)(=O)Nc2ccccn2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2122-77-2,EPA1,0,-1,,OCCOc1cc(Cl)c(Cl)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-21-8,VITIC,1,-1,"ETHYLENEO",C1CO1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+84174-22-1,EPA1,1,-1,,CN(Cc1ccc(Cl)cc1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+152-18-1,EPA1,0,-1,,COP(=S)(OC)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+83-46-5,VITIC,0,1,,CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+94740-40-6,EPA1,1,-1,,CC(=O)N1CCC[C@H]1C(=O)N(CC(=O)O)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50656-61-6,CCRIS,0,-1,,CC1C=C(C=O)C(=CC2CC(C)(C)CC12)C=O,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+124390-37-0,CCRIS,1,-1,,Cc1cc2ccccc2c3cc(c4ccccc4c13)[N+](=O)[O-],"EL-BAYOUMY,K, SHIUE,GH, AMIN,S AND HECHT,SS, THE EFFECTS OF BAY-REGIONMETHYL SUBSTITUTION ON 6-NITROCHRYSENE MUTAGENICITY IN SALMONELLA TYPHIMURIUMAND TUMORIGENICITY IN NEWBORN MICE, CARCINOGENESIS (LONDON) 10(9):1685-9,1989"
+126370-98-7,CCRIS,1,-1,,COc1cccc(CN2C3C2c4ccccc4c5ccccc35)c1,"ROLL,M, SHTELZER,S, STARK,AA AND BLUM,J, STRUCTURE-ACTIVITYRELATIONSHIPS IN MUTAGENICITY AND IN NUCLEOPHILIC RING OPENING OFN-(ARYLMETHYL)PHENANTHRENE 9,10-IMINES, MUTAGENESIS 5(1):25-30, 1990"
+128-39-2,VITIC,0,-1,"DR9901556",CC(C)(C)c1cccc(c1O)C(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+14628-90-1,CCRIS,1,-1,,COC1=CC=C(C=CC1=O)[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+23355-97-7,CCRIS,0,-1,,C[C@@H]1O[C@H]1c2ccccc2,"KRAEMER,A, PUDIL,J, FRANK,H, OESCH,F AND GLATT,H, SOME SUBSTRATES ANDINHIBITORS OF CYTOSOLIC EPOXIDE HYDROLASE INDUCE SISTER-CHROMATID EXCHANGES INMAMMALIAN CELLS, BUT DO NOT INDUCE GENE MUTATIONS IN SALMONELLA TYPHIMURIUM ANDV79 CELLS, MUTAT. RES. 290(2):165-174, 1993"
+1214-39-7,CCRIS,0,-1,"DR9808141",C(Nc1[nH]cnc2ncnc12)c3ccccc3,"PAVLICA,M, PAPES,D, FRANEKIC,J AND NAGY,B, EFFECTS OF BENZYLADENINE ONPROKARYOTIC AND EUKARYOTIC CELLS, MUTAT. RES. 281(4):277-282, 1992"
+38861-78-8,VITIC,0,-1,,CC(C)Cc1ccc(cc1)C(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+61477-96-1,CCRIS,0,-1,,CCN1CCN(C(=O)NC(C(=O)NC2C3SC(C)(C)C(N3C2=O)C(=O)O)c4ccccc4)C(=O)C1=O,"OHUCHIDA,A, TANIGUTI,A, KOUCHI,Y, MAEDA,Y, KASHIHARA,A AND OMAE,S,MUTAGENICITY TESTS OF TAZOBACTAM/PIPERACILLIN, TAZOBACTAM AND PIPERACILLIN, J.TOXICOL. SCI. 19(SUPPL. 2):263-280, 1994"
+98911-08-1,EPA1,1,-1,,CC(=O)N(O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+525-64-4,EPA1,1,-1,,Nc1ccc2c(Cc3cc(N)ccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53693-68-8,CCRIS,0,-1,,CCN(CC)c1ccc(cc1)c2ccc(cc2)c3ccc(cc3)c4ccc(cc4)N(CC)CC,"WUEBBLES,BJY AND FELTON,JS, EVALUATION OF LASER DYE MUTAGENICITY USINGTHE AMES/ SALMONELLA MICROSOME TEST, ENVIRON. MUTAGEN. 7(4):511-522,1985"
+80115-73-7,EPA1,1,-1,,CCC(=O)N(O)c1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+79560-36-4,CCRIS,1,-1,,COCc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+36193-75-6,EPA3,1,-1,,Nc1cnc2ccc3ccccc3c2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+55-55-0,VITIC,1,-1,,CNc1ccc(O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+142-83-6,EPA3,1,-1,,C\C=C/C=C\C=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+524-42-5,EPA1,1,-1,"NAPHQUI12",O=C1C=Cc2ccccc2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132832-26-9,CCRIS,1,-1,,OC1C2OC2c3cc4c5ccccc5c6ccccc6c4cc3C1O,"GLATT,H, PIEE,A, PAULY,K, STEINBRECHER,T, SCHRODE,R, OESCH,F ANDSEIDEL,A, FJORD- AND BAY-REGION DIOL-EPOXIDES INVESTIGATED FOR STABILITY, SOSINDUCTION IN ESCHERICHIA COLI, AND MUTAGENICITY IN SALMONELLA TYPHIMURIUM ANDMAMMALIAN CELLS,CANCER RES. 51(6):1659-1667, 1991"
+NOCAS_M535,EPA1,0,-1,,CCCCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)CC[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)O[C@H]1[C@H](O)[C@@H](CO)O[C@@H](O)[C@H]1NC(=O)C)C(=O)N)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2314-61-6,EPA1,0,-1,,S=C1SC=C(S1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71-43-2,VITIC,0,-1,"BENZENE",c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4938-72-1,VITIC,0,-1,,CC(C)COC(=O)COc1cc(Cl)c(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+933-78-8,VITIC,0,-1,,Oc1cc(Cl)cc(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105553-32-0,CCRIS,1,-1,,CN(N=O)N(C(=O)\C(=N/O)\C(=O)C)c1ccccc1,"OHTA,T, ASABE,Y AND TAKITANI,S, IDENTIFICATION OF MUTAGENICNITROSATION PRODUCTS OF ANTIPYRINE AND EVALUATION OF THEIR FORMATION UNDERSTOMACH CONDITIONS, CHEM. PHARM. BULL. 34(9):3866-3872, 1986"
+55-38-9,EPA2,0,-1,"FENTHION",COP(=S)(OC)Oc1ccc(SC)c(C)c1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+7493-63-2,VITIC,0,-1,,Nc1ccccc1C(=O)OCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+520-26-3,CCRIS,0,-1,,COc1ccc(cc1O)C2CC(=O)c3c(O)cc(OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)cc3O2,"PRIVAL,MJ, SIMMON,VF AND MORTELMANS,KE, BACTERIAL MUTAGENICITY TESTINGOF 49 FOOD INGREDIENTS GIVES VERY FEW POSITIVE RESULTS, MUTAT. RES.260(4):321-329, 1991"
+NOCAS_M392,EPA1,0,-1,,C=C[C@H]1CCC=CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16804-85-6,CCRIS,1,-1,,C1CCC2C(C1)C=Cc3ccccc23,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+1088-56-8,EPA1,1,-1,"LUMIFLAVI",CN1C2=NC(=O)NC(=O)C2=Nc3cc(C)c(C)cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M472,EPA1,0,-1,,NC(=O)CN1C[C@H](O)CC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-94-1,VITIC,0,-1,"GLUTARATE",OC(=O)CCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+97-53-0,VITIC,0,-1,"EUGENOL",COc1cc(CC=C)ccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95791-46-1,EPA1,1,-1,,Clc1cc2c3ccccc3ccc2c4ccccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96-17-3,CCRIS,0,-1,,CCC(C)C=O,"AESCHBACHER,HU, WOLLEB,U, LOLIGER,J, SPADONE,JC AND LIARDON,R,CONTRIBUTION OF COFFEE AROMA CONSTITUENTS TO THE MUTAGENICITY OF COFFEE, FOODCHEM. TOXICOL. 27(4):227-232, 1989"
+13071-79-9,VITIC,0,-1,"TERBUFOS",CCOP(=S)(OCC)SCSC(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1300-72-7,EPA1,0,-1,,Cc1ccc(cc1C)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+102059-18-7,EPA1,1,-1,,CC(=O)Nc1ccc(\C=C\C(=O)c2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3524-68-3,VITIC,0,-1,,OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120-80-9,VITIC,0,-1,"ACC-10255,PYROCATEC",Oc1ccccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107817-59-4,CCRIS,0,-1,,NC(CSC\C=C\Cl)C(=O)O,"DEKANT,W, VAMVAKAS,S, BERTHOLD,K, SCHMIDT,S, WILD,D AND HENSCHLER,D,BACTERIAL BETA-LYASE-MEDIATED CLEAVAGE AND MUTAGENICITY OF CYSTEINE CONJUGATESDERIVED FROM THE NEPHROCARCINOGENIC ALKENES TRICHLOROETHYLENE,TETRACHLOROETHYLENE AND HEXACHLOROBUTADIENE, CHEM.-BIOL. INTERACT. 60(1):31-45,1986"
+NOCAS_M111,EPA1,1,-1,,CC(=O)O[C@@H]1Cc2c3ccc4ccccc4c3cc5ccc(C)c1c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+32795-84-9,CCRIS,1,-1,,Brc1c2ccccc2cc3c1ccc4ccccc34,"FU,PP, VON TUNGELN,LS, UNRUH,LE, NI,Y AND CHOU,MW, COMPARATIVEREGIOSELECTIVE AND STEREOSELECTIVE METABOLISM OF 7-CHLOROBENZ[A]ANTHRACENE AND7-BROMOBENZ[A]-ANTHRACENE BY MOUSE AND RAT LIVER MICROSOMES, CARCINOGENESIS12(3):371-378, 1991"
+879-39-0,VITIC,0,-1,,[O-][N+](=O)c1cc(Cl)c(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5296-38-8,CCRIS,1,-1,,C(Oc1ccc(Cc2ccccc2)cc1)C3CO3,"ROSMAN,LB, CHAKRABORTY,PK, MESSERLY,EA AND SINSHEIMER,JE, MUTAGENICITYOF AROMATIC GLYCIDYL ETHERS WITH SALMONELLA, MUTAT. RES. 206(1):115-125,1988"
+55556-92-8,EPA2,1,-1,,O=NN1CCC=CC1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+275795-16-9,CCRIS,1,-1,,CC(C)(C)c1cc(ccc1N=O)c2ccccc2,"HAACHK,T ERDINGER,L AND BOCHE,G, MUTAGENICITY IN SALMONELLATYPHIMURIUM TA98 AND TA100 OF NITROSO AND RESPECTIVE HYDROXYLAMINE COMPOUNDS,MUTAT. RES. 491(1-2):183-193, 2001"
+26471-62-5,VITIC,1,-1,,Cc1cc(cc(c1)C#N=O)C#N=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60967-89-7,GENETOX,1,-1,,O[C@@H]1C=Cc2c(ccc3cc4ccccc4cc23)[C@H]1O,"BIOCHEM BIOPHYS RES COMMUN 72:680-686,1976"
+19996-03-3,EPA1,1,-1,,ClCc1c2ccccc2c(Cl)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+42713-66-6,GENETOX,1,-1,,N[C@H](CCCN(N=O)C(=O)N)C(=O)O,"MUTAT RES 48:131-138,1977"
+96018-75-6,CCRIS,0,-1,,ON(C=O)c1cccc(Cl)c1,"WEI,CI, COHEN,MD, SWARTZ,DD, FERNANDO,SY AND CORBETT,MD, MUTAGENICITYOF SOME MONOAROMATIC HYDROXAMIC ACIDS, TOXICOL. LETT. 24(1):111-116,1985"
+17455-23-1,CCRIS,0,-1,"DICY24CR8",C1CCC2OCCOCCOCCOC3CCCCC3OCCOCCOCCOC2C1,"ARENAZ,P, BITTICKS,L, PANNELL,K AND GARCIA,S, GENOTOXIC POTENTIAL OFCROWN ETHERS IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 4(6), 437-8, 1989"
+3290-92-4,EPA1,1,-1,,CCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78658-61-4,CCRIS,0,-1,,CCCCN(CC(O)c1ccc(O)cc1)N=O,"KIKUGAWA,K, KATO,T AND TAKEDA,Y, FORMATION OF A HIGHLY MUTAGENIC DIAZOCOMPOUND FROM THE BAMETHAN-NITRITE REACTION, MUTAT. RES. 177(1):35-43,1987"
+53499-68-6,EPA1,1,-1,,CNc1ccc(cc1)N=Nc2ccc(cc2)N(C)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6755-16-4,CCRIS,1,-1,,CCNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+84-69-5,VITIC,0,-1,"DIIBUPHTH",CC(C)COC(=O)c1ccccc1C(=O)OCC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+129117-54-0,EPA1,1,-1,,COc1ccc2[nH]c3c(C)cc(N)c(C)c3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55-80-1,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2cccc(C)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24085-06-1,EPA1,1,-1,,CC(=O)OCc1cc(ccc1OC(=O)C)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57470-78-7,CCRIS,0,-1,"CELIPROLO,CELIPRHCL",CCN(CC)C(=O)Nc1ccc(OCC(O)CNC(C)(C)C)c(c1)C(=O)C,"HUSSAIN,SS, AL-DAKAN,AA, ABOUL-ENEIN,HY AND HANNAN,MA, DNA STRANDBREAKS AND MUTATIONS CAUSED BY PENBUTOLOL, A BETA BLOCKER, MUTAT. RES.204(4):675-682, 1988"
+1684-40-8,VITIC,1,-1,"TACRINE,TACRINHCL",Nc1c2CCCCc2nc3ccccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+535-83-1,EPA1,0,-1,"TRIGONELL",C[n+]1cccc(c1)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86-00-0,VITIC,0,-1,,[O-][N+](=O)c1ccccc1c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M334,EPA1,0,1,"NORETHIAC",CC(=O)O[C@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)C#C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88847-89-6,CCRIS,0,-1,,Nc1nc(O)c2nc(O)n(C3CC(O)C(CO)O3)c2n1,"ARASHIDANI,K, IWAMOTO-TANAKA,N, MURAOKA,M AND KASAI,H, GENOTOXICITY OFRIBO- AND DEOXYRIBONUCLEOSIDES OF 8-HYDROXYGUANINE, 5-HYDROXYCYTOSINE, AND2-HYDROXYADENINE: INDUCTION OF SCE IN HUMAN LYMPHOCYTES AND MUTAGENICITY INSALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 403(1-2):223-227, 1998"
+35509-27-4,CCRIS,1,-1,,N#Cc1cccc2cccnc12,"SMITH,CJ, HANSCH,C AND MORTON,MJ, QSAR TREATMENT OF MULTIPLETOXICITIES: THE MUTAGENICITY AND CYTOTOXICITY OF QUINOLINES, MUTAT. RES.379(2):167-175, 1997"
+25870-67-1,EPA1,1,-1,,[O-][N+](=O)c1ccc(\C=C\C(=O)c2ccc(cc2)[N+](=O)[O-])cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1768-31-6,EPA1,1,-1,,ClC(Cl)C(=O)C(Cl)(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108278-71-3,CCRIS,1,-1,,NC(=O)N(CCC(=O)O)N=O,"JANZOWSKI,C, JACOB,D, HENN,I, ZANKL,H, POOL-ZOBEL,BL, WIESSLER,M ANDEISENBRAND,G,MECHANISM OF ACTION OF THE URINARY BLADDER CARCINOGENN-NITROSOBUTYL-3-CARBOXYPROPYLAMINE, IARC SCI. PUBL. 105(RELEVANCE HUM. CANCERN-NITROSO COMPD., TOB. MYCOTOXINS):332-338, 1991"
+105-13-5,EPA1,0,-1,"ANISEALCO",COc1ccc(CO)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39147-43-8,EPA1,1,-1,,Oc1ccc2cc3c4ccccc4c5ccccc5c3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2403-27-2,CCRIS,0,-1,,Brc1ccc(cc1)C(=O)\C=C\c2ccccc2,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+1849-36-1,EPA1,1,-1,,[O-][N+](=O)c1ccc(S)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108618-29-7,CCRIS,1,-1,,Nc1ccc(\C=C\c2ccc(cc2)C#N)cc1,"YOU,Z, BREZZELL,MD, DAS,SK, HOOBERMAN,BH AND SINSHEIMER,JE,SUBSTITUENT EFFECTS ON THE IN VITRO AND IN VIVO GENOTOXICITY OF 4-AMINOBIPHENYLAND 4-AMINOSTILBENE DERIVATIVES, MUTAT. RES. 320(1-2):45-58, 1994"
+99-59-2,EPA2,1,-1,,COc1ccc(cc1N)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+77-95-2,EPA3,0,-1,,O[C@@H]1C[C@@](O)(C[C@H](O)[C@H]1O)C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+10443-65-9,EPA1,0,-1,,OC(=O)C(=C)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24191-98-8,CCRIS,1,-1,,CN1CC(O)c2cc3OCOc3c4c5ccccc5CC1c24,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+59405-51-5,CCRIS,1,-1,,Cc1cc(N=Nc2cccnc2)c(N)cc1N,"SHAHIN,MM, MUTAGENICITY OF STRUCTURALLY RELATED PHENYLAZO-3-PYRIDINESIN SALMONELLA TYPHIMURIUM, CELL BIOL. TOXICOL. 9(1):33-47, 1993"
+2528-36-1,VITIC,0,-1,,CCCCOP(=O)(OCCCC)Oc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+123-51-3,VITIC,0,-1,"ISOPENTOL",CC(C)CCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60-09-3,VITIC,1,-1,"DR9604339",Nc1ccc(cc1)N=Nc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+69658-13-5,EPA3,1,-1,,OC(=O)CSc1ccc2c3ccccc3C(=O)c4cccc1c24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1904-98-9,EPA1,0,-1,"DIAMIPU26",Nc1nc(N)c2[nH]cnc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+612-24-8,CCRIS,0,-1,,[O-][N+](=O)c1ccccc1C#N,"SHIMIZU,M AND YANO,E, MUTAGENICITY OF MONO-NITROBENZENE DERIVATIVES INTHE AMES TEST AND REC ASSAY, MUTAT. RES. 170(1-2):11-22, 1986"
+64896-26-0,EPA1,0,-1,"SALICYLAZ",OC(=O)c1ccc(cc1)N=Nc2ccc(O)c(c2)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+612-41-9,CCRIS,0,-1,,OC(=O)\C=C\c1ccccc1[N+](=O)[O-],"EDER,E, DEININGER,C AND MUTH,D, GENOTOXICITY OF P-NITROCINNAMALDEHYDEAND RELATED ALPHA,BETA-UNSATURATED CARBONYL COMPOUNDS IN TWO BACTERIAL ASSAYS,MUTAGENESIS 6(4):261-269, 1991"
+130-13-2,CCRIS,0,-1,"NAPHTHION",Nc1ccc(c2ccccc12)S(=O)(=O)O,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+83-75-0,CCRIS,0,-1,,CCOC(=O)OC(C1CC2CCN1CC2C=C)c3ccnc4ccc(OC)cc34,"SIDEROPOULOS,AS AND SPECHT,SM, EVALUATION OF MICROBIAL TESTING METHODSFOR THE MUTAGENICITY OF QUINOLINE AND ITS DERIVATIVES, CURR. MICROBIOL. 11(2):59-65, 1984"
+32306-29-9,EPA1,0,-1,,CCOP(=O)(OCC)Oc1cc(on1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131229-61-3,CCRIS,1,-1,,CCCCON(OC(=O)C)C(=O)c1ccc(C)cc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+53175-28-3,CCRIS,1,-1,,C\C=C(/Cl)\C=O,"EDER,E, WEINFURTNER,E AND EDER MMG, GENOTOXICITY OF HALOGENATEDPROPENALS, ENVIRONMENTALLY RELEVANT OXYGEN CONTAINING SHORT CHAIN HALOCARBONS,ORGANOHALOGEN COMPD. 21(DIOXIN '94):239-242, 1994"
+112368-25-9,CCRIS,0,-1,,OC(=O)CCC(=O)Nc1ccc(Cl)c(Cl)c1Cl,"RASHID,KA, ARJMAND,M, SANDERMANN,H AND MUMMA,RO, MUTAGENICITY OFCHLOROANILINE/LIGNIN METABOLITES IN THE SALMONELLA/MICROSOME ASSAY, J. ENVIRON.SCI. HEALTH, PART B B22(6):721-729, 1987"
+51568-18-4,EPA1,0,-1,"SUCCINACE",CC(=O)CC(=O)CCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+122551-89-7,EPA1,1,-1,,ClC(Cl)C1=C(Cl)C(=O)OC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2082-81-7,EPA1,0,-1,,CC(=C)C(=O)OCCCCOC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5598-15-2,EPA1,0,-1,,CCOP(=O)(OCC)Oc1nc(Cl)c(Cl)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+633-03-4,EPA1,1,-1,,CCN(CC)c1ccc(cc1)C(=C2C=CC(=[N+](CC)CC)C=C2)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-40-0,VITIC,0,-1,"DIETTRIEN",NCCNCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+155164-59-3,CCRIS,0,-1,,COc1ccc(cc1)S(=O)(=O)N2N=CC(=C(Cl)C2=O)Cl,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+569-61-9,VITIC,1,-1,,Nc1ccc(cc1)C(=C2C=CC(=N)C=C2)c3ccc(N)cc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95-14-7,EPA1,1,-1,,c1ccc2[nH]nnc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3160-37-0,EPA3,0,-1,,CC(=O)\C=C/c1ccc2OCOc2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+145439-00-5,EPA1,1,-1,,CN(N=O)C(=O)c1c(ncn1C)N(C)C(=O)OC(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2498-76-2,EPA1,1,-1,,Cc1ccc2ccc3cc4ccccc4cc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+399-10-0,CCRIS,0,-1,,Fc1ccc(cc1)C(=O)\C=C\c2ccccc2,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+3342-98-1,EPA3,1,-1,,Cc1ccc2cc3c(ccc4ccccc34)c5[C@@H](O)Cc1c25,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M271,EPA1,1,-1,"AKLAVINON",CC[C@]1(O)C[C@@H](O)c2c(O)c3C(=O)c4c(O)cccc4C(=O)c3cc2[C@@H]1C(=O)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14992-81-5,CCRIS,0,-1,,Clc1c(Cl)c(Cl)c(C=C)c(Cl)c1Cl,"TARKPEA,M, HAGEN,I, CARLBERG,GE, KOLSAKER,P AND STORFLOR,H,MUTAGENICITY, ACUTE TOXICITY, AND BIOACCUMULATION POTENTIAL OF SIX CHLORINATEDSTYRENES, BULL. ENVIRON. CONTAM. TOXICOL. 35(4):525-530, 1985"
+60-12-8,VITIC,0,-1,"PHENYLETH",OCCc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+123-38-6,VITIC,0,-1,"PROPALDEH",CCC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2386-87-0,CCRIS,1,-1,,O=C(OCC1CCC2OC2C1)C3CCC4OC4C3,"SCHWEIKL,H SCHMALZ,G AND WEINMANN,W MUTAGENIC ACTIVITY OF STRUCTURALLYRELATED OXIRANES AND SILORANES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.521(1-2):19-27, 2002"
+105453-64-3,CCRIS,1,-1,,OC1C=Cc2c(ccc3cc4c(ccc5ccccc45)cc23)C1O,"PLATT,KL, SCHOLLMEIER,M, FRANK,H AND OESCH,F, STEROSELECTIVEMETABOLISM OF DIBENZ[A,H]ANTHRACENE TO TRANS-DIHYDRODIOLS AND THEIR ACTIVATIONTO BACTERIAL MUTAGENS, ENVIRON. HEALTH PERSPECT. 88:37-41, 1990"
+999-81-5,EPA2,0,-1,"CHLORMEQU,CLCHOLINE",C[N+](C)(C)CCCl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+85-91-6,EPA1,0,-1,,CNc1ccccc1C(=O)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+621-52-3,CCRIS,0,-1,,CCOc1cccc(c1)[N+](=O)[O-],"SHIMIZU,M AND YANO,E, MUTAGENICITY OF MONO-NITROBENZENE DERIVATIVES INTHE AMES TEST AND REC ASSAY, MUTAT. RES. 170(1-2):11-22, 1986"
+79660-72-3,EPA1,1,-1,"RO-236240",CN1CCN(CC1)c2c(F)cc3C(=O)C(=CN(CCF)c3c2F)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25703-79-1,VITIC,0,-1,,CC(O)COC(=O)C(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+73341-53-4,CCRIS,1,-1,,Cc1cccn2c1nc3ccc(NO)nc23,"WATANABE,M, ISHIDATE,M.,JR. AND NOHMI,T, SENSITIVE METHOD FOR THEDETECTION OF MUTAGENIC NITROARENES AND AROMATIC AMINES: NEW DERIVATIVES OFSALMONELLA TYPHIMURIUM TESTER STRAINS POSSESSING ELEVATED O-ACETYLTRANSFERASELEVELS, MUTAT. RES. 234(5):337-348, 1990"
+4460-86-0,VITIC,0,-1,"ASARYLALD",COc1cc(OC)c(C=O)cc1OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+148193-36-6,CCRIS,1,-1,,COc1nsc2c(OCC3CO3)cccc12,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+58-93-5,VITIC,0,-1,"HYDROCLID",NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105453-63-2,CCRIS,1,-1,,OC1C=Cc2ccc3cc4c(ccc5ccccc45)cc3c2C1O,"PLATT,KL, SCHOLLMEIER,M, FRANK,H AND OESCH,F, STEROSELECTIVEMETABOLISM OF DIBENZ[A,H]ANTHRACENE TO TRANS-DIHYDRODIOLS AND THEIR ACTIVATIONTO BACTERIAL MUTAGENS, ENVIRON. HEALTH PERSPECT. 88:37-41, 1990"
+616-44-4,EPA1,0,-1,,Cc1ccsc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1467-79-4,VITIC,0,-1,,CN(C)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+61422-45-5,EPA1,0,-1,"CARMOFUR",CCCCCCNC(=O)N1C=C(F)C(=O)NC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35142-06-4,EPA1,1,-1,"MEARISTOL",COC(=O)c1cc2OCOc2c3c1ccc4c(OC)cccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24260-08-0,EPA1,1,-1,,CCOC1=CC(=O)C(=CC1=O)NC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-95-6,VITIC,0,-1,,BrC(Br)C(Br)(Br)Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1007-36-9,EPA1,0,-1,,CNC(=O)Nc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3102-70-3,EPA1,1,-1,,Cc1cc(C)c(N)c(C)c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2163-68-0,CCRIS,0,-1,,CCNc1nc(O)nc(NC(C)C)n1,"BUTLER,MA AND HOAGLAND,RE, GENOTOXICITY ASSESSMENT OF ATRAZINE ANDSOME MAJOR METABOLITES IN THE AMES TEST, BULL. ENVIRON. CONTAM. TOXICOL.43(6):797-804, 1989"
+127-00-4,VITIC,1,-1,,C[C@@H](O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5869-25-0,EPA1,1,-1,,Nc1ccc2c3cccc4cccc(c2c1)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+625-48-9,VITIC,1,-1,,OCC[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+131-57-7,CCRIS,0,-1,"OXYBENZON",COc1ccc(C(=O)c2ccccc2)c(O)c1,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T, MORTELMANS,K AND SPECK,W,SALMONELLA MUTAGENICITY TESTS: III. RESULTS FROM THE TESTING OF 255 CHEMICALS,ENVIRON. MOL. MUTAGEN. 9(SUPPL.9):1-110, 1987"
+88-99-3,VITIC,0,-1,"PHTHALATE",OC(=O)c1ccccc1C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+116374-66-4,CCRIS,1,-1,,CN(C)CCCNc1c2ccccc2nc3c(F)ccc(c13)[N+](=O)[O-],"FERGUSON,LR, DENNY,WA AND O'ROURKE,SM, MUTAGENIC ACTIVITY OFNITRACRINE DERIVATIVES IN SALMONELLA TYPHIMURIUM: RELATIONSHIP TO DRUGPHYSICOCHEMICAL PARAMETERS, AND TO BACTERIAL UVRB AND RECA GENES AND PLASMIDPKM101, MUTAT. RES. 223(1):13-22, 1989"
+132929-89-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3cc4C=CCCc4c5ccc1c2c35,"FU,PP, JUNG,H, VON TUNGELN,LS AND HEFLICH,RH, MUTAGENICITY OFMONONITRODIHYDROBENZO[A]PYRENES, MUTAT. RES. 245(4):277-285, 1990"
+153260-28-7,CCRIS,1,-1,,CC1(C)Cc2ncccc2c3nc(N)sc13,"JAEN,JC, KROPKO,ML, THEISS,JC, WOLD,S, CAPRATHE,BW AND WISE,LD,ASSESSMENT OF MUTAGENIC POTENTIAL IN A SERIES OF COMPOUNDS STRUCTURALLY RELATEDTO 2-AMINO-3-METHYLIMIDAZO[4,5-F]QUINOLINE (IQ), EUR. J. MED. CHEM. 28(7-8):547-553, 1993"
+NOCAS_M377,EPA1,0,-1,,CCCC[C@@H](CC)COC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60877-90-9,CCRIS,0,-1,,Oc1ccccc1\C=N\c2snc3ccccc23,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+53-95-2,VITIC,1,-1,"HOFLUACAN",CC(=O)N(O)c1ccc2c(Cc3ccccc23)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+101-18-8,VITIC,0,-1,,Oc1cccc(Nc2ccccc2)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95-06-7,VITIC,1,-1,,CCN(CC)C(=S)SCC(=C)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+115-39-9,EPA1,0,-1,"BROMPHENB",Oc1c(Br)cc(cc1Br)C2(OS(=O)(=O)c3ccccc23)c4cc(Br)c(O)c(Br)c4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38434-77-4,EPA2,1,-1,,CCN(N=O)C#N,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+762-75-4,VITIC,0,-1,,CC(C)(C)OCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111712-46-0,CCRIS,0,-1,,CC(Br)(CBr)COP(=O)(OCC(C)(Br)CBr)OCC(C)(Br)CBr,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+50-07-7,EPA1,1,-1,,CO[C@]12[C@H]3N[C@H]3CN1C4=C([C@@H]2COC(=O)N)C(=O)C(=C(C)C4=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+124-07-2,VITIC,0,-1,"CAPRYLATE,SNOCTANOA",CCCCCCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98033-21-7,EPA1,1,-1,,Cn1ccc2c1ccc3ccc4ccc(O)cc4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2517-98-8,EPA1,1,-1,,CC(=O)OCc1c2ccccc2c(C)c3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14703-71-0,CCRIS,0,-1,,Nc1cccc(O)c1[N+](=O)[O-],"SHAHIN,MM, MUTAGENICITY EVALUATION OF NITROANILINES ANDNITROAMINOPHENOLS IN SALMONELLA TYPHIMURIUM, INT. J. COSMET. SCI. 7(6):277-289,1985"
+218-34-8,CCRIS,1,-1,,c1cnc2c(c1)ccc3c2ccc4cccnc34,"YAMADA,K HAKURA,A KATO,TA, MIZUTANI,T AND SAEKI,KI,NITROGEN-SUBSTITUTION EFFECTS ON THE MUTAGENICITY AND CYTOCHROME P450ISOFORM-SELECTIVITY OF CHRYSENE ANALOGS, MUTAT. RES. 586(1):87-95,2005"
+8003-03-0,EPA1,0,-1,,NC1=NC(=O)N(C=C1)[C@@H]2O[C@H](COP(=O)(O)O[C@@H]3[C@@H](CO)O[C@H]([C@@H]3O)n4cnc5c(N)ncnc45)[C@@H](O)[C@H]2O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+205-99-2,VITIC,1,-1,,c1ccc2c(c1)c3cccc4c5ccccc5cc2c34,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M312,EPA1,0,-1,,Cc1cccc(OC[C@@H](O)CNC(C)(C)C)c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+113202-60-1,CCRIS,1,-1,"FR-66973",CC(=O)Oc1cc(C=O)cc2N3CC4C(N4C(=O)C)C(OC(=O)C)(O3)C(COC(=O)N)c12,"HIRAI,O, MIYAMAE,Y, HATTORI,Y, TAKASHIMA,M, MIYAMOTO,A, ZAIZEN,K ANDMINE,Y, MICROBIAL MUTAGENICITY AND IN VITRO CHROMOSOME ABERRATION INDUCTION BYFK973, A NEW ANTITUMOR AGENT, MUTAT. RES. 324(1-2):43-50, 1994"
+119239-65-5,CCRIS,0,-1,,OC1C2OC2c3ccc4ncccc4c3C1O,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+100-22-1,VITIC,1,-1,,CN(C)c1ccc(cc1)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+68268-20-2,CCRIS,1,-1,,CCCN(C(=O)CCCl)c1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+4213-45-0,CCRIS,1,-1,"MEPACRMUS",COc1ccc2nc3cc(Cl)ccc3c(NC(C)CCCN(CCCl)CCCl)c2c1,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+121-66-4,EPA2,1,-1,"AMNITROTH",Nc1ncc(s1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+141511-28-6,CCRIS,1,-1,,[O-][N+](=O)c1cc2CCc3cc4CCCCc4c5CCc(c1)c2c35,"YU,S, HERRENO-SAENZ,D, MILLER,DW, KADLUBAR,FF AND FU,PP, MUTAGENICITYOF NITRO- POLYCYCLIC AROMATIC HYDROCARBONS WITH THE NITRO SUBSTITUENT SITUATEDAT THE LONGEST MOLECULAR AXIS, MUTAT. RES. 283(1):45-52, 1992"
+124-30-1,VITIC,0,-1,"STEARYLAM",CCCCCCCCCCCCCCCCCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+96-67-3,VITIC,0,-1,,Nc1cc(cc(c1O)S(=O)(=O)O)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+61695-72-5,EPA3,1,-1,,C1O[C@@H]1c2c3ccccc3cc4c2ccc5ccccc45,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+60-82-2,EPA1,0,-1,"PHLORETIN",Oc1ccc(CCC(=O)c2c(O)cc(O)cc2O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-71-7,VITIC,0,-1,"ENANTALDE",CCCCCCC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M6,EPA1,1,-1,,COc1cc(cc(OC)c1O)[C@H]2[C@H]3[C@H](COC3=O)[C@H](O[C@@H]4O[C@@H]5CO[C@H](O[C@H]5[C@H](O)[C@@H]4O)c6cccs6)c7cc8OCOc8cc27,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-62-7,EPA1,1,-1,,ClC(Cl)(Cl)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M508,EPA1,0,-1,,CC[C@@H]1NC(=O)c2cc(c(Cl)cc2N1)S(=O)(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61875-33-0,VITIC,1,-1,,Cc1cccc2nc(O)c(O)nc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2876-24-6,CCRIS,1,-1,,[O-][N+](=O)c1cccc2nc3ccccc3nc12,"WATANABE,T, HANASAKI,Y, HIRAYAMA,T AND FUKUI,S, MUTAGENICITY OF NITRO-AND AMINO-SUBSTITUTED PHENAZINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.225(3):75-82, 1989"
+102873-32-5,CCRIS,1,-1,,[O-][N+](=O)c1cccc(c1)c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K"
+98736-50-6,CCRIS,1,-1,,CN(Cc1ccc(Br)cc1)N=O,"SINGER,GM, ANDREWS,AW AND GUO,SM, QUANTITATIVE STRUCTURE-ACTIVITYRELATIONSHIP OF THE MUTAGENICITY OF SUBSTITUTED N-NITROSO-N-BENZYLMETHYLAMINES:POSSIBLE IMPLICATIONS FOR CARCINOGENICITY, J. MED. CHEM. 29(1):40-44,1986"
+630125-99-4,VITIC,1,-1,,CNc1cc(Oc2ccc(N)cc2)ncn1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+613-35-4,EPA1,1,-1,,CC(=O)Nc1ccc(cc1)c2ccc(NC(=O)C)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6312-87-4,EPA1,1,-1,,CC(=O)Nc1ccc(Oc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3244-54-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2[nH]c3ccc(cc3c2c1)[N+](=O)[O-],"HOLLOWAY,TC AND BALL,LM, SYNTHESIS AND MUTAGENICITY OF A SERIES OFNITRATED CARBAZOLES AND HYDROXYCARBAZOLES, MUTAGENESIS 8(4):321-327,1993"
+1447-88-7,EPA1,0,-1,"HISPIDULI",COc1c(O)cc2OC(=CC(=O)c2c1O)c3ccc(O)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+172374-60-6,CCRIS,1,-1,,CC(=O)Nc1ccc(Oc2ccc(cc2)N(OC(=O)C)C(=O)C)cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, GENOTOXICITY OF POTENTIAL METABOLITESOF NITROSCANATE- AN ANTISCHISTOSOMAL DRUG, MUTAT. RES. 335(3):235-243,1995"
+57-10-3,CCRIS,0,-1,"DICARBIDP,DP-1031,MGPALMITA,PALMITATE",CCCCCCCCCCCCCCCC(=O)O,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+18699-02-0,EPA1,0,-1,"MS-932",CC(=O)Nc1ccc(CC(=O)O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90-05-1,VITIC,0,-1,"GUAIACOL,GUAIACMET",COc1ccccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+160543-23-7,CCRIS,0,-1,,Cc1ccc2c(C)c3C(O)C(O)c4ccccc4c3nc2c1,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+113698-18-3,EPA1,1,-1,,COC1=CC(=O)c2c(nc(C)c3c4CCCCc4[nH]c23)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106-02-5,CCRIS,0,-1,,O=C1CCCCCCCCCCCCCCO1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+14901-08-7,EPA3,0,-1,,C[N+](=NC[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+107-05-1,VITIC,1,-1,"DR9604626",ClCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+94840-66-1,CCRIS,0,-1,,NC(CSC(F)(F)C(F)F)C(=O)O,"GREEN,T AND ODUM,J, STRUCTURE/ACTIVITY STUDIES OF THE NEPHROTOXIC ANDMUTAGENIC ACTION OF CYSTEINE CONJUGATES OF CHLORO AND FLUOROALKENES, CHEM. BIOL.INTERACT. 54(1):15-31, 1985"
+106686-63-9,CCRIS,1,-1,,COc1cccc(\C=C\C)c1OC,"RAMOS-OCAMPO,VE AND HSIA,MTS, MUTAGENICITY AND DNA-DAMAGING ACTIVITYOF CALAMUS OIL, ASARONE ISOMERS, AND DIMETHOXYPROPENYLBENZENE ANALOGUES,PHILLIP. ENTOMOL. 7(3):275-291, 1988"
+100-25-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc(cc1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+476-46-0,EPA3,1,-1,,Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+55-21-0,VITIC,0,-1,"BENZAMIDE",NC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+102-82-9,VITIC,0,-1,"TRIBUTAMI",CCCCN(CCCC)CCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+63019-39-6,EPA1,1,-1,,Oc1ccc2ccc3c4ccccc4ccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+207-09-0,CCRIS,0,-1,,c1ccc2nc3c(cc2c1)c4cccc5cccc3c45,"RAY,JK AND KAR,GK, ASSESSMENT OF THE MUTAGENIC ACTIVITY OF SOMEACENAPHTHO(1,2-B)QUINOLINES, CANCER LETT. 71(1-3):1-3, 1993"
+103942-97-8,EPA1,1,-1,,CN(C)CCNC(=O)c1cccc2nc3ccccc3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+8001-35-2,EPA3,1,-1,,ClC[C@]1(C(Cl)Cl)[C@@H]2CC(Cl)(Cl)[C@@]1(CCl)[C@H](Cl)[C@@H]2Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+51276-85-8,CCRIS,1,-1,,Nc1nc2cc(O)ccc2[nH]1,"SMITH,C, PAYNE,V, DOOLITTLE,DJ, DEBNATH,AK, LAWLOR,T AND HANSCH,C,MUTAGENIC ACTIVITY OF A SERIES OF SYNTHETIC AND NATURALLY OCCURRING HETEROCYCLICAMINES IN SALMONELLA, MUTAT. RES. 279(1):61-73, 1992"
+645-62-5,EPA3,0,-1,,CCC\C=C(\CC)/C=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+141-86-6,EPA1,1,-1,"DIAMPYR26",Nc1cccc(N)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+992-59-6,EPA3,0,-1,,Cc1cc(ccc1N=Nc2cc(c3ccccc3c2N)S(=O)(=O)O)c4ccc(N=Nc5cc(c6ccccc6c5N)S(=O)(=O)O)c(C)c4,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1820-59-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc(c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c(c1)[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K"
+24085-08-3,EPA1,1,-1,,CC(C)(C)N(CC(=O)c1ccc(O)c(CO)c1)Cc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1679-41-0,CCRIS,1,-1,,C\C(=C/C=O)\Cl,"EDER,E, WEINFURTNER,E AND EDER MMG, GENOTOXICITY OF HALOGENATEDPROPENALS, ENVIRONMENTALLY RELEVANT OXYGEN CONTAINING SHORT CHAIN HALOCARBONS,ORGANOHALOGEN COMPD. 21(DIOXIN '94):239-242, 1994"
+36133-88-7,EPA2,1,-1,,CC(=O)NCc1onc(n1)c2oc(cc2)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+150445-96-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(c1)nc(\C=N\OCc3ccccc3[N+](=O)[O-])n2Cc4ccccc4,"HRELIA,P, MOROTTI,M, VIGAGNI,F, BURNELLI,S, GARUTI,L, SABATINO,P ANDCANTELLI-FORTI,G, SYNTHESIS OF A SERIES OF 5-NITRO-(BENZIMIDAZOLES AND INDOLES)AS NOVEL ANTIMYCOTICS AND EVALUATION AS GENOTOXINS IN THE AMES TEST, MUTAGENESIS8(3):183-188, 1993"
+97919-22-7,EPA1,0,-1,"CHLSULFAQ",Nc1ccc(cc1)S(=O)(=O)Nc2cnc3c(Cl)cccc3n2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2942-42-9,CCRIS,1,-1,"NO2INDAZ7",[O-][N+](=O)c1cccc2c[nH]nc12,"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+36167-69-8,EPA1,1,-1,,COc1ccc2nc3cc(Cl)ccc3c(NCCCNCCCl)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+122365-35-9,CCRIS,1,-1,,Nc1c2ncn(C(c3ccccc3)c4ccccc4)c2nc[n+]1[O-],"GORROD,JW, IOANNIDES,C, LAM,SP AND NEVILLE,S, MUTAGENICITY TESTING OF9-N-SUBSTITUTED ADENINES AND THEIR N-OXIDATION PRODUCTS, ENVIRON. HEALTHPERSPECT. 101(SUPPL. 3):21-26, 1993"
+110-58-7,VITIC,0,-1,,CCCCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+17369-59-4,VITIC,1,-1,,CC\C=C\1/OC(=O)c2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107027-31-6,CCRIS,1,-1,,CN(C)CCNC(=O)c1cccc2ncc(nc12)c3ccccc3,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+51264-14-3,EPA1,1,-1,"AMSACRINE",COc1cc(NS(=O)(=O)C)ccc1Nc2c3ccccc3nc4ccccc24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68931-03-3,CCRIS,0,-1,"CARBISOCA",CCCCCCCOc1ccccc1NC(=O)OC(C)CN(CC)CC,"SIEKEL,P, A GENOTOXICOLOGICAL STUDY OF THE NEW LOCAL ANESTHETICCARBAMATE DERIVATIVES CARBISOCAINE, HEPTACAINE AND PENTACAINE, J. APPL. TOXICOL.10(4):239-243, 1990"
+932-97-8,CCRIS,1,-1,,O=C1C=CC(=N#N)C=C1,"KIKUGAWA,K AND KATO,T, FORMATION OF A MUTAGENIC DIAZOQUINONE BYINTERACTION OF PHENOL WITH NITRITE, FOOD CHEM. TOXICOL. 26(3):209-214,1988"
+3113-71-1,VITIC,1,-1,,Cc1cc(ccc1[N+](=O)[O-])C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M150,EPA1,1,-1,,C=CCOC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M40,EPA1,1,-1,,CC[C@@H](C)OC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+76024-59-4,CCRIS,1,-1,,OC1C(O)c2ccc3ccc4ccccc4c3c2C5OC15,"GLATT,H, PIEE,A, PAULY,K, STEINBRECHER,T, SCHRODE,R, OESCH,F ANDSEIDEL,A, FJORD- AND BAY-REGION DIOL-EPOXIDES INVESTIGATED FOR STABILITY, SOSINDUCTION IN ESCHERICHIA COLI, AND MUTAGENICITY IN SALMONELLA TYPHIMURIUM ANDMAMMALIAN CELLS,CANCER RES. 51(6):1659-1667, 1991"
+2516-93-0,EPA1,0,-1,,CCCCOCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56602-33-6,EPA1,0,-1,,CN(C)[P+](On1nnc2ccccc12)(N(C)C)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+118326-95-7,CCRIS,1,-1,,COc1ccc2C=CC3CCCCC3c2c1,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+95-47-6,VITIC,0,-1,,Cc1ccccc1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+50264-69-2,EPA1,0,-1,"LONIDAMIN",OC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+118-82-1,EPA1,0,-1,,CC(C)(C)c1cc(Cc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+814-78-8,EPA1,0,-1,,CC(=C)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M269,EPA1,1,-1,,CCOc1ccc(NC(=O)C[C@@H](C)O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64894-89-9,CCRIS,1,-1,,OC(=O)c1ccc(Nc2c3ccccc3nc4cc(ccc24)N=N#N)cc1,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+5634-39-9,EPA3,1,-1,,OC[C@@H]1CO[C@@H](CCI)O1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+146795-34-8,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+659-70-1,EPA1,0,-1,"ISOMYISOV",CC(C)CCOC(=O)CC(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1822-51-1,EPA1,0,-1,,ClCc1ccncc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+477-83-8,CCRIS,1,-1,"DAMNACAOL",COc1c(CO)c(O)cc2C(=O)c3ccccc3C(=O)c12,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+4606-98-8,CCRIS,0,-1,,Cc1ccc(COS(=O)(=O)c2ccc(C)cc2)cc1,"BALL,JC, FOXALL-VANAKEN,S AND JENSEN,TE, MUTAGENICITY STUDIES OFP-SUBSTITUTED BENZYL DERIVATIVES IN THE AMES SALMONELLA PLATE-INCORPORATIONASSAY, MUTAT. RES. 138(2-3):145-151, 1984"
+93-76-5,VITIC,0,-1,"245-T",OC(=O)COc1cc(Cl)c(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+76-06-2,EPA2,1,-1,,[O-][N+](=O)C(Cl)(Cl)Cl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+118354-49-7,CCRIS,0,-1,,Brc1ccc2C3CCCCC3C4OC4c2c1,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+81760-45-4,CCRIS,0,-1,,CCCCCCCCCCCCCCCC(=O)OCC1(O)CC23CCC4c5ccoc5C=CC4(C)C2CCC1C3,"PEZZUTO,JM, NANAYAKKARA,NPD, COMPADRE,CM, SWANSON,SM, KINGHORN,AD,GUENTHNER,TM, SPARNINS,VL AND LAM,LKT, CHARACTERIZATION OF BACTERIALMUTAGENICITY MEDIATED BY 13-HYDROXY-ENT-KAURENOIC ACID (STEVIOL) AND SEVERALSTRUCTURALLY-RELATED DERIVATIVES AND EVALUATION OF POTENTIAL TO INDUCEGLUTATHIONE S-TRANSFERASE IN MICE, MUTAT. RES. 169(3):93-103, 1986"
+698-63-5,EPA1,1,-1,"NITROFUR5",[O-][N+](=O)c1oc(C=O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+619-25-0,CCRIS,0,-1,,OCc1cccc(c1)[N+](=O)[O-],"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+95-65-8,VITIC,0,-1,,Cc1ccc(O)cc1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+143347-57-3,CCRIS,1,-1,,CC12CCC=C(C=O)C1(C2)C=O,"GUSTAFSSON,J AND STERNER,O, SYNTHESIS OF ANALOGS OF THE MUTAGENICSESQUITERPENES ISOVELLERAL AND MERULIDIAL VIA STEREOSELECTIVE CYCLOPROPANATIONOF CYCLOHEXENECARBALDEHYDES, TETRAHEDRON 51(13):3865-3872, 1995"
+123-09-1,EPA1,0,-1,,CSc1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10517-47-2,EPA1,1,-1,"HOPHENETI",CC(=O)c1ccc(NO)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+149-91-7,VITIC,0,-1,"BISUBGALL,GALLATEAL,GALLATE",OC(=O)c1cc(O)c(O)c(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+91540-30-6,CCRIS,1,-1,,C=CCN1C2C1c3ccccc3c4ccccc24,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+16110-14-8,EPA3,1,-1,,Cc1c2ccc3ccccc3c2cc4ccc(O)c(O)c14,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+134998-71-3,CCRIS,0,-1,,CCC(CCC(C)O)COC(=O)CCCCC(=O)O,"DIRVEN,HAAM, THEUWS,JLG, JONGENEELEN,FJ AND BOS,RP, NON-MUTAGENICITYOF 4 METABOLITES OF DI(2-ETHYLHEXYL)PHTHALATE (DEHP) AND 3 STRUCTURALLY RELATEDDERIVATIVES OF DI(2-ETHYLHEXYL)ADIPATE (DEHA) IN THE SALMONELLA MUTAGENICITYASSAY, MUTAT. RES. 260(1):121-130, 1991"
+99-56-9,EPA2,1,-1,,Nc1ccc(cc1N)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+98644-23-6,EPA1,1,-1,,OCc1c2ccccc2c(COS(=O)(=O)O)c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1937-35-5,EPA1,1,-1,,Nc1ccc2cc(cc(O)c2c1N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117-10-2,EPA1,1,-1,"DANTRON",Oc1cccc2C(=O)c3cccc(O)c3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3159-62-4,CCRIS,0,-1,,OCCCCCCCCCCCCCCCCCC(=O)O,"HACHIYA,N AND TAKIZAWA,Y, MUTAGENICITY OF PLASTIC ADDITIVES,HEN'IGENSEI SHIKEN 3(3):147-154, 1994"
+125847-46-3,CCRIS,1,-1,,OC1C=Cc2c(ccc3c4ccccc4sc23)C1O,"MISRA,B AND AMIN,S, SYNTHESIS AND MUTAGENICITY OF TRANS-DIHYDRODIOLMETABOLITES OF BENZO[B]NAPHTHO[2,1-D]THIOPHENE, CHEM. RES. TOXICOL. 3(2):93-97,1990"
+366-29-0,EPA3,0,-1,,CN(C)c1ccc(cc1)c2ccc(cc2)N(C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+134785-76-5,EPA1,1,-1,,COC(=O)Nc1nc2cc(ccc2[nH]1)\C(=N\O)\c3ccc(F)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94495-71-3,CCRIS,1,-1,,COc1c(O)c2OC3OC=CC3c2c4OC(=O)C5=C(CCC5=O)c14,"LAFONT,J, ROMAND,A AND LAFONT,P, EFFECTS OF MYCOTOXINS ON BACTERIALGENETICS, MICROBIOL., ALIMENTS, NUTR. 1(3):251-258, 1983"
+113600-15-0,EPA1,1,-1,,Fc1ccc2cc3c(cc2c1)c4cccc5cccc3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78-67-1,EPA1,0,-1,,CC(C)(N=NC(C)(C)C#N)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+45021-77-0,VITIC,0,-1,,C[N+](C)(C)CCCNC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+590-46-5,EPA1,0,-1,"BETAINE,BETAINHCL,BETAINEPH,CHLORALBE",C[N+](C)(C)CC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-42-2,VITIC,0,-1,"DIETHANOL",OCCNCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+84-60-6,EPA1,0,-1,"ANTHRAFLA",Oc1ccc2C(=O)c3cc(O)ccc3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26196-45-2,CCRIS,1,-1,,Nc1cc(c(N)cc1Cl)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+NOCAS_M69,EPA1,1,-1,,COP(=O)(OC)[C@H](O)C(Cl)(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67-45-8,CCRIS,1,-1,"FURAZOLID",[O-][N+](=O)c1oc(\C=N\N2CCOC2=O)cc1,"NI,Y, HEFLICH,RH, KADLUBAR,FF AND FU,PP, MUTAGENICITY OF NITROFURANSIN SALMONELLA TYPHIMURIUM TA98, TA98NR AND TA98/1,8DNP, MUTAT. RES.192(1):15-22, 1987"
+101126-67-4,CCRIS,0,-1,,[O-][N+](=O)c1c(Cl)cc2Oc3cc(Cl)c(Cl)cc3Oc2c1Cl,"DONNELLY,KC, JONES,DH AND SAFE,S, THE BACTERIAL MUTAGENICITY OFNITROPOLYCHLORINATED DIBENZO-P-DIOXINS, MUTAT. RES. 169(1-2):17-22,1986"
+29043-89-8,CCRIS,0,-1,,CCCCOCC=O,"HOFLACK,JC, LAMBOLEZ,L, ELIAS,Z AND VASSEUR,P, MUTAGENICITY OFETHYLENE GLYCOL ETHERS AND OF THEIR METABOLITES IN SALMONELLA TYPHIMURIUM HIS-,MUTAT. RES. 341(4):281-287, 1994"
+NOCAS_M574,EPA1,0,-1,,CCCC[C@@H](CC)COC(=O)\C=C\c1ccc(OC)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101910-34-3,CCRIS,0,-1,"SA-850",CS(=O)CCC(=O)N1C(CSC1c2ccccc2O)C(=O)O,"MORIKAWA,K, YAMAUCHI,H AND ISO,T, MUTAGENICITY TESTS ON(2R,4R)-2-(O-HYDROXYPHENYL)-3-(3-MERCAPTOPROPIONYL)-4-THIAZOLIDINECARBOXYLICACID (SA 446), IYAKUHIN KENKYU 17(1):43-50, 1986"
+94-26-8,VITIC,0,-1,"BUTYLPARA",CCCCOC(=O)c1ccc(O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+87261-28-7,CCRIS,1,-1,,OC1C=Cc2c(ccc3c(c4ccccc4cc23)[N+](=O)[O-])C1O,"FU,PP, CHOU,MW, MILLER,DW, WHITE,GL, HEFLICH,RH AND BELAND,FA, THEORIENTATION OF THE NITRO SUBSTITUENT PREDICTS THE DIRECT-ACTING BACTERIALMUTAGENICITY OF NITRATED POLYCYCLIC AROMATIC HYDROCARBONS, MUTAT. RES.143(3):173-181, 1985"
+613-92-3,CCRIS,1,-1,,N\C(=N/O)\c1ccccc1,"CLEMENT,B, SCHMEZER,P, WEBER,H, SCHLEHOFER,JR, SCHMITT,S AND POOL,BL,GENOTOXIC ACTIVITIES OF BENZAMIDINE AND ITS N-HYDROXYLATED METABOLITEBENZAMIDOXIME IN SALMONELLA TYPHIMURIUM AND MAMMALIAN CELLS, J. CANCER RES.CLIN. ONCOL. 114(4):363-368, 1988"
+133-90-4,VITIC,1,-1,,Nc1cc(Cl)cc(C(=O)O)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+470-90-6,CCRIS,1,-1,,CCOP(=O)(OCC)O\C(=C/Cl)\c1ccc(Cl)cc1Cl,"MORIYA,M OHTA,T WATANABE,K MIYAZAWA,T KATO,K AND SHIRASU,Y, FURTHERMUTAGENICITY STUDIES ON PESTICIDES IN BACTERIAL REVERSION ASSAY SYSTEMS, MUTAT.RES. 116(3-4):185-216,1982"
+80324-43-2,CCRIS,1,-1,,Nc1ccc(cc1)N=Nc2cccc(N)c2N,"YAMAGUCHI,T, ADSORPTION OF CARCINOGENIC AND/OR MUTAGENIC PIGMENTS ONDNA-BINDING SEPHAROSE, AGRIC. BIOL. CHEM. 52(3):845-847, 1988"
+78111-17-8,EPA1,0,-1,,C[C@@H](C[C@H](O)[C@H]1O[C@@H]2CC[C@@]3(CC[C@@H](O3)\C=C\[C@@H](C)[C@@H]4CC(=C[C@@]5(O[C@H](C[C@@](C)(O)C(=O)O)CC[C@@H]5O)O4)C)O[C@H]2[C@H](O)C1=C)[C@H]6O[C@@]7(CCCCO7)CC[C@H]6C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M360,EPA1,0,-1,,CC(C)(Oc1ccc(cc1)[C@@H]2CC2(Cl)Cl)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57609-64-0,EPA1,0,-1,,Nc1ccc(cc1)C(=O)OCCCOC(=O)c2ccc(N)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91134-58-6,CCRIS,1,-1,,CC(C)COC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+99346-49-3,EPA1,1,-1,"AZAURACIL",Oc1cnnc(O)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1321-74-0,EPA1,0,-1,,C=Cc1ccccc1C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+518-47-8,EPA1,0,-1,"FLUORESCE,FLUORESBI,FLUORESAG,FLUORESNA,FLUORTHIO",Oc1ccc2c(Oc3cc(O)ccc3C24OC(=O)c5ccccc45)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97-90-5,EPA1,0,-1,"ETGLYDIME,POLYMACON",CC(=C)C(=O)OCCOC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+143-07-7,VITIC,0,-1,"BUTYNORAT,LAURATE,PIPERALAU",CCCCCCCCCCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1204-41-7,EPA1,1,-1,,Cc1ccccc1c2ccc(N)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-96-7,VITIC,1,-1,,OC(=O)C(Br)(Br)Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5907-38-0,EPA1,1,-1,"METAMISCA,METAMISEP,METAMIZMG,METAMIZNA",CN(CS(=O)(=O)O)C1=C(C)N(C)N(C1=O)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70585-50-1,CCRIS,0,-1,,OC(=O)c1cc(I)cc2cccnc12,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+NOCAS_M184,EPA1,1,-1,,ClC(Cl)(Cl)[C@@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106686-67-3,CCRIS,1,-1,,O=S(=O)(Cc1ccccc1)N2C3C2c4ccccc4c5ccccc35,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+97931-40-3,CCRIS,0,-1,,OC1CCCc2c1c(c3ccc4cccc5ccc2c3c45)[N+](=O)[O-],"FU,PP, CHOU,MW, MILLER,DW, WHITE,GL, HEFLICH,RH AND BELAND,FA, THEORIENTATION OF THE NITRO SUBSTITUENT PREDICTS THE DIRECT-ACTING BACTERIALMUTAGENICITY OF NITRATED POLYCYCLIC AROMATIC HYDROCARBONS, MUTAT. RES.143(3):173-181, 1985"
+58-56-0,EPA1,0,-1,"ASCORBPYR,METADOXIN,PYRIDOXIN,PYRIDOASP,PYRIDOHCL,PYRIDOXOX,PYRIDSERP",Cc1ncc(CO)c(CO)c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16156-55-1,CCRIS,1,-1,,CC(C)CCOS(=O)(=O)C,"GLOWIENKE,S, FRIAUFF,W, ALLMENDINGER,T, MARTUS,HJ, SUTER,W ANDMUELLER,L, STRUCTURE-ACTIVITY CONSIDERATIONS AND IN VITRO APPROACHES TO ASSESSTHE GENOTOXICTY OF 19 METHANE-, BENZENE- AND TOLUENESULFONIC ACID ESTERS, MUTAT.RES. 581(1-2):23-34, 2005"
+17172-88-2,CCRIS,0,-1,,BrC(C(=O)NCc1ccccc1)c2ccccc2,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+4659-45-4,EPA1,1,-1,,ClC(=O)c1c(Cl)cccc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5460-35-5,EPA1,1,-1,,NC1=CC(=O)C(=O)c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13615-38-8,CCRIS,1,-1,,Cc1cc(c2ccccc2c1)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+421-20-5,EPA3,1,-1,,COS(=O)(=O)F,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+38083-17-9,CCRIS,0,-1,"CLIMBAZOL",CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n2ccnc2,"SUNAKAWA,T AND TAKAHASHI,Y, SAFETY EVALUATION OF CLIMBAZOLE(ANTIDANDRUFF AGENTS). I. MUTAGENICITY TESTS OF CLIMBAZOLE, NIPPON KOSHOHINKAGAKKAI 20(4):304-311, 1996"
+58-61-7,CCRIS,0,-1,,Nc1ncnc2c1ncn2C3OC(CO)C(O)C3O,"GUZZIE,PJ, OSHIRO,Y, SOELTER,S, BALWIERZ,PS, YOUNG,RR, GAD,SC ANDPIPER,CE,SELECTION AND EVALUATION OF AN APPROPRIATE MODEL FOR SCREENINGADENOSINE ANALOGS FOR CHROMOSOME ABERRATIONS, TOXICOL. METHODS 1(3):172-187,1991"
+630-20-6,VITIC,0,-1,,ClCC(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+146795-46-2,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2[N+](=O)[O-],"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+78-85-3,EPA1,1,-1,,CC(=C)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+790-60-3,EPA1,1,-1,,O1c2c1c3cc4ccccc4cc3c5ccccc25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1836-77-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc(Oc2c(Cl)cc(Cl)cc2Cl)cc1,"KITAMORI,S, TANAKA,Y, ISHIGURO,Y AND KONDO,H, MUTAGENICITY OFHERBICIDE CHLORNITROFEN (CNP) AND ITS REDUCTION PRODUCTS, SANGYO EISEIGAKUZASSHI 37(2):143-144, 1995"
+NOCAS_M370,EPA1,0,-1,,CC[C@@H](C)c1ccccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2461-43-0,CCRIS,1,-1,,C(Oc1ccccc1Cc2ccccc2)C3CO3,"ROSMAN,LB, CHAKRABORTY,PK, MESSERLY,EA AND SINSHEIMER,JE, MUTAGENICITYOF AROMATIC GLYCIDYL ETHERS WITH SALMONELLA, MUTAT. RES. 206(1):115-125,1988"
+10510-77-7,EPA1,1,-1,,CC[n+]1c2ccccc2nc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53043-28-0,EPA3,1,-1,,CC1=CC2=C(C=O)C(=O)[C@](C)(O)[C@H](O)C2=CO1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+75586-70-8,EPA1,1,-1,,C[n+]1c2ccccc2cc3ccc(N)cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+605-71-0,VITIC,1,-1,,[O-][N+](=O)c1cccc2c(cccc12)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3022-61-5,CCRIS,1,-1,"ACDITHR10",CC(=O)C1c2cccc(O)c2C(=O)c3c(O)cccc13,"MANNISTO,PT, KIRKLAND,D, VILUKSELA,M AND TIKKANEN,L, TOXICOLOGICALSTUDIES WITH DITHRANOL AND ITS 10-ACYL ANALOGS, ARCH. TOXICOL. 59(3):180-185,1986"
+1746-01-6,VITIC,0,-1,"TETRACDIB",Clc1cc2Oc3cc(Cl)c(Cl)cc3Oc2cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+92134-97-9,CCRIS,0,-1,,OCC(O)C(O)C(O)C(O)C1SCC(N1N=O)C(=O)O,"UMANO,K, SHIBAMOTO,T, FERNANDO,SY AND WEI,CI, MUTAGENICITY OF2-HYDROXYALKYL-N- NITROSOTHIAZOLIDINES, FOOD CHEM. TOXICOL. 22(4):253-259,1984"
+57-66-9,VITIC,0,-1,"PROBENECI",CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+96-99-1,EPA1,1,-1,,OC(=O)c1ccc(Cl)c(c1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4205-90-7,CCRIS,0,-1,"CLONIDINE,CLONIDHBR,CLONIDHCL,CLONIDTOS",Clc1cccc(Cl)c1NC2=NCCN2,"NAKAJIMA,M, KITAZAWA,M, FUJIWARA,M, INOUE,H, ASANO,N AND YAMAKAWA,Y,MUTAGENICITY STUDIES OF CLONIDINE, IYAKUHIN KENKYU 27(9):587-605,1996"
+110-61-2,VITIC,0,-1,"SUCCINONI",N#CCCC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+18523-48-3,CCRIS,0,-1,,OC(=O)CN=N#N,"MANGOLD,JB, MISCHKE,MR AND LAVELLE,JM, AZIDOALANINE MUTAGENICITY INSALMONELLA: EFFECT OF HOMOLOGATION AND ALPHA-METHYL SUBSTITUTION, MUTAT. RES.216(1):27-33, 1989"
+406-90-6,EPA3,1,-1,"FLUROXENE",FC(F)(F)COC=C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+136112-69-1,CCRIS,0,-1,,[O-][N+](=O)c1ccc(Nc2[nH]cnc3ncnc23)cc1,"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+NOCAS_M361,EPA1,0,-1,,OC(=O)C[C@H](Cl)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2657-25-2,CCRIS,0,-1,,Oc1ccc(cc1)C(=O)\C=C\c2ccccc2,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+109-09-1,VITIC,1,-1,,Clc1ccccn1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+475-54-7,GENETOX,0,-1,"OOSPOREIN",CC1=C(O)C(=C(C(=O)C1=O)C2=C(O)C(=C(C)C(=O)C2=O)O)O,"REPORT (LSU-5612):14 PP,1978"
+2872-48-2,EPA1,1,-1,,COc1cc(N)c2C(=O)c3ccccc3C(=O)c2c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M105,EPA1,1,-1,,C[C@@H](CN(C[C@H](C)OC(=O)C)N=O)OC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105360-93-8,EPA1,1,-1,,Oc1cc2ccc3cccc4ccc(n1)c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120812-52-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3ccc(c4c5CCCCc5c1c2c34)[N+](=O)[O-],"FU,PP, NI,YC, ZHANG,YM, HEFLICH,RH, WANG,YK AND LAI,JS, EFFECT OF THEORIENTATION OF NITRO SUBSTITUENT ON THE BACTERIAL MUTAGENICITY OFDINITROBENZO[E]PYRENES, MUTAT. RES. 225(3):121-125, 1989"
+999-97-3,VITIC,0,-1,,C[Si](C)(C)N[Si](C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+963-89-3,VITIC,1,-1,,Cc1ccc2nc3c(ccc4ccccc34)c(C)c2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7627-38-5,VITIC,1,-1,,ClCc1cnc(Cl)nc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+146795-27-9,CCRIS,1,-1,,COc1cccc(NC(=O)c2csc(c2)[N+](=O)[O-])c1,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+116-85-8,EPA1,1,-1,,Nc1ccc(O)c2C(=O)c3ccccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92-52-4,VITIC,0,-1,"BIPHENYL,DR0038586",c1ccc(cc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+71400-33-4,EPA1,1,-1,,[O-][N+](=O)c1ccc2Oc3cc(ccc3Oc2c1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105453-67-6,CCRIS,1,-1,,OC1C(O)c2cc3c(ccc4ccccc34)cc2c5ccccc15,"PLATT,KL, SCHOLLMEIER,M, FRANK,H AND OESCH,F, STEROSELECTIVEMETABOLISM OF DIBENZ[A,H]ANTHRACENE TO TRANS-DIHYDRODIOLS AND THEIR ACTIVATIONTO BACTERIAL MUTAGENS, ENVIRON. HEALTH PERSPECT. 88:37-41, 1990"
+517-82-8,CCRIS,1,-1,"ECHINOCHM,ECHINOCHR,HISTOCHRO",CCC1=C(O)C(=O)c2c(O)c(O)c(O)c(O)c2C1=O,"LEBEDEV,AV LEVITSKAYA,EL TIKHONOVA,EV AND IVANOVA,MV, ANTIOXIDANTPROPERTIES, AUTOOXIDATION, AND MUTAGENIC ACTIVITY OF ECHINOCHROME A COMPAREDWITH ITS ETHERIFIED DERIVATIVE, BIOCHEMISTRY (MOSCOW, RUSS. FED.) 66(8):885-893,2001"
+110-85-0,VITIC,0,-1,"72-70,PIPERAHCL,PIPERAZHI,PIPERAZPH",C1CNCCN1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+138580-44-6,EPA1,1,-1,,Cc1nc2C(=O)C=CC(=O)c2c3[nH]c4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54755-20-3,CCRIS,1,-1,,Cc1ccc2c(cccc2c1)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+33100-27-5,EPA1,0,-1,"15CROWN5",C1COCCOCCOCCOCCO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13707-88-5,CCRIS,0,-1,"ALPRENOLO,ALPRENHCL",CC(C)NCC(O)COc1ccccc1CC=C,"HUSSAIN,SS, AL-DAKAN,AA, ABOUL-ENEIN,HY AND HANNAN,MA, DNA STRANDBREAKS AND MUTATIONS CAUSED BY PENBUTOLOL, A BETA BLOCKER, MUTAT. RES.204(4):675-682, 1988"
+91259-16-4,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3cccc4c5ccccc5c1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78-34-2,EPA3,1,-1,,CCOP(=S)(OCC)S[C@@H]1OCCO[C@H]1SP(=S)(OCC)OCC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+106-24-1,CCRIS,0,-1,"GERANIOL",CC(=CCC\C(=C\CO)\C)C,"KONO,M, YOSHIDA,Y, ITAYA,Y, SHIMOBO,K, YOSHIKAWA,K, TERASHITA,T ANDSHISHIYAMA,J, ANTIMICROBIAL ACTIVITY AND MUTAGENICITY OF ALLYL ISOTHIOCYANATESAND SEVERAL ESSENTIAL OILS FROM SPICES, KINKI DAIGAKU NOGAKUBU KIYO 28:11-19,1995"
+89-61-2,VITIC,1,-1,,[O-][N+](=O)c1cc(Cl)ccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7083-63-8,EPA1,1,-1,,Nc1cccc2Cc3ccccc3c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39932-99-5,CCRIS,0,-1,,CC12CCC3C(CCC4CC(O)CCC34C)C1CCC(=O)N2,"VOUTSINAS,G, KAPPAS,A, DEMOPOULOS,NA AND CATSOULACOS,P, MUTAGENICACTIVITY OF THE ANTITUMOUR AGENT HOMO-AZA-STEROIDAL ESTER OFP-N,N-BIS(2-CHLOROETHYL) AMINOPHENOXYACETIC ACID (NSC 294859) IN THESALMONELLA/MICROSOME ASSAY, MUTAGENESIS 8(5):431-435, 1993"
+4465-94-5,EPA1,1,-1,,OCCCNP(=O)(O)N(CCCl)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115-20-8,GENETOX,1,-1,"TRICLETHA",OCC(Cl)(Cl)Cl,"PROC NATL ACAD SCI USA 72:5135-5139,1975"
+149862-55-5,CCRIS,0,-1,,CCCCNc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+103-70-8,VITIC,0,-1,,O=CNc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+29743-15-5,EPA1,1,-1,,CCCCOc1ccc(\C=N\c2ccc(CC)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+490-91-5,EPA1,0,-1,"DR9502016",CC(C)C1=CC(=O)C(=CC1=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+766-40-5,CCRIS,1,-1,,OC1OC(=O)C(=C1Cl)Cl,"HYTTINEN,JMT, NIITTUYKOSKI,M AND JANSSON,K,LACK OF UNIFORMITY IN THEMUTATIONAL SPECTRA OF CHLOROHYDROXYFURANONES IN SALMONELLA TYPHIMURIUM STRAINTA100, MUTAGENESIS 10(4):321-323, 1995"
+396-30-5,EPA1,1,-1,,Fc1ccc2ncccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-13-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc(C=C)cc1,"MULLEN,CA, RASHID,KA AND MUMMA,RO, MUTAGENIC POTENCY OF SOMECONJUGATED NITROAROMATIC COMPOUNDS AND ITS RELATIONSHIP TO STRUCTURE, MUTAT.RES. 188(4): 267-274, 1987"
+52101-36-7,CCRIS,0,-1,,COC(=O)c1occ(c2ccccc2)c1c3ccccc3,"ICHIKAWA,M, YAMAMOTO,K, TANAKA,A, SWAMINATHAN,S, HATCHER,JF, ERTURK,EAND BRYAN,GT, MUTAGENICITY OF 3,4-DIPHENYL-5-NITROFURAN ANALOGS IN SALMONELLATYPHIMURIUM, CARCINOGENESIS 7(8):1339-1344, 1986"
+25843-45-2,EPA2,1,-1,"AZOXYMETH",CN=[N+](C)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+30039-44-2,EPA1,1,-1,,CCC(=O)OCc1ccc(cc1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88-85-7,EPA2,0,-1,"DINOSEB",CCC(C)c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+83996-50-3,EPA1,1,-1,"AMBAMUSTI",CCOC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1cccc(c1)N(CCCl)CCCl)NC(=O)[C@@H](N)Cc2ccc(F)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23102-68-3,CCRIS,1,-1,,O1C2C1c3cscc3c4cscc24,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+62895-88-9,CCRIS,0,-1,,CC(C)OC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OC(C)C)ccc1N,"TAKAGI,Y, ENDOH,O, GOTO,S, KOHZAKI,K AND MATSUSHITA,H, MUTAGENICITY OFDIAMINODIPHENYLMETHANE AND RELATED COMPOUNDS, KANKYO KAGAKU 5(4):841-845,1995"
+113163-21-6,CCRIS,1,-1,,OC1C=Cc2c(ccc3cccnc23)C1O,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+25082-33-1,EPA1,1,-1,,c1ccc2cc3c(ccc4ccncc34)cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1143-38-0,VITIC,0,-1,"DITHRANOL",Oc1cccc2Cc3cccc(O)c3C(=O)c12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+479-27-6,EPA1,1,-1,,Nc1cccc2cccc(N)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+158366-45-1,CCRIS,1,-1,,CC(=O)c1cccn1[N+](=O)[O-],"WANG,CJ, LIN,YL AND LIN,JK, MUTAGENICITY AND CYTOTOXICITY OFNITROPYRROLE COMPOUNDS DERIVED FROM THE REACTION OF 2-ACETYLPYRROLE WITHNITRITE, FOOD CHEM. TOXICOL. 32(9):839-844, 1994"
+100-53-8,CCRIS,0,-1,,SCc1ccccc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION  CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING  CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF  THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL),1997"
+133561-39-4,CCRIS,1,-1,,Nc1ccc(c2ccc(cc2N)[N+](=O)[O-])c(c1)[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K, YAMANAKA,Y, ISHIHARA,M, SHINYA,M, TAKAHASHI,KAND WATANABE,T, STUDIES ON THE STRUCTURE ELUCIDATION OF MUTAGENIC METABOLITES OF2,4-DINITROBIPHENYL DERIVATIVES AGAINST SALMONELLA TYPHIMURIUM TA98, EISEIKAGAKU 37(3):229-238, 1991"
+42522-72-5,EPA3,1,-1,,Oc1c(Br)cc2c(Oc3c(Br)c(O)c(Br)cc3C24OS(=O)(=O)c5ccccc45)c1Br,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+103-89-9,EPA3,1,-1,"ACETOLUIP",CC(=O)Nc1ccc(C)cc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+122365-34-8,CCRIS,1,-1,,Nc1ncnc2c1ncn2C(c3ccccc3)c4ccccc4,"GORROD,JW, IOANNIDES,C, LAM,SP AND NEVILLE,S, MUTAGENICITY TESTING OF9-N-SUBSTITUTED ADENINES AND THEIR N-OXIDATION PRODUCTS, ENVIRON. HEALTHPERSPECT. 101(SUPPL. 3):21-26, 1993"
+69304-47-8,CCRIS,0,-1,,OCC1OC(CC1O)N2C=C(\C=C\Br)C(=O)NC2=O,"MARQUADT,H, WESTENDORF,J, SCHAEFER,A, BOLDT,J, DE CLERCQ,E ANDMARQUARDT,H, MUTAGENIC AND ANTIMUTAGENIC EFFECTS OF 5-SUBSTITUTED2'-DEOXYURIDINES DEPENDING ON THE NATURE OF THE 5-SUBSTITUENT, ARZNEIM.-FORSCH.38(12):1820-1824, 1988"
+220168-52-5,CCRIS,1,-1,,O=C(ON(OCc1ccccc1)C(=O)c2ccccc2)c3ccc(cc3)C#N,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+118353-05-2,CCRIS,0,-1,,Nc1nc(O)c2ncn(C3CC(CO)C=C3)c2n1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y90"
+55481-88-4,CCRIS,1,-1,"MOLLUGIN",COC(=O)c1c(O)c2ccccc2c3OC(C)(C)C=Cc13,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+1663-39-4,EPA1,0,-1,,CC(C)(C)OC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4368-56-3,EPA1,0,-1,,Nc1c2C(=O)c3ccccc3C(=O)c2c(NC4CCCCC4)cc1S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M160,EPA1,1,-1,,CCCC[C@@H]1C(=O)N(N(C1=O)c2ccc(O)cc2)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10318-26-0,VITIC,1,-1,,O[C@H](CBr)[C@H](O)[C@H](O)[C@@H](O)CBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+161697-01-4,EPA1,1,-1,,CCc1nc2ccc(NC)c(C)c2nc1CC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60110-37-4,CCRIS,0,-1,,CC(C)(Br)C(=O)NCc1ccccc1,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+868-85-9,EPA2,1,-1,,COP(=O)OC,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+127-07-1,EPA1,1,-1,"HYDROXURE",NC(=O)NO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+28553-12-0,VITIC,0,-1,,CC(C)CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+14953-63-0,CCRIS,1,-1,,Cn1cnc(c2ccccc2)c1[N+](=O)[O-],"EHLHARDT,WJ, BEAULIEU,BB AND GOLDMAN,P, MAMMALIAN CELL TOXICITY ANDBACTERIAL MUTAGENICITY OF NITROSOIMIDAZOLES, BIOCHEM. PHARMACOL.37(13):2603-2606, 1988"
+98033-23-9,EPA1,1,-1,,CNc1ccc2ccc3ccc(O)cc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+93261-88-2,CCRIS,1,-1,,[O-][N+](=O)c1oc(C(=O)CBr)c(c2ccccc2)c1c3ccccc3,"ICHIKAWA,M, YAMAMOTO,K, TANAKA,A, SWAMINATHAN,S, HATCHER,JF, ERTURK,EAND BRYAN,GT, MUTAGENICITY OF 3,4-DIPHENYL-5-NITROFURAN ANALOGS IN SALMONELLATYPHIMURIUM, CARCINOGENESIS 7(8):1339-1344, 1986"
+91-44-1,VITIC,0,-1,,CCN(CC)c1ccc2C(=CC(=O)Oc2c1)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+146795-39-3,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2cccc(Cl)c2,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+602-64-2,EPA1,1,-1,"ANTHRAGOL",Oc1cc2C(=O)c3ccccc3C(=O)c2c(O)c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+591-35-5,VITIC,0,-1,,Oc1cc(Cl)cc(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24463-19-2,EPA1,1,-1,,ClCc1c2ccccc2cc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103630-35-9,CCRIS,0,-1,,CC(=C)C1CCC(=C)C2C1C=C(C)C(=O)C3=C2C(=O)C(C)(O)C3,"ROJANAPO,W, PIMBUA,J, GLINSUKON,T, NAENGCHOMNONG,W ANDTHEBTARANONTH,Y, FAILURE OF DITERPENES FROM JATROPHA CURCAS TO INDUCE MUTATIONIN SALMONELLA TYPHIMURIUM TA98 AND TA100, RES. COMMUN. CHEM. PATHOL. PHARMACOL.58(3):397-400, 1987"
+109-65-9,CCRIS,1,-1,"BUTYLBROM",CCCCBr,"SIMMON,VF, KAUHANEN,K AND TARDIFF,RG, MUTAGENIC ACTIVITY OF CHEMICALSIDENTIFIED IN DRINKING WATER, DEV. TOXICOL. ENVIRON. SCI. 2:249-258,1977"
+95-93-2,EPA1,0,-1,,Cc1cc(C)c(C)cc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+136861-01-3,CCRIS,1,-1,,Nc1cc(N)c(c2ccccc2)c(c1)[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K, YAMANAKA,Y, ISHIHARA,M, SHINYA,M, TAKAHASHI,KAND WATANABE,T, STUDIES ON THE STRUCTURE ELUCIDATION OF MUTAGENIC METABOLITES OF2,4-DINITROBIPHENYL DERIVATIVES AGAINST SALMONELLA TYPHIMURIUM TA98, EISEIKAGAKU 37(3):229-238, 1991"
+146795-32-6,CCRIS,1,-1,,CCc1cccc(NC(=O)c2csc(c2)[N+](=O)[O-])c1,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+22216-66-6,CCRIS,1,-1,,COc1ccc([Se]c2ccc(OC)cc2)cc1,"MASLAT,AO AND KHALIL,AM, MUTAGENIC EFFECTS OF TWO SUSPECTEDANTICARCINOGENIC ORGANOSELENIUM COMPOUNDS IN SALMONELLA TYPHIMURIUM, TOXICOL.ENVIRON. CHEM. 33(1-2):23-29, 1991"
+NOCAS_M248,EPA1,1,-1,,N1[C@@H]2[C@H]1c3cccc4cccc2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+129-79-3,VITIC,1,-1,,[O-][N+](=O)c1ccc2c(c1)C(=O)c3cc(cc(c23)[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+119-41-5,EPA1,0,-1,"EFLOXATE",CCOC(=O)COc1ccc2C(=O)C=C(Oc2c1)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M318,EPA1,0,-1,,Clc1ccc(CO[C@H](Cn2ccnc2)c3ccc(Cl)cc3Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-02-1,VITIC,0,-1,,c1ccsc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+420-46-2,EPA1,0,-1,,CC(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+688-74-4,VITIC,0,-1,,CCCCOB(OCCCC)OCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105-95-3,CCRIS,0,-1,,O=C1CCCCCCCCCCCC(=O)OCCO1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION  CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING  CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF  THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL),1997"
+13010-07-6,CCRIS,1,-1,,CCCN(N=O)C(=N)N[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+64-18-6,VITIC,0,-1,"FORMATEAL,CAFORMATE,FORMATEPB,FORMATE,DR0005598,FORMATENA",OC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+76002-91-0,CCRIS,1,-1,,CC(C)(c1ccc(OCC(O)CO)cc1)c2ccc(OCC3CO3)cc2,"SUEIRO,RA ARAUJO,M SUAREZ,S AND GARRIDO,MJ,MUTAGENIC POTENTIAL OFBISPHENOL A DIGLYCIDYL ETHER (BADGE) AND ITS HYDROLYSIS-DERIVED PRODUCTS IN THEAMES SALMONELLA ASSAY, MUTAGENESIS 16(4):303-307, 2001"
+97-23-4,VITIC,1,-1,"DICLPHEN",Oc1ccc(Cl)cc1Cc2cc(Cl)ccc2O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+74-83-9,VITIC,1,-1,,CBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+96346-61-1,CCRIS,0,1,,CN(C)c1ccc(cc1)C2CC3(C)C(CCC3(O)CCCO)C4CCC5=CC(=O)CCC5=C24,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+97975-05-8,CCRIS,0,-1,,OCC1OC(CC1O)N2C=C(CCCCl)C(=O)NC2=O,"MARQUADT,H, WESTENDORF,J, SCHAEFER,A, BOLDT,J, DE CLERCQ,E ANDMARQUARDT,H, MUTAGENIC AND ANTIMUTAGENIC EFFECTS OF 5-SUBSTITUTED2'-DEOXYURIDINES DEPENDING ON THE NATURE OF THE 5-SUBSTITUENT, ARZNEIM.-FORSCH.38(12):1820-1824, 1988"
+123-72-8,VITIC,0,-1,,CCCC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106532-68-7,CCRIS,1,-1,,CCCCCC(=O)\N=C\1/SN(C(=O)CCCCC)c2ccc(cc12)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+54357-08-3,CCRIS,1,-1,,Cc1ccc2cc(ccc2c1)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+1124-33-0,CCRIS,1,-1,,[O-][N+](=O)c1cc[n+]([O-])cc1,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+87-68-3,VITIC,0,-1,,ClC(=C(Cl)C(=C(Cl)Cl)Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+25003-82-1,EPA1,1,-1,,c1ccc2c(c1)ccc3cc4cnccc4cc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61064-66-2,EPA1,1,-1,,ClNc1ccc2c(Cc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98046-75-4,CCRIS,1,-1,,[O-][N+](=O)c1cnc2c(c1)nc3ccccn23,"N'GOY,K, SAINT-RUF,G AND DE MEESTER,C, MUTAGENICITY OF SOMEDERIVATIVES OF DIPYRIDO[1,2-A:3',2'-D]IMIDAZOLES IN SALMONELLA TYPHIMURIUM WITHMETABOLIC ACTIVATION"
+18028-55-2,EPA1,1,-1,,Cc1ccc(C)c2c3ccccc3[nH]c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92130-56-8,CCRIS,0,-1,,Cc1cc2ncccc2c3ncn(C)c13,"GRIVAS,S AND JAEGERSTAD,M, MUTAGENICITY OF SOME SYNTHETIC QUINOLINESAND QUINOXALINES RELATED TO IQ, MEIQ OR MEIQX IN AMES TEST, MUTAT. RES. 137(1):29-32, 1984"
+480-54-6,EPA3,1,-1,,C\C=C/1\C[C@H](C)[C@@](O)(CO)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@H]23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+712-12-9,CCRIS,0,-1,,CC(C)CNc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+42135-22-8,EPA1,1,-1,,[O-][N+](=O)c1ccc2C(=O)c3ccccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+153-78-6,EPA1,1,-1,,Nc1ccc2c(Cc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17309-86-3,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2ccc3[nH]ncc3c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+49852-85-9,EPA1,1,-1,,BrCc1c2ccccc2c3ccc4cccc5ccc1c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+836-37-3,CCRIS,1,-1,,COC(=O)\C(=C\c1oc(cc1)[N+](=O)[O-])\C#N,"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+15254-64-5,EPA1,1,-1,,Cc1cc(C)c2c(ccc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+619-17-0,EPA2,1,-1,,Nc1cc(ccc1C(=O)O)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+513-85-9,CCRIS,0,-1,,CC(O)C(C)O,"IWATA,T, KOKUBA,S, ARIGA,F, HIRAMATSU,Y, NOSE,T AND AOYAMA,T,MUTAGENICITY OF LENAMPICILLIN HYDROCHLORIDE (KBT-1585)B AND ITS METABOLITES,CHEMOTHERAPY 32(SUPPL. 8):153-160, 1984"
+41340-19-6,CCRIS,0,-1,,CCC1(CC(=O)O)OCCc2c1[nH]c3c(C)cccc23,"IWAKURA,K, TAMURA,H, SUMI,N AND NOMURA,A, MUTAGENICITY STUDIES OFMETABOLITES, DEGRADATION PRODUCTS AND IMPURITY OF ETODOLAC, OYO YAKURI40(6):747-757, 1990"
+3811-71-0,EPA1,1,-1,,Nc1cc(N)c(cc1N=Nc2ccc(cc2)c3ccc(cc3)N=Nc4ccc(O)c(c4)C(=O)O)N=Nc5ccc(cc5)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95969-40-7,CCRIS,0,-1,"MPTP-NO",C[N+]1([O-])CCC(=CC1)c2ccccc2,"CASHMAN,JR, MUTAGENICITY OF MPTP(1-METHYL-4-PHENYL-1,2,3,6-TETRAHYDROPYRIDINE) AND ITS METABOLITES, TOXICOLOGY43(2):173-182, 1987"
+6534-28-7,EPA3,1,-1,,CC(=O)Nc1ccc(NC(=O)C)c2C(=O)c3ccccc3C(=O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+357-57-3,EPA3,0,-1,,COc1cc2N3[C@H]4[C@@H]5[C@@H](CC3=O)OCC=C6CN7CC[C@]4([C@H]7C[C@@H]56)c2cc1OC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+83407-42-5,CCRIS,0,-1,,CNc1c(C)cc2ncccc2c1N,"GRIVAS,S AND JAEGERSTAD,M, MUTAGENICITY OF SOME SYNTHETIC QUINOLINESAND QUINOXALINES RELATED TO IQ, MEIQ OR MEIQX IN AMES TEST, MUTAT. RES. 137(1):29-32, 1984"
+24953-56-8,CCRIS,0,-1,,COc1nncc2ccccc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+83905-01-5,CCRIS,0,-1,,CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC3OC(C)CC(C3O)N(C)C)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O,"AMACHER,DE, ELLIS,JH,JR, JOYCE,AJ, MUEHLBAUER,PA, TURNER,GN,WAHRENBURG,MG, HOLDEN,HE AND RAY,VA, PRECLINICAL TOXICOLOGY STUDIES WITHAZITHROMYCIN GENETIC TOXICOLOGY EVALUATION, MUTAT. RES. 300(2):79-90,1993"
+321-14-2,EPA1,0,-1,,OC(=O)c1cc(Cl)ccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+62641-67-2,EPA3,1,-1,,C[C@H]1CN(N=O)C(=O)NC1=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+94500-44-4,EPA1,1,-1,,ClCc1cc2c3ccccc3cc4ccc5cccc1c5c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6223-35-4,EPA1,0,-1,"GUAIASUL3,GUALENATE",CC(C)c1ccc(C)c2c(cc(C)c2c1)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-17-4,CCRIS,1,-1,,COc1ccc(cc1)[N+](=O)[O-],"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+NOCAS_M212,EPA1,1,-1,,O1[C@@H]2C=Cc3c(ccc4c5C=Cc6cccc(cc34)c56)[C@H]12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63642-50-2,EPA3,1,-1,,O=C1CCCc2c1ccc3c2ccc4ccccc34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+108-45-2,VITIC,1,-1,"PHENYLENM",Nc1cccc(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+140-79-4,EPA2,1,-1,"DINITROSP",O=NN1CCN(CC1)N=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+56-93-9,VITIC,0,-1,"BENZALKON,BZTRIMEAM",C[N+](C)(C)Cc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3173-72-6,CCRIS,0,-1,,O=C=Nc1cccc2c(cccc12)N=C=O,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+112-55-0,VITIC,0,-1,,CCCCCCCCCCCCS,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13395-02-3,EPA1,1,-1,"ARISTOLA1",COc1cccc2c1cc3NC(=O)c4cc5OCOc5c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+505-29-3,EPA1,1,-1,,C1CSCCS1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M67,EPA1,1,-1,,NC(=O)C1(O[C@H]1C(=O)c2ccccc2)C(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101328-75-0,EPA1,1,-1,,CCCCCn1cc2C[C@@H]3[C@H](C=C(C)CN3C)c4cccc1c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+838-88-0,VITIC,1,-1,,Cc1cc(Cc2ccc(N)c(C)c2)ccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+75-87-6,VITIC,1,-1,"CHLORAL",ClC(Cl)(Cl)C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16974-10-0,CCRIS,0,-1,,CCCCCC\C=C/CCCCCCOC(=O)C,"ABDEL-GHANI,SB, MARTINEZ-LOPEZ,E, PEREZ-PERTEJO,Y, BAYOUMI,AE,GARCIA-FERNANDEZ,A, BALANA-FOUCE,R AND ORDONEZ,D, CYTOTOXICITY AND MUTAGENICITYOF FOUR INSECT PHEROMONES IN CHO-K1 CELLS, BULL. ENVIRON. CONTAMIN. TOXICOL.73(6):963-970, 2004"
+135-76-2,CCRIS,0,-1,,Oc1ccc2c(cccc2c1)S(=O)(=O)O,"YAMADA,M, KATO,Y, NAKAMURA,M AND ITO,Y, MUTAGENICITY STUDY OF SUNSETYELLOW FCF AND IT'S IMPURITY, FOODS FOOD INGREDIENTS J. JPN. 164:93-99,1995"
+5975-78-0,CCRIS,0,-1,"ZEARALANO",CC1CCCC(=O)CCCCCc2cc(O)cc(O)c2C(=O)O1,"INGEROWSKI,GH, SCHEUTWINKEL-REICH,M AND STAN,HJ, MUTAGENICITY STUDIESON VETERINARY ANABOLIC DRUGS WITH THE SALMONELLA/MICROSOME TEST, MUTAT. RES.91(2):93-98, 1981"
+56-53-1,EPA2,0,-1,"DIETHYLST",CC\C(=C(\CC)/c1ccc(O)cc1)\c2ccc(O)cc2,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+3025-52-3,EPA1,1,-1,,CCN(CC)c1ccc(cc1)N=Nc2ccc(cc2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+580-15-4,EPA1,0,-1,,Nc1ccc2ncccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-91-9,CCRIS,0,-1,,OC(=S)c1ccccc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+962-58-3,EPA1,1,-1,"DR0034139",CCOP(=O)(OCC)Oc1cc(C)nc(n1)C(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4435-53-4,CCRIS,0,-1,,COC(C)CCOC(=O)C,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+299-28-5,CCRIS,0,-1,"SBGLUCONA,CHOLINGLU,FERROGLUC,GLUCONANA,GLUCONATE,FERASTRAL,NSC-93616,PIPERAGLU,GLUCALDRA,KGLUCONAT,GLUCASPNA,STIBOGLNA",OCC(O)C(O)C(O)C(O)C(=O)O,"FUJITA,H AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVES WITHSALMONELLA TYPHIMURIUM TA97 AND TA102. II., KENKYU NENPO - TOKYO-TORITSU EISEIKENKYUSHO 38:423-430, 1987"
+143603-80-9,CCRIS,1,-1,,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3ccc(O)cc3,"LOPEZ DE CERAIN,A, GARCIA,E, BEORLEGUI,JJ, GULLON,A, ARRARAS,JA ANDMONGE,A, MUTAGENIC EVALUATION OF 3-(4'-BENZYLIDENEAMINO)INDOLE-2-ETHYLCARBOXYLATE IN HIS- SALMONELLA TYPHIMURIUM STRAINS, REV. TOXICOL. 10(3):151-154,1993"
+2645-07-0,VITIC,1,-1,,OC(=O)CNC(=O)c1ccc(cc1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+108-80-5,EPA3,0,-1,"CYANURATE",O=C1NC(=O)NC(=O)N1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+84030-17-1,CCRIS,0,-1,,Oc1ccc2cc(cc(c2c1N=Nc3ccc(cc3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O,"YAMADA,M, KATO,Y, NAKAMURA,M AND ITO,Y, MUTAGENICITY STUDY OF SUNSETYELLOW FCF AND IT'S IMPURITY, FOODS FOOD INGREDIENTS J. JPN. 164:93-99,1995"
+1253-28-7,CCRIS,0,1,,CCCCCC(=O)OC1(CCC2C3CCC4=CC(=O)CCC4C3CCC12C)C(=O)C,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+55556-85-9,EPA3,1,-1,,O[C@H]1CCCN(C1)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+4252-78-2,VITIC,1,-1,,ClCC(=O)c1ccc(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+73215-03-9,CCRIS,1,-1,,[O-][N+](=O)c1ccc(CNc2[nH]cnc3ncnc23)cc1,"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+13177-25-8,EPA1,1,-1,,Nc1ccc2cccc3c4ccccc4c1c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+37797-31-2,EPA1,1,-1,,CC(=O)OCc1ccc(cc1)N=Nc2ccc(COC(=O)C)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111712-45-9,CCRIS,1,-1,,CC(OP(=O)(OC(C)C(Br)CBr)OC(C)C(Br)CBr)C(Br)CBr,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+64920-32-7,EPA1,1,-1,,O[C@@H]1C=Cc2ccc3c(ccc4ccccc34)c2[C@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103946-55-0,CCRIS,1,-1,,C(OCC1CCC2OC2C1)C3CCC4OC4C3,"SCHWEIKL,H SCHMALZ,G AND WEINMANN,W MUTAGENIC ACTIVITY OF STRUCTURALLYRELATED OXIRANES AND SILORANES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.521(1-2):19-27, 2002"
+57309-27-0,CCRIS,0,-1,,CC1(N(O)c2ccccc2C1=O)c3ccccc3,"DAMIANI,E GRECI,L AND HRELIA,P, CYTO- AND GENOTOXIC EFFECTS OF NOVELAROMATIC NITROXIDE RADICALS IN VITRO, FREE RADICAL BIOL. MED. 28(3):330-336,2000"
+224-41-9,EPA3,1,-1,,c1ccc2c(c1)ccc3cc4ccc5ccccc5c4cc23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+135105-89-4,CCRIS,1,-1,,COc1cc(OC)c2C3C=COC3Oc2c1,"TURMO,E, SANCHEZ-BAEZA,F, BUJONS,J, CAMPS,F, CASELLAS,M, SOLANAS,AMAND MESSEGUER,A, SYNTHESIS AND MUTAGENICITY OF THE AFLATOXIN B1 MODEL 3A,8A-DIHYDRO-4,6-DIMETHOXYFURO[2,3-B]BENZOFURAN AND ITS 2,3-EPOXY DERIVATIVE, J.AGRIC. FOOD CHEM. 39(10):1723-1728, 1991"
+630-16-0,EPA3,1,-1,,BrCC(Br)(Br)Br,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+142044-37-9,EPA1,1,-1,,C[n+]1cccc2[C@@H]3O[C@@H]3C=Cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3585-32-8,EPA1,1,-1,,CNN=NC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125372-29-4,CCRIS,1,-1,,Cc1cc2ncccc2c3nc(N=N#N)n(C)c13,"WILD,D, AND DIRR,A, MUTAGENIC NITRENES/NITRENIUM IONS FROMAZIDO-IMIDAZOARENES AND THEIR STRUCTURE-ACTIVITY RELATIONSHIP, MUTAGENESIS4(6):446-52, 1989"
+133743-71-2,CCRIS,0,-1,,COC(=O)C1=C(C)N=C(C)C(=C(O)OCCc2ccc(cc2)N3CCN(CC3)C(c4ccccc4)c5ccccc5)C1c6cccc(c6)[N+](=O)[O-],"ANDO,N, KOSHIBA,H AND ABE,S, MUTAGENICITY STUDIES OF WATANIDIPINEHYDROCHLORIDE IN BACTERIAL REVERSE MUTATION TEST, IN VITRO CHROMOSOME ABERRATIONTEST AND MOUSE BONE-MARROW MICRONUCLEUS TEST, YAKURI TO CHIRYO25(SUPPL.3):S675-S684, 1997"
+134109-03-8,CCRIS,1,-1,,OC1C=Cc2c(ccc3c(Cl)c4ccccc4cc23)C1O,"FU,PP, VON TUNGELN,LS, UNRUH,LE, NI,Y AND CHOU,MW, COMPARATIVEREGIOSELECTIVE AND STEREOSELECTIVE METABOLISM OF 7-CHLOROBENZ[A]ANTHRACENE AND7-BROMOBENZ[A]-ANTHRACENE BY MOUSE AND RAT LIVER MICROSOMES, CARCINOGENESIS12(3):371-378, 1991"
+42286-46-4,EPA1,1,-1,,O=C1C(=O)c2cc3ccccc3c4ccc5cccc1c5c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101021-43-6,EPA1,1,-1,,Cc1ccc2c(ccc3[nH]c4ccc5ccccc5c4c23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2782-91-4,VITIC,0,-1,"TETMTHIOU",CN(C)C(=S)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+63224-45-3,EPA3,1,-1,,CCCCCCCCCCCCCCN(OC(=O)C)c1ccc2c(Cc3ccccc23)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+463-51-4,EPA3,1,-1,,C=C=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+119239-64-4,CCRIS,0,-1,,OC1C(O)c2ccc3c(ccc[n+]3[O-])c2C4OC14,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+2039-87-4,VITIC,0,-1,,Clc1ccccc1C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+88746-58-1,CCRIS,1,-1,,BrCc1cc2c3ccccc3c4cccc(c1)c24,"BALL,JC, AND YOUNG,WC, AMES ASSAY MUTAGENICITY AND ELECTRONICSTRUCTURE CALCULATIONS OF BROMOMETHYLFLUORANTHENES, CHLOROMETHYLFLUORANTHENES,AND HYDROXYMETHYLFLUORANTHENES, CHEM.-BIOL. INTERACT. 77(3):291-302,1991"
+90301-75-0,CCRIS,0,-1,,NC1=NC(=O)N(C=C1CCCl)C2CC(O)C(CO)O2,"MARQUADT,H, WESTENDORF,J, SCHAEFER,A, BOLDT,J, DE CLERCQ,E ANDMARQUARDT,H, MUTAGENIC AND ANTIMUTAGENIC EFFECTS OF 5-SUBSTITUTED2'-DEOXYURIDINES DEPENDING ON THE NATURE OF THE 5-SUBSTITUENT, ARZNEIM.-FORSCH.38(12):1820-1824, 1988"
+4189-44-0,CCRIS,1,-1,,NC(=S(=O)=O)N,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+191861-18-4,CCRIS,0,-1,,Fc1cnc2c(ccc3ncc(F)cc23)c1,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+299-88-7,CCRIS,0,-1,"BENTIAMIN",C\C(=C(/CCOC(=O)c1ccccc1)\SC(=O)c2ccccc2)\N(Cc3cnc(C)nc3N)C=O,"FUJITA,H AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVES WITHSALMONELLA TYPHIMURIUM TA97 AND TA102. II., KENKYU NENPO - TOKYO-TORITSU EISEIKENKYUSHO 38:423-430, 1987"
+37364-66-2,EPA1,0,-1,,C[C@@H](O)[C@H](NC(=O)[C@@H](C)[C@H](O)[C@@H](C)NC(=O)[C@@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@H](N)C(=O)N)[C@@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O[C@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+618-87-1,CCRIS,1,-1,,Nc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+14918-69-5,EPA1,1,-1,,Oc1c(Cl)c(Cl)c(O)c2C(=O)C=CC(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+27321-96-6,CCRIS,0,1,,CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OCCOCCO,"VIERNSTEIN,H, GOTTWALD,B AND WOTTAWA,A, THE MUTAGENIC POTENTIAL OFPOLYOXYLALKYLENE STEROL ETHERS, OESTERR. FORSCHUNGSZENT. SEIBERSDORF [BER.],REPORT NO. OEFZS-4388, 1-10, 1987"
+172374-59-3,CCRIS,1,-1,,CC(=O)Nc1ccc(Oc2ccc(cc2)N(O)C=O)cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, GENOTOXICITY OF POTENTIAL METABOLITESOF NITROSCANATE- AN ANTISCHISTOSOMAL DRUG, MUTAT. RES. 335(3):235-243,1995"
+146795-42-8,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2cccc(Br)c2,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+396-31-6,EPA1,0,-1,,Fc1cnc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5437-38-7,VITIC,1,-1,,Cc1cccc(C(=O)O)c1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+122-69-0,CCRIS,1,-1,"STYRACIN",O=C(OC\C=C\c1ccccc1)\C=C\c2ccccc2,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+3689-24-5,VITIC,1,-1,"SULFOTEPP",CCOP(=S)(OCC)OP(=S)(OCC)OCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+34433-31-3,CCRIS,0,-1,"HI-6",NC(=O)c1cc[n+](COC[n+]2ccccc2\C=N\O)cc1,"PUTNAM,D, SAN,RHC, BIGGER,CA, LEVINE,BS AND JACOBSON-KRAM,D, GENETICTOXICOLOGY ASSESSMENT OF HI-6 DICHLORIDE, ENVIRON. MOL. MUTAGEN. 27(2):152-161,1996"
+117066-35-0,EPA1,0,-1,,O[C@H]1[C@H](O)c2nc3ccc4ccccc4c3cc2c5ccccc15,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1116-40-1,VITIC,0,-1,,CC(C)CN(CC(C)C)CC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+153654-34-3,CCRIS,1,-1,,Oc1c(cc2c3ccccc3[nH]c2c1[N+](=O)[O-])[N+](=O)[O-],"HOLLOWAY,TC AND BALL,LM, SYNTHESIS AND MUTAGENICITY OF A SERIES OFNITRATED CARBAZOLES AND HYDROXYCARBAZOLES, MUTAGENESIS 8(4):321-327,1993"
+589-15-1,EPA1,0,-1,,BrCc1ccc(Br)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+83-38-5,VITIC,0,-1,,Clc1cccc(Cl)c1C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+102408-26-4,EPA1,1,-1,,CNc1nc2c3cccnc3ccc2n1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+66860-80-8,CCRIS,0,-1,,ClCC1(C(Cl)Cl)C2C(Cl)C(Cl)C1(C(Cl)Cl)C(Cl)C2Cl,"STEINBERG,M, KINOSHITA,FK AND BALLANTYNE,M,MUTAGENICITY STUDIES WITHTOXAPHENE CONGENERS, ORGANOHALOGEN COMPD. 35(ANALYSIS, CHLORINATED BORNANES,CHIRAL CONTAMINANTS, POLYMER ADDITIVES AND MONOMERS):243-246, 1998"
+107-15-3,VITIC,1,-1,"DR0004418,ETHYLEDIA,ETHYLEDIH",NCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+153260-24-3,CCRIS,0,-1,,Nc1nc2C3CCCNC3CCc2s1,"JAEN,JC, KROPKO,ML, THEISS,JC, WOLD,S, CAPRATHE,BW AND WISE,LD,ASSESSMENT OF MUTAGENIC POTENTIAL IN A SERIES OF COMPOUNDS STRUCTURALLY RELATEDTO 2-AMINO-3-METHYLIMIDAZO[4,5-F]QUINOLINE (IQ), EUR. J. MED. CHEM. 28(7-8):547-553, 1993"
+133-37-9,CCRIS,0,-1,,O[C@@H]([C@H](O)C(=O)O)C(=O)O,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+54954-12-0,EPA1,1,-1,,OC[C@H]1O[C@@H](Oc2cc(O)cc3Oc4c(O)ccc(O)c4C(=O)c23)[C@H](O)[C@@H](O)[C@@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+148-79-8,VITIC,1,-1,"TIABENDAZ",c1ccc2[nH]c(nc2c1)c3cscn3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2438-72-4,GENETOX,1,-1,"BUFEXAMAC",CCCCOc1ccc(CC(=O)NO)cc1,"PROC NATL ACAD SCI USA 72:5135-5139,1975"
+5709-67-1,CCRIS,1,-1,,[O-][N+](=O)c1nc2ccccc2[nH]1,"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+67730-11-4,EPA1,1,-1,,Cc1cccn2c1nc3ccc(N)nc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5855-71-0,CCRIS,1,-1,,Nc1ccc(c2ccc(N)cc2[N+](=O)[O-])c(c1)[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K, YAMANAKA,Y, ISHIHARA,M, SHINYA,M, TAKAHASHI,KAND WATANABE,T, STUDIES ON THE STRUCTURE ELUCIDATION OF MUTAGENIC METABOLITES OF2,4-DINITROBIPHENYL DERIVATIVES AGAINST SALMONELLA TYPHIMURIUM TA98, EISEIKAGAKU 37(3):229-238, 1991"
+159092-81-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(c1)cc(c3ccc(cc23)[N+](=O)[O-])[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+645-09-0,VITIC,1,-1,,NC(=O)c1cccc(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+92-48-8,VITIC,0,-1,"MECUMARI6",Cc1ccc2OC(=O)C=Cc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+53-43-0,CCRIS,0,1,,CC12CCC3C(CC=C4CC(O)CCC34C)C1CCC2=O,"WATANABE,K, SASAKI,T AND KAWAKAMI,K, COMPARISONS OF CHEMICALLY-INDUCEDMUTATION AMONG FOUR BACTERIAL STRAINS, SALMONELLA TYPHIMURIUM TA102 AND TA2638,AND ESCHERICHIA COLI WP2/PKM101 AND WP2 UVRA/PKM101: COLLABORATIVE STUDY III ANDEVALUATION OF THE USEFULNESS OF THESE STRAINS, MUTAT. RES. 416(3):169-181,1998"
+100-65-2,VITIC,1,-1,,ONc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+153654-32-1,CCRIS,1,-1,,Oc1c(cc2c3cc(ccc3[nH]c2c1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"HOLLOWAY,TC AND BALL,LM, SYNTHESIS AND MUTAGENICITY OF A SERIES OFNITRATED CARBAZOLES AND HYDROXYCARBAZOLES, MUTAGENESIS 8(4):321-327,1993"
+623-10-9,EPA1,1,-1,,Cc1ccc(NO)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91-23-6,EPA2,1,-1,,COc1ccccc1[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+119-39-1,VITIC,0,-1,"PHTHALAZO",Oc1nncc2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+88-05-1,EPA1,1,-1,,Cc1cc(C)c(N)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+809-73-4,EPA1,0,-1,,CC(C)(C)C1=CC(=CC=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C=C(C1=O)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111070-57-6,EPA1,1,-1,,[O-][N+](=O)c1oc(\C=N\N2C(=O)C=C(C=C2c3ccccc3)c4ccccc4)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19322-27-1,CCRIS,1,-1,,CC1=C(O)C(=O)CO1,"HIRAMOTO,K, SEKIGUCHI,K, AYUHA,K, ASO-O,R, MORIYA,N, KATO,T ANDKIKUGAWA,K, DNA BREAKING ACTIVITY AND MUTAGENICITY OF SOY SAUCE:CHARACTERIZATION OF THE ACTIVE COMPONENTS AND IDENTIFICATION OF4-HYDROXY-5-METHYL-3(2H)-FURANONE, MUTAT. RES. 359(2):119-132, 1996"
+NOCAS_M260,EPA1,1,-1,,CC[C@@H](Cl)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+31383-81-0,CCRIS,1,-1,,COC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OC)ccc1N,"TAKAGI,Y, ENDOH,O, GOTO,S, KOHZAKI,K AND MATSUSHITA,H, MUTAGENICITY OFDIAMINODIPHENYLMETHANE AND RELATED COMPOUNDS, KANKYO KAGAKU 5(4):841-845,1995"
+40855-12-7,EPA3,1,-1,,OCCNCc1oc(cc1)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+149396-88-3,CCRIS,1,-1,,COc1cc(C(O)c2ncc([N+](=O)[O-])n2C)c(O)c(c1)C(C)(C)C,"DUBINI,F, RIVIERA,L, SCALTRITO,MM AND BELLOTTI,MG, SUSCEPTIBILITY OFHELICOBACTER PYLORI AND PHARMACOKINETIC PROPERTIES IN MICE OF NEW5-NITROIMIDAZOLE DERIVATIVES DEVOID OF MUTAGENIC ACTIVITY IN THE AMES TEST, J.CHEMOTHER. (FLORENCE) 5(3):168-173, 1993"
+88-89-1,VITIC,1,-1,"AF-64A,BUTAMBENP,PICRATE,PICRATEAG",Oc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+67604-48-2,CCRIS,0,-1,"NARINGENI",Oc1ccc(cc1)C2CC(=O)c3c(O)cc(O)cc3O2,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y96"
+122-48-5,EPA1,0,-1,"ZINGERONE",COc1cc(CCC(=O)C)ccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134-72-5,EPA3,0,-1,,CN[C@H](C)[C@@H](O)c1ccccc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+62-31-7,EPA2,1,-1,"DOPAMINE,DOPAMIHCL",NCCc1ccc(O)c(O)c1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+18829-55-5,CCRIS,1,-1,,CCCC\C=C\C=O,"EDER,E, DEININGER,C, NEUDECKER,T AND DEININGER,D, MUTAGENICITY OFBETA-ALKYL SUBSTITUTED ACROLEIN CONGENERS IN THE SALMONELLA TYPHIMURIUM STRAINTA100 AND GENOTOXICTY TESTING IN THE SOS CHROMOTEST, ENVIRON. MOL. MUTAGEN.19(4):338-345, 1992"
+58086-32-1,EPA1,1,-1,,COC(=O)c1cccc2Oc3c4[C@@H]5C=CO[C@H]5Oc4cc(OC)c3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1845-30-3,CCRIS,0,-1,"VERBENOL",CC1=CC(O)C2CC1C2(C)C,"PODSTAVKOVA,S, MIADOKOVA,E, VLCEK,D, VLCKOVA,V AND KIJOVSKA,L, TESTINGOF THE POTENTIAL GENETIC RISK OF THE CIS-VERBENOL AND A PHEROMONIC MIXTURE, ACTAFAC. RERUM NAT. UNIV. COMENIANAE, FORM. PROT. NAT. 13:37-51, 1990 (PUBL.1991)"
+163930-30-1,VITIC,1,-1,,ICCc1ccc(OCc2ccccc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+143603-75-2,CCRIS,1,-1,,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3cc(OC)c(OC)c(OC)c3,"LOPEZ DE CERAIN,A, GARCIA,E, BEORLEGUI,JJ, GULLON,A, ARRARAS,JA ANDMONGE,A, MUTAGENIC EVALUATION OF 3-(4'-BENZYLIDENEAMINO)INDOLE-2-ETHYLCARBOXYLATE IN HIS- SALMONELLA TYPHIMURIUM STRAINS, REV. TOXICOL. 10(3):151-154,1993"
+NOCAS_M101,EPA1,1,-1,,[O-][N+](=O)c1ccc(s1)[C@@H]2NC(=O)c3ccccc3N2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+129401-88-3,EPA1,0,-1,,C=CC(=O)N1CCN(CC1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39565-00-9,EPA3,1,-1,,CC(=O)c1ccc(s1)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+290-37-9,EPA1,0,-1,"PYRAZINE",c1cnccn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2523-37-7,EPA1,1,-1,,CC1c2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+79-94-7,VITIC,0,-1,,CC(C)(c1cc(Br)c(O)c(Br)c1)c2cc(Br)c(O)c(Br)c2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107-25-5,VITIC,0,-1,,COC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+152-84-1,CCRIS,0,-1,,OC1COC(OCC2OC(Oc3ccc4C(=O)c5ccccc5C(=O)c4c3O)C(O)C(O)C2O)C(O)C1O,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+79-43-6,VITIC,1,-1,"DICLACETA",OC(=O)C(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+82-05-3,EPA1,1,-1,"BENZANTHO",O=C1c2ccccc2c3cccc4cccc1c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111712-47-1,CCRIS,1,-1,,CC(Br)C(Br)COP(=O)(OCC(Br)C(C)Br)OCC(Br)C(C)Br,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+34256-82-1,EPA1,0,-1,,CCOCN(C(=O)CCl)c1c(C)cccc1CC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80-82-0,CCRIS,0,-1,,OS(=O)(=O)c1ccccc1[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+106-30-9,EPA1,0,-1,,CCCCCCC(=O)OCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39638-32-9,CCRIS,1,-1,,CC(C)(Cl)OC(C)(C)Cl,"SIMMON,VF, KAUHANEN,K AND TARDIFF,RG, MUTAGENIC ACTIVITY OF CHEMICALSIDENTIFIED IN DRINKING WATER, DEV. TOXICOL. ENVIRON. SCI. 2:249-258,1977"
+4792-83-0,CCRIS,0,-1,,CCOc1ccc(cc1)N=[N+]([O-])c2ccc(OCC)cc2,"MCCOY,EC, ROSENKRANZ,HS AND BARTSCH,H, MUTAGENICITY OF THE PHENACETINMETABOLITES: N-HYDROXY-P-PHENETIDINE AND NITROSOPHENETOL IN S. TYPHIMURIUM TA100AND DERIVATIVES DEFICIENT IN NITROREDUCTASE OR O-ACETYLASE: PROBES FOR TESTINGINTRABACTERIAL METABOLIC"
+78448-07-4,EPA1,1,-1,,Oc1ccc2c(ccc3[nH]c4ccc5ccccc5c4c23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+82-50-8,EPA1,1,-1,,OS(=O)(=O)c1cccc2C(=O)c3c(cccc3[N+](=O)[O-])C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M174,EPA1,1,-1,,CC(=C)C(=O)OC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125157-98-4,CCRIS,1,-1,,CC1C2C(=Nc3ccc(C)cc23)N(C)c4ccccc14,"RAHDEN-STARON,I, PECZYNSKA-CZOCH,W AND KACZMAREK,L, MUTAGENICITY OFCARBOLINE METHYL DERIVATIVES IN SALMONELLA, ACTA MICROBIOL. POL. 43(2):247-250,1994"
+21638-36-8,CCRIS,1,-1,"NIFURIMID",CC1CN(\N=C\c2oc(cc2)[N+](=O)[O-])C(=O)N1,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+109621-21-8,CCRIS,0,-1,,COC(=O)C(CSCC(Br)c1ccccc1)NC(=O)C,"ZOETEMELK,CEM, MOHN,GR, VAN DER GEN,A AND BREIMER,DD, 1,2-DIBROMOCOMPOUNDS. THEIR MUTAGENICITY IN SALMONELLA STRAINS DIFFERING IN GLUTATHIONECONTENT AND THEIR ALKYLATING POTENTIAL, BIOCHEM. PHARMACOL. 36(11):1829-1835,1987"
+72-57-1,EPA1,1,-1,"TRYPANBLU",Cc1cc(ccc1N=Nc2c(O)c3c(N)cc(cc3cc2S(=O)(=O)O)S(=O)(=O)O)c4ccc(N=Nc5c(O)c6c(N)cc(cc6cc5S(=O)(=O)O)S(=O)(=O)O)c(C)c4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+140-49-8,VITIC,1,-1,,CC(=O)Nc1ccc(cc1)C(=O)CCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2832-19-1,EPA1,0,-1,,OCNC(=O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+497841-28-8,VITIC,1,-1,,C[C@@H](Nc1[nH]cnc2nc(cc12)c3ccc(CCl)cc3)c4ccccc4,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+96910-73-5,CCRIS,1,-1,,CC1C=C(C=O)C(=CC2(O)CC(C)(C)CC12)C=O,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+25956-17-6,EPA1,0,-1,"ALLURARED",COc1cc(c(C)cc1N=Nc2c(O)ccc3cc(ccc23)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57816-08-7,EPA3,1,-1,,C1c2ccc3ccccc3c2Cc4ccc5ccccc5c14,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1149-99-1,CCRIS,1,-1,,CC1=C2C(O)C(C)(CO)C=C2C(=O)C(C)(O)C13CC3,"NAGAO,T, SAITO,K, HIRAYAMA,E, UCHIKOSHI,K, KOYAMA,K, NATORI,S,MORISAKI,N, IWASAKI,S AND MATSUSHIMA,T, MUTAGENICITY OF PTAQUILOSIDE, THECARCINOGEN IN BRACKEN, AND ITS RELATED ILLUDANE-TYPE SESQUITERPENES. I.MUTAGENICITY IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 215(2):173-8,1989"
+624-76-0,EPA3,1,-1,,OCCI,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+14882-94-1,CCRIS,0,-1,,CC(=O)OC(C)(C)C1Cc2cc3C=C(C(=O)Oc3cc2O1)C(C)(C)C=C,"SCHIMMER,O, KIEFER,J AND PAULINI,H, INHIBITORY EFFECTS OFFUROCOUMARINS IN SALMONELLA TYPHIMURIUM TA98 ON THE MUTAGENICITY OF DICTAMNINEAND RUTACRIDONE, PROMUTAGENS FROM RUTA GRAVEOLENS L, MUTAGENESIS 6(6):501-506,1991"
+100-03-8,VITIC,0,-1,,OS(=O)c1ccc(Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+57-41-0,VITIC,0,-1,"PHETOINCA,PHENYTOIN,PHENYTONA",O=C1NC(=O)C(N1)(c2ccccc2)c3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+835-64-3,EPA1,0,-1,,Oc1ccccc1c2oc3ccccc3n2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68268-44-0,CCRIS,0,-1,,CC(C)CN(C(=O)CCCl)c1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+91-93-0,VITIC,1,-1,,COc1cc(ccc1N=C=O)c2ccc(N=C=O)c(OC)c2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+74940-61-7,CCRIS,0,-1,,COP(=O)(OC)C(OC(=O)CCl)C(Cl)(Cl)Cl,"KAPPAS,A, VACHKOVA,R, LALCHEV,S, TZONEVA,M AND MARKAKI,M, GENOTOXICITYSTUDIES ON THE ORGANOPHOSPHORUS INSECTICIDE CHLORACETOPHONE, MUTAT. RES.240(3):203-8, 1990"
+393-77-1,CCRIS,0,-1,,Oc1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-],"MAZZA,G, DACARRO,C, BONFERONI,C AND BONFERONI,B, STUDIES ON THEMUTAGENIC ACTIVITY OF BENZOTRIFLUORIDE AND TWELVE DERIVATIVES IN MICROBIALSHORT-TERM ASSAYS,FARMACO, ED. PRAT. 41(7):215-225, 1986"
+62018-92-2,EPA3,1,-1,,CCCCN(CCC(=O)O)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+25074-67-3,EPA1,1,-1,,Clc1ccc2c(oc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+124878-08-6,CCRIS,1,-1,,COc1cc(OC)c(cc1OC)C2OC2C,"KIM,SG, LIEM,A, STEWART,BC AND MILLER,JA, NEW STUDIES ONTRANS-ANETHOLE OXIDE AND TRANS-ASARONE OXIDE, CARCINOGENESIS 20(7):1303-1307,1999"
+119-26-6,CCRIS,1,-1,,NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+522-06-5,EPA1,1,-1,"FLINDERAM",COc1c2ccoc2nc3c(OC)c4OCOc4cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119-15-3,VITIC,1,-1,,Oc1ccc(Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+75464-10-7,CCRIS,1,-1,"PRDITHR10",CCC(=O)C1c2cccc(O)c2C(=O)c3c(O)cccc13,"MANNISTO,PT, KIRKLAND,D, VILUKSELA,M AND TIKKANEN,L, TOXICOLOGICALSTUDIES WITH DITHRANOL AND ITS 10-ACYL ANALOGS, ARCH. TOXICOL. 59(3):180-185,1986"
+3626-29-7,EPA1,1,-1,,OC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)c3ccc(cc3)N=Nc4ccc(N=Nc5ccc(O)c(c5)C(=O)O)c6cc(ccc46)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+158729-30-7,CCRIS,0,-1,,[O-][N+](=O)c1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1Cl,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+67274-52-6,CCRIS,1,-1,,CC(=O)N(O)c1ccc(cc1)[N+](=O)[O-],"CORBETT,MD, WEI,CI AND CORBETT,BR, NITROREDUCTASE-DEPENDENTMUTAGENICITY OF P-NITROPHENYLHYDROXYLAMINE AND ITS N-ACETYL AND N-FORMYLHYDROXAMIC ACIDS, CARCINOGENESIS 6(5):727-732, 1985"
+334-48-5,VITIC,0,-1,"CAPRATE,DEDP,JM-280",CCCCCCCCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+96563-01-8,CCRIS,0,-1,,NC(CSC(F)(F)C(F)Cl)C(=O)O,"VAMVAKAS,S, BERTHOLD,K, DEKANT,W AND HENSCHLER,D, BACTERIAL CYSTEINECONJUGATE BETA-LYASE AND THE METABOLISM OF CYSTEINE S-CONJUGATES. STRUCTURALREQUIREMENTS FOR THE CLEAVAGE OF S-CONJUGATES AND THE FORMATION OF REACTIVEINTERMEDIATES, CHEM.-BIOL. INTERACT. 65(1):59-71, 1988"
+482-27-9,EPA1,0,-1,"ISOPIMPIN",COc1c2OC(=O)C=Cc2c(OC)c3ccoc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1563-66-2,EPA1,0,-1,"CARBOFURA",CNC(=O)Oc1cccc2CC(C)(C)Oc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108283-47-2,CCRIS,1,-1,,CC(C)(C)OC(=O)C(N)CN=N#N,"LAVELLE,JM AND MANGOLD,JB, STRUCTURE-ACTIVITY RELATIONSHIPS OF THEAZIDE METABOLITE, AZIDOALANINE, IN S. TYPHIMURIUM, MUTAT. RES. 177(1):27-33,1987"
+94-80-4,VITIC,0,-1,,CCCCOC(=O)COc1ccc(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+634-67-3,EPA1,0,-1,,Nc1ccc(Cl)c(Cl)c1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+31647-36-6,EPA1,1,-1,,Cc1cc2cccc3ccc4c5ccccc5cc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1574-41-0,CCRIS,0,-1,,C\C=C/C=C,"MADHURSREE,B GOTO,S OHKUBO,T TIAN,H ANDO,F FUKUHARA,M TOHKIN,M ANDWATANABE,I, MUTAGENICITY TESTING OF 1,3-BUTADIENE, 1,4-PENTADIENE-3-OL,ISOPRENE-2,4-HEXADIENE, CIS- AND TRANS-PIPERYLENE, J. HEALTH SCI. 48(1):73-78,2002"
+611-33-6,EPA1,1,-1,,Clc1cccc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+65271-80-9,EPA1,1,-1,"MITOXANTR,MITOXAHCL",OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+341-69-5,EPA3,0,-1,,CN(C)CCO[C@H](c1ccccc1)c2ccccc2C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M231,EPA1,1,-1,,CCc1c(O)ccc2c3CCO[C@@](CC)(CC(=O)O)c3[nH]c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57-83-0,EPA1,0,1,,CC(=O)[C@H]1CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+603-02-1,EPA1,1,-1,,Cc1ccc(c(C)c1[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6300-61-4,EPA3,1,-1,,Cc1cc(N=Nc2ccc(cc2)S(=O)(=O)O)c(N)cc1N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+5141-20-8,CCRIS,1,-1,"LIGHTGRSF",CCN(Cc1cccc(c1)S(=O)(=O)O)c2ccc(cc2)C(=C3C=CC(=[N+](CC)Cc4cccc(c4)S(=O)(=O)O)C=C3)c5ccc(cc5)S(=O)(=O)O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+13177-26-9,EPA1,1,-1,,Nc1cc2c3ccccc3c4cccc(c1)c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10567-95-0,EPA1,1,-1,,Cc1cc2c(C)c3ccccc3nc2c4ccccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+488-11-9,CCRIS,1,-1,,OC(=O)\C(=C(/Br)\C=O)\Br,"LALONDE,RT AND LEO,HR, INTERACTIVE CHLORINE-BY-BROMINE ANDHYDROGEN-BY-HYDROXYL GROUP REPLACEMENT EFFECTS IN 2(5H)-FURANONE MUTAGENICITY,CHEM. RES. TOXICOL. 7(6):779-783, 1994"
+141-84-4,VITIC,0,-1,"RHODANINE",O=C1CSC(=S)N1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+58632-95-4,CCRIS,0,-1,,CC(C)(C)OC(=O)O\N=C(/C#N)\c1ccccc1,"ALLEN,JS AND PANFILI,J, AMES SALMONELLA/MAMMALIAN-MICROSOME TESTING OFPEPTIDES AND PEPTIDE SYNTHESIS REAGENTS, MUTAT. RES. 170(1-2):23-29,1986"
+106-95-6,VITIC,1,-1,,BrCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+314-40-9,GENETOX,0,-1,,CCC(C)N1C(=O)NC(=C(Br)C1=O)C,"REPORT (LSU-5612):14 PP,1978"
+53757-28-1,CCRIS,1,-1,,[O-][N+](=O)c1oc(cc1)c2cscn2,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+2315-20-0,EPA3,1,-1,,NC(=N)NN=C(\C=C/c1oc(cc1)[N+](=O)[O-])\C=C/c2oc(cc2)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M526,EPA1,0,-1,,ClC1=C(Cl)[C@@]2(Cl)[C@H]3COS(=O)OC[C@@H]3[C@]1(Cl)C2(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120-82-1,VITIC,0,-1,,Clc1ccc(Cl)c(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M456,EPA1,0,-1,,COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@@H]([C@H](O)[C@H](C)O5)N6CCOC[C@H]6C#N)c4c(O)c3C(=O)c12)C(=O)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98736-45-9,CCRIS,1,-1,,COc1cccc(CN(C)N=O)c1,"SINGER,GM, ANDREWS,AW AND GUO,SM, QUANTITATIVE STRUCTURE-ACTIVITYRELATIONSHIP OF THE MUTAGENICITY OF SUBSTITUTED N-NITROSO-N-BENZYLMETHYLAMINES:POSSIBLE IMPLICATIONS FOR CARCINOGENICITY, J. MED. CHEM. 29(1):40-44,1986"
+13007-92-6,VITIC,0,-1,"FEPENTACA,NICO",[C-]#[O+],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+38915-38-7,EPA1,1,-1,,CCCCOc1ccc2nc3cc(Cl)ccc3c(NCCCNCCCl)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-69-0,EPA3,1,-1,,Cc1cc(C)cc(N)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+58-90-2,VITIC,0,-1,,Oc1c(Cl)cc(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2598-29-0,EPA1,0,-1,,CC(=O)Oc1cccc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+34522-72-0,CCRIS,1,-1,,Fc1cc(F)c2cccnc2c1,"KATO,T, SAEKI,K, KAWAZOE,Y AND HAKURA,A, EFFECTS OF OLIGOFLUORINESUBSTITUTION ON THE MUTAGENICITY OF QUINOLINE: A STUDY WITH TWELVEFLUOROQUINOLINE DERIVATIVES, MUTAT. RES. 439(2):149-157, 1999"
+3179-47-3,VITIC,0,-1,,CCCCCCCCCCOC(=O)C(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+579-07-7,EPA1,0,-1,,CC(=O)C(=O)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+27532-75-8,EPA1,1,-1,,Cc1ccc2cc3ccccc3c(C)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+958-09-8,CCRIS,0,-1,,Nc1ncnc2c1ncn2C3CC(O)C(CO)O3,"INOUE,T, MURAKAMI,K AND FUFII,T, MUTAGENIC POTENTIAL OF CORDYCEPIN(3'-DEOXYADENOSINE) IN SALMONELLA AND SOYBEAN TESTER STRAINS, MUTAT. RES.174(3):179-182, 1986"
+75-33-2,VITIC,0,-1,,CC(C)S,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4985-70-0,EPA1,0,-1,,Clc1cccc2cc3ccccc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+72076-98-3,EPA1,1,-1,,c1ccc2c(c1)cc3sc4cccc5ccc2c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91598-91-3,EPA1,1,-1,,CC(=O)Nc1ccc2ccc3c(O)ccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+81-48-1,VITIC,0,-1,,Cc1ccc(Nc2ccc(O)c3C(=O)c4ccccc4C(=O)c23)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+86412-49-9,CCRIS,0,-1,,CC(=O)N(O)c1ccc(Cl)c(Cl)c1,"MCMILLAN,DC, SHADDOCK,JG, HEFLICH,RH, CASCIANO,DA AND HINSON,JA,EVALUATION OF PROPANIL AND ITS N-OXIDIZED DERIVATIVES FOR GENOTOXICITY IN THESALMONELLA TYPHIMURIUM REVERSION, CHINESE HAMSTER OVARY/HYPOXANTHINE GUANINEPHOSPHORIBOSYL TRANSFERASE, AND RAT HEPATOCYTE/DNA REPAIR ASSAYS, FUNDAM. APPL.TOXICOL. 11(3): 429-439, 1988"
+160543-04-4,CCRIS,1,-1,,OCc1ccc2nc3c(ccc4ccccc34)c(CO)c2c1,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+27946-19-6,CCRIS,1,-1,,ClC(C(=O)NCc1ccccc1)c2ccccc2,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+8065-41-6,EPA1,0,-1,,C[C@@H](O)[C@@H](N)[C@H](O)[C@H](O)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3268-87-9,VITIC,0,-1,,Clc1c(Cl)c(Cl)c2Oc3c(Cl)c(Cl)c(Cl)c(Cl)c3Oc2c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4494-26-2,CCRIS,0,-1,,OCC1OC(CC1O)N2C=C(C=O)C(=O)NC2=O,"PATEL,U, BHIMANI,R AND FRENKEL,K, MECHANISM OF MUTAGENICITY BY5-HYDROPEROXYMETHYL-2'-DEOXYURIDINE, AN INTERMEDIATE PRODUCT OF IONIZINGRADIATION, IN BACTERIA. HPMDU BACTERIAL MUTAGENICITY AND OXIDATION OF DNA BASES,MUTAT. RES. 283(2):145-156, 1992"
+1689-71-0,CCRIS,0,-1,"STILBENEO",O1C(C1c2ccccc2)c3ccccc3,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+94500-53-5,CCRIS,0,-1,,OCc1cc2cccc3ccc4cc5ccccc5c1c4c23,"BALL,JC, FOXALL-VANAKEN,S, LEON,AA, DAUB,GH AND JAGT,DLV, 11-AND 12-CHLOROMETHYLBENZO[A]PYRENE ARE POTENT DIRECT-ACTING MUTAGENS IN THE AMES ASSAY,MUTAT. RES. 142(4):141-144, 1985"
+145627-70-9,CCRIS,1,-1,,OC1C(O)c2ccc3c4CCCc4ccc3c2C5OC15,"PAPAPARASKEVA-PETRIDES,C, IOANNIDES,C, BOYD,GW, YOUNG,RJ, HARVEY,RGAND COOMBS, MM, THE MUTAGENICITY OF CHEMICALLY SYNTHESIZED METABOLITES OF16,17-DIHYDRO-15H-CYCLOPENTA[A]PHENANTHRENE AND ITS CARCINOGENIC 11-METHYLHOMOLOG, MUTAGENESIS 8(4):307-310, 1993"
+21655-84-5,EPA1,1,-1,"C-383",Cc1nccc2c3ccccc3[nH]c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+144605-96-9,CCRIS,1,-1,,COC(=O)C1Cc2c([nH]c3ccc(cc23)[N+](=O)[O-])C(C)N1N=O,"SALVI,NA, CHOUGHULEY,AS, SHETTY,TK AND BHATTACHARYA,RK, NITROSATIONAND MUTAGENICITY OF TETRAHYDRO-BETA-CARBOLINE DERIVATIVES, TOXICOL. ENVIRON.CHEM. 36(1-2):47-56, 1992"
+14097-03-1,CCRIS,1,-1,,CCN(CC[N+](C)(C)C)c1ccc(cc1)N=Nc2ccc(cc2Cl)[N+](=O)[O-],"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+35231-44-8,EPA1,0,-1,,COc1ccc2C(=CC(=O)Oc2c1)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120209-97-4,EPA1,1,-1,,Nc1ccc2nc3cc(N)ccc3nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+389104-59-0,CCRIS,0,-1,,CC(C)(C)c1c(N)ccc2c1Cc3ccccc23,"GLENDE,C SCHMITT,H ERDINGER,L ENGELHARDT,G AND BOCHE,G, TRANSFORMATIONOF MUTAGENIC AROMATIC AMINES INTO NON-MUTAGENIC SPECIES BY ALKYL SUBSTITUENTS.PART I. ALKYLATION ORTHO TO THE AMINO FUNCTION. MUTAT. RES. 498(1-2):19-37,2001"
+91-20-3,VITIC,0,-1,"NAPHTHALE",c1ccc2ccccc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+150-76-5,VITIC,0,-1,"MEQUINOL",COc1ccc(O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98033-22-8,EPA1,1,-1,,CN1CCc2c1ccc3ccc4ccc(O)cc4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132742-04-2,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3c4C=CCCc4cc5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M534,EPA1,0,-1,,C[C@@H](O)CNC[C@@H](C)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51-17-2,VITIC,0,-1,"BENZIMIDA",c1ccc2[nH]cnc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+66850-95-1,CCRIS,0,-1,,OC(=O)CCC(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C(=O)O,"RASHID,KA, BABISH,JG AND MUMMA,RO, TESTING OF 2,4,5-T-AMINO ACIDCONJUGATES FOR MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM STRAINS, MUTAT. RES.136(3):217- 221, 1984"
+152-20-5,EPA1,0,-1,,COP(=O)(OC)SC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19020-26-9,CCRIS,0,-1,,CCc1ccnc2ccccc12,"SAEKI,K, TAKAHASHI,K AND KAWAZOE,Y, POTENT MUTAGENIC POTENTIAL OF4-METHYLQUINOLINE: METABOLIC AND MECHANISTIC CONSIDERATIONS, BIOL. PHARM. BULL.19(4):541-546, 1996"
+54556-98-8,EPA1,0,-1,"PROPIVERI,PROPIVHCL",CCCOC(C(=O)OC1CCN(C)CC1)(c2ccccc2)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+34430-24-5,CCRIS,0,-1,,CCC[CH-][N+](=O)[O-],"CONAWAY,CC, HUSSAIN,NS, WAY,BM AND FIALA,ES, EVALUATION OF SECONDARYNITROALKANES, THEIR NITRONATES, PRIMARY NITROALKANES, NITROCARBINOLS, AND OTHERALIPHATIC NITRO COMPOUNDS IN THE AMES SALMONELLA ASSAY, MUTAT. RES.261(3):197-207, 1991"
+843-55-0,EPA1,0,-1,,Oc1ccc(cc1)C2(CCCCC2)c3ccc(O)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+42509-80-8,EPA1,1,-1,,CCOP(=S)(OCC)Oc1nc(Cl)n(n1)C(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2393-18-2,CCRIS,0,-1,,Nc1ccc(\C=C\C(=O)O)cc1,"EDER,E, DEININGER,C AND MUTH,D, GENOTOXICITY OF P-NITROCINNAMALDEHYDEAND RELATED ALPHA,BETA-UNSATURATED CARBONYL COMPOUNDS IN TWO BACTERIAL ASSAYS,MUTAGENESIS 6(4):261-269, 1991"
+352-11-4,EPA1,0,-1,,Fc1ccc(CCl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-63-6,EPA1,0,-1,,Cc1ccc(C)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+627-03-2,EPA1,0,-1,"POLYDIOXA",CCOCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39501-62-7,CCRIS,1,-1,,ONc1ccc(Oc2ccccc2)cc1,"GUPTA,RL, DEY,DK AND JUNEJA,TR, MUTAGENICITY OF 4-NITRODIPHENYL ETHERAND ITS METABOLITES, TOXICOL. LETT. 34(1):13-21, 1986"
+150-30-1,CCRIS,0,-1,,NC(Cc1ccccc1)C(=O)O,"WU,X, SKOG,K AND JAEGERSTAD,M, TRIGONELLINE, A NATURALLY OCCURRINGCONSTITUENT OF GREEN COFFEE BEANS BEHIND THE MUTAGENIC ACTIVITY OF ROASTEDCOFFEE?, MUTAT. RES. 391(3):171-177, 1997"
+91-95-2,EPA1,1,-1,,Nc1ccc(cc1N)c2ccc(N)c(N)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78996-87-9,CCRIS,1,-1,,Cc1cc2c(O)cccc2c3cc4ccccc4cc13,"MUSHTAQ,M, FU,PP, MILLER,DW AND YANG,SK, METABOLISM OF6-METHYLBENZ[A]ANTHRACENE BY RAT LIVER MICROSOMES AND MUTAGENICITY OFMETABOLITES, CANCER RES. 45(9): 4006-4014, 1985"
+81840-15-5,EPA1,0,-1,"DR9805258",COc1ccc(cc1OC)C(=O)N2CCN(CC2)c3ccc4NC(=O)CCc4c3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105-54-4,EPA1,0,-1,"DR9601704",CCCC(=O)OCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4560-58-1,CCRIS,0,1,,CC(CCC(=O)O)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(=O)C12C,"MORI,Y, NII,H, MASUDA,A, MIZUMOTO,K, KONISHI,Y, UNE,M AND HOSHITA,T,ABSENCE OF MUTAGENIC ACTION OF 5BETA-CHOLAN-24-OIC ACID DERIVATIVES IN THEBACTERIAL FLUCTUATION AND STANDARD AMES TEST, MUTAT. RES. 262(4):267-274,1991"
+10353-98-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2cccc3C=Cc1c23,"VANCE,WA AND LEVIN,DE, STRUCTURAL FEATURES OF NITROAROMATICS THATDETERMINE MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM, ENVIRON. MUTAGEN.6(6):797-811, 1984"
+2223-82-7,EPA1,0,-1,,CC(C)(COC(=O)C=C)COC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103088-83-1,EPA1,1,-1,,O=C1C=Cc2ccc3c(ccc4ccccc34)c2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+608-25-3,VITIC,0,-1,,Cc1c(O)cccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+85-83-6,EPA1,1,-1,"SUDAN-4",Cc1ccccc1N=Nc2ccc(N=Nc3c(O)ccc4ccccc34)c(C)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80266-02-0,CCRIS,1,-1,,COc1cc(NS(=O)(=O)C)ccc1Nc2c3ccccc3nc4cc(ccc24)N=N#N,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+6754-13-8,EPA3,0,-1,,C[C@@H]1C[C@H]2OC(=O)C(=C)[C@H]2[C@H](O)[C@]3(C)[C@H]1C=CC3=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+2307-69-9,CCRIS,1,-1,,CC(C)OS(=O)(=O)c1ccc(C)cc1,"GLOWIENKE,S, FRIAUFF,W, ALLMENDINGER,T, MARTUS,HJ, SUTER,W ANDMUELLER,L, STRUCTURE-ACTIVITY CONSIDERATIONS AND IN VITRO APPROACHES TO ASSESSTHE GENOTOXICTY OF 19 METHANE-, BENZENE- AND TOLUENESULFONIC ACID ESTERS, MUTAT.RES. 581(1-2):23-34, 2005"
+102877-14-5,CCRIS,0,-1,,Nc1cccc2nc3cccc(N)c3nc12,"WATANABE,T, HANASAKI,Y, HIRAYAMA,T AND FUKUI,S, MUTAGENICITY OF NITRO-AND AMINO-SUBSTITUTED PHENAZINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.225(3):75-82, 1989"
+NOCAS_M323,EPA1,0,-1,,CN(C)CC[C@@H](c1ccccc1)c2ccccn2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-00-5,EPA2,1,-1,,[O-][N+](=O)c1ccc(Cl)cc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+13925-00-3,EPA1,0,-1,,CCc1cnccn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+58139-51-8,EPA3,1,-1,,Nc1nc(cs1)c2cc(cs2)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+215226-73-6,CCRIS,1,-1,,OC(=O)\C(=C(\CCl)/C(Cl)Cl)\Cl,"FRANZEN,R, GOTO,S, TANABE,K AND MORITA,M, GENOTOXIC ACTIVITY OFCHLORINATED BUTENOIC ACIDS IN SALMONELLA TYPHIMURIUM STRAINS TA98, TA100 ANDTA104, MUTAT. RES. 417(1):31-37, 1998"
+556-18-3,CCRIS,0,-1,,Nc1ccc(C=O)cc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+87976-77-0,CCRIS,1,-1,,OS(=O)(=O)OCc1c2ccccc2cc3c1ccc4ccccc34,"WATABE,T, HAKAMATA,Y, HIRATSUKA,A AND OGURA,K, A 7-HYDROXYMETHYLSULFATE ESTER AS AN ACTIVE METABOLITE OF THE CARCINOGEN,7-HYDROXYMETHYLBENZ[A]ANTHRACENE, CARCINOGENESIS 7(2):207-214, 1986"
+6837-97-4,EPA3,1,-1,,Oc1ccc(Cl)c2C(=O)c3c(O)ccc(Cl)c3C(=O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+156-51-4,EPA2,1,-1,,OS(=O)(=O)ONNCCc1ccccc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+4836-66-2,CCRIS,1,-1,,OCc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],"MORI,M, MIYAHARA,T, MOTO-O,K, FUKUKAWA,M, KOZUKA,H, MIYAGOSHI,M ANDNAGAYAMA,T, MUTAGENICITY OF URINARY METABOLITES OF 2,4-DINITROTOLUENE TOSALMONELLA TYPHIMURIUM, CHEM. PHARM. BULL. 33(10):4556-4563, 1985"
+156243-44-6,EPA1,1,-1,,CNc1ccc2ncc(C)nc2c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+42464-80-2,CCRIS,0,-1,,CC(=O)Nc1cccc2ncccc12,"JORDAN,VC, LABABIDI,MK AND LANGAN-FAHEY,S, SUPPRESSION OF MOUSEMAMMARY TUMORIGENESIS BY LONG-TERM TAMOXIFEN THERAPY, J. NATL. CANCER INST.83:492-496, 1991"
+676-46-0,CCRIS,0,-1,"CYCLOPLAT,MALATE,KMALATE",OC(CC(=O)O)C(=O)O,"FUJITA,H, AOKI,N AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVESWITH SALMONELLA TYPHIMURIUM TA97 AND TA102. IX, TOKYO-TORITSU EISEI KENKYUSHOKENKYU NENPO 45:191-199, 1994"
+160637-28-5,CCRIS,1,-1,,Cc1ccc2nc3c4C=CC(O)C(O)c4ccc3c(C)c2c1,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+71439-68-4,CCRIS,1,-1,,C1CN=C(N\N=C\c2c3ccccc3c(\C=N\NC4=NCCN4)c5ccccc25)N1,"VENITT,S, CROFTON-SLEIGH,C, AGBANDJE,M, JENKINS,TC AND NEIDLE,S,ANTHRACENE-9,10-DIONES AS POTENTIAL ANTICANCER AGENTS: BACTERIAL MUTATIONSTUDIES OF AMIDO-SUBSTITUTED DERIVATIVES REVEAL AN UNEXPECTED LACK OFMUTAGENICITY, J. MED. CHEM. 41:3748-3752, 1998"
+15444-20-9,EPA1,1,-1,"LYSICAMIN",COc1cc2ccnc3C(=O)c4ccccc4c(c1OC)c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1555-94-8,EPA1,0,-1,,CCOc1cccc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94-41-7,CCRIS,0,-1,"BW-24",O=C(\C=C\c1ccccc1)c2ccccc2,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+105-39-5,EPA1,0,-1,,CCOC(=O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131524-41-9,CCRIS,0,-1,,O\N=C\c1cccc[n+]1CCOCC#C,"ORNER,G, SEEWALD,JB, NIEDING,WJ AND KORTE,DW, MUTAGENIC POTENTIAL OF2-HYDROXYIMINOMETHYL-1-(2'PROPARGYLOXYETHYL)PYRIDINIUM CHLORIDE IN THE AMESSALMONELLA/MAMMALIAN MICROSOME MUTAGENICITY TEST, U.S. ARMY MEDICAL RESEARCH ANDDEVELOPMENT COMMAND, NTIS AD-A212646, 1989"
+527-61-7,EPA1,0,-1,,CC1=CC(=O)C=C(C)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+555-77-1,EPA1,0,-1,"TRICLMETN,TRICLMHCL",ClCCN(CCCl)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3077-85-8,EPA1,1,-1,,[O-][N+](=O)c1ccc2[nH]c3ccccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105928-88-9,CCRIS,1,-1,,NC(CN=N#N)C(=O)O,"OWAIS,WM, RONALD,RC, KLEINHOFS,A AND NILAN,RA, SYNTHESIS ANDMUTAGENICITY OF THE TWO STEREOISOMERS OF AN AZIDE METABOLITE (AZIDOALANINE),MUTAT. RES. 175(3):121-126, 1986"
+90223-04-4,CCRIS,0,-1,,Cn1c(N)nc2cc(O)ccc12,"SMITH,C, PAYNE,V, DOOLITTLE,DJ, DEBNATH,AK, LAWLOR,T AND HANSCH,C,MUTAGENIC ACTIVITY OF A SERIES OF SYNTHETIC AND NATURALLY OCCURRING HETEROCYCLICAMINES IN SALMONELLA, MUTAT. RES. 279(1):61-73, 1992"
+81593-11-5,CCRIS,1,-1,,CS(=O)(=O)N1C2C1c3ccccc3c4ccccc24,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+4812-40-2,CCRIS,1,-1,"HOMETRONI",OCCn1c(CO)ncc1[N+](=O)[O-],"CHACKO,M, NAGABHUSHAN,M, SARKAR,S AND BHIDE,SV, STUDIES ON THEPOSSIBLE MUTAGENIC ACTION OF METRONIDAZOLE, INDIAN J. EXP. BIOL. 25(4):240-243,1987"
+50-24-8,EPA1,0,1,"PDNISOLON",C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+149127-57-1,CCRIS,0,-1,,CCN=NC(C)(C)OO,"MOCHIZUKI,M, MICHIHIRO,K, SHIOMI,K, ITOH,K, TANGE,Y AND HIZATATE,S,AUTOOXIDATION OF ALKYLHYDRAZONES AND MUTAGENICITY OF THE RESULTINGHYDROPEROXIDES, BIOL. PHARM. BULL. 16(1):96-98, 1993"
+79-20-9,VITIC,0,-1,"MEACETATE",COC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+79-00-5,VITIC,0,-1,,ClCC(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100288-36-6,CCRIS,0,-1,,CC1C=C(C=O)C(C=O)C(O)C2CC(C)(C)CC12,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+81-14-1,VITIC,0,-1,,CC(=O)c1c(C)c(c(c(c1C)[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1068-57-1,EPA1,1,-1,"ACHYDRAZI",CC(=O)NN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2835-95-2,VITIC,1,-1,,Cc1ccc(N)cc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107456-13-3,CCRIS,0,-1,,CCCCOC(=O)c1cccc2cccnc12,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+343-27-1,EPA3,1,-1,"HARMINE",COc1ccc2c(c1)[nH]c3c(C)nccc23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+87625-62-5,CCRIS,1,-1,,CC1CC2(OC3OC(CO)C(O)C(O)C3O)C=C(C)C4(CC4)C(C)(O)C2C1=O,"NAGAO,T, SAITO,K, HIRAYAMA,E, UCHIKOSHI,K, KOYAMA,K, NATORI,S,MORISAKI,N, IWASAKI,S AND MATSUSHIMA,T, MUTAGENICITY OF PTAQUILOSIDE, THECARCINOGEN IN BRACKEN, AND ITS RELATED ILLUDANE-TYPE SESQUITERPENES. I.MUTAGENICITY IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 215(2):173-8,1989"
+88598-58-7,CCRIS,0,-1,,[O-][N+](=O)c1c2CCCCc2c3ccc4cccc5ccc1c3c45,"FU,PP, CHOU,MW, MILLER,DW, WHITE,GL, HEFLICH,RH AND BELAND,FA, THEORIENTATION OF THE NITRO SUBSTITUENT PREDICTS THE DIRECT-ACTING BACTERIALMUTAGENICITY OF NITRATED POLYCYCLIC AROMATIC HYDROCARBONS, MUTAT. RES.143(3):173-181, 1985"
+149396-89-4,CCRIS,0,-1,,Cn1c(ncc1[N+](=O)[O-])C(O)c2cc(cc(c2O)C(C)(C)C)C(C)(C)C,"DUBINI,F, RIVIERA,L, SCALTRITO,MM AND BELLOTTI,MG, SUSCEPTIBILITY OFHELICOBACTER PYLORI AND PHARMACOKINETIC PROPERTIES IN MICE OF NEW5-NITROIMIDAZOLE DERIVATIVES DEVOID OF MUTAGENIC ACTIVITY IN THE AMES TEST, J.CHEMOTHER. (FLORENCE) 5(3):168-173, 1993"
+1838-56-8,EPA1,0,-1,,CC(=O)Nc1cc2Cc3ccccc3c2cc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7597-18-4,CCRIS,1,-1,"NO2INDAZ6",[O-][N+](=O)c1ccc2c[nH]nc2c1,"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+13675-34-8,EPA1,0,-1,,CC(=C)C(=O)OCCCCCOC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+575-41-7,EPA3,0,-1,,Cc1cc(C)c2ccccc2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M471,EPA1,0,-1,,CCCCCCCCCCCC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155164-67-3,CCRIS,0,-1,,Cc1ccc(cc1)C(=O)N2N=CC(=C(Cl)C2=O)Cl,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+140460-97-5,CCRIS,1,-1,,OC1C2OC2c3c(ccc4cc5c(ccc6ccccc56)nc34)C1O,"CHANG,RL, BATTISTA,S, WONG,CQ, KUMAR,S, KOLE,PL, SIKKA,HC, BALANI,SK,JERINA, DM, CONNEY,AH AND WOOD,AW, BACTERIAL AND MAMMALIAN CELL MUTAGENICITY OFFOUR OPTICALLY ACTIVE BAY-REGION 10,11-DIOL-8,9-EPOXIDES OF THE NITROGENHETEROCYCLE DIBENZ[A,H]ACRIDINE, CARCINOGENESIS 14(11):2233-2237,1993"
+138805-29-5,CCRIS,1,-1,,Cc1ccc(N)cc1N=Nc2cc(N)ccc2C,"SAYAMA,M, MORI,M, NAKADA,Y, KAGAMIMORI,S AND KOZUKA,H, METABOLISM OF2,4-DINITROTOLUENE BY SALMONELLA TYPHIMURIUM STRAINS TA98, TA98NR ANDTA98/1,8-DNP6, AND MUTAGENICITY OF THE METABOLITES OF 2,4-DINITROTOLUENE ANDRELATED COMPOUNDS TO STRAINS TA98 AND TA100, MUTAT. RES. 264(3):147-153,1991"
+51-44-5,VITIC,0,-1,,OC(=O)c1ccc(Cl)c(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+36274-29-0,EPA1,0,-1,,Cc1ncc2CCCc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+357204-50-3,CCRIS,1,-1,,CCCCON(OC(=O)C)C(=O)c1ccc2ccccc2c1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+33868-17-6,EPA2,1,-1,,CN(N=O)C#N,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+1897-45-6,VITIC,0,-1,"CHLOROTHA",Clc1c(Cl)c(C#N)c(Cl)c(C#N)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+271-89-6,VITIC,0,-1,,o1ccc2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+81-88-9,EPA1,1,-1,"RHODAMINB",CCN(CC)c1ccc2c(c3ccccc3C(=O)O)c4ccc(cc4[o+]c2c1)N(CC)CC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-97-0,EPA1,1,-1,"BROMETENA,METHENAMI,METHENABZ,METHENABO,METHENAET,METHENHBR,METHENHCL,METHENAHI,METHENMGS,METHENMET,METHENAPH,METHENRES,METHENAGN,METHENCOC",C1N2CN3CN(CN1C3)C2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M460,EPA1,0,-1,,C[N@+]1([O-])CCC[C@@H]1c2cccnc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2835-68-9,EPA1,0,-1,"AMINOBEN4",NC(=O)c1ccc(N)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4548-53-2,EPA1,0,-1,,Cc1cc(C)c(cc1N=Nc2cc(c3ccccc3c2O)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50618-02-5,CCRIS,1,-1,,COc1ccc(cc1)C2OC2C,"KIM,SG, LIEM,A, STEWART,BC AND MILLER,JA, NEW STUDIES ONTRANS-ANETHOLE OXIDE AND TRANS-ASARONE OXIDE, CARCINOGENESIS 20(7):1303-1307,1999"
+621-95-4,EPA1,1,-1,,Nc1ccc(CCc2ccc(N)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+218-01-9,EPA1,1,-1,"CHRYSENE",c1ccc2c(c1)ccc3c4ccccc4ccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24245-98-5,CCRIS,1,-1,,[O-][N+](=O)c1cccc2nscc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+2437-29-8,VITIC,0,-1,"MALACHIGR,MALACGROX",CN(C)c1ccc(cc1)C(=C2C=CC(=[N+](C)C)C=C2)c3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+117-61-3,VITIC,0,-1,,Nc1ccc(c2ccc(N)cc2S(=O)(=O)O)c(c1)S(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13132-28-0,CCRIS,1,-1,,[O-][N+](=O)C1=Cc2cccc3cccc1c23,"VANCE,WA AND LEVIN,DE, STRUCTURAL FEATURES OF NITROAROMATICS THATDETERMINE MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM, ENVIRON. MUTAGEN.6(6):797-811, 1984"
+108-21-4,VITIC,0,-1,"IPRACETAT",CC(C)OC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+53757-30-5,EPA3,1,-1,,[O-][N+](=O)c1oc(\C=C/c2csc(NC=O)n2)cc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+116374-64-2,CCRIS,1,-1,,COC(=O)c1ccc(c2c(NCCCN(C)C)c3ccccc3nc12)[N+](=O)[O-],"FERGUSON,LR, DENNY,WA AND O'ROURKE,SM, MUTAGENIC ACTIVITY OFNITRACRINE DERIVATIVES IN SALMONELLA TYPHIMURIUM: RELATIONSHIP TO DRUGPHYSICOCHEMICAL PARAMETERS, AND TO BACTERIAL UVRB AND RECA GENES AND PLASMIDPKM101, MUTAT. RES. 223(1):13-22, 1989"
+17241-59-7,EPA1,0,-1,,OCc1ccc2C(=O)c3ccccc3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54292-63-6,CCRIS,0,-1,,CCN(CC)c1ccc(cc1)N=Nc2cccnc2,"SHAHIN,MM, MUTAGENICITY OF STRUCTURALLY RELATED PHENYLAZO-3-PYRIDINESIN SALMONELLA TYPHIMURIUM, CELL BIOL. TOXICOL. 9(1):33-47, 1993"
+110-49-6,EPA3,1,-1,,COCCOC(=O)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+80214-83-1,CCRIS,0,-1,,CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC3OC(C)CC(C3O)N(C)C)C(C)(O)CC(C)\C(=N\OCOCCOC)\C(C)C(O)C1(C)O,"ARUGA,F, NAGASAWA,Y AND WADA,H, MUTAGENICITY STUDY ON9-[O-[(2-METHOXYETHOXY)METHYL]OXIME] ERYTHROMYCIN (RU28965) IN BACTERIA, YAKURITO CHIRYO 16(11):4437-41, 1988"
+23537-16-8,CCRIS,0,-1,,Cc1cc(O)c2C(=C3C(=O)C4C(O)C5C6C(O)C(C(=O)C7=C(O)c8c(O)cc(C)cc8C(=O)C467)C35C(=O)c2c1)O,"KRIVOBOK,S, SEIGLE-MURANDI,F, STEIMAN,R, MARZIN,DR AND BETINA,V,MUTAGENICITY OF SUBSTITUTED ANTHRAQUINONES IN THE AMES/SALMONELLA MICROSOMESYSTEM, MUTAT. RES. 279(1):1-8, 1992"
+613-50-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ncccc2c1,"SIDEROPOULOS,AS AND SPECHT,SM, EVALUATION OF MICROBIAL TESTING METHODSFOR THE MUTAGENICITY OF QUINOLINE AND ITS DERIVATIVES, CURR. MICROBIOL. 11(2):59-65, 1984"
+191861-16-2,CCRIS,1,-1,,Fc1cc2cccnc2c3cccnc13,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+106532-69-8,CCRIS,1,-1,,CCCCCCCC(=O)\N=C\1/SN(C(=O)CCCCCCC)c2ccc(cc12)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+6149-33-3,CCRIS,1,-1,,Nc1ccc(Oc2ccc(cc2)[N+](=O)[O-])cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, GENOTOXICITY OF POTENTIAL METABOLITESOF NITROSCANATE- AN ANTISCHISTOSOMAL DRUG, MUTAT. RES. 335(3):235-243,1995"
+17722-71-3,EPA1,0,-1,,OC(=O)CCC(=O)Nc1ccc(Cl)c(Cl)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+79-41-4,EPA1,0,-1,"EUDRARSRL,DR0003810,METHACRYL,POLMEAMET,DR0018086,PVAPMETHA",CC(=C)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+607-59-0,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2cccc3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54-88-6,EPA1,1,-1,,CN(C)c1ccc(N=Nc2ccccc2)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23250-39-7,EPA1,1,-1,,Nc1c2ccccc2nc3ccc(Cl)cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+93106-60-6,EPA1,1,-1,"ENROFLOXA",CCN1CCN(CC1)c2cc3N(C=C(C(=O)O)C(=O)c3cc2F)C4CC4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+118745-12-3,CCRIS,1,-1,,CCC(=O)N(O)c1ccc(\C=C\c2ccccc2)cc1,"WANG,CY, LINSMAIER-BEDNAR,EM, LEE,MS AND KING,CM, MUTAGENICITIES OFN-ACYL-N-ARYLHYDROXYLAMINES FOR SALMONELLA, CHEM-BIOL. INTERACT.67(3-4):215-223, 1988"
+NOCAS_M218,EPA1,1,-1,,BrC[C@@H](Br)COP(=O)(OC[C@H](Br)CBr)OC[C@H](Br)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+74340-04-8,CCRIS,1,-1,,OC1C=Cc2c(cc3c4ccccc4c5c6ccccc6cc2c35)C1O,"MALAVEILLE,C, HAUTEFEUILLE,A, PERIN-ROUSSEL,O, SAGUEM,S,CROISY-DELCEY,M, ZAJDELA,F AND BARTSCH,H, POSSIBLE INVOLVEMENT OF A VICINAL,NON-BAY-REGION DIHYDRODIOL EPOXIDE IN THE ACTIVATION OF DIBENZO[A,E]FLUORANTHENEINTO BACTERIAL MUTAGENS, CARCINOGENESIS 5(10):1263-1266, 1984"
+4463-22-3,EPA1,1,-1,,CC(=O)N(O)c1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2212-99-9,CCRIS,1,-1,,CC1(C)CC2C=C(C=O)C34CC3(C2C1)C(=O)OC4O,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+NOCAS_M90,EPA1,1,-1,,C[C@@]1(CO1)c2ccc(cc2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+31464-26-3,EPA1,1,-1,,CN(CCC#N)c1ccc(cc1)N=Nc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26761-45-5,EPA3,1,-1,,CCCCCCC(C)(C)C(=O)OC[C@@H]1CO1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+116-14-3,VITIC,0,-1,"POLYTEF",FC(=C(F)F)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+138914-14-4,CCRIS,0,-1,,C[C@H](CO)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2390-59-2,EPA1,1,-1,,CCN(CC)c1ccc(cc1)C(=C2C=CC(=[N+](CC)CC)C=C2)c3ccc(cc3)N(CC)CC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15356-70-4,EPA3,0,-1,,CC(C)[C@H]1CC[C@H](C)C[C@@H]1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+117066-30-5,CCRIS,1,-1,,OC1C=Cc2c(ccc3nc4ccc5ccccc5c4cc23)C1O,"BONIN,AM, ROSARIO,CA, DUKE,CC, BAKER,RSU, RYAN,AJ AND HOLDER,GM, THEMUTAGENICITY OF DIBENZ[A,J]ACRIDINE, SOME METABOLITES AND OTHER DERIVATIVES INBACTERIA AND MAMMALIAN CELLS, CARCINOGENESIS 10(6):1079-1084, 1989"
+NOCAS_M84,EPA1,1,-1,,CC[C@@]12O[C@]1(C(=O)OC)C(=O)O[C@H]2C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M245,EPA1,1,-1,,CCCCCCOC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+85977-49-7,EPA1,1,-1,"TCNU",CN(C)S(=O)(=O)CCNC(=O)N(CCCl)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57-50-1,EPA2,0,-1,,OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+NOCAS_M461,EPA1,0,-1,,CCCCCCCCC\C=C\C[C@H]1CC(=O)OC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+183249-38-9,CCRIS,0,-1,,CC1C=Cc2ccc3ccc4ccccc4c3c12,"MARROCCHI,A, MINUTI,L, MOROZZI,G, PAMPANELLA,L AND TATICCHI,A,SYNTHESIS AND MUTAGENICITY OF SOME CYCLO[C]PHENANTHRENES ANDINDENO[C]PHENANTHRENES, CARCINOGENESIS 17(9):2009-2012, 1996"
+37151-16-9,CCRIS,1,-1,,Nc1nc(nc2c1ncn2C3OC(CO)C(O)C3O)c4ccc(cc4)[N+](=O)[O-],"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+151378-31-3,CCRIS,1,-1,,OC1C(O)c2cccc3c4cc5ccccc5cc4C6(OC16)c23,"MARSHALL,MV, HE,ZM, WEYAND,EH, RICE,JE AND LAVOIE,EJ, MUTAGENICACTIVITY OF THE 4,5- AND 9,10-DIHYDRODIOLS OF BENZO[J]FLUORANTHENE AND THEIRSYN- AND ANTI-DIHYDRODIOL EPOXIDES IN SALMONELLA TYPHIMURIUM, ENVIRON. MOL.MUTAGEN. 22(1):34-45, 1993"
+1169-60-4,EPA1,1,-1,,COC(=O)c1cc2OCOc2c3c4cccc(OC)c4cc(c13)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M426,EPA1,0,-1,,C[C@@H]1C(C)(C)c2cc(C)c(cc2C1(C)C)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10396-63-1,CCRIS,0,-1,,OC1COC(Nc2ccc(cc2)[N+](=O)[O-])C(O)C1O,"PIGNATELLI,B, MALAVEILLE,C, FRIESEN,M, HAUTEFEUILLE,A AND BARTSCH,H,SYNTHESIS, STRUCTURE-ACTIVITY RELATIONSHIPS AND A REACTION MECHANISM FORMUTAGENIC N-NITROSO DERIVATIVES OF GLYCOSYLAMINES AND AMADORI COMPOUNDS - MODELSUBSTANCES FOR N-NITROSATED EARLY MAILLARD REACTION PRODUCTS, FOOD CHEM.TOXICOL. 25(9):669-680, 1987"
+110786-18-0,CCRIS,0,-1,,[O-][N+](=O)c1ccccc1COC(=O)c2ccccc2,"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+1609-93-4,CCRIS,1,-1,,OC(=O)\C=C\Cl,"CONNORS,TF, STUART,JD AND COPE,JB, CHROMATOGRAPHIC AND MUTAGENICANALYSES OF 1,2-DICHLOROPROPANE AND 1,3-DICHLOROPROPYLENE AND THEIR DEGRADATIONPRODUCTS, BULL. ENVIRON. CONTAM. TOXICOL. 44(2):288-293, 1990"
+81943-37-5,CCRIS,1,-1,,CC(=O)OCN(N=O)c1ccccc1,"GOLD,B AND SALMASI,S, CARCINOGENICITY TESTS OFACETOXYMETHYLPHENYLNITROSAMINE AND BENZENEDIAZONIUM TETRAFLUOROBORATE IN SYRIANHAMSTERS, CANCER LETT. 15:289-300, 1982"
+96-54-8,EPA1,0,-1,,Cn1cccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+574-25-4,EPA1,1,-1,"MERCAPURR",OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(S)ncnc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+144561-63-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(CCc3cc4CCCCc4cc23)c1,"YU,S, HERRENO-SAENZ,D, MILLER,DW, KADLUBAR,FF AND FU,PP, MUTAGENICITYOF NITRO- POLYCYCLIC AROMATIC HYDROCARBONS WITH THE NITRO SUBSTITUENT SITUATEDAT THE LONGEST MOLECULAR AXIS, MUTAT. RES. 283(1):45-52, 1992"
+357204-48-9,CCRIS,1,-1,,[O-][N+](=O)c1cccc(c1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+137-07-5,CCRIS,1,-1,"AMINOTPH2",Nc1ccccc1S,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION  CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING  CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF  THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL),1997"
+88-44-8,EPA1,0,-1,,Cc1ccc(N)c(c1)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+135086-92-9,CCRIS,1,-1,,Oc1c2nc3ccccc3c2nnn1\N=C\c4ccccc4,"GARCIA,E, LOPEZ-DE-CERAIN,A, MARTINEZ-MERINO,V AND MONGE,A,QUANTITATIVE STRUCTURE-MUTAGENIC ACTIVITY RELATIONSHIPS OF TRIAZINOINDOLEDERIVATIVES, MUTAT. RES. 268(1):1-9, 1992 & GARCIA,E, LOPEZ-DE-CERAIN,A,GULLON,A, ARRARAS,JA AND MONGE,A, BACTERIAL MUTAGENIC EVALUATION OF A SERIES OF4'-SUBSTITUTED DERIVATIVES OF3-BENZYLIDENAMINO-5H-1,2,3-TRIAZIN[5,4-B]INDOL-4-ONE, MUTAGENESIS 7(1):31-35,1992"
+56-04-2,EPA2,0,-1,"METHIOURA",Cc1cc(O)nc(S)n1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+NOCAS_M129,EPA1,1,-1,,ClC(Cl)(Cl)SN1C(=O)[C@@H]2CC=CC[C@H]2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6203-18-5,CCRIS,0,-1,,CN(C)c1ccc(\C=C\C=O)cc1,"EDER,E, DEININGER,C AND MUTH,D, GENOTOXICITY OF P-NITROCINNAMALDEHYDEAND RELATED ALPHA,BETA-UNSATURATED CARBONYL COMPOUNDS IN TWO BACTERIAL ASSAYS,MUTAGENESIS 6(4):261-269, 1991"
+16568-02-8,EPA1,0,-1,,C\C=N\N(C)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M301,EPA1,1,-1,,CCO[P@](=O)(Oc1ccc(cc1)[N+](=O)[O-])c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+789-07-1,CCRIS,1,-1,,[O-][N+](=O)c1cc2ccc3cccc4ccc(c1)c2c34,"YU,S, HERRENO-SAENZ,D, MILLER,DW, KADLUBAR,FF AND FU,PP, MUTAGENICITYOF NITRO- POLYCYCLIC AROMATIC HYDROCARBONS WITH THE NITRO SUBSTITUENT SITUATEDAT THE LONGEST MOLECULAR AXIS, MUTAT. RES. 283(1):45-52, 1992"
+142438-60-6,CCRIS,1,-1,,COC(=O)C12OC1(C)C(C)OC2=O,"KIM,IS, AND BJELDANES,LF, SYNTHESES AND MUTAGENICITY OF FUSARIN C RINGANALOGS, J. AGRIC. FOOD CHEM. 40(9):1625-1630, 1992"
+65199-11-3,CCRIS,1,-1,,O=C1C=Cc2c(cc3ccc4cccc5ccc2c3c45)C1=O,"FLOWERS-GEARY,L, BLECZINSKI,W, HARVEY,RG AND PENNING,TM, CYTOTOXICITYAND MUTAGENICITY OF POLYCYCLIC AROMATIC HYDROCARBON O-QUINONES PRODUCED BYDIHYDRODIOL DEHYDROGENASE, CHEM.- BIOL. INTERACT. 99(1-3):55-72, 1995"
+2106-54-9,CCRIS,0,-1,,OC(=O)C(F)(F)C(F)(Cl)C(F)(F)C(F)(Cl)C(F)(F)Cl,"GODIN,CS, MYHR,BC, LAWLOR,TE, YOUNG,RR, MURLI,H AND CIFONE,MA,ASSESSMENT OF THE POTENTIAL GENOTOXICITY OF PERFLUORODECANOIC ACID ANDCHLOROTRIFLUOROETHYLENE TRIMER AND TETRAMER ACIDS, FUNDAM. APPL. TOXICOL.18(4):557-569, 1992"
+2381-15-9,EPA1,1,-1,,Cc1ccc2cc3ccc4ccccc4c3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10147-37-2,EPA1,1,-1,,CC(C)S(=O)(=O)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16323-43-6,VITIC,0,-1,,OC(=O)\C=C\c1ccc(\C=C\C(=O)O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+183249-39-0,CCRIS,0,-1,,O=C1CCc2c3CCCc3c4c(ccc5ccccc45)c12,"MARROCCHI,A, MINUTI,L, MOROZZI,G, PAMPANELLA,L AND TATICCHI,A,SYNTHESIS AND MUTAGENICITY OF SOME CYCLO[C]PHENANTHRENES ANDINDENO[C]PHENANTHRENES, CARCINOGENESIS 17(9):2009-2012, 1996"
+5116-24-5,EPA1,1,-1,,OC[C@H]1O[C@H](C[C@H]1O)N2C=C(CO)C(=O)NC2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18559-59-6,CCRIS,0,-1,"TRETOQUIN,TRETQUHCL",COc1cc(CC2NCCc3cc(O)c(O)cc23)cc(OC)c1OC,"STOYANOV,I, NIKOLOV,I, CHERNOZEMSKII,I AND STOICHEV,I, ASSESSMENT FORMUTAGENICITY OF 10 PHARMACEUTICAL PRODUCTS FOLLOWING AMES, MICRONUCLEUS, ANDSPERM MORPHOLOGY TESTING,TOXIC. ASSESS. 2(2):207-215, 1987"
+18296-45-2,EPA1,1,-1,,CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@H]1C[C@H](OC(=O)C)[C@]23CO3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99124-76-2,CCRIS,1,-1,,NC(CCCCNC=CC=O)C(=O)O,"PLASTARAS,JP RIGGINS,JN OTTENEDER,M AND MARNETT,LJ, REACTIVITY ANDMUTAGENICITY OF ENDOGENOUS DNA OXOPROPENYLATING AGENTS: BASE PROPENALS,MALONDIALDEHYDE, AND N-OXOPROPENYLLYSINE, CHEM. RES. TOXICOL. 13(12):1235-1242,2000"
+104-67-6,CCRIS,0,-1,"DR0036884",CCCCCCCC1CCC(=O)O1,"FUJITA,H AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVES WITHSALMONELLA TYPHIMURIUM TA97 AND TA102. II., KENKYU NENPO - TOKYO-TORITSU EISEIKENKYUSHO 38:423-430, 1987"
+140-29-4,VITIC,0,-1,,N#CCc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+90594-13-1,EPA1,1,-1,,Nc1cnc2c(c1)nc3ccccn23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17564-64-6,EPA1,1,-1,,ClCN1C(=O)c2ccccc2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+843-23-2,CCRIS,1,-1,,CC(=O)N(O)c1ccc(\C=C\c2ccccc2)cc1,"WANG,CY, LINSMAIER-BEDNAR,EM, LEE,MS AND KING,CM, MUTAGENICITIES OFN-ACYL-N-ARYLHYDROXYLAMINES FOR SALMONELLA, CHEM-BIOL. INTERACT.67(3-4):215-223, 1988"
+38914-97-5,EPA1,1,-1,,CCN(CCCl)CCCNc1c2ccccc2nc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35281-32-4,EPA3,1,-1,,C1Cc2cc3cccc4ccc5cc6cccc1c6c2c5c34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+33757-42-5,EPA1,1,-1,,CC(=O)Nc1cccc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106532-71-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccccc3)\c2c1)C(=O)c4ccccc4,"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+612-25-9,CCRIS,0,-1,,OCc1ccccc1[N+](=O)[O-],"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+146683-80-9,CCRIS,1,-1,,Cc1cccc2C3OC3c4cc5ccccc5cc4c12,"GLATT,H, ABU-SHQARA,E, MARTINE,U, BAIDOSSI,W, HARVEY,RG AND BLUM,J,K-REGION OXIDES AND IMINES DERIVED FROM ALKYLATED BENZ[A]ANTHRACENE CONGENERS:SYNTHESIS, STABILITY IN AQUEOUS MEDIA AND MUTAGENICITY, MUTAGENESIS 9(2):83-92,1994"
+NOCAS_M58,EPA1,1,-1,,COC(=O)[C@]12O[C@@]1(C)[C@@H](OC2=O)C(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+62641-69-4,EPA3,1,-1,,Cc1c2ccccc2cc3c4[C@H](O)[C@H](O)C=Cc4ccc13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+146795-30-4,CCRIS,1,-1,,Cc1cccc(NC(=O)c2csc(c2)[N+](=O)[O-])c1,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+NOCAS_M161,EPA1,1,-1,,Cc1ccccc1OC[C@H]2CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+114-26-1,EPA1,1,-1,"PROPOXUR",CNC(=O)Oc1ccccc1OC(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96196-27-9,VITIC,1,-1,,Cc1cc(N)ccc1c2ccc(N)cc2C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+134-09-8,CCRIS,0,-1,"ANTHRAMEN",CC(C)C1CCC(C)CC1OC(=O)c2ccccc2N,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y90"
+668-17-7,CCRIS,1,-1,,CCC1(O)CC(OC2CC(C(O)C(C)O2)N(C)C)c3c(O)c4C(=O)c5c(O)ccc(O)c5C(=O)c4cc3C1C(=O)OC,"THOMAS,HF, MUTAGENIC AND CYTOTOXIC POTENCIES OF A SERIES OFANTHRACYCLINE DERIVATIVES AS MEASURED BY HIS+ REVERSION, 8-AZAGUANINE RESISTANCEAND DIRECT PLATING CYTOTOXICITY TESTS IN SALMONELLA TYPHIMURIUM, TERATOG.,CARCINOG., MUTAGEN. 6(3):219-235, 1986"
+78-79-5,VITIC,0,-1,,CC(=C)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98911-07-0,EPA1,1,-1,,CC(=O)N(O)c1ccc(Oc2ccc(Cl)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51481-10-8,CCRIS,0,-1,,CC1=CC2OC3C(O)CC(C)(C34CO4)C2(CO)C(O)C1=O,"KNASMUELLER,S, BRESGEN,N, KASSIE,F, MERSCH-SUNDERMANN,V, GELDERBLOM,W,ZOEHRER,E AND ECKL,PM, GENOTOXIC EFFECTS OF THREE FUSARIUM MYCOTOXINS, FUMONISINB1, MONILIFORMIN AND VOMITOXIN IN BACTERIA AND IN PRIMARY CULTURES OF RATHEPATOCYTES, MUTAT. RES. 391(1,2):39-48, 1997"
+497-19-8,EPA1,0,-1,"ALCO3,ALHYDCARB,NH4BICARB,BACO3,DR0005597,CABICARBO,CARBALDRA,CARBICARB,H2CO3,CUCO3,FECO3,HYDROTALC,LICARBONA,MGCO3,MNCO3,KHCO3,NASESQUIC,ZNCO3",OC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3811-49-2,CCRIS,1,-1,,COP1(=S)OCc2ccccc2O1,"MORIYA,M OHTA,T WATANABE,K MIYAZAWA,T KATO,K AND SHIRASU,Y, FURTHERMUTAGENICITY STUDIES ON PESTICIDES IN BACTERIAL REVERSION ASSAY SYSTEMS, MUTAT.RES. 116(3-4):185-216,1982"
+NOCAS_M325,EPA1,0,-1,,C[C@@]12CC[C@H](C[C@@H]1O2)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M352,EPA1,0,-1,,C[C@H](CCl)OP(=O)(O[C@H](C)CCl)O[C@H](C)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+11041-12-6,CCRIS,0,-1,,CCC(C)c1cccc(c1)C(C)CC(CC)c2ccc(C[N+](C)(C)C)cc2,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y85"
+1874-23-3,CCRIS,1,-1,,COC(=O)c1oc(cc1)[N+](=O)[O-],"ICHIKAWA,M, YAMAMOTO,K, TANAKA,A, SWAMINATHAN,S, HATCHER,JF, ERTURK,EAND BRYAN,GT, MUTAGENICITY OF 3,4-DIPHENYL-5-NITROFURAN ANALOGS IN SALMONELLATYPHIMURIUM, CARCINOGENESIS 7(8):1339-1344, 1986"
+133831-61-5,EPA1,1,-1,,[O-][N+](=O)c1ccccc1SSC(=C(Cl)Cl)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96-50-4,VITIC,1,-1,"AMINOTIAZ",Nc1nccs1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+84174-21-0,EPA1,1,-1,,CN(Cc1ccc(F)cc1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+87-61-6,VITIC,0,-1,,Clc1cccc(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1689-89-0,CCRIS,0,-1,"NITROXINI",Oc1c(I)cc(cc1[N+](=O)[O-])C#N,"YOSHIMURA,H, NAKAMURA,M AND KOEDA,T, LACK OF MUTAGENICITY OFFASCIOLICIDES, VET. RES. COMMUN. 9(2):147-152, 1985"
+122-99-6,VITIC,0,-1,"PHENOXETO",OCCOc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+94-11-1,EPA1,0,-1,,CC(C)OC(=O)COc1ccc(Cl)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6789-88-4,VITIC,0,-1,,CCCCCCOC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+42576-02-3,CCRIS,1,-1,,COC(=O)c1cc(Oc2ccc(Cl)cc2Cl)ccc1[N+](=O)[O-],"OGURI,A, KARAKAMA,K, ARAKAWA,N, SUGIMURA,T AND WAKABAYASHI,K,DETECTION OF MUTAGENICITY OF DIPHENYL ETHER HERBICIDES IN SALMONELLA TYPHIMURIUMYG1026 AND YG1021, MUTAT. RES. 346(1):57-60, 1995"
+609-20-1,VITIC,1,-1,,Nc1cc(Cl)c(N)c(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6923-22-4,EPA1,1,-1,"MONOCROTO",CNC(=O)\C=C(/C)\OP(=O)(OC)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M446,EPA1,0,-1,,COC(=C1[C@H](C(=C(C)N=C1C)C(=O)OC\C=C\c2ccccc2)c3cccc(c3)[N+](=O)[O-])O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99520-59-9,EPA1,1,-1,,Oc1ccc2c(c1)c3ccc4ccc5cccc6cc2c3c4c56,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+481-42-5,EPA1,1,-1,"PLUMBAGIN",CC1=CC(=O)c2c(O)cccc2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+638-07-3,EPA1,0,-1,,CCOC(=O)CC(=O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67-72-1,VITIC,0,-1,"HEXACLETH",ClC(Cl)(Cl)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13301-61-6,CCRIS,1,-1,,CCN(CCC#N)c1ccc(cc1)N=Nc2c(Cl)cc(cc2Cl)[N+](=O)[O-],"UMBUZEIRO,GDA FREEMAN,HS WARREN,SH PALMA DE OLIVEIRA,D TEARO,YWATANABE,T AND CLAXTON,LD, THE CONTRIBUTION OF AZO DYES TO THE MUTAGENICACTIVITY OF THE CRISTAIS RIVER, CHEMOSPHERE 60(1):55-64, 2005"
+3048-64-4,CCRIS,0,-1,,C=CC1CC2CC1C=C2,"VERGNES,JS AND BALLANTYNE,B, INVESTIGATIONS ON THE IN VITRO AND INVIVO GENOTOXIC POTENTIAL OF 5-VINYL-2-NORBORNENE, J. APPL. TOXICOL.18(2):129-142, 1998"
+135-20-6,EPA1,1,-1,"CUPFERRON",ON(N=O)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-68-6,VITIC,0,-1,"METAURINN",CNCCS(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+156-43-4,VITIC,1,-1,"PHENETIDP",CCOc1ccc(N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M43,EPA1,1,-1,,C(Oc1ccc2sncc2c1)[C@H]3CO3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M29,EPA1,1,-1,,CCN(CC)CCC[C@@H](C)Nc1ccnc2cc(Cl)ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+73819-63-3,CCRIS,0,-1,"261-115",NC(=N)c1ccc2cc([nH]c2c1)C(=N)N,"STAUFFERT,I, PAULINI,H, STEINMANN,U, SIPPEL,H AND ESTLER,CJ,INVESTIGATIONS ON MUTAGENICITY AND GENOTOXICITY OF PENTAMIDINE AND SOME RELATEDTRYPANOCIDAL DIAMIDINES, MUTAT. RES. 245(2):93-98, 1990"
+NOCAS_M421,EPA1,0,-1,,C[C@@H](O)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M258,EPA1,1,-1,,CCc1cc(O)cc2c3CCO[C@@](CC)(CC(=O)O)c3[nH]c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+9000-30-0,CCRIS,0,-1,,CCC1OC(CO)C(COCC2OC(COC3OC(CO)C(O)C(O)C3O)C(OC)C(O)C2O)C(O)C1O,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T AND MORTELMANS,K, SALMONELLAMUTAGENICITY TESTS. V. RESULTS FROM THE TESTING OF 311 CHEMICALS, ENVIRON. MOL.MUTAGEN. 19(SUPPL.21):2-141, 1992"
+530-62-1,EPA1,0,-1,,O=C(n1ccnc1)n2ccnc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+557-30-2,CCRIS,0,-1,,O\N=C\C=N\O,"WATANABE,K, SAKAMOTO,K AND SASAKI,T, COMPARISONS ON CHEMICALLY-INDUCEDMUTAGENICITY AMONG FOUR BACTERIAL STRAINS, SALMONELLA TYPHIMURIUM TA102 ANDTA2638, AND ESCHERICHIA COLI WP2/PKM101 AND WP2 UVRA/PKM101: COLLABORATIVE STUDY1, MUTAT. RES. 361(2-3):143-155, 1996"
+5418-93-9,EPA1,0,-1,,Nc1nc2cc(Cl)ccc2[nH]1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7226-23-5,EPA1,0,-1,,CN1CCCN(C)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+135325-62-1,CCRIS,1,-1,,BrCc1ccc2cccc3c4ccccc4c1c23,"BALL,JC, AND YOUNG,WC, AMES ASSAY MUTAGENICITY AND ELECTRONICSTRUCTURE CALCULATIONS OF BROMOMETHYLFLUORANTHENES, CHLOROMETHYLFLUORANTHENES,AND HYDROXYMETHYLFLUORANTHENES, CHEM.-BIOL. INTERACT. 77(3):291-302,1991"
+106532-74-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccc(Cl)cc3)\c2c1)C(=O)c4ccc(Cl)cc4,"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+51856-71-4,CCRIS,1,-1,,Cc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])N=[N+]([O-])c2cc(c(C)c(c2)[N+](=O)[O-])[N+](=O)[O-],"GEORGE,SE HUGGINS-CLARK,G AND BROOKS,LR, USE OF A SALMONELLAMICROSUSPENSION BIOASSAY TO DETECT THE MUTAGENICITY OF MUNITIONS COMPOUNDS ATLOW CONCENTRATIONS, MUTAT. RES. 490(1):45-56, 2001"
+86334-96-5,CCRIS,0,-1,,CC(N(CC1(O)CCC(O)C(O)C1O)N=O)C(=O)O,"POOL,BL, ROEPER,H, ROEPER,S AND ROMRUEN,K, MUTAGENICITY STUDIES ONN-NITROSATED PRODUCTS OF THE MAILLARD BROWNING REACTION:N-NITROSO-FRUCTOSE-AMINO ACIDS, FOOD CHEM. TOXICOL. 22(10):797-801,1984"
+111-90-0,VITIC,0,-1,"DIETGLYET",CCOCCOCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+156-10-5,EPA2,1,-1,,O=Nc1ccc(Nc2ccccc2)cc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+1466-88-2,CCRIS,1,-1,,[O-][N+](=O)c1ccccc1\C=C\C=O,"EDER,E, DEININGER,C AND MUTH,D, GENOTOXICITY OF P-NITROCINNAMALDEHYDEAND RELATED ALPHA,BETA-UNSATURATED CARBONYL COMPOUNDS IN TWO BACTERIAL ASSAYS,MUTAGENESIS 6(4):261-269, 1991"
+42583-46-0,CCRIS,1,-1,,COc1cc2OC3OC4OC4C3c2c5OC(=O)C6=C(CCC6=O)c15,"TURMO,E, SANCHEZ-BAEZA,F, BUJONS,J, CAMPS,F, CASELLAS,M, SOLANAS,AMAND MESSEGUER,A, SYNTHESIS AND MUTAGENICITY OF THE AFLATOXIN B1 MODEL 3A,8A-DIHYDRO-4,6-DIMETHOXYFURO[2,3-B]BENZOFURAN AND ITS 2,3-EPOXY DERIVATIVE, J.AGRIC. FOOD CHEM. 39(10):1723-1728, 1991"
+3328-25-4,CCRIS,1,1,,CC(C)CCCC(C)C1CCC2C3C=CC4(CC(O)CCC4(C)C3CCC12C)OO,"SMITH,LL, SMART,VB AND GOWDA,NMM, MUTAGENIC STEROL HYDROPEROXIDES,MUTAT. RES. 161(1):39-48, 1986"
+5464-79-9,EPA3,1,-1,,COc1cccc2sc(N)nc12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+2402-78-0,EPA1,0,-1,,Clc1cccc(Cl)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78-81-9,VITIC,0,-1,"ISOBUTYLA,JM-122,JM-2,JM-222",CC(C)CN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+63041-77-0,EPA1,1,-1,,Cc1cccc2c1cc3ccc4cccc5ccc2c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5306-96-7,EPA1,0,-1,,Cc1c(C)c(N)ccc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80440-44-4,CCRIS,0,-1,,O=C1c2cccc3cccc(c4ccc5ccccc5c14)c23,"MOELLER,M, HAGEN,I AND RAMDAHL,T, MUTAGENICITY OF POLYCYCLIC AROMATICCOMPOUNDS (PAC) IDENTIFIED IN SOURCE EMISSIONS AND AMBIENT AIR, MUTAT. RES.157(2-3): 149-156, 1985"
+633-65-8,VITIC,0,-1,"BERBERINE,BERBERICL,BERBERICI,BERBERINS",COc1ccc2cc3c4cc5OCOc5cc4CC[n+]3cc2c1OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1147-55-3,EPA1,1,-1,,CC(=O)Nc1ccc2c(Cc3cccc(O)c23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94-74-6,EPA1,0,-1,"MCPA",Cc1cc(Cl)ccc1OCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17024-17-8,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c1ccc3ccccc23,"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+96-18-4,VITIC,1,-1,,ClCC(Cl)CCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+148021-80-1,CCRIS,1,-1,,OC1C=Cc2c(ccc3c4CCC(=O)c4ccc23)C1O,"BOYD,GW, YOUNG,RJ, HARVEY,RG, COOMBS,MM AND IOANNIDES,C, THEMETABOLISM AND ACTIVATION OF 15,16-DIHYDROCYCLOPENTA[A]PHENANTHREN-17-ONE BYCYTOCHROME P-450 PROTEINS, EUR. J. PHARMACOL., ENVIRON. TOXICOL. PHARMACOL.SECT. 228(5-6): 275-282, 1993"
+4651-67-6,CCRIS,0,1,,CC(CCC(=O)O)C1CCC2C3C(CCC12C)C4(C)CCC(O)CC4CC3=O,"MORI,Y, NII,H, MASUDA,A, MIZUMOTO,K, KONISHI,Y, UNE,M AND HOSHITA,T,ABSENCE OF MUTAGENIC ACTION OF 5BETA-CHOLAN-24-OIC ACID DERIVATIVES IN THEBACTERIAL FLUCTUATION AND STANDARD AMES TEST, MUTAT. RES. 262(4):267-274,1991"
+2243-78-9,EPA1,1,-1,,Nc1ccc(cc1)c2ccc(N)cc2[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142762-84-3,CCRIS,1,-1,,COC(=O)C1CSC2N1C(=O)C(=C2Cl)Cl,"LALONDE,RT, XIE,S AND BU,L, TEST OF CHIRAL RECOGNITION IN THESALMONELLA TYPHIMURIUM (TA100) MUTAGENICITY OF MUCOCHLORIC ACID-CYSTEINEADDUCTS, ENVIRON. MOL. MUTAGEN. 22(3):181-187, 1993"
+58957-92-9,CCRIS,1,-1,,CC1OC(CC(N)C1O)OC2CC(O)(Cc3c(O)c4C(=O)c5ccccc5C(=O)c4c(O)c23)C(=O)C,"COLE,JA AND THOMAS,HF, IMPACT OF A POINT MUTATION IN THE MUC REGION OFPLASMID PKM101 ON ANTHRACYCLINE-INDUCED MUTAGENESIS IN SALMONELLA TYPHIMURIUM,ENVIRON. MUTAGEN. 7(1):129-133, 1985"
+448-19-1,VITIC,1,-1,,COc1cc(F)ccc1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+29700-20-7,CCRIS,1,-1,"PERLOLYRI",OCc1oc(cc1)c2[nH]ccc3c4ccccc4nc23,"OSHITA,I, KANAMORI,H, MIZUTA,M AND SAKAMOTO,I, A MUTAGENICBETA-CARBOLINE DERIVATIVE IN SOY SAUCE, SHOKUHIN EISEIGAKU ZASSHI 32(4):272-277,1991"
+131119-02-3,CCRIS,1,-1,,Cn1c2ccccc2c3nn[n+]([O-])c(C(=O)OCCCl)c13,"LOPEZ DE CERAIN,A, GARCIA,E, GULLON,A, IGNACIO,RJ AND MONGE,A,MUTAGENIC EVALUATION OF SOME TRIAZINO INDOLES USING THE SALMONELLA/MAMMALIANMICROSOME ASSAY, MUTAGENESIS 5(4):307-311, 1990"
+179073-71-3,CCRIS,1,-1,,Cc1ccc2cc3c(ccc4ccccc34)c5C(Cc1c25)OS(=O)(=O)O,"JEONG,HK, SHLYANKEVICH,M AND SURH,YJ, INTRINSIC MUTAGENICITY ANDELECTROPHILICITY OF 1-SULFOOXY-3-METHYLCHOLANTHRENE: IMPLICATIONS FOR METABOLICACTIVATION OF THE CARCINOGEN 3-METHYLCHOLANTHRENE, BIOCHEM. MOL. BIOL. INT.37(5):885-893, 1995"
+174794-16-2,CCRIS,0,-1,,CCC(=O)OCc1cccc(c1)[N+](=O)[O-],"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+578-68-7,CCRIS,0,-1,"AMINOQUI4",Nc1ccnc2ccccc12,"JORDAN,VC, LABABIDI,MK AND LANGAN-FAHEY,S, SUPPRESSION OF MOUSEMAMMARY TUMORIGENESIS BY LONG-TERM TAMOXIFEN THERAPY, J. NATL. CANCER INST.83:492-496, 1991"
+13394-86-0,EPA1,1,-1,,Cc1ccccc1c2ccc(N)c(C)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64-02-8,EPA1,0,-1,"PIPEREDCA,EDTA-CONA,DICOBALTE,EDTAK2,EDTANA,EDTA,EDTAFE,DR9509202,EDTA-ZN,EDTAZNNA3,EDTACR,EDTACU,EDTACUCA,EDTAZNCA,GD-EDTA,DR9801051,DR9801052,EDTA-MGNA,EDTANACA,FEREDETAT",OC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89873-24-5,CCRIS,1,-1,,N#N=Nc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+39081-15-7,EPA1,1,-1,,Oc1cccc2cc3c4ccccc4c5ccccc5c3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+915-67-3,EPA2,0,-1,"AMARANTH",Oc1c(N=Nc2ccc(c3ccccc23)S(=O)(=O)O)c4ccc(cc4cc1S(=O)(=O)O)S(=O)(=O)O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+131-53-3,VITIC,1,-1,"DIOXYBENZ",COc1ccc(C(=O)c2ccccc2O)c(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4130-42-1,EPA1,0,-1,,CCc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+157730-35-3,EPA1,1,-1,,Cn1c(N)nc2nc3cnccc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16533-72-5,CCRIS,0,-1,"EP-0",OC(=O)C1OC1C(=O)O,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+96-45-7,EPA1,1,-1,"ETHTHIOUR",S=C1NCCN1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3096-62-6,EPA1,1,-1,,Cc1cccc(NO)c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-95-4,VITIC,0,-1,"TRICLPHEN,TRICLOFEP",Oc1cc(Cl)c(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+58917-91-2,CCRIS,1,-1,,OC1=c2c(O)cc3cccc4ccc(c2c34)C56CCCCC15O6,"GLATT,H, PIEE,A, PAULY,K, STEINBRECHER,T, SCHRODE,R, OESCH,F ANDSEIDEL,A, FJORD- AND BAY-REGION DIOL-EPOXIDES INVESTIGATED FOR STABILITY, SOSINDUCTION IN ESCHERICHIA COLI, AND MUTAGENICITY IN SALMONELLA TYPHIMURIUM ANDMAMMALIAN CELLS,CANCER RES. 51(6):1659-1667, 1991"
+112575-92-5,CCRIS,1,-1,,O[C@H]1C=C2c3cc4ccccc4cc3c5cccc([C@@H]1O)c25,"WEYAND,EH, GEDDIE,N, RICE,JE, CZECH,A, AMIN,S AND LAVOIE,EJ,METABOLISM AND MUTAGENIC ACTIVITY OF BENZO[K]FLUORANTHENE AND 3-,8- AND9-FLUOROBENZO[K] FLUORANTHENE, CARCINOGENESIS 9(7):1277-1281, 1988"
+521-61-9,EPA1,1,-1,"PHYSCION",COc1cc(O)c2C(=O)c3c(O)cc(C)cc3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+482-44-0,EPA1,1,-1,"IMPERATOR",CC(=CCOc1c2OC(=O)C=Cc2cc3ccoc13)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88-17-5,EPA1,0,-1,,Nc1ccccc1C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115664-58-9,CCRIS,1,-1,,Oc1ccc2c(c1)c3cccc4c(ccc2c34)[N+](=O)[O-],"CONSOLO,MC, ANDERS,M AND HOWARD,PC, MUTAGENICITY OF THE PHENOLICMICROSOMAL METABOLITES OF 3-NITROFLUORANTHENE AND 1-NITROPYRENE IN STRAINS OFSALMONELLA TYPHIMURIUM, MUTAT. RES. 210(2):263-269, 1989"
+99520-66-8,CCRIS,0,-1,,Oc1cc2ccc3c4ccccc4c5cc6cccc1c6c2c35,"RICE,JE, COLEMAN,DT, HOSTED,TJ JR, LAVOIE,EJ, MCCAUSTLAND,DJ ANDWILEY,JC JR, IDENTIFICATION OF MUTAGENIC METABOLITES OF INDENO[1,2,3-CD]PYRENEFORMED IN VITRO WITH RAT LIVER ENZYMES, CANCER RES. 45(11, PT. 1):5421-5425,1985"
+69527-46-4,CCRIS,1,-1,,[O-][N+](=O)c1oc(C=C(C#N)C#N)cc1,"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+313-67-7,CCRIS,1,-1,"ARISTOLO1,ARISTOLNA",COc1cccc2c1cc(c3c(cc4OCOc4c23)C(=O)O)[N+](=O)[O-],"CHAKRABARTY,SN, PAKRASHI,A AND SIDDIQUI,KAI, ARISTOLIC ACID ANANTIFERTILITY AGENT IS NON-MUTAGENIC TO BACTERIAL SYSTEM, INDIAN J. PHARMACOL.19(1):26-31, 1987"
+148174-23-6,CCRIS,0,-1,,ClCCC(=O)\N=C\1/SN(C(=O)CCCl)c2ccccc12,"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+5329-15-7,EPA1,1,-1,,COc1cc(N)ccc1NC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6309-46-2,EPA1,0,-1,,CC(=O)Oc1ccc(CO)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M66,EPA1,1,-1,,OC[C@@H](O)CN=[N+]=[N-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+28434-86-8,EPA1,1,-1,,Nc1ccc(Oc2ccc(N)c(Cl)c2)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17796-82-6,EPA1,0,-1,,O=C1N(SC2CCCCC2)C(=O)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+62826-28-2,CCRIS,1,-1,,COc1ccccc1CC2CO2,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+146177-64-2,EPA1,1,-1,,Cc1cc2c(nc(N)n2C)c3nc(cnc13)c4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-70-2,VITIC,0,-1,,COc1ccc(Nc2ccc(OC)cc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+55621-29-9,EPA3,1,-1,,CCCCN(C[C@H](O)CC)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+18409-46-6,CCRIS,1,-1,,O=C\C=C\C=C\C=O,"WITZ,G, GAD,SC, TICE,RR, OSHIRO,Y, PIPER,CE AND GOLDSTEIN,BD, GENETICTOXICITY OF THE BENZENE METABOLITE TRANS,TRANS-MUCONALDEHYDE IN MAMMALIAN ANDBACTERIAL CELLS, MUTAT. RES. 240(4):295-306, 1990"
+160543-15-7,CCRIS,1,-1,,Cc1ccc2nc3c4C=CC(O)C(O)c4ccc3c(CO)c2c1,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+108-99-6,VITIC,0,-1,,Cc1cccnc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100-37-8,VITIC,0,-1,"DIETETHAN,MALAMINOL",CCN(CC)CCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100593-23-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3ccc(N=O)c4ccc1c2c34,"FIFER,EK, HEFLICH,RH, DJURIC,Z, HOWARD,PC AND BELAND,FA, SYNTHESIS ANDMUTAGENICITY OF 1-NITRO-6-NITROSOPYRENE  AND 1-NITRO-8-NITROSOPYRENE, POTENTIALINTERMEDIATES IN"
+14090-00-7,CCRIS,0,-1,,COc1c(C)c(N)c(C)cc1N,"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+NOCAS_M208,EPA1,1,-1,,OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@H]1SCCN1N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+143603-79-6,CCRIS,1,-1,,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3ccc(NC(=O)C)cc3,"LOPEZ DE CERAIN,A, GARCIA,E, BEORLEGUI,JJ, GULLON,A, ARRARAS,JA ANDMONGE,A, MUTAGENIC EVALUATION OF 3-(4'-BENZYLIDENEAMINO)INDOLE-2-ETHYLCARBOXYLATE IN HIS- SALMONELLA TYPHIMURIUM STRAINS, REV. TOXICOL. 10(3):151-154,1993"
+106532-78-9,CCRIS,1,-1,,[O-][N+](=O)c1ccc(cc1)C(=O)\N=C\2/SN(C(=O)c3ccc(cc3)[N+](=O)[O-])c4ccc(cc24)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+500-66-3,VITIC,0,-1,"OLIVETOL",CCCCCc1cc(O)cc(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+10161-33-8,CCRIS,0,-1,,CC12C=CC3=C4CCC(=O)C=C4CCC3C1CCC2O,"INGEROWSKI,GH, SCHEUTWINKEL-REICH,M AND STAN,HJ, MUTAGENICITY STUDIESON VETERINARY ANABOLIC DRUGS WITH THE SALMONELLA/MICROSOME TEST, MUTAT. RES.91(2):93-98, 1981"
+24225-71-6,EPA1,1,-1,,CC(=O)N(Nc1ccc2c(Cc3ccccc23)c1)c4ccc5c(Cc6ccccc56)c4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+389104-55-6,CCRIS,0,-1,,CC(C)(C)c1c(N)ccc2ccccc12,"GLENDE,C SCHMITT,H ERDINGER,L ENGELHARDT,G AND BOCHE,G, TRANSFORMATIONOF MUTAGENIC AROMATIC AMINES INTO NON-MUTAGENIC SPECIES BY ALKYL SUBSTITUENTS.PART I. ALKYLATION ORTHO TO THE AMINO FUNCTION. MUTAT. RES. 498(1-2):19-37,2001"
+75776-00-0,EPA1,1,-1,,CNc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1629-58-9,VITIC,1,-1,,CCC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+97509-27-8,EPA1,1,-1,,O[C@@H]1C=Cc2c(cc3ccccc3c2[N+](=O)[O-])[C@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1679-02-3,EPA1,0,-1,,Cc1ccc2ccc3c4ccc5c(C)cccc5c4ccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+372-47-4,EPA1,0,-1,,Fc1cccnc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+144651-75-2,CCRIS,0,-1,,OC(=O)C1Cc2c([nH]c3ccccc23)C(Cc4ccccc4O)N1,"PAPAVERGOU,E, IOANNIDES,C AND CLIFFORD,MN, THE EVALUATION IN THE AMESTEST OF THE MUTAGENICITY OF TETRAHYDRO-BETA-CARBOLINE-3-CARBOXYLIC ACIDS FROMSMOKED FOODS, FOOD ADDIT. CONTAM. 9(2):183-187, 1992"
+593-56-6,VITIC,0,-1,,CON,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+104-87-0,EPA1,0,-1,,Cc1ccc(C=O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132059-52-0,CCRIS,1,-1,,OC1OC(=O)C(=C1C(Br)Br)Cl,"RAMOS,I LLOVERAS,M SOLANS,X HUICI,A AND MESSEGUER,A, BROMINATEDANALOGS OF 3-CHLORO-4-(DICHLORO-METHYL)-5-HYDROXY-2(5H)-FURANONE: PREPARATIONSOF 3-CHLORO-4-(BROMOCHLOROMETHYL)-5-HYDROXY-2(5H)-FURANONE AND MUTAGENICITYSTUDIES, ENVIRON. TOXICOL. CHEM. 19(11):2631-2636, 2000"
+456-27-9,EPA1,1,-1,,[O-][N+](=O)c1ccc(cc1)[N+]#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7470-44-2,EPA3,1,-1,,C([C@@H]1CO1)c2ccc3OCOc3c2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+518-83-2,EPA1,1,-1,"PURPUROXA",Oc1cc(O)c2C(=O)c3ccccc3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1122-54-9,VITIC,0,-1,"ACPYRIDI4",CC(=O)c1ccncc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+81924-79-0,CCRIS,1,-1,,CCN(CC)c1cc(NC(=O)C)c(cc1OC)N=Nc2ccc(cc2)[N+](=O)[O-],"ELLIOTT,BM, JACKH,R AND JUNG,R, EVALUATION OF THE GENOTOXICITY OF4-DIETHYLAMINO-4'-NITROAZOBENZENE AND SEVEN ANALOGUES, MUTAGENESIS 9(6):517-521, 1994"
+35282-72-5,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2cccc(CCl)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80984-66-3,CCRIS,1,-1,,N1C2C1c3cccc4C5NC5c6cccc2c6c34,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+17413-38-6,CCRIS,0,-1,,COc1cc(O)cc2c1cc(c3c(cc4OCOc4c23)C(=O)O)[N+](=O)[O-],"PEZZUTO,JM, SWANSON,SM, MAR,W, CHE,CT, CORDELL,GA AND FONG,HHS,EVALUATION OF THE MUTAGENIC AND CYTOSTATIC POTENTIAL OF ARISTOLOCHIC ACID(3,4-METHYLENEDIOXY-8-METHYOXY-10-NITROPHENANTHRENE-1-CARBOXYLIC ACID) ANDSEVERAL OF ITS DERIVATIVES, MUTAT. RES. 206(4):447-454, 1988"
+39115-11-2,EPA3,1,-1,,OC[C@H]1O[C@@H](Oc2ccc(O)c3C(=O)c4ccccc4C(=O)c23)[C@H](O)[C@@H](O)[C@@H]1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+75-38-7,VITIC,1,-1,,FC(=C)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+67-20-9,EPA2,1,-1,"NITROFURN,NITROFUNA",[O-][N+](=O)c1oc(\C=N\N2CC(=O)NC2=O)cc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+114-83-0,VITIC,1,-1,"ACPHENHYD",CC(=O)NNc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2876-22-4,EPA1,1,-1,,Nc1cccc2nc3ccccc3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+749-49-5,CCRIS,0,-1,,COc1ccc2nccc(C(OC(=O)C(C)O)C3CC4CCN3CC4C=C)c2c1,"SIDEROPOULOS,AS AND SPECHT,SM, EVALUATION OF MICROBIAL TESTING METHODSFOR THE MUTAGENICITY OF QUINOLINE AND ITS DERIVATIVES, CURR. MICROBIOL. 11(2):59-65, 1984"
+142438-64-0,CCRIS,1,-1,,CCC1=C(C(=O)OC)C(=O)OC1C,"KIM,IS, AND BJELDANES,LF, SYNTHESES AND MUTAGENICITY OF FUSARIN C RINGANALOGS, J. AGRIC. FOOD CHEM. 40(9):1625-1630, 1992"
+635-27-8,EPA1,1,-1,,Clc1cccc2ncccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M230,EPA1,1,-1,,C[C@@H](O)CN(CC(=O)C)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+362-74-3,CCRIS,0,-1,,CCCC(=O)Nc1ncnc2c1ncn2C3OC4COP(=O)(O)OC4C3OC(=O)CCC,"SHIMADA,H AND EBINE,Y, MUTAGENICITY STUDIES WITH N6,O2'-DIBUTYRYLCYCLIC ADENOSINE 3',5'-MONOPHOSPHATE (DBCAMP), MUTAT. RES. 192(1):1-6,1987"
+3074-00-8,EPA1,0,-1,,O=C1c2cccc3ccc4ccc5cccc1c5c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-44-1,VITIC,0,-1,,Cc1cccc(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60129-67-1,CCRIS,1,-1,,OCCN(CCO)c1ccc(cc1)N=Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-],"ELLIOTT,BM, JACKH,R AND JUNG,R, EVALUATION OF THE GENOTOXICITY OF4-DIETHYLAMINO-4'-NITROAZOBENZENE AND SEVEN ANALOGUES, MUTAGENESIS 9(6):517-521, 1994"
+16813-36-8,EPA2,1,-1,,O=NN1CCC(=O)NC1=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+86853-93-2,CCRIS,0,-1,,O=C1c2ccccc2c3c1ccc4ccc5ccccc5c34,"MARROCCHI,A, MINUTI,L, MOROZZI,G, PAMPANELLA,L AND TATICCHI,A,SYNTHESIS AND MUTAGENICITY OF SOME CYCLO[C]PHENANTHRENES ANDINDENO[C]PHENANTHRENES, CARCINOGENESIS 17(9):2009-2012, 1996"
+423-39-2,CCRIS,0,-1,,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)I,"DODD,DE HOFFMAN,GM AND HARDY,CJ, PERFLUORO-N-BUTYL IODIDE: ACUTETOXICITY, SUBCHRONIC TOXICITY AND GENOTOXICITY EVALUATIONS, INT. J. TOXICOL.23(4):249-258, 2004"
+40911-07-7,EPA3,1,-1,,CCCCN(CC[C@@H](C)O)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+613-12-7,EPA1,1,-1,,Cc1ccc2cc3ccccc3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112965-21-6,CCRIS,0,-1,,CC(\C=C\C(O)C1CC1)C2CCC3\C(=C\C=C\4/CC(O)CC(O)C4=C)\CCCC23C,"KITAGAKI,T, OGUMA,Y, YOKOTA,F, ONO,M, SHIRAKAWA,K, NAGATA,M ANDKONISHI,R, A MUTAGENICITY STUDY OF CALCIPOTRIOL (MC903),J. TOXICOL. SCI.21(SUPPL. 2):465-474, 1996"
+121-89-1,VITIC,1,-1,,CC(=O)c1cccc(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+124-70-9,CCRIS,1,-1,,C[Si](Cl)(Cl)C=C,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y90"
+546-80-5,EPA3,0,-1,"THUJONE",CC(C)[C@@]12C[C@@H]1[C@H](C)C(=O)C2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+71339-55-4,CCRIS,1,-1,,Cc1c2ccccc2c(CO)c3ccccc13,"SURH,YJ, BLOMQUIST,JC,"
+36504-68-4,EPA3,1,-1,,C1Cc2cc3ccc4cccc5ccc(c2[C@@H]6O[C@H]16)c3c45,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+610-48-0,EPA1,0,-1,,Cc1cccc2cc3ccccc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3958-60-9,CCRIS,0,-1,,[O-][N+](=O)c1ccccc1CBr,"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+116911-14-9,CCRIS,1,-1,,OCC(O)C(N=N#N)c1ccccc1,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+60-29-7,VITIC,0,-1,"DIETHYLET",CCOCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+614-48-2,CCRIS,0,-1,,[O-][N+](=O)c1cccc(\C=C\C(=O)c2ccccc2)c1,"MULLEN,CA, RASHID,KA AND MUMMA,RO, MUTAGENIC POTENCY OF SOMECONJUGATED NITROAROMATIC COMPOUNDS AND ITS RELATIONSHIP TO STRUCTURE, MUTAT.RES. 188(4): 267-274, 1987"
+4261-16-9,CCRIS,1,-1,,Nc1c2ncn(Cc3ccccc3)c2nc[n+]1[O-],"GORROD,JW, IOANNIDES,C, LAM,SP AND NEVILLE,S, MUTAGENICITY TESTING OF9-N-SUBSTITUTED ADENINES AND THEIR N-OXIDATION PRODUCTS, ENVIRON. HEALTHPERSPECT. 101(SUPPL. 3):21-26, 1993"
+933-88-0,EPA1,1,-1,,Cc1ccccc1C(=O)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64811-02-5,CCRIS,0,-1,,OS(=O)(=O)Oc1c2ccccc2c3ccc4cccc5ccc1c3c45,"IRWIN,SE, KWEI,GY, BLACKBURN,GR, THURMAN,R AND KAUFFMAN,FC,MUTAGENICITY OF BENZO[A]PYRENYL-1-SULFATE IN THE AMES TEST,ENVIRON. MOL.MUTAGEN. 19(3):253- 258, 1992"
+NOCAS_M10,EPA1,1,-1,"ETHACRIDI,ETHACRILA",CCOc1ccc2nc3cc(N)ccc3c(N)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+244775-76-6,CCRIS,1,-1,,CCCON(OC(=O)C)C(=O)c1ccccc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+1034-41-9,VITIC,0,-1,,OC1C2(Cl)C3(Cl)C4(Cl)C(Cl)(Cl)C5(Cl)C(Cl)(C1(Cl)C35Cl)C24Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98-86-2,VITIC,0,-1,"ACETOPHEO",CC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+52171-93-4,EPA3,1,-1,,CC1=CCCc2c1cc(C)c3c2ccc4ccccc34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+116355-83-0,CCRIS,0,-1,"FUMONISB1",CCCCC(C)C(OC(=O)CC(CC(=O)O)C(=O)O)C(CC(C)CC(O)CCCCC(O)CC(O)C(C)N)OC(=O)CC(CC(=O)O)C(=O)O,"GELDERBLOM,WC AND SNYMAN,SD, MUTAGENICITY OF POTENTIALLY CARCINOGENICMYCOTOXINS PRODUCED BY FUSARIUM MONILIFORME, MYCOTOXIN RES. 7(2):46-52,1991"
+336629-39-1,CCRIS,1,-1,,CCCOc1cc(c(OC)cc1N\N=C(/C(=O)C)\C(=O)Nc2ccc(cc2)[N+](=O)[O-])c3cc(OCCC)c(N\N=C(/C(=O)C)\C(=O)Nc4ccc(cc4)[N+](=O)[O-])cc3OC,"NAKPATHOM,M HINKS,D AND FREEMAN,HS, SYNTHESIS AND EVALUATION OFORGANIC PIGMENTS. 4. NEW MONOARYLIDE AND DIARYLIDE PIGMENTS, DYES PIGM.48(2):93-103, 2001"
+56438-59-6,CCRIS,1,-1,,COc1ccc(CCC2CO2)cc1,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+4337-51-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2C(=O)NSc2c1,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+59-92-7,EPA3,1,-1,,N[C@H](Cc1ccc(O)c(O)c1)C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+2634-33-5,EPA1,0,-1,,Oc1nsc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+523-50-2,EPA1,0,-1,"ANGELICIN",O=C1Oc2c(C=C1)ccc3occc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+491-80-5,EPA1,0,-1,"BIOCHANIA",COc1ccc(cc1)C2=COc3cc(O)cc(O)c3C2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1503-91-9,EPA1,0,-1,,CC(=O)N(O)c1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17177-50-3,CCRIS,1,-1,,OCC(O)C1CO1,"ADLER,ID, KLIESCH,U, NYLUND,L AND PELTONEN,K, IN VITRO AND IN VIVOMUTAGENICITY OF THE BUTADIENE METABOLITES BUTADIENE DIOLEPOXIDE, BUTADIENEMONOEPOXIDE AND DIEPOXYBUTANE, MUTAGENESIS 12(5):339-345, 1997"
+123-31-9,VITIC,0,-1,"HYDROQUON",Oc1ccc(O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98114-60-4,EPA1,1,-1,,CCN=NO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63358-49-6,CCRIS,0,-1,,CNC(=O)CC(N)C(=O)NC(C(=O)NC1C2SC(C)(C)C(N2C1=O)C(=O)O)c3ccc(O)cc3,"ONO,T, NITO,S, AOI,Y AND HIGAKI,K, MUTAGENCITY STUDIES OFASPOXICILLIN, OYO YAKURI 30(2):249-255, 1985"
+55022-75-8,CCRIS,0,-1,,O1C2C1C3N=NC2C4OC34,"STARK,AA AND RASTETTER,WH, STRUCTURE-ACTIVITY RELATIONSHIPS IN THEMUTAGENICITY AND CYTOTOXICITY OF PUTATIVE METABOLITES AND RELATED ANALOGS OFBENZENE DERIVED FROM THE VALENCE TAUTOMERS BENZENE OXIDE AND OXEPIN, ENVIRON.MOL. MUTAGEN. 28(3):284-293, 1996"
+26541-56-0,EPA1,1,-1,,CC(=O)ON(C(=O)C)c1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+27729-98-2,CCRIS,0,-1,,Fc1ccc(cc1)C2OC2C(=O)c3ccccc3,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+103-84-4,VITIC,0,-1,"ACETANILI",CC(=O)Nc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+102-81-8,VITIC,0,-1,,CCCCN(CCO)CCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99523-86-1,CCRIS,1,-1,,Cc1ccc2nsc(N)c2c1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+102408-25-3,EPA1,1,-1,,Cn1c(N)nc2ccc3ncccc3c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+520-18-3,EPA1,1,-1,"KAEMPFERO",OC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M401,EPA1,0,-1,,Oc1cccc2OC(=O)C(=Cc12)[C@@H]3CCc4ccccc4C3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+484-20-8,VITIC,1,-1,"BERGAPTEN,PSOBERAN",COc1c2C=CC(=O)Oc2cc3occc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13345-26-1,GENETOX,1,-1,,Oc1ccc2c(c1)cc3ccc4cccc5ccc2c3c45,"CANCER RES 36:3350-3357,1976"
+66452-61-7,CCRIS,1,-1,,CC(C)Sc1cc(Cc2ccc(N)c(SC(C)C)c2)ccc1N,"TAKAGI,Y, ENDOH,O, GOTO,S, KOHZAKI,K AND MATSUSHITA,H, MUTAGENICITY OFDIAMINODIPHENYLMETHANE AND RELATED COMPOUNDS, KANKYO KAGAKU 5(4):841-845,1995"
+75-25-2,VITIC,1,-1,"BROMOFORM",BrC(Br)Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+54-21-7,EPA1,0,-1,"SALICYNH4,ANACARDAT,SALICYLBI,BISUBSALI,SALICATCH,CHOLMGSAL,HISTAMSAL,IMIDAZSAL,SALICYLMG,SALICYLHG,METHENSAL,METRSALNA,NIKSALIN,PICOLAMIN,SALCOLEX,SALICYALU,SALICYLCA,SALICATCU,SALICDIET,SALICYLLI,SALICYMDO,SALICYMOR,SALICYLOL,SALICYLSR,SALICATNA,TISALICYL",OC(=O)c1ccccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13256-32-1,EPA3,1,-1,,CNC(=O)N(C)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+90098-04-7,CCRIS,0,-1,"REBAMIPID",OC(=O)C(Cc1cc(O)nc2ccccc12)NC(=O)c3ccc(Cl)cc3,"KANEKO,E, SHIBAHARA,T, KATO,K, AWOGI,T, ITOH,T, FUKAZAWA,Y ANDTSUSHIMOTO,G, IN VITRO MUTAGENICITY TESTS OF THE ANTIULCER AGENT(+/-)-2-(4-CHLOROBENZOYLAMINO)- 3-[2(1H)-QUINOLINON-4-YL]PROPIONIC ACID(OPC-12759), IYAKUHIN KENKYU 20(2): 492-8,1989"
+71807-56-2,CCRIS,0,-1,,Cc1[nH]cnc1CSCCN=C(NCC#C)NC#N,"ISHIDA,F, KONDO,H, FUKUSHIMA,M AND KAMEI,T,MUTAGENIC EVALUATION OFETINTIDINE (BL-5641), A NOVEL HISTAMINE H2-RECEPTOR ANTAGONIST, USING REVERSEMUTATION TESTS IN BACTERIA AND FORWARD MUTATION TESTS IN V79 CHINESE HAMSTERCELLS, MUTAT. RES. 188(4):301-306, 1987"
+NOCAS_M152,EPA1,1,-1,,CC(C)(COC[C@H]1CO1)COC[C@H]2CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+102-06-7,VITIC,1,-1,,N=C(Nc1ccccc1)Nc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5405-41-4,VITIC,0,-1,,CCOC(=O)CC(C)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+38915-40-1,EPA1,1,-1,,CCCCOc1ccc2nc3cc(Cl)ccc3c(NCCCN(CC)CCCl)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+135626-95-8,CCRIS,0,-1,,CC1(CC(O)C2(C)C(CCC3C4(C)CCCC23OC4=O)C1)C=C,"HENGSTLER,JG, LOEFFLER,S, SCHAEFER,M, GLATT,HR, FUCHS,J, FLESCH,P ANDOESCH,F, DNA STRAND BREAK INDUCTION, MUTAGENICITY, AND CYTOTOXICITY OF THEMYCOTOXINS 11BETA-HYDROXY-7-DEOXYROSENONOLACTONE, ROSENONOLACTONE, ANDTRICHOTHECIN, MYCOTOXIN RES. 8(2):77-83, 1992"
+129018-59-3,CCRIS,1,-1,,Cn1c(nc2ncc(cc12)c3ccccc3)[N+](=O)[O-],"WILD,D, WATKINS,BE AND VANDERLAAN,M, AZIDO-AND NITRO-PHIP, RELATIVESOF THE HETEROCYCLIC ARYLAMINE AND FOOD MUTAGEN PHIP - MECHANISM OF THEIRMUTAGENICITY IN SALMONELLA, CARCINOGENESIS 12(6):1091-1096, 1991"
+475-38-7,EPA1,1,-1,"NAPHTHAZA",Oc1ccc(O)c2C(=O)C=CC(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106532-67-6,CCRIS,1,-1,,CC(C)CC(=O)\N=C\1/SN(C(=O)CC(C)C)c2ccc(cc12)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+19202-92-7,EPA3,0,-1,,C[C@@H]1C[C@H]2OC(=O)[C@]3(C)[C@H]2[C@@H](O[C@]3(C)O)[C@]4(C)[C@H]1C=CC4=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+13379-35-6,EPA1,1,-1,,COc1ccc2Oc3cc(OC)cc(O)c3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94764-55-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(c1)sc3ccccc23,"WATANABE,T, KAJI,H, TAKASHIMA,M, KASAI,T, LEWTAS,J AND HIRAYAMA,T,METABOLIC ACTIVATION"
+298-18-0,VITIC,1,-1,,C1O[C@H]1[C@H]2CO2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+33424-05-4,EPA3,1,-1,,C1O[C@@H]1c2cc3ccccc3c4ccccc24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+67450-45-7,CCRIS,0,-1,"U-48753E",CCC(=O)N(C1CCCC1N(C)C)c2ccc(Cl)c(Cl)c2,"AARON,CS, STANKOWSKI,LF JR, HARBACH,PR, VALENCIA,R, MAYO,JK,MIRSALIS,J, MAZUREK,JH, STEINMETZ,KL, WISER,SK, ZIMMER,DM AND TRZOS,RJ,COMPARATIVE MUTAGENICITY TESTING OF A DRUG CANDIDATE, U-48753E: MECHANISM OFINDUCTION OF GENE MUTATIONS IN MAMMALIAN CELLS AND QUANTITATION OF POTENTIALHAZARD, MUTAT. RES. 223(2):111-120, 1989"
+149396-90-7,CCRIS,0,-1,,Cc1cc(C(O)c2ncc([N+](=O)[O-])n2C)c(O)c(c1)C(C)(C)C,"DUBINI,F, RIVIERA,L, SCALTRITO,MM AND BELLOTTI,MG, SUSCEPTIBILITY OFHELICOBACTER PYLORI AND PHARMACOKINETIC PROPERTIES IN MICE OF NEW5-NITROIMIDAZOLE DERIVATIVES DEVOID OF MUTAGENIC ACTIVITY IN THE AMES TEST, J.CHEMOTHER. (FLORENCE) 5(3):168-173, 1993"
+437-50-3,EPA1,1,-1,,COc1cc(O)c2C(=O)c3cc(O)ccc3Oc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-80-1,EPA1,0,-1,"CUOLEATE,ELAIDATE,MONOETINO,MONTAN103",CCCCCCCC\C=C\CCCCCCCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+34041-03-7,CCRIS,1,-1,,CN(C)C(=S)SNCCNSC(=S)N(C)C,"MORIYA,M OHTA,T WATANABE,K MIYAZAWA,T KATO,K AND SHIRASU,Y, FURTHERMUTAGENICITY STUDIES ON PESTICIDES IN BACTERIAL REVERSION ASSAY SYSTEMS, MUTAT.RES. 116(3-4):185-216,1982"
+97-41-6,CCRIS,0,-1,,CCOC(=O)C1C(C=C(C)C)C1(C)C,"SIMMON,VF, RICCIO,ES, ROBINSON,DE AND MITCHELL,AD, IN VITROMICROBIOLOGICAL MUTAGENICITY AND UNSCHEDULED DNA SYNTHESIS STUDIES OF FIFTEENPESTICIDES, EPA/600/1-85/006, NTIS PB85-193761, 1985"
+41830-80-2,EPA1,1,-1,,Nc1ccc2N=C3C(=CC(=N)c4ccccc34)Oc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+129129-64-2,CCRIS,0,-1,,CN1C=CN(CCC[n+]2ccc(cc2)C(=O)N)C1\C=N\O,"ORNER,G, SEEWALD,JB, NIEDING,WJ AND KORTE,DW, MUTAGENIC POTENTIAL OF1-[1-(2-HYDROXYIMINOMETHYL-3-METHYL)IMIDAZOLO]-3-[1-(4-CARBOMOYLPYRIDINIUM)]-PROPANE DICHLORIDE HYDRATE IN THE AMES SALMONELLA/MAMMALIAN MICROSOMEMUTAGENICITY TEST, LETTERMAN ARMY INSTITUTE OF RESEARCH, LAIR-IR-383:TOXICOLOGYSER-239, JULY 1989"
+148193-37-7,CCRIS,0,-1,,Nc1ccc2C(=O)NSc2c1,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+104775-36-2,EPA1,0,-1,"DQ-2511",CNC(=O)c1cccc(NCC(=O)NCCc2ccc(OC)c(OC)c2)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-16-4,VITIC,0,-1,,OCC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6264-66-0,EPA1,1,-1,,Nc1ccc(Oc2ccc(N)c(N)c2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+34592-47-7,EPA1,0,-1,,OC(=O)[C@@H]1CSCN1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7251-61-8,EPA1,0,-1,,Cc1cnc2ccccc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2068-78-2,CCRIS,0,-1,,CCC1(O)CC2CN(CCc3c([nH]c4ccccc34)C(C2)(C(=O)OC)c5cc6c(cc5OC)N(C=O)C7C(O)(C(OC(=O)C)C8(CC)C=CCN9CCC67C89)C(=O)OC)C1,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+160543-06-6,CCRIS,0,-1,,Cc1ccc2c(CO)c3ccc4ccccc4c3nc2c1,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+90-19-7,EPA1,1,-1,"RHAMNETIN",COc1cc(O)c2C(=O)C(=C(Oc2c1)c3ccc(O)c(O)c3)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88193-04-8,EPA1,1,-1,,Cc1cc2[nH]c3cc(C)c4ccccc4c3c2c5ccccc15,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10353-53-4,CCRIS,1,-1,,C=CCCC1CO1,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+5836-85-1,EPA1,1,-1,,COc1cc2C(=O)CCc2c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97-99-4,CCRIS,0,-1,"THFA",OCC1CCCO1,"AESCHBACHER,HU, WOLLEB,U, LOLIGER,J, SPADONE,JC AND LIARDON,R,CONTRIBUTION OF COFFEE AROMA CONSTITUENTS TO THE MUTAGENICITY OF COFFEE, FOODCHEM. TOXICOL. 27(4):227-232, 1989"
+210245-96-8,CCRIS,0,-1,,CN(C)c1ccc(cc1)N=Nc2ccc(OC3OC(CO)C(O)C(O)C3O)cc2,"BARNI,E BAROLO,C QUAGLIOTTO,P VALLDEPARAS,J AND VISCARDI,G, NOVELAZOBENZENE DERIVATIVES CONTAINING A GLUCOPYRANOSIDE MOIETY. PART I: SYNTHESIS,CHARCTERISATION AND MUTAGENIC PROPERTIES, DYES PIGM. 46(1):29-36,2000"
+92382-74-6,CCRIS,1,-1,,CCN(CC)[N+](=NO)[O-],"DONOVAN,PJ, SMITH,GT, LAWLOR,TE, CIFONE,MA, MURLI,H AND KEEFER,LK,QUANTIFICATION OF DIAZENIUMDIOLATE MUTAGENICITY IN FOUR DIFFERENT IN VITROASSAYS, NITRIC OXIDE 1(2):158-166, 1997"
+98096-09-4,CCRIS,1,-1,,Cc1ccc2C(=O)c3cccc4ccc1c2c34,"RICE,JE, MAKOWSKI,GS, HOSTED,TJ,JR AND LAVOIE,EJ, METHYLENE-BRIDGEDBAY REGION CHRYSENE AND PHENANTHRENE DERIVATIVES AND THEIR KETO ANALOGS:MUTAGENICITY IN SALMONELLA TYPHIMURIUM AND TUMOR INITIATING ACTIVITY ON MOUSESKIN, CANCER LETT. 27(2):199-206, 1985"
+146818-20-4,CCRIS,1,-1,,CCc1ccc(NC(=O)c2csc(c2)[N+](=O)[O-])cc1,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+31120-85-1,CCRIS,1,-1,,CCOP(=O)(NC(C)C)Oc1ccccc1C(=O)OC(C)C,"ONODERA,S, MAEDA,S AND SAITOH,T, MUTAGENIC AND MASS SPECTROMETRICCHARACTERIZATION OF OXYGEN ANALOGS (P=0) DERIVATIZED FROM ORGANOTHIOPHOSPHORUSPESTICIDES, KANKYO KAGAKU 5(3):617-624, 1995"
+642-83-1,CCRIS,0,-1,"ACEGLATON",CC(=O)OC1C2OC(=O)C(OC(=O)C)C2OC1=O,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+128753-93-5,CCRIS,0,-1,,CC12OOC1(CO)Oc3ccccc23,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+1193-54-0,EPA1,1,-1,,ClC1=C(Cl)C(=O)NC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+501-92-8,EPA1,0,-1,,Oc1ccc(CC=C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+140-88-5,VITIC,0,-1,"DR9700475,DR9800782,EUDRAE30D",CCOC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M9,EPA1,1,-1,,ClC[C@H](Br)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2431-96-1,EPA1,0,-1,,CCN(CC)C(=O)Cc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88-96-0,VITIC,0,-1,,NC(=O)c1ccccc1C(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107-21-1,VITIC,0,-1,"DR9804550,ETHYLENEG",OCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106636-46-8,EPA1,1,-1,,Cc1cn2c(N=O)c(nc2s1)c3ccc(cc3)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+158366-46-2,EPA1,1,-1,,CC(=O)c1c(cc([N+](=O)[O-])n1[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+145241-76-5,CCRIS,1,-1,,Fc1ccc2cccnc2c1F,"KATO,T, SAEKI,K, KAWAZOE,Y AND HAKURA,A, EFFECTS OF OLIGOFLUORINESUBSTITUTION ON THE MUTAGENICITY OF QUINOLINE: A STUDY WITH TWELVEFLUOROQUINOLINE DERIVATIVES, MUTAT. RES. 439(2):149-157, 1999"
+51357-79-0,CCRIS,1,-1,,Nc1snc2ccc(Cl)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+113058-39-2,EPA1,1,-1,,Oc1cccc2c3cc4ccccc4cc3c5ccccc5c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71-33-0,EPA1,0,-1,,O=C1NC=NC(=O)N1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125369-84-8,CCRIS,1,-1,,[O-][N+](=O)c1ccccc1\C=C\C=C(/C#N)\c2ccc(Br)cc2,"MASLAT,AO AND AL-ARAB,M, MUTAGENIC ACTIVITY OF THREE PENTADIENENITRILEDERIVATIVES OF SUSPECTED HERBICIDAL ACTION,TOXICOL. ENVIRON. CHEM.30(1-2):95-99, 1991"
+99-04-7,VITIC,0,-1,,Cc1cccc(c1)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2883-98-9,CCRIS,1,-1,"ASARONEAL",COc1cc(OC)c(\C=C\C)cc1OC,"RAMOS-OCAMPO,VE AND HSIA,MTS, MUTAGENICITY AND DNA-DAMAGING ACTIVITYOF CALAMUS OIL, ASARONE ISOMERS, AND DIMETHOXYPROPENYLBENZENE ANALOGUES,PHILLIP. ENTOMOL. 7(3):275-291, 1988"
+1875-48-5,EPA1,0,-1,,NN1C(=O)c2ccccc2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+655-86-7,EPA1,1,-1,"DR9900399",Nc1cc2nc3ccccc3nc2cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+149862-57-7,CCRIS,0,-1,,CC(C)CCNc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+3416-21-5,CCRIS,1,-1,,Cc1ccc2cc3c4ccccc4C5OC5c3c6CCc1c26,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+2458-12-0,VITIC,1,-1,,Cc1ccc(cc1N)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+15562-42-2,CCRIS,0,-1,,COc1ccc2C(=O)c3nccc4cc(OC)c(OC)c(c2c1)c34,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+62018-91-1,EPA3,1,-1,,CCCCN(C[C@H](O)CCO)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+143922-96-7,CCRIS,1,-1,,Cc1c(N)cccc1N=[N+]([O-])c2cccc(N)c2C,"SAYAMA,M, INOUE,M, MORI,MA, MARUYAMA,Y AND KOZUKA,H, BACTERIALMETABOLISM OF 2,6-DINITROTOLUENE WITH SALMONELLA TYPHIMURIUM AND MUTAGENICITY OFTHE METABOLITES OF 2,6-DINITROTOLUENE AND RELATED COMPOUNDS, XENOBIOTICA 22(6):633-640, 1992"
+114838-69-6,CCRIS,1,-1,,CC(=O)O[C@@H]1[C@]2(C)C[C@]2(C=O)C(=C3CC(C)(C)C[C@]13O)C=O,"ANKE,H, STERNER,O AND STEGLICH,W, STRUCTURE-ACTIVITY RELATIONSHIPS FORUNSATURATED DIALDEHYDES. 3. MUTAGENIC, ANTIMICROBIAL, CYTOTOXIC, AND PHYTOTOXICACTIVITIES OF MERULIDIAL DERIVATIVES, J. ANTIBIOT. 42(5):738-744,1989"
+24903-48-8,EPA1,1,-1,,c1ccc2c(c1)ccc3cc4c(ccc5ccncc45)cc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+102-50-1,VITIC,1,-1,,COc1ccc(N)c(C)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6313-44-6,CCRIS,0,-1,,[O-][N+](=O)C1c2ccccc2C(=O)c3ccccc13,"MOELLER,M, HAGEN,I AND RAMDAHL,T, MUTAGENICITY OF POLYCYCLIC AROMATICCOMPOUNDS (PAC) IDENTIFIED IN SOURCE EMISSIONS AND AMBIENT AIR, MUTAT. RES.157(2-3): 149-156, 1985"
+58917-67-2,CCRIS,1,-1,,OC1C2OC2c3c(cc4ccc5cccc6ccc3c4c56)C1O,"GLATT,H, PIEE,A, PAULY,K, STEINBRECHER,T, SCHRODE,R, OESCH,F ANDSEIDEL,A, FJORD- AND BAY-REGION DIOL-EPOXIDES INVESTIGATED FOR STABILITY, SOSINDUCTION IN ESCHERICHIA COLI, AND MUTAGENICITY IN SALMONELLA TYPHIMURIUM ANDMAMMALIAN CELLS,CANCER RES. 51(6):1659-1667, 1991"
+693-98-1,VITIC,0,-1,"MEIMIDAZ2",Cc1ncc[nH]1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+76150-91-9,EPA1,0,-1,,Clc1cnc(Oc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c(Cl)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13256-06-9,EPA3,1,-1,,CCCCCN(CCCCC)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+42397-64-8,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3c(ccc4ccc1c2c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+21259-20-1,GENETOX,1,-1,,CC(C)CC(=O)OC1CC2(COC(=O)C)C(OC3C(O)C(OC(=O)C)C2(C)C34CO4)C=C1C,"PROC NATL ACAD SCI USA 72:5135-5139,1975"
+112-52-7,VITIC,0,-1,"LAURYLCHL",CCCCCCCCCCCCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+131119-01-2,CCRIS,1,-1,,Cn1c(CC(=O)OCCCl)c(C(=O)O)c2ccccc12,"LOPEZ DE CERAIN,A, GARCIA,E, GULLON,A, IGNACIO,RJ AND MONGE,A,MUTAGENIC EVALUATION OF SOME TRIAZINO INDOLES USING THE SALMONELLA/MAMMALIANMICROSOME ASSAY, MUTAGENESIS 5(4):307-311, 1990"
+1028-11-1,CCRIS,0,-1,"NITROSUPY",[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Nc2ccccn2,"TEMCHAROEN,P, NERAPATTANAKID,S, TOSKULKAO,C, GLINSUKON,T, PAOVARO,CAND RUCHIRAWAT,S, MUTAGENIC ACTIVITY OF NEWLY SYNTHESIZED SULFA DRUGS TOSALMONELLA TYPHIMURIUM, MUTAT. RES. 321(4):187-195, 1994"
+32692-19-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2NCCc2c1,"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+81-55-0,VITIC,1,-1,,Oc1ccc(c2C(=O)c3c(C(=O)c12)c(O)ccc3[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+482-89-3,EPA3,1,-1,"INDIGOTIN",Oc1c([nH]c2ccccc12)C3=Nc4ccccc4C3=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+59283-76-0,CCRIS,1,-1,,Cc1c(NO)cc(cc1[N+](=O)[O-])[N+](=O)[O-],"PADDA,RS WANG,CY HUGHES,JB AND BENNETT,GN, MUTAGENICITY OFTRINITROTOLUENE AND METABOLITES FORMED DURING ANAEROBIC DEGRADATION BYCLOSTRIDIUM ACETOBUTYLICUM ATCC 824, ENVIRON. TOXICOL. CHEM. 19(12):2871-2875,2000"
+930-68-7,VITIC,0,-1,,O=C1CCCC=C1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+67028-20-0,EPA1,0,-1,,Cc1cccc2cc3ccc4ccccc4c3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+555-84-0,EPA1,1,-1,,[O-][N+](=O)c1oc(\C=N\N2CCNC2=O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13909-09-6,CCRIS,1,-1,"SEMUSTINE",CC1CCC(CC1)NC(=O)N(CCCl)N=O,"ASHBY,J, VOGEL,EW, TINWELL,H, CALLANDER,RD AND SHUKER,DEG,MUTAGENICITY TO SALMONELLA, DROSOPHILA AND THE MOUSE BONE MARROW OF THE HUMANANTINEOPLASTIC AGENT FOTEMUSTINE: PREDICTION OF CARCINOGENIC POTENCY, MUTAT.RES. 286(1):101- 109, 1993"
+147151-64-2,CCRIS,0,-1,,CC12CCC3C(CCC4=CC(=O)NCCC34C)C1CCC2OC(=O)\C=C\c5cccc(c5)N(CCCl)CCCl,"VOUTSINAS,G, KAPPAS,A, DEMOPOULOS,NA AND CAMOUTSIS,C, MUTAGENICITY OFFOUR HOMO-AZA-STEROIDAL ESTERS OF M-N,N-BIS(2-CHLOROETHYL)AMINOCINNAMIC ACID INTHE AMES TEST, MUTAT. RES. 319(4):325-329, 1993"
+159416-83-8,CCRIS,0,-1,,COc1cc(C)cc2c(O)c(cc(O)c12)c3c(C)cc4c(O)ccc(O)c4c3OC,"HAZRA,B, PAL,S, SHETTY,TK AND BHATTACHARYA,RK, AN INVESTIGATION ON THEMUTAGENIC ACTIVITY OF DIOSPYRIN AND ITS SEMISYNTHETIC DERIVATIVES, MED. SCI.RES. 23(7):449-450, 1995"
+90597-22-1,CCRIS,0,-1,,NC1=NC(=O)N(C=C1)C2C=C(CO)C(O)C2O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y90"
+21313-86-0,CCRIS,1,-1,,Nc1[nH]cnc2nc(nc12)c3ccc(cc3)[N+](=O)[O-],"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+86334-97-6,CCRIS,0,-1,,OC1CCC(O)(CN(N=O)C(Cc2ccccc2)C(=O)O)C(O)C1O,"POOL,BL, ROEPER,H, ROEPER,S AND ROMRUEN,K, MUTAGENICITY STUDIES ONN-NITROSATED PRODUCTS OF THE MAILLARD BROWNING REACTION:N-NITROSO-FRUCTOSE-AMINO ACIDS, FOOD CHEM. TOXICOL. 22(10):797-801,1984"
+58139-46-1,EPA3,1,-1,,[O-][N+](=O)c1ccc(s1)c2csc(NC=O)n2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+6344-63-4,EPA1,1,-1,,Nc1cccc2c1Cc3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106232-36-4,CCRIS,1,-1,,O=Nc1[nH]cnc1c2ccccc2,"EHLHARDT,WJ, BEAULIEU,BB AND GOLDMAN,P, MAMMALIAN CELL TOXICITY ANDBACTERIAL MUTAGENICITY OF NITROSOIMIDAZOLES, BIOCHEM. PHARMACOL.37(13):2603-2606, 1988"
+18883-66-4,CCRIS,1,-1,,CN(N=O)C(=O)NC1C(O)OC(CO)C(O)C1O,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+96563-07-4,CCRIS,1,-1,,CC1c2ccccc2c3cc(C)ccc13,"LAVOIE,EJ, COLEMAN,DT, GEDDIE,NG AND RICE,JE, STUDIES ON THEMUTAGENICITY AND TUMOR-INITIATING ACTIVITY OF METHYLATED FLUORENES, CHEM.-BIOL.INTERACT. 52(3):301-309, 1985"
+597-25-1,EPA1,0,-1,,COP(=O)(OC)N1CCOCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+491-59-8,EPA1,1,-1,"CHRYSAROB",Cc1cc(O)c2c(O)c3c(O)cccc3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105-87-3,EPA3,0,-1,"NERYLACET",CC(=CCC\C(=C/COC(=O)C)\C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+136950-74-8,CCRIS,1,-1,,CC(=O)c1ccc2[nH]c3c(C)cc(c(C)c3c2c1)[N+](=O)[O-],"ANDRE,V, BIOSSART,C, SICHEL,F, GAUDUCHON,P, LE TALAER,JY, LANCELOT,JC,MERCIER,C, CHEMTOB,S, RAOULT,E AND TALLEC,A, MUTAGENICITY OF NITRO- ANDAMINO-SUBSTITUTED CARBAZOLES IN SALMONELLA TYPHIMURIUM. III. METHYLATEDDERIVATIVES OF 9H-CARBAZOLE, MUTAT. RES. 389(2-3):247-260, 1997"
+91085-62-0,EPA1,1,-1,,Cl\C=C(\Cl)/SCc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+116-54-1,EPA1,1,-1,,COC(=O)C(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+58683-84-4,EPA3,1,-1,,COc1cc(ccc1[N+](=O)[O-])N=Nc2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+17804-35-2,VITIC,0,-1,"BENOMYL",CCCCNC(=O)n1c(NC(=O)OC)nc2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1747-60-0,EPA3,1,-1,,COc1ccc2nc(N)sc2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+13743-07-2,EPA2,1,-1,"HENU",NC(=O)N(CCO)N=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+129812-24-4,CCRIS,1,-1,,CC1=CC(=O)Oc2cc3OC4(C)OOC4(C)c3cc12,"ADAM,W, HAUER,H, MOSANDL,T, SAHA-MOELLER,CR, WAGNER,W AND WILD,D,FUROCOUMARIN-, NAPHTHOFURAN-, AND FUROQUINOLINE-ANNULATED 1,2-DIOXETANES:SYNTHESIS, THERMOLYSIS, AND MUTAGENICITY, LIEBIGS ANN. CHEM. (12):1227-1236,1990"
+159092-73-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(cc3ccccc3c2c1)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+476-71-1,CCRIS,0,-1,"DOMESTICI",COc1cc2CCN(C)C3Cc4cc5OCOc5cc4c(c1O)c23,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+67019-26-5,CCRIS,0,-1,,CCCCCCCC(=O)Nc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+101489-25-2,CCRIS,0,-1,,COc1ccc(O)c2C(=O)c3c(OC)cc4OC5OCCC5c4c3Oc12,"MORI,H, SUGIE,S, YOSHIMI,N, KITAMURA,J, NIWA,M, HAMASAKI,T ANDKAWAI,K, GENOTOXIC EFFECTS OF A VARIETY OF STERIGMATOCYSTIN-RELATED COMPOUNDS INTHE HEPATOCYTE/DNA-REPAIR TEST AND THE SALMONELLA MICROSOME ASSAY, MUTAT. RES.173(3):217-222, 1986"
+106532-72-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccccc3Cl)\c2c1)C(=O)c4ccccc4Cl,"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+75-91-2,VITIC,1,-1,"BUHYPEROX",CC(C)(C)OO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+112654-68-9,CCRIS,1,-1,,ClC(=C1OC(=O)C(=C1)Cl)Cl,"SMEDS,A, FRANZEN,R AND KRONBERG,L, OCCURRENCE OF SOME CHLORINATED ENOLLACTONES AND CYCLOPENTENE-1,3-DIONES IN CHLORINE-TREATED WATERS, ENVIRON. SCI.TECHNOL. 29(9):1839-1844, 1995"
+13109-99-4,CCRIS,1,-1,"BA-42517",[O-][N+](=O)c1cnc(s1)N2CCCC2=O,"HOF,H, MUTAGENIC ACTIVITIES OF NITROTHIAZOLE DERIVATIVES, ZENTRALBL.BAKTERIOL., MIKROBIOL. HYG., ABT. 1, ORIG. B 181(1-2):64-70, 1985"
+124489-20-9,CCRIS,1,-1,,Cn1c(NO)nc2ncc(cc12)c3ccccc3,"BUONARATI,MH AND FELTON,JS, ACTIVATION OF 2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-B]PYRIDINE (PHIP) TO MUTAGENIC METABOLITES,CARCINOGENESIS(LONDON) 11(7):1133-8, 1990"
+63449-41-2,EPA1,0,-1,"BENZODODE",CCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+21884-44-6,EPA2,0,-1,"LUTEOSKYR",Cc1cc(O)c2C(=C3C(=O)C4C(O)C5C6C(O)C(C(=O)C7=C(O)c8c(O)cc(C)c(O)c8C(=O)C467)C35C(=O)c2c1O)O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+65267-04-1,EPA1,1,-1,,NC(=O)CNC(=O)N(CCCl)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+279242-11-4,CCRIS,0,-1,,CC(C)(C)c1ccc(cc1)c2ccc(cc2)[N+](=O)[O-],"HAACHK,T ERDINGER,L AND BOCHE,G, MUTAGENICITY IN SALMONELLATYPHIMURIUM TA98 AND TA100 OF NITROSO AND RESPECTIVE HYDROXYLAMINE COMPOUNDS,MUTAT. RES. 491(1-2):183-193, 2001"
+3244-90-4,EPA3,0,-1,,CCCOP(=S)(OCCC)OP(=S)(OCCC)OCCC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+111249-52-6,CCRIS,1,-1,,Cc1cc(N)c(C)c2c3ccccc3[nH]c12,"ANDRE,V, BIOSSART,C, SICHEL,F, GAUDUCHON,P, LE TALAER,JY, LANCELOT,JC,MERCIER,C, CHEMTOB,S, RAOULT,E AND TALLEC,A, MUTAGENICITY OF NITRO- ANDAMINO-SUBSTITUTED CARBAZOLES IN SALMONELLA TYPHIMURIUM. III. METHYLATEDDERIVATIVES OF 9H-CARBAZOLE, MUTAT. RES. 389(2-3):247-260, 1997"
+4196-87-6,VITIC,0,-1,,CC(COC(=O)c1ccccc1)(COC(=O)c2ccccc2)COC(=O)c3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+129812-30-2,CCRIS,0,-1,,CC12OOC1(C)c3ccc4cccnc4c3O2,"ADAM,W, HAUER,H, MOSANDL,T, SAHA-MOELLER,CR, WAGNER,W AND WILD,D,FUROCOUMARIN-, NAPHTHOFURAN-, AND FUROQUINOLINE-ANNULATED 1,2-DIOXETANES:SYNTHESIS, THERMOLYSIS, AND MUTAGENICITY, LIEBIGS ANN. CHEM. (12):1227-1236,1990"
+123-92-2,VITIC,0,-1,,CC(C)CCOC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M291,EPA1,1,-1,,CCCCCCCCCCCCCCCCCC(=O)OCC1=CC=C2C(=CC[C@H](C=C12)C(=C)C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+28342-33-8,EPA1,1,-1,,COc1ccc2c3ccc4cc5OCOc5cc4c3N(C)C(=O)c2c1OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+220168-43-4,CCRIS,1,-1,,Cc1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+1516-74-1,CCRIS,1,-1,,N#N=Nc1nc2ccccc2[nH]1,"WILD,D, AND DIRR,A, MUTAGENIC NITRENES/NITRENIUM IONS FROMAZIDO-IMIDAZOARENES AND THEIR STRUCTURE-ACTIVITY RELATIONSHIP, MUTAGENESIS4(6):446-52, 1989"
+146-68-9,CCRIS,0,-1,,[O-][N+](=O)c1ccc(cc1)n2nc(n[n+]2c3ccc(I)cc3)c4ccccc4,"CATALLO,WJ, GALE,RJ, WONG,RL AND BENDER,ME,REDUCIBLE DYE2-(P-IODOPHENYL)-3- (P-NITROPHENYL)-5-(PHENYL)-2H-TETRAZOLIUM CHLORIDE (INT) FORUSE IN AQUATIC TOXICOLOGY: NOTES ON CHEMICAL STRUCTURE, ELECTROCHEMISTRY, ANDTOXICITY, ASTM SPEC. TECH. PUBL. 1096(AQUAT. TOXICOL. RISK ASSESS.: 13 THVOL.):222-236, 1990"
+873-76-7,EPA1,0,-1,,OCc1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+127-47-9,CCRIS,0,-1,"RETINOLAC",CC(=O)OC\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C,"FUJITA,H AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVES WITHSALMONELLA TYPHIMURIUM TA97A AND TA102. (I), KENKYU NENPO - TOKYO-TORITSU EISEIKENKYUSHO 37:447-452, 1986"
+70222-95-6,CCRIS,1,-1,,COc1cccc2C(=O)c3c(O)c4C(CC(O)(Cc4c(O)c3C(=O)c12)C(=O)CO)OC5CC(C(O)C(C)O5)N(C)C,"THOMAS,HF, MUTAGENIC AND CYTOTOXIC POTENCIES OF A SERIES OFANTHRACYCLINE DERIVATIVES AS MEASURED BY HIS+ REVERSION, 8-AZAGUANINE RESISTANCEAND DIRECT PLATING CYTOTOXICITY TESTS IN SALMONELLA TYPHIMURIUM, TERATOG.,CARCINOG., MUTAGEN. 6(3):219-235, 1986"
+107210-39-9,CCRIS,1,-1,,CN(C)CCCNc1c2ccccc2nc3c(ccc(c13)[N+](=O)[O-])N(CCOC(=O)C)CCOC(=O)C,"FERGUSON,LR, DENNY,WA AND O'ROURKE,SM, MUTAGENIC ACTIVITY OFNITRACRINE DERIVATIVES IN SALMONELLA TYPHIMURIUM: RELATIONSHIP TO DRUGPHYSICOCHEMICAL PARAMETERS, AND TO BACTERIAL UVRB AND RECA GENES AND PLASMIDPKM101, MUTAT. RES. 223(1):13-22, 1989"
+6810-26-0,EPA1,1,-1,,ONc1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-11-3,VITIC,0,-1,"BESILATCA,BESILATCO",OS(=O)(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+159092-80-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(c1)c(cc3cccc(c23)[N+](=O)[O-])[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+125369-76-8,CCRIS,1,-1,,Cc1ccc(cc1)\C(=C\C=C\c2ccccc2[N+](=O)[O-])\C#N,"AL-ARAB,MM, GHANEM,BS AND MASLAT,AO, SYNTHESIS OF 2,5-DIARYL-2,4-PENTADIENENITRILES AND THEIR SPECTRAL, FLUORESCENCE AND MUTAGENIC PROPERTIES,TOXICOL. ENVIRON. CHEM. 25(2-3):155-162, 1990"
+72492-12-7,EPA1,0,-1,"SPIZOFURO",CC(=O)c1ccc2OC3(CC3)C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97-42-7,EPA3,0,-1,,CC(=O)O[C@H]1C[C@H](CC=C1C)C(=C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+33175-34-7,CCRIS,0,-1,,ONc1ccc(Cl)c(Cl)c1,"MCMILLAN,DC, SHADDOCK,JG, HEFLICH,RH, CASCIANO,DA AND HINSON,JA,EVALUATION OF PROPANIL AND ITS N-OXIDIZED DERIVATIVES FOR GENOTOXICITY IN THESALMONELLA TYPHIMURIUM REVERSION, CHINESE HAMSTER OVARY/HYPOXANTHINE GUANINEPHOSPHORIBOSYL TRANSFERASE, AND RAT HEPATOCYTE/DNA REPAIR ASSAYS, FUNDAM. APPL.TOXICOL. 11(3): 429-439, 1988"
+110-21-4,VITIC,0,-1,,NC(=O)NNC(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+55556-93-9,EPA3,1,-1,,OC1CCN(CC1)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+83287-02-9,EPA1,1,-1,"MENISPORP",COc1ccc2c(c1)C(=O)c3c(OC)c(OC)cc4ccnc2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19622-55-0,CCRIS,1,-1,"CL-64855,CL-75805",Cn1c(ncc1[N+](=O)[O-])c2nnc(N)s2,"DE MORAIS,MA,JR, DECASSIA CAFE FERREIRA,R AND DE SOUZA FERREIRA,LC,MUTAGENIC ACTIVATION OF CL64,855, AN ANTI-TRYPANOSOMA CRUZI NITRODERIVANT, BYBACTERIAL NITROREDUCTASES, GENET. MOL. BIOL. 21(4):567-572, 1998"
+67508-86-5,EPA3,1,-1,,CN[C@H]1C[C@@H](O[C@H]2C[C@](O)(Cc3c(O)c4C(=O)c5cccc(OC)c5C(=O)c4c(O)c23)C(=O)C)O[C@@H](C)[C@@H]1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+7422-80-2,EPA1,0,-1,,CCCCN(N)CCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3333-66-2,EPA1,1,-1,,Cc1c(C)c2c(Cl)c3ccccc3nc2c4ccccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128-95-0,EPA1,1,-1,"DIAMANT14",Nc1ccc(N)c2C(=O)c3ccccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55965-84-9,EPA1,1,-1,"KATHON-CG",CN1SC(=CC1=O)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-37-2,EPA3,0,-1,,Clc1cccc(Br)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+98-82-8,VITIC,0,-1,"CUMENE",CC(C)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+79-06-1,EPA2,0,-1,"ACRYLAMID",NC(=O)C=C,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+121-17-5,VITIC,0,-1,,[O-][N+](=O)c1cc(ccc1Cl)C(F)(F)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5470-37-1,CCRIS,0,-1,,CC1NC(Cc2c1[nH]c3ccccc23)C(=O)O,"PAPAVERGOU,E, IOANNIDES,C AND CLIFFORD,MN, THE EVALUATION IN THE AMESTEST OF THE MUTAGENICITY OF TETRAHYDRO-BETA-CARBOLINE-3-CARBOXYLIC ACIDS FROMSMOKED FOODS, FOOD ADDIT. CONTAM. 9(2):183-187, 1992"
+120-75-2,EPA1,0,-1,,Cc1nc2ccccc2s1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+73870-33-4,EPA1,1,-1,,O=NN1CCSC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+121625-60-3,CCRIS,0,-1,,CC12OC1C3CCCCC3c4ccccc24,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+83053-60-5,EPA1,0,-1,,CCCCOc1cc2C(=O)CCc2c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111955-14-7,EPA1,1,-1,,OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N(N=O)c2ccc(cc2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7763-77-1,EPA3,1,-1,,Cl[C@@H]1CO1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+621-96-5,EPA1,1,-1,,Nc1ccc(\C=C\c2ccc(N)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6190-65-4,EPA1,0,-1,,CC(C)Nc1nc(N)nc(Cl)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M182,EPA1,1,-1,,CC[C@@H](C)COC(=O)\C=C\c1ccc(cc1)\N=C\c2ccc(OC)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+607-35-2,CCRIS,1,-1,,[O-][N+](=O)c1cccc2cccnc12,"DELLARCO,VL AND PRIVAL,MJ, MUTAGENICITY OF NITRO COMPOUNDS INSALMONELLA TYPHIMURIUM IN THE PRESENCE OF FLAVIN MONONUCLEOTIDE IN APREINCUBATION ASSAY, ENVIRON. MOL. MUTAGEN. 13(2):116-127, 1989"
+130536-38-8,CCRIS,0,-1,,OC1C=Cc2ncccc2C1O,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+91-62-3,VITIC,1,-1,,Cc1ccc2ncccc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+185-70-6,EPA1,0,-1,,C1CCC2(CC1)CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M224,EPA1,1,-1,,C1CC[C@H]2O[C@H]2C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-67-8,EPA1,0,-1,"MESITYLEN",Cc1cc(C)cc(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88-73-3,EPA2,1,-1,,[O-][N+](=O)c1ccccc1Cl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+2381-39-7,EPA1,1,-1,,Cc1c2ccccc2c3ccc4cccc5ccc1c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86-50-0,VITIC,1,-1,"AZINPHOSM",COP(=S)(OC)SCN1N=Nc2ccccc2C1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+25081-31-6,EPA1,1,-1,,OC(=O)CN(CC(=O)O)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117929-15-4,CCRIS,1,-1,,[O-][N+](=O)c1cc2ccc3cc(cc4ccc(c1)c2c34)[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K"
+72999-11-2,CCRIS,0,-1,,COC(=O)\C(=C\c1occc1)\[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+17433-31-7,VITIC,0,-1,"AZAPICYL",CC(=O)NNC(=O)c1ccccn1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+170660-63-6,CCRIS,1,-1,,ClC1C(=O)NC(=O)C1=C(Cl)Cl,"HADDON,WF, BINDER,RG, WONG,RY, HARDEN,LA, WILSON,RE, BENSON,M ANDSTEVENS KL, POTENT BACTERIAL MUTAGENS PRODUCED BY CHLORINATION OF SIMULATEDPOULTRY CHILLER WATER, J. AGRIC. FOOD CHEM. 44(1):256-263, 1996"
+77500-04-0,EPA1,1,-1,,Cc1cnc2ccc3c(nc(N)n3C)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+163275-67-0,CCRIS,1,-1,,Fc1cccc2ccc3ncccc3c12,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+52744-22-6,CCRIS,1,-1,,CC(=O)C1(O)CC(O)c2c(O)c3C(=O)c4c(O)cccc4C(=O)c3c(O)c2C1,"VASIL'EVA,SV, MAKHOVA,EV, EFREMENKOVA,OV AND BARTOSHEVICH,YE:GENOTOXIC AND MUTAGENIC EFFECTS OF ANTITUMOR ANTHRACYCLINES AND AGLYCONES:STUDIES WITH"
+1069-55-2,CCRIS,0,-1,"BUCRILATE",CC(C)COC(=O)C(=C)C#N,"RIETVELD,EC, GARNAAT,MA AND SEUTTER-BERLAGE,F, BACTERIAL MUTAGENICITYOF SOME METHYL 2-CYANOACRYLATES AND METHYL 2-CYANO-3-PHENYLACRYLATES, MUTAT.RES. 188(2):97-104, 1987"
+619-90-9,EPA1,1,-1,,CC(=O)OCc1ccc(cc1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M338,EPA1,0,-1,,CC(=O)O[C@H]1[C@H](O)[C@@H]2O[C@H]3C=C(C)C(=O)[C@H](O)[C@@]3(CO)[C@@]1(C)[C@@]24CO4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105427-03-0,CCRIS,1,-1,,O=C(Nc1ccccc1)C2CO2,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+523-47-7,EPA3,0,-1,,CC1=CC[C@H]2[C@H](C1)[C@H](CC=C2C)C(C)(C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M126,EPA1,1,-1,,COC(=O)[C@]12O[C@@]1(C)[C@@](C)(O)NC2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+20589-63-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c3cccc4cccc(c5cccc1c25)c34,"ANDERSON,JG, MCCALLA,DR, BRYANT,DW, MCCARRY,BE AND BROMKE,AM,METABOLIC ACTIVATION"
+446-86-6,EPA1,1,-1,"AZATHIOPR,AZATHIONA",Cn1cnc(c1Sc2[nH]cnc3ncnc23)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16665-89-7,CCRIS,0,-1,,CCc1cccc(CC)c1NC(=O)C,"TESSIER,DM AND CLARK,JM, QUANTITATIVE ASSESSMENT OF THE MUTAGENICPOTENTIAL OF ENVIRONMENTAL DEGRADATIVE PRODUCTS OF ALACHLOR, J. AGRIC. FOODCHEM. 43(9): 2504-2512, 1995"
+NOCAS_M372,EPA1,0,-1,,NC1=NC(=O)N(C=C1)[C@H]2O[C@@H](COP(=O)(O)O)[C@H](O)[C@H]2O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14953-62-9,CCRIS,1,-1,,[O-][N+](=O)c1[nH]cnc1c2ccccc2,"EHLHARDT,WJ, BEAULIEU,BB AND GOLDMAN,P, MAMMALIAN CELL TOXICITY ANDBACTERIAL MUTAGENICITY OF NITROSOIMIDAZOLES, BIOCHEM. PHARMACOL.37(13):2603-2606, 1988"
+106-27-4,EPA1,0,-1,"DR9607510",CCCC(=O)OCCC(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+493-52-7,EPA1,1,-1,"METHYLRED",CN(C)c1ccc(cc1)N=Nc2ccccc2C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+885-62-1,CCRIS,0,-1,,OS(=O)(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+110690-43-2,CCRIS,0,-1,"BOF-A2",CCOCN1C=C(F)C(=O)N(C(=O)c2cccc(c2)C(=O)Oc3nc(OC(=O)c4ccccc4)ccc3C#N)C1=O,"SHIBAHARA,T, KANEKO,E, ITOH,T, AWOGI,T, TSUSHIMOTO,G, TAKAHASHI,N,MARSHALL,RR AND KIRKLAND,DJ, MUTAGENIC AND CLASTOGENIC PROPERTIES OF3-[3-(6-BENZOYLOXY-3-CYANO-2-PYRIDYLOXYCARBONYL)BENZOYL]-1-ETHOXYMETHYL-5-FLUOROURACIL(BOF-A2), A NEW 5-FLUOROURACIL DERIVATIVE WITH ANTITUMOR ACTIVITY,J. TOXICOL. SCI. 18(3):11-19, 1993"
+3787-28-8,EPA1,1,-1,,ClC(=C(Cl)C=O)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+928-73-4,CCRIS,0,-1,,NC(=O)N\N=C\C(=O)O,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+163275-65-8,CCRIS,1,-1,,Fc1cnc2ccc3ccccc3c2c1,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+50-84-0,VITIC,0,-1,,OC(=O)c1ccc(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+304-28-9,EPA1,1,-1,,CC(=O)Nc1ccc2c(Cc3cc(NC(=O)C)ccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97747-88-1,CCRIS,0,1,,CN(C)c1ccc(cc1)C2CC3(C)C(CCC3(O)\C=C\CO)C4CCC5=CC(=O)CCC5=C24,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+95896-78-9,EPA1,1,-1,,Cc1cnc2cc(C)c3c(nc(N)n3C)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2752-54-7,CCRIS,0,-1,,CC(C)CC(NC(=O)COc1ccc(Cl)cc1Cl)C(=O)O,"RASHID,KA, BABISH,JG AND MUMMA,RO, POTENTIAL OF2,4-DICHLOROPHENOXYACETIC ACID COJUGATES AS PROMUTAGENS IN THESALMONELLA/MICROSOME MUTAGENICITY TEST, J. ENVIRON. SCI. HEALTH. PART BB19(8-9):689-701, 1984"
+95-84-1,VITIC,1,-1,,Cc1ccc(O)c(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+125973-99-1,EPA1,1,-1,,ClCC1=CC(=O)OC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63390-11-4,EPA1,1,-1,,Nc1ccc(cc1)c2cc(Cl)c(N)c(Cl)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54522-53-1,CCRIS,0,1,,COC1(CCC(C)COC2OC(CO)C(O)C(O)C2O)OC3CC4C5CC=C6CC(CCC6(C)C5CCC4(C)C3C1C)OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7OC9OC(C)C(O)C(O)C9O,"KIM,SW, SON,KH AND CHUNG,KC, MUTAGENIC EFFECT OF STEROIDAL SAPONINSFROM SMILAX CHINA RHIZOMES, YAKHAK HOECHI 33(5):285-289, 1989"
+2945-96-2,EPA1,1,-1,,COc1cc(N=Nc2ccc(N)cc2)c(C)cc1N=Nc3c(O)c4cc(N)ccc4cc3S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+62681-13-4,EPA3,1,-1,,CCOC(=O)N(CCOC(=O)C)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+3531-19-9,CCRIS,1,-1,,Nc1c(Cl)cc(cc1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+16757-83-8,EPA1,1,-1,,Cc1cc2cc3ccccc3c4ccc5cccc1c5c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94-70-2,EPA1,0,-1,,CCOc1ccccc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+33399-00-7,CCRIS,0,-1,"BROMFENVP",CCOP(=O)(OCC)O\C(=C/Br)\c1ccc(Cl)cc1Cl,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+10227-50-6,CCRIS,1,-1,"BA-34357",O=C1NCCN1c2nccs2,"HOF,H, MUTAGENIC ACTIVITIES OF NITROTHIAZOLE DERIVATIVES, ZENTRALBL.BAKTERIOL., MIKROBIOL. HYG., ABT. 1, ORIG. B 181(1-2):64-70, 1985"
+19083-00-2,CCRIS,0,1,,CC1CCC2(OC1)OC3CC4C5CC=C6CC(CCC6(C)C5CCC4(C)C3C2C)OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7OC9OC(C)C(O)C(O)C9O,"KIM,SW, SON,KH AND CHUNG,KC, MUTAGENIC EFFECT OF STEROIDAL SAPONINSFROM SMILAX CHINA RHIZOMES, YAKHAK HOECHI 33(5):285-289, 1989"
+134109-01-6,CCRIS,0,-1,,OC1C(O)c2c(Cl)c3ccccc3cc2c4ccccc14,"FU,PP, VON TUNGELN,LS, UNRUH,LE, NI,Y AND CHOU,MW, COMPARATIVEREGIOSELECTIVE AND STEREOSELECTIVE METABOLISM OF 7-CHLOROBENZ[A]ANTHRACENE AND7-BROMOBENZ[A]-ANTHRACENE BY MOUSE AND RAT LIVER MICROSOMES, CARCINOGENESIS12(3):371-378, 1991"
+91254-92-1,CCRIS,1,-1,,Oc1cc2cccc3ccc4ccc(c1c4c23)[N+](=O)[O-],"SANGAIAH,R, RAMACHANDRAN,P, ZHANG,J AND BALL,LM, SYNTHESIS ANDBIOLOGICAL ACTIVITY OF METABOLITES OF ENVIRONMENTAL NITROARENES, POLYCYCLICAROMAT. COMPD. 11(1-4):283-290, 1996"
+60877-85-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc(\C=N\c2snc3c(Cl)cc(Cl)cc23)cc1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+96839-34-8,CCRIS,0,-1,,OCc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],"SAYAMA,M, MORI,M, SHIROKAWA,T, INOUE,M, MIYAHARA,T AND KOZUKA,H,MUTAGENICITY OF 2,6-DINITROTOLUENE AND ITS METABOLITES, AND THEIR RELATEDCOMPOUNDS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 226(3):181-184, 1989"
+670-54-2,EPA1,0,-1,,N#CC(=C(C#N)C#N)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98079-51-7,CCRIS,1,-1,"LOMEFLOXA,NY-198,LOMEFLMES",CCN1C=C(C(=O)O)C(=O)c2cc(F)c(N3CCNC(C)C3)c(F)c12,"ALBERTINI,S, CHETELAT,AA, MILLER,B, MUSTER,W, PUJADAS,E, STROBEL,R ANDGOCKE,E,GENOTOXICITY OF 17 GYRASE- AND FOUR MAMMALIAN TOPOISOMERASE II-POISONSIN PROKARYOTIC"
+87-44-5,EPA3,0,-1,,C\C\1=C\CCC(=C)[C@@H]2CC(C)(C)[C@@H]2CC1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+64283-13-2,GENETOX,1,-1,,OC1C(O)c2c3ccccc3cc4ccc5cccc1c5c24,"CANCER RES 37:1757-1762,1977"
+8065-48-3,EPA3,1,-1,"DEMETON",CCOP(=S)(OCC)OCCSCC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+10114-58-6,VITIC,1,-1,,Nc1ccc(N=Nc2cccc(c2)N=Nc3ccc(N)cc3N)c(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+918-00-3,EPA1,1,-1,,CC(=O)C(Cl)(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96-69-5,VITIC,0,-1,,Cc1cc(O)c(cc1Sc2cc(c(O)cc2C)C(C)(C)C)C(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+525-03-1,EPA1,0,-1,,NC1c2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+822-36-6,VITIC,0,-1,"MEIMIDAZ4",Cc1c[nH]cn1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M398,EPA1,0,-1,,CCCC[C@@H](CC)CN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M95,EPA1,1,-1,,C([C@H]1CO1)c2ccc(Cc3ccccc3)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+58-94-6,VITIC,0,-1,"CHLOROTHI,CHLOROTNA",NS(=O)(=O)c1cc2c(NC=NS2(=O)=O)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M255,EPA1,1,-1,,O1[C@@H]2[C@H]1c3c(c4ccccc24)c5ccccc5c6ccccc36,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+79-92-5,EPA1,0,-1,,CC1(C)[C@@H]2CC[C@@H](C2)C1=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M289,EPA1,1,-1,"MENTHONE",CC(C)[C@@H]1CC[C@@H](C)CC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+36164-42-8,EPA1,1,-1,,CC(=O)Nc1ccc2cccnc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M92,EPA1,1,-1,,O[C@@H]1Cc2cc3cccc4ccc5ccc1c2c5c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M374,EPA1,0,-1,,CC(C)CC[C@@H](C)Nc1ccc(N[C@H](C)CCC(C)C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91991-18-3,CCRIS,1,-1,,CC(=O)Nc1snc2ccc(Cl)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+51-36-5,VITIC,0,-1,,OC(=O)c1cc(Cl)cc(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+126-99-8,VITIC,0,-1,,ClC(=C)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+70987-78-9,CCRIS,1,-1,,Cc1ccc(cc1)S(=O)(=O)OCC2CO2,"SINSHEIMER,JE, CHEN,R, DAS,SK, HOOBERMAN,BH, OSORIO,S AND YOU,Z, THEGENOTOXICITY OF ENANTIOMERIC ALIPHATIC EPOXIDES, MUTAT. RES. 298(3):197-206,1993"
+514-78-3,CCRIS,0,-1,"CANTHAXAN",C\C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C(=O)CCC1(C)C)\C=C\C=C(/C)\C=C\C2=C(C)C(=O)CCC2(C)C,"AZUINE,MA, GOSWAMI,UC, KAYAL,JJ AND BHIDE,SV, ANTIMUTAGENIC ANDANTICARCINOGENIC EFFECTS OF CAROTENOIDS AND DIETARY PALM OIL, NUTR. CANCER17(3):287-295, 1992"
+5679-89-0,EPA1,0,-1,,Cc1ccc(cc1[N+](=O)[O-])N=[N+]([O-])c2ccc(C)c(c2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53693-67-7,CCRIS,0,-1,,Nc1ccc(cc1)c2ccc(cc2)c3ccc(cc3)c4ccc(N)cc4,"WUEBBLES,BJY AND FELTON,JS, EVALUATION OF LASER DYE MUTAGENICITY USINGTHE AMES/ SALMONELLA MICROSOME TEST, ENVIRON. MUTAGEN. 7(4):511-522,1985"
+32784-82-0,EPA1,1,-1,"864-T,IMPROSULF",CS(=O)(=O)OCCCNCCCOS(=O)(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64099-26-9,CCRIS,1,-1,,COc1nsc2ccc(cc12)[N+](=O)[O-],"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+106-99-0,VITIC,1,-1,,C=CC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+610-39-9,CCRIS,1,-1,,Cc1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+2873-97-4,VITIC,0,-1,,CC(=O)CC(C)(C)NC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2310-17-0,EPA1,0,-1,"PHOSALONE",CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50782-69-9,CCRIS,0,-1,"VX",CCOP(=O)(C)SCCN(C(C)C)C(C)C,"GOLDMAN,M, ROSENBLATT,LS, WILSON,BW, KAWAKAMI,TG, CULBERTSON,MR,SCHREIDER,JP, REMSEN,JF AND SHIFRINE,M, TOXICITY STUDIES ON AGENT VX, GOV. REP.ANNOUNCE. INDEX (U.S.) 89(8):1-251, 1989"
+142713-64-2,CCRIS,1,-1,,COc1cc(CNC(=O)C(C)Br)ccc1O,"DOLZANI,L, TAMARO,M, LAGATOLLA,C, MONTI-BRAGADIN,C, CAVICCHIONI,G,MARCHETTI,P AND D'ANGELI,F, STRUCTURE-ACTIVITY RELATIONSHIP IN THE MUTAGENICEFFECT OF CHIRAL OR RACEMIC 2-BROMOPROPANAMIDES ON SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 19(4):311-315, 1992"
+533-74-4,EPA3,1,-1,"DAZOMET",CN1CSC(=S)N(C)C1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+5806-00-8,CCRIS,0,-1,,Cc1c(cccc1[N+](=O)[O-])N=[N+]([O-])c2cccc(c2C)[N+](=O)[O-],"SAYAMA,M, INOUE,M, MORI,MA, MARUYAMA,Y AND KOZUKA,H, BACTERIALMETABOLISM OF 2,6-DINITROTOLUENE WITH SALMONELLA TYPHIMURIUM AND MUTAGENICITY OFTHE METABOLITES OF 2,6-DINITROTOLUENE AND RELATED COMPOUNDS, XENOBIOTICA 22(6):633-640, 1992"
+115-32-2,VITIC,0,-1,"DICOFOL",OC(c1ccc(Cl)cc1)(c2ccc(Cl)cc2)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16338-97-9,EPA3,1,-1,,C=CCN(CC=C)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+459-56-3,EPA1,0,-1,,OCc1ccc(F)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2675-77-6,VITIC,1,-1,"CHLORONEB",COc1cc(Cl)c(OC)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+110-18-9,VITIC,0,-1,"DR9807509",CN(C)CCN(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4430-25-5,EPA1,0,-1,,Oc1c(Br)cc(cc1Br)C2(OS(=O)(=O)c3c(Br)c(Br)c(Br)c(Br)c23)c4cc(Br)c(O)c(Br)c4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4801-39-2,VITIC,1,-1,,NCC(=O)Nc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+93673-37-1,EPA1,1,-1,,O[C@H]1C=Cc2c(ccc3c4C=Cc5cccc(cc23)c45)[C@@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+626-17-5,EPA1,0,-1,,N#Cc1cccc(c1)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-84-8,VITIC,0,-1,,O(c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6146-52-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2[nH]ccc2c1,"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+66789-78-4,CCRIS,0,-1,,CC(C)CC(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C(=O)O,"RASHID,KA, BABISH,JG AND MUMMA,RO, TESTING OF 2,4,5-T-AMINO ACIDCONJUGATES FOR MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM STRAINS, MUTAT. RES.136(3):217- 221, 1984"
+61841-39-2,EPA1,1,-1,,Nc1ccc(cc1)c2ccc(N)c(c2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91-08-7,VITIC,1,-1,,Cc1c(cccc1N=C=O)N=C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24463-15-8,EPA1,1,-1,,OCc1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86803-19-2,EPA1,1,-1,,ClCc1cccc2cc3ccc4cccc5ccc(c12)c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56-55-3,VITIC,1,-1,"BENZANTHR",c1ccc2cc3c(ccc4ccccc34)cc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+159092-75-8,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c(cc3ccccc3c12)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+120404-27-5,CCRIS,0,-1,,OCCNc1ccc(cc1)N=Nc2ccc(cc2)N(CCO)CCO,"SHAHIN,MM, EVALUATION OF THE MUTAGENICITY OF AZO DYES IN SALMONELLATYPHIMURIUM: A STUDY OF STRUCTURE-ACTIVITY RELATIONSHIPS, MUTAGENESIS 4(2):115-125, 1989"
+1197-01-9,VITIC,0,-1,,Cc1ccc(cc1)C(C)(C)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7269-58-1,CCRIS,1,-1,,Nc1nc(NO)c2ncn(C3OC(CO)C(O)C3O)c2n1,"MCCARTNEY,M, MCCOY,EC, ROSENKRANZ,HS AND GINER-SOROLLA,A, CARCINOGENICN-HYDROXYLAMINOPURINE DERIVATIVES DO NOT ACT AS BASE ANALOG MUTAGENS INSALMONELLA TYPHIMURIUM, MUTAT. RES. 144(4):231-237, 1985"
+138-42-1,CCRIS,0,-1,,OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+41372-08-1,EPA2,0,-1,,CC(N)(Cc1ccc(O)c(O)c1)C(=O)O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+6959-47-3,VITIC,1,-1,,ClCc1ccccn1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+93673-33-7,CCRIS,1,-1,,O1C2C1c3c4c2cccc4cc5ccc6ccccc6c35,"BARTCZAK,AW, SANGAIAH,R, BALL,LM, WARREN,SH AND GOLD,A, SYNTHESIS ANDBACTERIAL MUTAGENICITY OF THE CYCLOPENTA OXIDES OF THE FOUR CYCLOPENTA-FUSEDISOMERS OF BENZANTHRACENE, MUTAGENESIS 2(2):101-105, 1987"
+122-57-6,EPA3,1,-1,,CC(=O)\C=C/c1ccccc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+146795-33-7,CCRIS,1,-1,,CCc1ccccc1NC(=O)c2csc(c2)[N+](=O)[O-],"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+1929-82-4,VITIC,1,-1,,Clc1cccc(n1)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+461-58-5,EPA1,1,-1,"DR9701836",NC(=N)NC#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-01-0,VITIC,0,-1,"DEANOL,DEANOLHCL",CN(C)CCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100690-33-3,CCRIS,1,-1,,CCCCCOc1ccc(cc1)N=O,"GUPTA,RL, DEY,DK AND JUNEJA,TR, STRUCTURE-MUTAGENICITY RELATIONSHIPSWITHIN A SERIES OF PARA-ALKOXYNITROSOBENZENES, TOXICOL. LETT. 28(2-3):125-132,1985"
+39179-91-4,EPA1,1,-1,,Cc1ccc(NCCCl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-48-7,VITIC,0,-1,"CRESOL",Cc1ccccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111712-49-3,CCRIS,0,-1,,BrCC(Br)CCOP(=O)(OCCC(Br)CBr)OCCC(Br)CBr,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+132297-89-3,CCRIS,1,-1,,COc1ccc2nc3c(cc2c1)c4cccc5cccc3c45,"RAY,JK AND KAR,GK, ASSESSMENT OF THE MUTAGENIC ACTIVITY OF SOMEACENAPHTHO(1,2-B)QUINOLINES, CANCER LETT. 71(1-3):1-3, 1993"
+545-06-2,EPA3,1,-1,,ClC(Cl)(Cl)C#N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+481-39-0,EPA1,1,-1,"JUGLONE",Oc1cccc2C(=O)C=CC(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6623-66-1,CCRIS,1,-1,,[O-][N+](=O)c1ccc2OC(=O)c3ccccc3c2c1,"WATANABE,T, KAJI,H, TAKASHIMA,M, KASAI,T, LEWTAS,J AND HIRAYAMA,T,METABOLIC ACTIVATION"
+150445-98-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(c1)nc(\C=N\OCc3ccccc3[N+](=O)[O-])n2Cc4ccc(Cl)cc4Cl,"HRELIA,P, MOROTTI,M, VIGAGNI,F, BURNELLI,S, GARUTI,L, SABATINO,P ANDCANTELLI-FORTI,G, SYNTHESIS OF A SERIES OF 5-NITRO-(BENZIMIDAZOLES AND INDOLES)AS NOVEL ANTIMYCOTICS AND EVALUATION AS GENOTOXINS IN THE AMES TEST, MUTAGENESIS8(3):183-188, 1993"
+21490-63-1,EPA1,1,-1,,C[C@@H]1O[C@@H]1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+148-82-3,EPA3,1,-1,"MEDPHALAN",N[C@H](Cc1ccc(cc1)N(CCCl)CCCl)C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M190,EPA1,1,-1,,C[C@@H](O)c1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51-21-8,EPA2,0,-1,"FLUOROURA,FURACILNA,FLUORTROM",Oc1ncc(F)c(O)n1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+3343-64-4,CCRIS,0,-1,,CCCCSCCC(N)C(=O)O,"ALLEN,JS AND PANFILI,J, AMES SALMONELLA/MAMMALIAN-MICROSOME TESTING OFPEPTIDES AND PEPTIDE SYNTHESIS REAGENTS, MUTAT. RES. 170(1-2):23-29,1986"
+82-28-0,VITIC,1,-1,,Cc1ccc2C(=O)c3ccccc3C(=O)c2c1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+483-84-1,VITIC,1,-1,,Oc1c(cc(c2ccc(cc12)S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+59804-37-4,EPA1,0,-1,,CN1C(=C(O)c2sccc2S1(=O)=O)C(=O)Nc3ccccn3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3520-42-1,EPA1,1,-1,,CCN(CC)c1ccc2C(=C3C=CC(=[N+](CC)CC)C=C3Oc2c1)c4ccc(cc4S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142438-72-0,CCRIS,0,-1,,CCC1(OC1(C(=O)N)C(=O)OC)C(C)O,"KIM,IS, AND BJELDANES,LF, SYNTHESES AND MUTAGENICITY OF FUSARIN C RINGANALOGS, J. AGRIC. FOOD CHEM. 40(9):1625-1630, 1992"
+80-08-0,VITIC,0,-1,"DAPSONE",Nc1ccc(cc1)S(=O)(=O)c2ccc(N)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6633-40-5,CCRIS,1,-1,,Oc1ccc2c(Cc3cc(ccc23)[N+](=O)[O-])c1,"CUI,XS, BERGMAN,J AND MOLLER,L, PRENEOPLASTIC LESIONS, DNA ADDUCTFORMATION AND MUTAGENICITY OF 5-,7- AND 9-HYDROXY-2-NITROFLUORENE, METABOLITESOF THE AIR POLLUTANT 2-NITROFLUORENE, MUTAT. RES. 369(3-4):147-156,1996"
+6428-31-5,EPA1,1,-1,,Nc1ccc(N=Nc2ccc(cc2)N=Nc3c(N)c4c(O)c(N=Nc5ccc(cc5)N=Nc6ccc(N)cc6N)c(cc4cc3S(=O)(=O)O)S(=O)(=O)O)c(N)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86674-50-2,CCRIS,1,-1,,OC1C(O)c2ccc(c3ccc4cccc1c4c23)[N+](=O)[O-],"EL-BAYOUMY,K AND HECHT,SS, MUTAGENICITY OF K-REGION DERIVATIVES OF1-NITROPYRENE, REMARKABLE ACTIVITY OF 1- AND3-NITRO-5H-PHENANTHRO[4,5-BCD]PYRAN-5-ONE, MUTAT. RES. 170(1-2):31-40,1986"
+98033-26-2,CCRIS,1,-1,,Cc1nc2c(ccc3ccc4ccc(O)cc4c23)[nH]1,"FRIESEN,M, O'NEILL,IK, MALAVEILLE,C, GARREN,L, HAUTEFEUILLE,A ANDBARTSCH,H, SUBSTITUTED HYDROXYPHENANTHRENES IN OPIUM PYROLYSATES IMPLICATED INOESOPHAGEAL CANCER"
+833-50-1,EPA1,0,-1,,o1c(nc2ccccc12)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139259-64-6,CCRIS,1,-1,,CC(C)ON(OC(=O)C)C(=O)c1ccccc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+127502-69-6,CCRIS,1,-1,,CC(C)c1cc(ccc1N)c2ccccc2,"GLENDE,C SCHMITT,H ERDINGER,L ENGELHARDT,G AND BOCHE,G, TRANSFORMATIONOF MUTAGENIC AROMATIC AMINES INTO NON-MUTAGENIC SPECIES BY ALKYL SUBSTITUENTS.PART I. ALKYLATION ORTHO TO THE AMINO FUNCTION. MUTAT. RES. 498(1-2):19-37,2001"
+94500-54-6,EPA1,1,-1,,ClCc1cc2cccc3ccc4cc5ccccc5c1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+113698-22-9,EPA1,1,-1,,COC1=CC(=O)c2c(nc(C)c3c4ccccc4[nH]c23)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86439-49-8,EPA1,1,-1,,Nc1cc2[nH]c3ccccc3c2cc1[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-08-1,VITIC,0,-1,,CCS,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+353-59-3,VITIC,0,-1,,FC(F)(Cl)Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+622-79-7,CCRIS,1,-1,,N#N=NCc1ccccc1,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+1484-12-4,EPA1,1,-1,,Cn1c2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13284-42-9,EPA1,0,-1,,CC\C=C/C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134998-76-8,EPA1,1,-1,,O=Nc1ccc2ccc3c4CCCCc4cc5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+83-79-4,EPA3,0,-1,,COc1cc2OC[C@@H]3Oc4c5C[C@H](Oc5ccc4C(=O)[C@H]3c2cc1OC)C(=C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+135295-00-0,EPA1,1,-1,,OCc1ccc2c3cccc4cccc(c2c1)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1119-40-0,VITIC,0,-1,"GLUTARDME",COC(=O)CCCC(=O)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+618-39-3,EPA1,0,-1,"BENZAMIDI",NC(=N)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3546-41-6,EPA1,1,-1,"PYRVINIUM,PYRVINIUE",CN(C)c1ccc2c(ccc(\C=C\c3cc(C)n(c3C)c4ccccc4)[n+]2C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128-08-5,EPA1,1,-1,"BRSUCCINI",BrN1C(=O)CCC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+184582-67-0,CCRIS,0,-1,,CN1c2ccc3OCCOCCOCCOCCOCCOCCOc4ccc1c(c4)C(=S)c2c3,"TANAKA,M, CSURI,K, MUCSI,I, MOLNAR,J, GALY,JP AND BARBE,J,MUTAGENICITY OF SYNTHETIC ACRIDINONES AND THIOACRIDINES IN DIRECT AMESSALMONELLA MUTAGENICITY ASSAY, HETEROCYCL. COMMUN. 2(5):463-467, 1996"
+7433-46-7,EPA1,0,-1,,CNC(=O)NO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3113-72-2,VITIC,1,-1,,Cc1ccc(c(c1)C(=O)O)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M114,EPA1,1,-1,,[O-][N+](=O)c1ccc(O[C@H]2CO2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-35-7,VITIC,0,-1,"TAURINE",NCCS(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+88-21-1,EPA1,1,-1,"ORTHANILA",Nc1ccccc1S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19866-62-7,CCRIS,0,-1,,[O-][n+]1cc2ncccc2cn1,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+15299-08-8,EPA1,1,-1,,Cc1ccc2c(c1)c3cc4ccccc4c5cc6ccccc6c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2498-75-1,EPA1,1,-1,,Cc1ccc2c(ccc3cc4ccccc4cc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57-14-7,EPA1,1,-1,"DMHYDRA11",CN(C)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+192-87-0,CCRIS,0,-1,,C1c2ccccc2c3c1ccc4ccc5ccccc5c34,"MARROCCHI,A, MINUTI,L, MOROZZI,G, PAMPANELLA,L AND TATICCHI,A,SYNTHESIS AND MUTAGENICITY OF SOME CYCLO[C]PHENANTHRENES ANDINDENO[C]PHENANTHRENES, CARCINOGENESIS 17(9):2009-2012, 1996"
+119-65-3,EPA1,0,-1,"DR9606478",c1ccc2cnccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22994-85-0,CCRIS,1,-1,"BENZNIDAZ",[O-][N+](=O)c1nccn1CC(=O)NCc2ccccc2,"FERREIRA,RCC AND FERREIRA,LCS, MUTAGENICITY OF NIFURTIMOX ANDBENZNIDAZOLE IN THE SALMONELLA/MICROSOME ASSAY, BRAZ. J. MED. BIOL. RES.19(1):19-25, 1986"
+141-38-8,CCRIS,0,-1,,CCCCCCCCC1OC1CCCCCCCC(=O)OCC(CC)CCCC,"CANTER,DA, ZEIGER,E, HAWORTH,S, LAWLOR,T, MORTELMANS,K AND SPECK,W,COMPARATIVE MUTAGENICITY OF ALIPHATIC EPOXIDES IN SALMONELLA, MUTAT. RES.172(2):105-138, 1986"
+121-47-1,VITIC,0,-1,"METANILAT",Nc1cccc(c1)S(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+75476-80-1,CCRIS,1,-1,,[O-][N+](=O)c1ccc2C=CCc2c1,"VANCE,WA AND LEVIN,DE, STRUCTURAL FEATURES OF NITROAROMATICS THATDETERMINE MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM, ENVIRON. MUTAGEN.6(6):797-811, 1984"
+18523-47-2,CCRIS,1,-1,,OC(=O)CCN=N#N,"LAVELLE,JM AND MANGOLD,JB, STRUCTURE-ACTIVITY RELATIONSHIPS OF THEAZIDE METABOLITE, AZIDOALANINE, IN S. TYPHIMURIUM, MUTAT. RES. 177(1):27-33,1987"
+10169-02-5,EPA3,0,-1,,Oc1ccc2ccccc2c1N=Nc3ccc(c4ccc(cc4S(=O)(=O)O)N=Nc5c(O)ccc6ccccc56)c(c3)S(=O)(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+70951-83-6,CCRIS,1,-1,,OC1C(O)c2c(ccc3c2ccc4ccccc34)C5OC15,"GLATT,H, WAMELING,C, ELSBERG,S, THOMAS,H, MARQUARDT,H, HEWER,A,PHILLIPS,DH, OESCH,F AND SEIDEL,A, GENOTOXICITY CHARACTERISTICS OF REVERSEDIOL-EPOXIDES OF CHRYSENE, CARCINOGENESIS 14(1):11-19, 1993"
+81542-82-7,CCRIS,0,-1,,CC(C)(C)NCC(O)COc1ccc(O)cc1C2CCCC2,"HUSSAIN,SS, AL-DAKAN,AA, ABOUL-ENEIN,HY AND HANNAN,MA, DNA STRANDBREAKS AND MUTATIONS CAUSED BY PENBUTOLOL, A BETA BLOCKER, MUTAT. RES.204(4):675-682, 1988"
+25103-58-6,EPA3,0,-1,,CCCCC(S)(CCC)CCCC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+98-08-8,VITIC,0,-1,,FC(F)(F)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7779-16-0,VITIC,0,-1,,Nc1ccccc1C(=O)OC2CCCCC2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95389-75-6,CCRIS,1,-1,,Cn1c(N=N#N)nc2ccc3ccccc3c12,"WILD,D, AND DIRR,A, MUTAGENIC NITRENES/NITRENIUM IONS FROMAZIDO-IMIDAZOARENES AND THEIR STRUCTURE-ACTIVITY RELATIONSHIP, MUTAGENESIS4(6):446-52, 1989"
+14691-88-4,EPA1,1,-1,,CC1(C)CC(N)CC(C)(C)N1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6066-82-6,EPA1,0,-1,"HOSUCCINI",ON1C(=O)CCC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+141-97-9,EPA1,0,-1,"ETACETOAC",CCOC(=O)CC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+124617-86-3,CCRIS,1,-1,,CC(=O)ON(OCc1ccccc1)C(=O)c2ccccc2,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+61691-83-6,EPA3,1,-1,,COc1ccc([C@H](OC(=O)C)C=C)c2ccccc12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+183249-37-8,EPA1,1,-1,,C1C=Cc2c1ccc3ccc4ccccc4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97851-13-3,CCRIS,0,-1,,Oc1ccc(cc1[N+](=O)[O-])c2cccc(c2O)[N+](=O)[O-],"SUZUKI,J, SATO,T AND SUZUKI,S, HYDROXYNITROBIPHENYLS PRODUCED BYPHOTOCHEMICAL REACTION OF BIPHENYL IN AQUEOUS NITRATE SOLUTION AND THEIRMUTAGENICITIES, CHEM. PHARM. BULL. 33(6):2507-2515, 1985"
+92-67-1,VITIC,1,-1,"BIPHENAMP",Nc1ccc(cc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+159714-85-9,CCRIS,1,-1,,CCc1c2C3OC3c4ccccc4c2cc5ccccc15,"GLATT,H, ABU-SHQARA,E, MARTINE,U, BAIDOSSI,W, HARVEY,RG AND BLUM,J,K-REGION OXIDES AND IMINES DERIVED FROM ALKYLATED BENZ[A]ANTHRACENE CONGENERS:SYNTHESIS, STABILITY IN AQUEOUS MEDIA AND MUTAGENICITY, MUTAGENESIS 9(2):83-92,1994"
+124817-06-7,CCRIS,1,-1,,OC(CN=N#N)c1ccccc1,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+75-26-3,EPA1,1,-1,,CC(C)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1594-56-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc(SC#N)c(c1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+443-48-1,EPA2,1,-1,"FLAP,METRONIDA,METRONHCL",Cc1ncc([N+](=O)[O-])n1CCO,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+57564-91-7,CCRIS,1,-1,,NC(CCC(=O)N(CC(=O)O)C(=O)C(N)CSN=O)C(=O)O,"CARTER,MH AND JOSEPHY,PD, MUTAGENICITY OF THIONITRITES IN THE AMESTEST. THE BIOLOGICAL ACTIVITY OF THIYL FREE RADICALS,BIOCHEM. PHARMACOL.35(21):3847-3851, 1986"
+603-54-3,VITIC,0,-1,,NC(=O)N(c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+607-30-7,EPA1,1,-1,,ONc1cccc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105467-73-0,CCRIS,1,-1,,OC1C2OC2c3c(ccc4nc5ccc6ccccc6c5cc34)C1O,"BONIN,AM, ROSARIO,CA, DUKE,CC, BAKER,RSU, RYAN,AJ AND HOLDER,GM, THEMUTAGENICITY OF DIBENZ[A,J]ACRIDINE, SOME METABOLITES AND OTHER DERIVATIVES INBACTERIA AND MAMMALIAN CELLS, CARCINOGENESIS 10(6):1079-1084, 1989"
+NOCAS_M199,EPA1,1,-1,,C=CC(=O)OC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+114882-46-1,EPA1,1,-1,,O=Nc1ccc2ccc3cc4ccccc4c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+41122-70-7,VITIC,0,-1,,CCCCCCc1ccc(cc1)c2ccc(cc2)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+80830-42-8,CCRIS,0,-1,"RENTIAPRI",OC(=O)C1CSC(N1C(=O)CCS)c2ccccc2O,"MORIKAWA,K, YAMAUCHI,H AND ISO,T, MUTAGENICITY TESTS ON(2R,4R)-2-(O-HYDROXYPHENYL)-3-(3-MERCAPTOPROPIONYL)-4-THIAZOLIDINECARBOXYLICACID (SA 446), IYAKUHIN KENKYU 17(1):43-50, 1986"
+147-47-7,VITIC,0,-1,,CC1=CC(C)(C)Nc2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+544-63-8,VITIC,0,-1,"MYRISTATE,DR0019529",CCCCCCCCCCCCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M465,EPA1,0,-1,,C[C@@H]1OCCc2cc3c(cc12)C(C)(C)[C@@H](C)C3(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63412-06-6,EPA2,1,-1,,CN(N=O)C(=O)c1ccccc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+67508-85-4,EPA3,1,-1,,CC[C@]1(O)C[C@H](O[C@@H]2C[C@H](N)[C@@H](O)[C@H](C)O2)c3c(O)c4C(=O)c5c(O)ccc(O)c5C(=O)c4cc3[C@H]1C(=O)OC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+103978-08-1,CCRIS,1,-1,"CP-67804",CCN1C=C(C(=O)O)C(=O)c2cc(F)c(c(F)c12)c3ccc(O)cc3,"ALBERTINI,S, CHETELAT,AA, MILLER,B, MUSTER,W, PUJADAS,E, STROBEL,R ANDGOCKE,E,GENOTOXICITY OF 17 GYRASE- AND FOUR MAMMALIAN TOPOISOMERASE II-POISONSIN PROKARYOTIC"
+123016-76-2,CCRIS,1,-1,,NC(=O)N(c1ccccc1)c2ccc(cc2)C(=O)O,"EL-TERRAS,A, BRAUN,R, STENZ,E AND SCHUSTER,G, MUTAGENICITY ASSAY WITHSALMONELLA TYPHIMURIUM REVEALING BIOTRANSFORMATION OF ANTIPHYTOVIRAL SUBSTANCESBY CELL-FREE PLANT EXTRACT, ZENTRALBL. MIKROBIOL. 144(3):197-202,1989"
+23355-64-8,CCRIS,1,-1,,OCCN(CCO)c1ccc(N=Nc2c(Cl)cc(cc2Cl)[N+](=O)[O-])c(Cl)c1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+88741-68-8,EPA1,1,-1,,COc1ccc2C(=O)c3c(OC)c(OC)cc4ccnc(c2c1)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3351-28-8,EPA3,1,-1,,Cc1cccc2c1ccc3c4ccccc4ccc23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+115609-71-7,EPA1,1,-1,,Cc1cnc2c(n1)c(C)cc3c2nc(N)n3C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+578-67-6,EPA1,1,-1,,Oc1cccc2ncccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24027-84-7,GENETOX,1,-1,,Oc1cc2cccc3ccc4c5ccccc5cc1c4c23,"PROC NATL ACAD SCI USA 72:5135-5139,1975"
+131862-22-1,CCRIS,1,-1,,CN(C)CCNC(=O)c1cccc2cc(oc12)c3ccccc3,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+102791-33-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2OC(=O)c3cccc4ccc1c2c34,"EL-BAYOUMY,K AND HECHT,SS, MUTAGENICITY OF K-REGION DERIVATIVES OF1-NITROPYRENE, REMARKABLE ACTIVITY OF 1- AND3-NITRO-5H-PHENANTHRO[4,5-BCD]PYRAN-5-ONE, MUTAT. RES. 170(1-2):31-40,1986"
+113393-59-2,EPA1,1,-1,"DETERROL",CC(=C)c1ccc(C)c2ccc(CO)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M550,EPA1,0,-1,,CC(C)[C@@H]1CC[C@@H](C)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84-11-7,EPA1,0,-1,,O=C1C(=O)c2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+180913-77-3,EPA1,1,-1,,CC(=O)Nc1ccc2C(=O)C(=O)c3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+345667-01-8,CCRIS,1,-1,,CC(C)(C)c1cc(ccc1NO)c2ccccc2,"HAACHK,T ERDINGER,L AND BOCHE,G, MUTAGENICITY IN SALMONELLATYPHIMURIUM TA98 AND TA100 OF NITROSO AND RESPECTIVE HYDROXYLAMINE COMPOUNDS,MUTAT. RES. 491(1-2):183-193, 2001"
+873-69-8,CCRIS,0,-1,,O\N=C\c1ccccn1,"WATANABE,K, SAKAMOTO,K AND SASAKI,T, COMPARISONS ON CHEMICALLY-INDUCEDMUTAGENICITY AMONG FOUR BACTERIAL STRAINS, SALMONELLA TYPHIMURIUM TA102 ANDTA2638, AND ESCHERICHIA COLI WP2/PKM101 AND WP2 UVRA/PKM101: COLLABORATIVE STUDY1, MUTAT. RES. 361(2-3):143-155, 1996"
+312304-89-5,CCRIS,1,-1,,CC(=O)OCN(CCCCCl)N=O,"ISHIKAWA,S SAITOH,N AND MOCHIZUKI,M, SYNTHESIS AND PROPERTIES OF NOVELBIFUNCTIONAL NITROSAMINES WITH OMEGA-CHLOROALKYL GROUPS, CHEM. PHARM. BULL.48(10):1500-1503, 2000"
+55446-27-0,EPA3,1,-1,,COc1cc2O[C@H]3OC=C[C@H]3c2c4OC(=O)C5=C([C@@H](O)C[C@@H]5O)c14,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+63-25-2,EPA1,1,-1,"CARBARIL",CNC(=O)Oc1cccc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155379-82-1,CCRIS,1,-1,,Cc1cc(N)cc(c1N)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+100757-60-6,EPA1,0,-1,,ClCc1ccc2ccc3cc4ccccc4c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51325-35-0,EPA2,1,-1,,CC(=O)Nc1nc(NC(=O)C)nc(n1)c2oc(cc2)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+79-27-6,VITIC,0,-1,,BrC(Br)C(Br)Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4176-53-8,EPA1,1,-1,,Nc1cccc2c1ccc3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139495-76-4,CCRIS,1,-1,,CN1CCN(CC1)c2cc3N(C4CC4)C5=CC(=O)NC(=O)N5c3cc2F,"ALBERTINI,S, CHETELAT,AA, MILLER,B, MUSTER,W, PUJADAS,E, STROBEL,R ANDGOCKE,E,GENOTOXICITY OF 17 GYRASE- AND FOUR MAMMALIAN TOPOISOMERASE II-POISONSIN PROKARYOTIC"
+108-88-3,VITIC,0,-1,"TOLUENE",Cc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+56525-92-9,CCRIS,0,-1,,COc1nncc2ncccc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+2757-90-6,EPA1,1,-1,,N[C@@H](CCC(=O)NNc1ccc(CO)cc1)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132742-02-0,CCRIS,1,-1,,[O-][N+](=O)c1c2C=CCCc2c3ccc4cccc5ccc1c3c45,"FU,PP, JUNG,H, VON TUNGELN,LS AND HEFLICH,RH, MUTAGENICITY OFMONONITRODIHYDROBENZO[A]PYRENES, MUTAT. RES. 245(4):277-285, 1990"
+6983-79-5,VITIC,1,-1,"ME-BIXIN",COC(=O)\C=C\C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C(=O)OC)/C)\C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111380-08-6,EPA1,1,-1,,Cn1cnc(c2ccccc2)c1N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+218-08-6,EPA1,1,-1,,c1ccc2c(c1)ccc3c4cccnc4ccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+74006-72-7,CCRIS,0,-1,,O=C1CC2SCC=CN12,"WAKISAKA,Y, IZUMI,A AND NISHIMOTO,Y, MUTAGENICITY TEST OF 7432-S, ANORAL CEPHAM ANTIBIOTICS(I)-REVERSION TEST ON BACTERIA, CHEMOTHERAPY 37(SUPPL.1): 1073-1078, 1989"
+3268-49-3,EPA1,0,-1,,CSCCC=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92339-11-2,CCRIS,0,-1,"IODIXANOL",CC(=O)N(CC(O)CN(C(=O)C)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c2c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c2I,"IGARASHI,M, NAKAYAMA,S, JONES,E AND SHIMADA,H, MUTAGENCITY STUDIES OFIODIXANOL, A NEW NONIONIC ISOTONIC CONTRAST MEDIUM, J. TOXICOL. SCI. 20(SUPPL.1):125-131, 1995"
+153654-33-2,CCRIS,1,-1,,Oc1cc2[nH]c3ccccc3c2cc1[N+](=O)[O-],"HOLLOWAY,TC AND BALL,LM, SYNTHESIS AND MUTAGENICITY OF A SERIES OFNITRATED CARBAZOLES AND HYDROXYCARBAZOLES, MUTAGENESIS 8(4):321-327,1993"
+97461-43-3,CCRIS,1,-1,,COC(=O)\C(=C\c1oc(cc1)[N+](=O)[O-])\C,"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+82-39-3,EPA1,1,-1,,COc1cccc2C(=O)c3ccccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+129-73-7,EPA1,0,-1,,CN(C)c1ccc(cc1)C(c2ccccc2)c3ccc(cc3)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+143-16-8,VITIC,0,-1,,CCCCCCNCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1195-79-5,EPA3,0,-1,,C[C@]12CC[C@H](C1)C(C)(C)C2=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+683-51-2,EPA1,1,-1,,ClC(=C)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+602-60-8,VITIC,1,-1,,[O-][N+](=O)c1c2ccccc2cc3ccccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+25168-15-4,EPA3,0,-1,,CC(C)CCCCCOC(=O)Cc1cc(Cl)c(Cl)cc1Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+24519-27-5,CCRIS,0,-1,,N#CC1=C(SCCS1)C#N,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+5221-17-0,CCRIS,1,-1,,BrCC(Br)C=O,"GORDON,WP, SOEDERLUND,EJ, HOLME,JA, NELSON,SD, IYER,L, RIVEDAL,E ANDDYBING, E,THE GENOTOXICITY OF 2-BROMOACROLEIN AND 2,3-DIBROMOPROPANAL,CARCINOGENESIS 6(5):705-709, 1985"
+121-88-0,EPA2,1,-1,,Nc1ccc(cc1O)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+620-02-0,EPA1,0,-1,,Cc1oc(C=O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67809-14-7,EPA1,1,-1,,CN(C=O)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+149-32-6,CCRIS,0,-1,,OCC(O)C(O)CO,"KAWAMURA,Y, SAITO,Y, IMAMURA,M AND MODDERMAN,JP, MUTAGENICITY STUDIESON ERYTHRITOL IN BACTERIAL REVERSION ASSAY SYSTEMS AND IN CHINESE HAMSTERFIBROBLAST CELLS, REGUL. TOXICOL. PHARMACOL. 24(2, PT. 2):S261-S263,1996"
+136-35-6,VITIC,1,-1,,N(N=Nc1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16110-09-1,EPA1,0,-1,,Clc1ccc(Cl)nc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2154-67-8,EPA1,0,-1,,CC1(C)C=C(C(=O)O)C(C)(C)N1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16596-38-6,EPA1,1,-1,,CC(C)CN(N)CC(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+122349-91-1,EPA1,1,-1,,Cc1cc(C)c2cc(C)c(N)cc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+579527-03-0,VITIC,1,-1,,Clc1cc(Cl)cc(c1)N2C(=O)N3C[C@H](C[C@@]3(Cc4ccc(cc4)C#N)C2=O)N=[N+]=[N-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+89-58-7,VITIC,1,-1,,Cc1ccc(C)c(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+363-03-1,EPA1,0,-1,,O=C1C=CC(=O)C(=C1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139259-93-1,CCRIS,1,-1,,CC(=O)ON(OCc1ccc(cc1)C(C)(C)C)C(=O)c2ccccc2,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+58139-53-0,EPA3,1,-1,,CC(=O)Nc1nc(cs1)c2cc(cs2)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1582-09-8,EPA2,1,-1,"DR0026195",CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+88-14-2,EPA1,0,-1,"FUROATE-2",OC(=O)c1occc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2278-22-0,CCRIS,1,-1,,CC(=O)OO[N+](=O)[O-],"KLEINDIENST,TE, SHEPSON,PB, EDNEY,EO AND CLAXTON,LD, PEROXYACETYLNITRATE: MEASUREMENT OF ITS MUTAGENIC ACTIVITY USING THE SALMONELLA/MAMMALIANMICROSOME REVERSION ASSAY, MUTAT. RES. 157(2-3):123-128, 1985"
+2646-17-5,VITIC,1,-1,,Cc1ccccc1N=Nc2c(O)ccc3ccccc23,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+982-57-0,EPA3,0,-1,,O[C@H]([C@H](COC(=O)CCC(=O)O)NC(=O)C(Cl)Cl)c1ccc(cc1)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+108-64-5,EPA1,0,-1,,CCOC(=O)CC(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64099-28-1,EPA1,1,-1,,COc1nsc2ccc(N)cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70-25-7,EPA2,1,-1,"MNNG",CN(N=O)C(=N)N[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+NOCAS_M495,EPA1,0,-1,,[O-][N+](=O)c1ccc(cc1)[C@@H]2O[C@H]2C(=O)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63038-82-4,EPA3,1,-1,,O[C@H]1[C@H](O)c2cc3ccc4ccccc4c3cc2[C@@H]5O[C@H]15,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+160543-18-0,CCRIS,0,-1,,Cc1c2C3OC3c4ccccc4c2nc5ccc(CO)cc15,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+113600-17-2,EPA1,1,-1,,Fc1cccc2cc3c(cc12)c4cccc5cccc3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+116208-67-4,EPA1,1,-1,,Fc1ccc2c3cc4ccccc4cc3c5cccc1c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M200,EPA1,1,-1,,BrC[C@@H](Br)COC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1591-56-6,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2ccc(NC(=O)C)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-57-8,VITIC,0,-1,,Oc1ccccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+947-73-9,EPA1,1,-1,,Nc1cc2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+159092-77-0,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c1c(cc3cccc(c23)[N+](=O)[O-])[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+1116-54-7,VITIC,1,-1,,OCCN(CCO)N=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+146795-44-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc(NC(=O)c2csc(c2)[N+](=O)[O-])cc1,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+2439-35-2,VITIC,0,-1,,CN(C)CCOC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+334-22-5,EPA1,1,-1,"NORCHLORM",ClCCNCCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112368-26-0,CCRIS,0,-1,,OC(=O)CCC(=O)Nc1cc(Cl)c(Cl)c(Cl)c1,"RASHID,KA, ARJMAND,M, SANDERMANN,H AND MUMMA,RO, MUTAGENICITY OFCHLOROANILINE/LIGNIN METABOLITES IN THE SALMONELLA/MICROSOME ASSAY, J. ENVIRON.SCI. HEALTH, PART B B22(6):721-729, 1987"
+70403-80-4,CCRIS,0,-1,,COc1ccc2cc3N(C)CCc4cc(OC)c(OC)c(c2c1)c34,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+163275-68-1,CCRIS,1,-1,,Fc1ccc(F)c2c1ccc3ncccc23,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+1728-95-6,EPA1,1,-1,,COc1ccc(cc1)c2nc(c3ccccc3)c([nH]2)c4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+158729-24-9,CCRIS,0,-1,,Clc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+646-06-0,EPA1,0,-1,,C1COCO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+8004-87-3,CCRIS,1,-1,,CNc1ccc(cc1)C(=C2C=CC(=[N+](C)C)C=C2)c3ccc(cc3)N(C)C,"YAMAGUCHI,T, ADSORPTION OF CARCINOGENIC AND/OR MUTAGENIC PIGMENTS ONDNA-BINDING SEPHAROSE, AGRIC. BIOL. CHEM. 52(3):845-847, 1988"
+134170-56-2,CCRIS,0,-1,,COC(=O)c1oc(N(OC(=O)C)C(=O)C)c(c2ccccc2)c1c3ccccc3,"SWAMINATHAN,S, HATCHER,JF, YAMAMOTO,K, TANAKA,A, ICHIKAWA,M ANDBRYAN,GT, MUTAGENICITY OF N- AND O-ACETYL DERIVATIVES OF METHYL 3,4-DIPHENYL-5-HYDROXYLAMINO-2-FUROATE AND N-HYDROXY-4-AMINOBIPHENYL IN SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 17(2):84-92, 1991"
+96-11-7,EPA1,1,-1,,BrCC(Br)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3096-52-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c3ccccc3C(=O)c2c1,"WATANABE,T, KAJI,H, TAKASHIMA,M, KASAI,T, LEWTAS,J AND HIRAYAMA,T,METABOLIC ACTIVATION"
+463-40-1,CCRIS,0,-1,,CC\C=C\C\C=C\C\C=C\CCCCCCCC(=O)O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y85"
+531-82-8,EPA2,1,-1,"ACTOFURAN",CC(=O)Nc1nc(cs1)c2oc(cc2)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+32433-28-6,CCRIS,0,-1,,CC(=O)Nc1ccnc2ccccc12,"JORDAN,VC, LABABIDI,MK AND LANGAN-FAHEY,S, SUPPRESSION OF MOUSEMAMMARY TUMORIGENESIS BY LONG-TERM TAMOXIFEN THERAPY, J. NATL. CANCER INST.83:492-496, 1991"
+13687-09-7,CCRIS,1,-1,"BISAZIR",CNP(=S)(N1CC1)N2CC2,"DEVI,KR AND REDDY,PP, MUTAGENICITY STUDIES OF AZIRIDINES USING HOSTMEDIATED ASSAY, MED. SCI. RES. 15(19):1175-1176, 1987"
+105708-74-5,CCRIS,1,-1,,BrCc1c2cccc3ccc4cc5cccc6ccc1c(c56)c4c23,"ROGAN,EG, CAVALIERI,EL, WALKER,BA, BALASUBRAMANIAN,R, WISLOCKI,PG,ROTH,RW AND SAUGIER,RK, MUTAGENICITY OF BENZYLIC ACETATES, SULFATES AND BROMIDESOF POLYCYCLIC AROMATIC HYDROCARBONS, CHEM.-BIOL. INTERACT. 58(3):253-275,1986"
+305-03-3,VITIC,1,-1,"CHLORAMBU",OC(=O)CCCc1ccc(cc1)N(CCCl)CCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+28124-29-0,EPA1,1,-1,,Nc1ccc2nc3c(N)cccc3nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+147318-81-8,CCRIS,0,-1,,CSCC(NC(=O)COc1cccc2cnccc12)C(=O)NC(Cc3ccccc3)C(O)C(=O)N4CSCC4C(=O)NC(C)(C)C,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y96"
+51938-13-7,EPA3,1,-1,,CCCCN(CCCO)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+96-91-3,VITIC,1,-1,,Nc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+557-91-5,EPA1,0,-1,,CC(Br)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4823-47-6,VITIC,1,-1,,BrCCOC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+133831-62-6,EPA1,1,-1,,[O-][N+](=O)c1ccccc1SS\C(=C(/Cl)\C(F)(F)F)\Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-63-4,VITIC,0,-1,"BUTAND114",OCCCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+146177-58-4,EPA1,1,-1,,Cc1cc2c(nc(N)n2C)c3nc(C)c(C)nc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2524-03-0,CCRIS,0,-1,,COP(=S)(Cl)OC,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+103369-09-1,CCRIS,0,-1,,CC(=O)OCNC(=O)c1ccc(Cl)cc1,"OVERTON,M, THREADGILL,MD, CHIPMAN,JK, GESCHER,A AND HICKMAN,JA, THEFORMATION AND METABOLISM OF N-HYDROXYMETHYL COMPOUNDS. IX.N-(ACETOXYMETHYL)-4-CHLOROBENZAMIDE, AN ELECTROPHILE BUT NOT A MUTAGEN INSALMONELLA TYPHIMURIUM, BIOCHEM. PHARMACOL. 35(23):4161-4165, 1986"
+106636-48-0,EPA1,1,-1,,[O-][N+](=O)c1ccc(cc1)c2nc3SCCn3c2[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+148-53-8,CCRIS,0,-1,,COc1cccc(C=O)c1O,"MIKULASOVA,M AND BOHOVICOVA,I, GENOTOXIC EFFECT OF VANILLINDERIVATIVES, BIOLOGIA (BRATISLAVA) 55(3):229-234, 2000"
+6639-36-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2sc3ccccc3c2c1,"WATANABE,T, KAJI,H, TAKASHIMA,M, KASAI,T, LEWTAS,J AND HIRAYAMA,T,METABOLIC ACTIVATION"
+41340-36-7,EPA1,0,-1,,CCc1cccc2c(CCO)c[nH]c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+33973-15-8,CCRIS,1,-1,,CC12OOC1(C)c3ccccc3O2,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+134-20-3,VITIC,0,-1,"MEANTHRAN",COC(=O)c1ccccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+81340-58-1,EPA1,1,-1,,[O-][N+](=O)c1ccc2c3ccccc3c4cccc5ccc1c2c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+555-16-8,CCRIS,1,-1,"DR9510450",[O-][N+](=O)c1ccc(C=O)cc1,"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+80-30-8,VITIC,0,-1,,Cc1ccc(cc1)S(=O)(=O)NC2CCCCC2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+75-11-6,EPA1,0,-1,,ICI,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139495-80-0,CCRIS,1,-1,,CN1CCN(CC1)c2cc3N(C4CC4)C5=CC(=O)N(O)C(=O)N5c3cc2F,"ALBERTINI,S, CHETELAT,AA, MILLER,B, MUSTER,W, PUJADAS,E, STROBEL,R ANDGOCKE,E,GENOTOXICITY OF 17 GYRASE- AND FOUR MAMMALIAN TOPOISOMERASE II-POISONSIN PROKARYOTIC"
+108283-49-4,CCRIS,1,-1,,CC(C)(C)OC(=O)NC(CN=N#N)C(=O)O,"LAVELLE,JM AND MANGOLD,JB, STRUCTURE-ACTIVITY RELATIONSHIPS OF THEAZIDE METABOLITE, AZIDOALANINE, IN S. TYPHIMURIUM, MUTAT. RES. 177(1):27-33,1987"
+NOCAS_M383,EPA1,0,-1,,ClC(Cl)[C@H](c1ccc(Cl)cc1)c2ccccc2Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132059-53-1,CCRIS,1,-1,,OC1OC(=O)C(=C1C(Br)Br)Br,"RAMOS,I LLOVERAS,M SOLANS,X HUICI,A AND MESSEGUER,A, BROMINATEDANALOGS OF 3-CHLORO-4-(DICHLORO-METHYL)-5-HYDROXY-2(5H)-FURANONE: PREPARATIONSOF 3-CHLORO-4-(BROMOCHLOROMETHYL)-5-HYDROXY-2(5H)-FURANONE AND MUTAGENICITYSTUDIES, ENVIRON. TOXICOL. CHEM. 19(11):2631-2636, 2000"
+5623-11-0,EPA1,1,-1,,CC(=O)Nc1cccc(N)c1C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23696-28-8,CCRIS,1,-1,"OLAQUINDO",Cc1c(C(=O)NCCO)[n+]([O-])c2ccccc2[n+]1[O-],"NUNOSHIBA,T AND NISHIOKA,H, GENOTOXICITY OF QUINOXALINE 1,4-DIOXIDEDERIVATIVES IN ESCHERICHIA COLI AND SALMONELLA TYPHIMURIUM, MUTAT. RES.217(3):203-209, 1989"
+84-24-2,EPA1,0,-1,,CCCCCC(=O)Cc1cc(O)cc2Oc3c(CCCCC)c(C(=O)O)c(O)cc3OC(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4170-30-3,EPA3,1,-1,,C\C=C/C=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+99520-57-7,CCRIS,0,-1,,OC1C(O)c2ccc3cccc4cc5c6ccccc6C1=c5c2c34,"RICE,JE, COLEMAN,DT, HOSTED,TJ JR, LAVOIE,EJ, MCCAUSTLAND,DJ ANDWILEY,JC JR, IDENTIFICATION OF MUTAGENIC METABOLITES OF INDENO[1,2,3-CD]PYRENEFORMED IN VITRO WITH RAT LIVER ENZYMES, CANCER RES. 45(11, PT. 1):5421-5425,1985"
+331-39-5,EPA2,0,-1,"CAFFEATE",OC(=O)\C=C\c1ccc(O)c(O)c1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+191861-15-1,CCRIS,0,-1,,Fc1cnc2cccc(F)c2c1,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+142382-12-5,CCRIS,1,-1,,OC(=O)c1ccc(CCC(=O)CCC#N)cc1,"TATSUMI,K, KITAMURA,S, KATO,M AND HIRAOKA,K, METABOLISM OF SODIUMNIFURSTYRENATE, A VETERINARY ANTIMICROBIAL NITROFURAN IN ANIMALS AND FISH, DRUGMETAB. DISPOS. 20(2):226-233, 1992"
+109-69-3,VITIC,0,-1,"BUTYLCHLO",CCCCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+109-84-2,EPA2,1,-1,,NNCCO,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+2478-38-8,EPA1,0,-1,"ACETOSYRI",COc1cc(cc(OC)c1O)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+159394-72-6,EPA1,1,-1,,[O-][N+](=O)c1ccc(\C=C\c2cccc(c2)C#N)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M131,EPA1,1,-1,,ClC(Cl)(Cl)C[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-05-4,VITIC,0,-1,"A-105,CORVIC,DR9607341",CC(=O)OC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+585-86-4,EPA1,0,-1,"MALTITOL",OC[C@@H](O)[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16310-69-3,EPA3,1,-1,,C1CCc2c(C1)ccc3cc4CCc5ccccc5c4cc23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+570-24-1,VITIC,1,-1,,Cc1cccc(c1N)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+51775-36-1,CCRIS,0,-1,,ClCC1(CCl)C2CC(Cl)(Cl)C1(CCl)C(Cl)C2Cl,"STEINBERG,M, KINOSHITA,FK AND BALLANTYNE,M,MUTAGENICITY STUDIES WITHTOXAPHENE CONGENERS, ORGANOHALOGEN COMPD. 35(ANALYSIS, CHLORINATED BORNANES,CHIRAL CONTAMINANTS, POLYMER ADDITIVES AND MONOMERS):243-246, 1998"
+107-51-7,CCRIS,0,-1,,C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+56316-37-1,EPA3,1,-1,,CCCN(CCCC(=O)O)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+98600-98-7,CCRIS,1,-1,,Cc1cc2C(O)C(O)C=Cc2c3cc4ccccc4cc13,"MUSHTAQ,M, FU,PP, MILLER,DW AND YANG,SK, METABOLISM OF6-METHYLBENZ[A]ANTHRACENE BY RAT LIVER MICROSOMES AND MUTAGENICITY OFMETABOLITES, CANCER RES. 45(9): 4006-4014, 1985"
+71-36-3,VITIC,0,-1,"BUTANOL,DR9703386",CCCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+17376-04-4,VITIC,0,-1,,ICCc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+57117-24-5,EPA3,1,-1,,CS\C(=N/OC(=O)N(C)N=O)\C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+106532-75-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccc(Cl)c(Cl)c3)\c2c1)C(=O)c4ccc(Cl)c(Cl)c4,"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+29082-74-4,EPA1,0,-1,,ClC(=C(Cl)c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68279-00-5,CCRIS,0,-1,,CCCCCCCCSCN1CN(C)C=C1,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+55400-88-9,CCRIS,1,-1,,O1C2C1c3cccc4C5OC5c6cccc2c6c34,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+77-79-2,VITIC,0,-1,,O=S1(=O)CC=CC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111-66-0,VITIC,0,-1,,CCCCCCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1436-34-6,CCRIS,0,-1,,CCCCC1CO1,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+52-24-4,VITIC,1,-1,"THIOTEPA",S=P(N1CC1)(N2CC2)N3CC3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+344-07-0,EPA1,0,-1,,Fc1c(F)c(F)c(Cl)c(F)c1F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10159-46-3,CCRIS,1,-1,,CNP(=O)(N(C)C)N(C)C,"SARRIF,AM, KRAHN,DF, DONOVAN,SM AND O'NEIL,RM, EVALUATION OFHEXAMETHYLPHOSPHORAMIDE FOR GENE MUTATIONS IN SALMONELLA TYPHIMURIUM USING PLATEINCORPORATION, PREINCUBATION, AND SUSPENSION ASSAYS, MUTAT. RES.380(1-2):167-177, 1997"
+36355-01-8,EPA1,0,-1,,Brc1cc(Br)c(c(Br)c1)c2c(Br)cc(Br)cc2Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64724-48-7,CCRIS,0,-1,,CC(=O)Nc1ccc2c(Cc3ccccc23)c1OC(=O)C,"CREBELLI,R AND IORIO,MA, CHEMISTRY AND IN VITRO MUTAGENICITY OF2-AMINOFLUORENE DERIVATIVES, CHEM.-BIOL. INTERACT. 54(1):71-83, 1985"
+144280-50-2,EPA1,1,-1,,[O-][N+](=O)c1ccc2oc3ccc(cc3c2c1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-14-2,VITIC,0,-1,,ClCC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+135-23-9,VITIC,0,-1,"METHAPYRI,METHAPFUM,METHPYHCL",CN(C)CCN(Cc1cccs1)c2ccccn2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+117-80-6,EPA1,1,-1,"DICHLONE",ClC1=C(Cl)C(=O)c2ccccc2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+954-46-1,EPA1,1,-1,,[O-][N+](=O)c1cc2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+476-60-8,EPA1,1,-1,,Oc1ccc(O)c2c(O)c3ccccc3c(O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+66-81-9,EPA3,0,-1,,C[C@H]1C[C@@H](C)C(=O)[C@H](C1)[C@@H](O)CC2CC(=O)NC(=O)C2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+121-92-6,VITIC,1,-1,"NITROBENM",OC(=O)c1cccc(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+121-50-6,EPA1,0,-1,,Nc1cc(ccc1Cl)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+130536-45-7,CCRIS,0,-1,,C1Cc2ncccc2C3OC13,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+105-76-0,EPA1,0,-1,,CCCCOC(=O)\C=C/C(=O)OCCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38252-74-3,EPA3,1,-1,,CCCCN(CCCC(=O)O)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+115084-48-5,CCRIS,0,-1,,Nc1ccc(Cc2cc(O)c(N)c(Cl)c2)cc1Cl,"KUSLIKIS,BI, TROSKO,JE AND BRASELTON,WE, JR., MUTAGENICITY AND EFFECTON GAP- JUNCTIONAL INTERCELLULAR COMMUNICATION OF4,4'-METHYLENEBIS(2-CHLOROANILINE) AND ITS OXIDIZED METABOLITES, MUTAGENESIS6(1):19-24, 1991"
+185-75-1,CCRIS,1,-1,,C1COCC2(C1)CO2,"SINSHEIMER,JE, CHAKRABORTY,PK, MESSERLY,EA AND GADDAMIDI,V,MUTAGENICITY OF OXASPIRO COMPOUNDS WITH SALMONELLA, MUTAT. RES. 224(2):171-5,1989"
+62641-70-7,EPA3,1,-1,,Cc1c2ccccc2cc3c4C=C[C@@H](O)[C@H](O)c4ccc13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+70883-13-5,CCRIS,1,-1,,CCSc1cc(Cc2ccc(N)c(SCC)c2)ccc1N,"TAKAGI,Y, ENDOH,O, GOTO,S, KOHZAKI,K AND MATSUSHITA,H, MUTAGENICITY OFDIAMINODIPHENYLMETHANE AND RELATED COMPOUNDS, KANKYO KAGAKU 5(4):841-845,1995"
+594-70-7,CCRIS,0,-1,,CC(C)(C)[N+](=O)[O-],"CONAWAY,CC, HUSSAIN,NS, WAY,BM AND FIALA,ES, EVALUATION OF SECONDARYNITROALKANES, THEIR NITRONATES, PRIMARY NITROALKANES, NITROCARBINOLS, AND OTHERALIPHATIC NITRO COMPOUNDS IN THE AMES SALMONELLA ASSAY, MUTAT. RES.261(3):197-207, 1991"
+821-95-4,EPA1,0,-1,,CCCCCCCCCC=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M408,EPA1,0,-1,,CCC[C@@H](C)C[C@H](OC(=O)C[C@@H](CC(=O)O)C(=O)O)[C@H](C[C@H](C)C[C@H](O)CCCC[C@H](O)C[C@H](O)[C@H](C)N)OC(=O)C[C@@H](CC(=O)O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+606-37-1,VITIC,1,-1,,[O-][N+](=O)c1cc(c2ccccc2c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+29761-21-5,VITIC,0,-1,,CC(C)CCCCCCCOP(=O)(Oc1ccccc1)Oc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1522-92-5,VITIC,1,-1,,OCC(CBr)(CBr)CBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+519-23-3,EPA1,1,-1,"ELLIPTICI",Cc1c2ccncc2c(C)c3c4ccccc4[nH]c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+162022-85-7,CCRIS,0,-1,,[O-][n+]1cc2ccncc2cn1,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+1516-21-8,EPA1,1,-1,,COc1ccc(cc1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+333-41-5,VITIC,0,-1,"DIAZINON",CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111-69-3,VITIC,0,-1,,N#CCCCCC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1825-21-4,VITIC,1,-1,,COc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+115084-47-4,CCRIS,1,-1,,Nc1ccc(Cc2ccc(NO)c(Cl)c2)cc1Cl,"KUSLIKIS,BI, TROSKO,JE AND BRASELTON,WE, JR., MUTAGENICITY AND EFFECTON GAP- JUNCTIONAL INTERCELLULAR COMMUNICATION OF4,4'-METHYLENEBIS(2-CHLOROANILINE) AND ITS OXIDIZED METABOLITES, MUTAGENESIS6(1):19-24, 1991"
+119-27-7,EPA1,1,-1,,COc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105052-39-9,EPA1,1,-1,"R-7779",COc1ccc2C=C(Oc3cccc1c23)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56-57-5,CCRIS,1,-1,"NITROQUOX",[O-][N+](=O)c1cc[n+]([O-])c2ccccc12,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+39515-41-8,CCRIS,0,-1,"FENPROPAT",CC1(C)C(C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2)C1(C)C,"RYU,JC, KIM,KR, KIM,HJ, RYU,EK, LEE,SY, JUNG,SO, YOUN,JY, KIM,MH ANDKWON,OS, EVALUATION OF THE GENETIC TOXICITY OF SYNTHETIC CHEMICALS (II), APYRETHROID INSECTICIDE, FENPROPATHRIN, ARCH. PHARMACOL. RES. 19(4):251-257,1996"
+NOCAS_M155,EPA1,1,-1,,CC(C)OC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-49-8,EPA1,0,-1,,Cc1ccccc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M510,EPA1,0,-1,,O[C@@H]1OCC=C2OC(=O)C=C12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+104-49-4,VITIC,0,-1,,O=C=Nc1ccc(cc1)N=C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+732-11-6,EPA1,1,-1,"PHOSMET",COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-73-2,VITIC,0,-1,,CCCCOCCOCCOCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100-69-6,EPA1,0,-1,,C=Cc1ccccn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2867-47-2,CCRIS,1,-1,"EUDRAGITE,DMAEMETHA",CN(C)CCOC(=O)C(=C)C,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+106532-65-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)CCCCl)\c2c1)C(=O)CCCCl,"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+128753-87-7,CCRIS,1,-1,,COc1cccc2OC3(C)OOC3(C)c12,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+156243-39-9,EPA1,1,-1,,Cc1cnc2cc3nc(N)n(C)c3c(C)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98090-89-2,CCRIS,1,-1,,Cc1ccc2Cc3cccc4ccc1c2c34,"RICE,JE, MAKOWSKI,GS, HOSTED,TJ,JR AND LAVOIE,EJ, METHYLENE-BRIDGEDBAY REGION CHRYSENE AND PHENANTHRENE DERIVATIVES AND THEIR KETO ANALOGS:MUTAGENICITY IN SALMONELLA TYPHIMURIUM AND TUMOR INITIATING ACTIVITY ON MOUSESKIN, CANCER LETT. 27(2):199-206, 1985"
+146177-60-8,EPA1,1,-1,,Cc1cnc2c(C)c(C)c3c(nc(N)n3C)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63041-76-9,EPA1,1,-1,,Cc1ccc2c(c1)cc3ccc4cccc5ccc2c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131862-15-2,CCRIS,1,-1,,CN(C)CCNC(=O)c1cccc2c3ccccc3cnc12,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+135577-57-0,CCRIS,1,-1,,Cn1c(N=N#N)nc2ncc(cc12)c3ccccc3,"WILD,D, WATKINS,BE AND VANDERLAAN,M, AZIDO-AND NITRO-PHIP, RELATIVESOF THE HETEROCYCLIC ARYLAMINE AND FOOD MUTAGEN PHIP - MECHANISM OF THEIRMUTAGENICITY IN SALMONELLA, CARCINOGENESIS 12(6):1091-1096, 1991"
+146795-36-0,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2cccc(F)c2,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+7166-19-0,EPA3,1,-1,,[O-][N+](=O)\C(=C\c1ccccc1)\Br,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+75-29-6,EPA3,1,-1,"ISOPROPCL",CC(C)Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+64-17-5,VITIC,0,-1,"ETHANOL",CCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6628-97-3,EPA1,1,-1,,O=C1C=C(Nc2ccccc2)C(=O)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M420,EPA1,0,-1,,C[C@@H](CC(=O)O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M278,EPA1,1,-1,,OC[C@@H]1SCCN1N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5422-34-4,CCRIS,1,-1,"HOETLACTN",CC(O)C(=O)NCCO,"SATORY,E, CSUKAS,I AND RACZ,I, DATA ON THE MUTAGENIC AND CELL TOXICEXAMINATIONS OF DIFFERENT PHARMACEUTICAL ADDITIVES II , ACTA PHARM. HUNG. 56(3)97-108, 1986"
+1705-85-7,EPA3,1,-1,,Cc1cc2c3ccccc3ccc2c4ccccc14,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+66789-82-0,CCRIS,0,-1,,OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)COc3cc(Cl)c(Cl)cc3Cl,"RASHID,KA, BABISH,JG AND MUMMA,RO, TESTING OF 2,4,5-T-AMINO ACIDCONJUGATES FOR MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM STRAINS, MUTAT. RES.136(3):217- 221, 1984"
+99346-47-1,CCRIS,1,-1,,OC1C=Cc2c(cc3ccc4c(O)ccc5ccc2c3c45)C1O,"GLATT,H, SEIDEL,A, SCHRODE,R, RIBEIRO,O, KIRKBY,CA, HIROM,PC ANDOESCH,F, 3-HYDROXYBENZO[A]PYRENE-7,8-DIHYDRODIOL COMPARED WITHBENZO[A]PYRENE-7,8- DIHYDRODIOL AND 3-HYDROXYBENZO[A]PYRENE WITH REGARD TOMUTAGENICITY, POLYNUCL. AROMAT. HYDROCARBONS: MEAS., MEANS, METAB., 11TH INT.SYMP. (1987) PP. 357-368, 1991"
+146177-59-5,EPA1,1,-1,,Cc1c(C)c2c(nc(N)n2C)c3nccnc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-21-7,VITIC,1,-1,,CC(=O)OCCOCCOCCOC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78-63-7,VITIC,0,-1,,CC(C)(C)OOC(C)(C)CCC(C)(C)OOC(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98-29-3,VITIC,0,-1,"TBUPYROC4",CC(C)(C)c1ccc(O)c(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+91-58-7,VITIC,0,-1,,Clc1ccc2ccccc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+123-66-0,EPA1,0,-1,"ETCAPROAT",CCCCCC(=O)OCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78-83-1,VITIC,0,-1,"ISOBUTALC",CC(C)CO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+23815-63-6,CCRIS,1,-1,,NC(CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O,"KERKLAAN,PRM, BOUTER,S, TE KOPPELE,JM, VERMEULEN,NPE, VAN BLADEREN,PJAND MOHN,GR,MUTAGENICITY OF HALOGENATED AND OTHER SUBSTITUTED DINITROBENZENES INSALMONELLA TYPHIMURIUM TA100 AND DERIVATIVES DEFICIENT IN GLUTATHIONE(TA100/GSH-) AND NITROREDUCTASE (TA100NR), MUTAT. RES. 176(2):171-180,1987"
+7151-65-7,EPA1,1,-1,,CC(=O)N(Cl)c1ccc2c(Cc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90147-19-6,CCRIS,1,-1,,CCCCOC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+119260-67-2,CCRIS,0,-1,,Nc1ccc(Cc2ccc(N=O)c(Cl)c2)cc1Cl,"KUSLIKIS,BI, TROSKO,JE AND BRASELTON,WE, JR., MUTAGENICITY AND EFFECTON GAP- JUNCTIONAL INTERCELLULAR COMMUNICATION OF4,4'-METHYLENEBIS(2-CHLOROANILINE) AND ITS OXIDIZED METABOLITES, MUTAGENESIS6(1):19-24, 1991"
+192-65-4,EPA1,1,-1,,c1ccc2c(c1)cc3c4ccccc4c5cccc6ccc2c3c56,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+333-27-7,EPA1,1,-1,,COS(=O)(=O)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54-85-3,EPA1,1,-1,"ISONIAZID,ISONIAZME",NNC(=O)c1ccncc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+83053-57-0,EPA1,0,-1,,CCOc1cc2C(=O)CCc2c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55256-58-1,CCRIS,1,-1,,COc1c(Cl)ccc2Oc3cc4OC5OC=CC5c4c(OC)c3C(=O)c12,"KFIR,R, JOHANNSEN,E AND VLEGGAAR,R, MUTAGENIC ACTIVITY OF AUSTOCYSTINS- SECONDARY METABOLITES OF ASPERGILLUS USTUS,BULL. ENVIRON. CONTAM. TOXICOL.37(5):643-650, 1986"
+218-21-3,CCRIS,1,-1,,c1cnc2c(c1)ccc3c4cccnc4ccc23,"YAMADA,K HAKURA,A KATO,TA, MIZUTANI,T AND SAEKI,KI,NITROGEN-SUBSTITUTION EFFECTS ON THE MUTAGENICITY AND CYTOCHROME P450ISOFORM-SELECTIVITY OF CHRYSENE ANALOGS, MUTAT. RES. 586(1):87-95,2005"
+2519-30-4,EPA1,0,-1,,CC(=O)Nc1ccc(c2cc(c(N=Nc3ccc(N=Nc4ccc(cc4)S(=O)(=O)O)c5ccc(cc35)S(=O)(=O)O)c(O)c12)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M575,EPA1,0,-1,,C[C@@H](S)C(=O)NCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+161221-84-7,CCRIS,0,-1,,COc1cc(C)cc2c(OC(=O)C)c(cc(OC(=O)C)c12)c3c(C)cc4c(OC(=O)C)ccc(OC(=O)C)c4c3OC,"HAZRA,B, PAL,S, SHETTY,TK AND BHATTACHARYA,RK, AN INVESTIGATION ON THEMUTAGENIC ACTIVITY OF DIOSPYRIN AND ITS SEMISYNTHETIC DERIVATIVES, MED. SCI.RES. 23(7):449-450, 1995"
+3740-52-1,CCRIS,1,-1,,OC(=O)Cc1ccccc1[N+](=O)[O-],"SHIMIZU,M AND YANO,E, MUTAGENICITY OF MONO-NITROBENZENE DERIVATIVES INTHE AMES TEST AND REC ASSAY, MUTAT. RES. 170(1-2):11-22, 1986"
+126-27-2,VITIC,0,-1,"MUCAINE,OXETACAIN,OXETACHCL",CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M11,EPA1,1,-1,,CCN(CC)CCC[C@@H](C)Nc1c2ccc(Cl)cc2nc3ccc(OC)cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+66-27-3,VITIC,1,-1,"MEMESILAT",COS(=O)(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2429-82-5,EPA1,1,-1,,Nc1ccc2cc(c(N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5ccc(O)c(c5)C(=O)O)c(O)c2c1)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+20268-51-3,CCRIS,0,-1,,[O-][N+](=O)c1c2ccccc2cc3c1ccc4ccccc34,"FU,PP, CHOU,MW, MILLER,DW, WHITE,GL, HEFLICH,RH AND BELAND,FA, THEORIENTATION OF THE NITRO SUBSTITUENT PREDICTS THE DIRECT-ACTING BACTERIALMUTAGENICITY OF NITRATED POLYCYCLIC AROMATIC HYDROCARBONS, MUTAT. RES.143(3):173-181, 1985"
+16090-02-1,CCRIS,0,-1,"TINOPAAMS",OS(=O)(=O)c1cc(Nc2nc(Nc3ccccc3)nc(n2)N4CCOCC4)ccc1\C=C\c5ccc(Nc6nc(Nc7ccccc7)nc(n6)N8CCOCC8)cc5S(=O)(=O)O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+2837-89-0,CCRIS,0,-1,,FC(Cl)C(F)(F)F,"MALLEY,LA, FRAME,SR, ELLIOTT,GS, BENTLY,KS, BROCK,WJ, TROCHIMOWICZ,HJAND RUSCH,GM, CHRONIC TOXICITY, ONCOGENICITY, AND MUTAGENICITY STUDIES WITHCHLOROTETRAFLUOROETHANE (HCFC-124), DRUG CHEM. TOXICOL. 21(4):417-477,1998"
+139-96-8,VITIC,0,-1,"CARBANTLS,LAUSUCUAM,LAUSULTRI,LAURYLSUF,LAURYLSMG,LAURYLSUL",CCCCCCCCCCCCOS(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+89-82-7,VITIC,0,-1,"PULEGONE",C[C@@H]1CCC(=C(C)C)C(=O)C1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+128753-86-6,CCRIS,1,-1,,CC(=O)c1cccc2c1OC3(C)OOC23C,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+78533-30-9,EPA1,1,-1,,BrCc1c2ccccc2cc3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-20-0,VITIC,1,-1,"CHLOROACL",ClCC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2589-58-4,CCRIS,0,-1,,CCC(C)Nc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+153954-29-1,EPA1,1,-1,,Cc1cnc2cc(CO)c3c(nc(N)n3C)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+622-51-5,VITIC,0,-1,,Cc1ccc(NC(=O)N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60197-68-4,EPA3,1,-1,,CC(=O)OC[C@H]1O[C@@H](Oc2cccc3C(=O)c4cccc(O)c4C(=O)c23)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+68267-99-2,CCRIS,1,-1,,CN(C(=O)CCCl)c1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+2275-23-2,EPA3,1,-1,,CNC(=O)[C@@H](C)SCCSP(=O)(OC)OC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+32451-61-9,CCRIS,0,-1,,NC(=O)Nc1cccc2cccnc12,"SMITH,CJ, HANSCH,C AND MORTON,MJ, QSAR TREATMENT OF MULTIPLETOXICITIES: THE MUTAGENICITY AND CYTOTOXICITY OF QUINOLINES, MUTAT. RES.379(2):167-175, 1997"
+189-55-9,EPA1,1,-1,,c1ccc2c(c1)cc3ccc4cc5ccccc5c6ccc2c3c46,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+130933-91-4,CCRIS,1,-1,,OC1C2OC2c3c(ccc4c5C=Cc6cccc(cc34)c56)C1O,"SANGAIAH,R, GOLD,A, NEWCOMB,KO AND BALL,LM,SYNTHESIS AND BIOLOGICALACTIVITY OF BAY-REGION METABOLITES OF A CYCLOPENTA-FUSED POLYCYCLIC AROMATICHYDROCARBON: BENZ[J]ACEANTHRYLENE, J. MED. CHEM. 34(2):546-549, 1991"
+96-47-9,CCRIS,0,-1,,CC1CCCO1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y00"
+99523-59-8,CCRIS,1,-1,,Cc1ccc2nsc(NC(=O)C(Cl)(Cl)Cl)c2c1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+57-13-6,VITIC,0,-1,"CARBAMPER,UREA",NC(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100-02-7,VITIC,0,-1,"NITROPHOP",Oc1ccc(cc1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M183,EPA1,1,-1,,C[C@H]1CC(=O)O1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59-51-8,EPA2,0,-1,"CUMETHION,FEMETHIOA,MN-MET,MANPRO,METHIONIR",CSCCC(N)C(=O)O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+102791-32-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3cccc4C(=O)C(=O)c1c2c34,"EL-BAYOUMY,K AND HECHT,SS, MUTAGENICITY OF K-REGION DERIVATIVES OF1-NITROPYRENE, REMARKABLE ACTIVITY OF 1- AND3-NITRO-5H-PHENANTHRO[4,5-BCD]PYRAN-5-ONE, MUTAT. RES. 170(1-2):31-40,1986"
+115044-41-2,CCRIS,1,-1,,Cc1cnc2ccc3c(nc(NO)n3C)c2n1,"NEGISHI,C, YAMAIZUMI,Z AND SATO,S, NUCLEIC ACID BINDING ANDMUTAGENICITY OF ACTIVE METABOLITES OF2-AMINO-3,8-DIMETHYLIMIDAZO[4,5-F]QUINOXALINE, MUTAT. RES. 210(1):127-134,1989"
+112309-62-3,CCRIS,1,-1,,OC(=O)C=C(C(Cl)Cl)C(Cl)Cl,"FRANZEN,R, GOTO,S, TANABE,K AND MORITA,M, GENOTOXIC ACTIVITY OFCHLORINATED BUTENOIC ACIDS IN SALMONELLA TYPHIMURIUM STRAINS TA98, TA100 ANDTA104, MUTAT. RES. 417(1):31-37, 1998"
+24096-53-5,EPA1,0,-1,,Clc1cc(Cl)cc(c1)N2C(=O)CCC2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6931-54-0,CCRIS,0,-1,,CC1(C)C2CCC3(CO3)C1C2,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+6548-29-4,EPA1,0,-1,,Nc1c(N=Nc2ccc(cc2Cl)c3ccc(N=Nc4c(N)c(cc5cc(ccc45)S(=O)(=O)O)S(=O)(=O)O)c(Cl)c3)c6ccc(cc6cc1S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+194479-79-3,CCRIS,1,-1,,Nc1c2ccccc2nc3ccc(I)cc13,"TOMOSAKA,H, OMATA,S, HASEGAWA,E AND ANZAI,K, THE EFFECTS OFSUBSTITUENTS INTRODUCED INTO 9-AMINOACRIDINE ON FRAMESHIFT MUTAGENICITY AND DNABINDING AFFINITY, BIOSCI., BIOTECHNOL., BIOCHEM. 61(7):1121-1125,1997"
+60391-92-6,EPA2,0,-1,,NC(=O)N(CC(=O)O)N=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+57074-51-8,EPA3,1,-1,,C[C@H]1C[C@H]2OC(=O)C(=C)[C@H]2C[C@@]3(C)[C@H](O)O[C@H](O)C[C@H]13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+646-14-0,VITIC,0,-1,,CCCCCC[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+615-53-2,EPA3,1,-1,,CCOC(=O)N(C)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+220168-39-8,CCRIS,1,-1,,O=C(ON(OCc1ccccc1)C(=O)c2ccccc2)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+55936-76-0,EPA3,1,-1,,COC(=O)c1ccc(cc1)N=Nc2ccc(cc2)N(C)OC(=O)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+128753-96-8,CCRIS,1,-1,,CC(=O)OCC12OOC1(C)c3ccccc3O2,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+88321-09-9,CCRIS,0,-1,,CCOC(=O)C1OC1C(=O)NC(CC(C)C)C(=O)NCCC(C)C,"YASUI,H, GOTO,H, SUZUKI,H, SAKAI,S, TAKAMURA,T AND NAKANE,S,TOXICOLOGICAL STUDIES ON ETHYL(+)-(2S,3S)-3-[(S)-3-METHYL-1-(3-METHYLBUTYLCARBAMOYL]-2- OXIRANECARBOXYLATE(EST). IX. MUTAGENICITY OF EST, IYAKUHIN KENKYU 17(4):815-825, 1986"
+1671-82-5,CCRIS,1,-1,,Cn1ccnc1[N+](=O)[O-],"NOSS,MB, PANICUCCI,R, MCCLELLAND,RA AND RAUTH,AM, PREPARATION,TOXICITY AND MUTAGENICITY OF 1-METHYL-2-NITROSOIMIDAZOLE. A TOXIC2-NITROIMIDAZOLE REDUCTION PRODUCT, BIOCHEM. PHARMACOL. 37(13):2585-2593,1988"
+364-74-9,VITIC,1,-1,,[O-][N+](=O)c1cc(F)ccc1F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+149127-58-2,CCRIS,1,-1,,CCCN=NC(C)(C)OO,"MOCHIZUKI,M, MICHIHIRO,K, SHIOMI,K, ITOH,K, TANGE,Y AND HIZATATE,S,AUTOOXIDATION OF ALKYLHYDRAZONES AND MUTAGENICITY OF THE RESULTINGHYDROPEROXIDES, BIOL. PHARM. BULL. 16(1):96-98, 1993"
+396-32-7,EPA1,1,-1,,Fc1ccc2cccnc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+593-60-2,VITIC,1,-1,,BrC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+53198-46-2,EPA3,1,-1,,CN(N=O)[C@H](OC(=O)C)c1ccccc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+623-30-3,EPA3,0,-1,,O=C\C=C/c1occc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M249,EPA1,1,-1,,N[C@@H](CCC(=O)NNc1ccccc1)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97-56-3,VITIC,1,-1,,Cc1ccccc1N=Nc2ccc(N)c(C)c2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M497,EPA1,0,-1,,CCOC(=O)[C@H](SP(=S)(OC)OC)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5776-39-6,EPA1,1,-1,,C[n+]1c2ccccc2cc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25376-45-8,VITIC,0,-1,,Cc1cc(N)cc(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3333-52-6,VITIC,0,-1,,CC(C)(C#N)C(C)(C)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+89-87-2,VITIC,1,-1,,Cc1ccc(c(C)c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+547-58-0,EPA3,0,-1,"METHYLORA",CN(C)c1ccc(cc1)N=Nc2ccc(cc2)S(=O)(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+499-75-2,EPA1,0,-1,"CARVACROL",CC(C)c1ccc(C)c(O)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+129-43-1,EPA1,1,-1,,Oc1cccc2C(=O)c3ccccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1465-25-4,VITIC,1,-1,,NCCNc1cccc2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M537,EPA1,0,-1,,C[C@H](CS)[C@@H]1CC[C@@H](C)[C@H](S)C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4584-49-0,EPA3,1,-1,,C[C@H](Cl)CN(C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+555-03-3,CCRIS,0,-1,,COc1cccc(c1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+29706-59-0,CCRIS,1,-1,,OCc1c(O)c2C(=O)c3ccccc3C(=O)c2cc1OC4OC(COC5OCC(O)C(O)C5O)C(O)C(O)C4O,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+22071-15-4,CCRIS,0,-1,"KETOPROFE,KETOPRLYS,KETOPRONA",CC(C(=O)O)c1cccc(c1)C(=O)c2ccccc2,"PHILIPOSE,B, SINGH,R, KHAN,KA AND GIRI,AK, COMPARITIVE MUTAGENIC ANDGENOTOXIC EFFECTS OF THREE PROPIONIC ACID DERIVATIVES IBUPROFEN, KETOPROFEN ANDNAPROXEN, MUTAT. RES. 393(1-2):123-131, 1997"
+NOCAS_M438,EPA1,0,-1,,CCOC(=O)C[C@H](S[P@@](=O)(OC)SC)C(=O)OCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M100,EPA1,1,-1,,Cc1ccc(cc1C)[C@@](OC(=O)NC2CCCCC2)(C#C)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4196-86-5,EPA3,0,-1,,COCC(COC(=O)c1ccccc1)(COC(=O)c2ccccc2)COC(=O)c3ccccc3,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+6967-29-9,EPA1,1,-1,,CCc1cccc(CC)c1NC(=O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4359-61-9,CCRIS,0,-1,,CC(=O)N(N)C(=O)C,"BHIDE,SV, BHALERAO,EB, SARODE,AV AND MARU,GB, MUTAGENICITY ANDCARCINOGENICITY OF MONO AND DIACETYL HYDRAZINE, CANCER LETT. 23(2):235-240,1984"
+67730-10-3,EPA1,1,-1,,Nc1ccc2nc3ccccn3c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15791-78-3,VITIC,1,-1,,OCCc1ccc(Nc2ccc(O)c3C(=O)c4c(O)ccc(c4C(=O)c23)[N+](=O)[O-])cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6270-13-9,EPA1,1,-1,,OCCN(CCO)c1ccc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119-61-9,VITIC,0,-1,"BENZOPHON",O=C(c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+53-03-2,EPA2,1,1,,CC12CC(=O)C3C(CCC4=CC(=O)C=CC34C)C1CCC2(O)C(=O)CO,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+105801-28-3,CCRIS,1,-1,,ON(C=O)c1ccc(Oc2ccc(Cl)cc2)cc1,"MIYAUCHI,M, ENDOH,Y AND UEMATSU,T, MUTAGENIC ACTIVITY OF THE AMIDODERIVATIVES AND THEIR HYDROXAMIC ACIDS OF NITROBIPHENYL ETHERS, BULL. ENVIRON.CONTAM. TOXICOL. 55(3):446-452, 1995"
+79-21-0,VITIC,0,-1,"PERACETAT",CC(=O)OO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111-96-6,VITIC,0,-1,"DIGLYME",COCCOCCOC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+26148-68-5,EPA1,1,-1,,Nc1ccc2c3ccccc3[nH]c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1077-28-7,EPA3,0,-1,,OC(=O)CCCC[C@@H]1CCSS1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+31969-03-6,CCRIS,0,-1,,Cc1cccc(N=Nc2c(O)ccc3ccccc23)c1C,"HAYAKAWA,Y, MIYAGOSHI,M AND NAGAYAMA,T, HYGIENIC STUDIES OF COAL TARDYES USED IN DRUGS AND COSMETICS. II. STRUCTURAL ISOMERS OF RED NO. 505, EISEIKAGAKU 30(4):211-215, 1984"
+35250-53-4,VITIC,0,-1,,SCCc1cnccn1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+720-69-4,CCRIS,1,-1,,Nc1nc(N)nc(n1)c2oc(cc2)[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+4316-73-8,EPA1,0,-1,"SARCOSINE",CNCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14448-67-0,EPA1,1,-1,,CN1\C(=N\N)\Sc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63019-38-5,EPA1,1,-1,,Oc1cccc2c1ccc3c4ccccc4ccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+859-97-2,CCRIS,0,1,,CC(CCC(=O)O)C1CCC2C3C(CCC12C)C4(C)CCC(=O)CC4CC3=O,"MORI,Y, NII,H, MASUDA,A, MIZUMOTO,K, KONISHI,Y, UNE,M AND HOSHITA,T,ABSENCE OF MUTAGENIC ACTION OF 5BETA-CHOLAN-24-OIC ACID DERIVATIVES IN THEBACTERIAL FLUCTUATION AND STANDARD AMES TEST, MUTAT. RES. 262(4):267-274,1991"
+5581-32-8,CCRIS,0,-1,,CC(C)(c1ccc(OCC(O)CO)cc1)c2ccc(OCC(O)CO)cc2,"SUEIRO,RA ARAUJO,M SUAREZ,S AND GARRIDO,MJ,MUTAGENIC POTENTIAL OFBISPHENOL A DIGLYCIDYL ETHER (BADGE) AND ITS HYDROLYSIS-DERIVED PRODUCTS IN THEAMES SALMONELLA ASSAY, MUTAGENESIS 16(4):303-307, 2001"
+1794-45-2,CCRIS,1,-1,,Clc1ccccc1\C=C\C=O,"EDER,E, WEINFURTNER,E AND EDER MMG, GENOTOXICITY OF HALOGENATEDPROPENALS, ENVIRONMENTALLY RELEVANT OXYGEN CONTAINING SHORT CHAIN HALOCARBONS,ORGANOHALOGEN COMPD. 21(DIOXIN '94):239-242, 1994"
+1253-84-5,CCRIS,1,1,,CC(C)CCCC(C)C1CCC2C3CC(O)C4(O)CC(O)CCC4(C)C3CCC12C,"CHENG,YW KANG,JJ SHIH,YL LO,YL AND WANG,CF, CHOLESTEROL-3-BETA,5-ALPHA, 6-BETA-TRIOL INDUCED GENOTOXICITY THROUGH REACTIVE OXYGEN SPECIESFORMATION, FOOD CHEM. TOXICOL. 43(4):617-622, 2005"
+3385-21-5,CCRIS,0,-1,,NC1CCCC(N)C1,"TAKAHASHI,A AND ONO,H, MUTAGENICITY ASSESSMENT IN 44 EPOXY RESINHARDENERS IN SALMONELLA TYPHIMURIUM TESTER STRAINS, CHEM. EXPRESS 8(9):785-788,1993"
+113779-16-1,EPA1,1,-1,,C1=Cc2cc3cccc4c5ccccc5c6ccc1c2c6c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75464-11-8,EPA1,1,-1,"BUTANTRON",CCCC(=O)C1c2cccc(O)c2C(=O)c3c(O)cccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M520,EPA1,0,-1,,CC(=C)[C@@H]1CC=C(C)[C@@H](O)C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2835-39-4,VITIC,0,-1,,CC(C)CC(=O)OCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+43210-67-9,EPA1,0,-1,"FENBENDAZ",COC(=O)Nc1nc2cc(Sc3ccccc3)ccc2[nH]1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-11-8,EPA1,1,-1,,[O-][N+](=O)c1ccc(CBr)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109380-46-3,CCRIS,1,-1,,CCOC(=O)C(C#N)c1snc2ccc(cc12)[N+](=O)[O-],"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+1608-51-1,CCRIS,0,-1,,Fc1ccc(\C=C\C(=O)c2ccccc2)cc1,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+830-96-6,EPA1,0,-1,"INDOLEPRO",OC(=O)CCc1c[nH]c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6281-32-9,EPA1,0,-1,,OCc1ccnc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3475-63-6,EPA1,1,-1,,CN(C)C(=O)N(C)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7269-60-5,EPA1,1,-1,,Cn1cnc2c(NO)ncnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+85-44-9,VITIC,0,-1,"PHTHALICA",O=C1OC(=O)c2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+74518-94-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc(\C=C\c2ccc(cc2)C#N)cc1,"HOOBERMAN,BH, BREZZELL,MD, DAS,SK, YOU,Z AND SINSHEIMER,JE,SUBSTITUENT EFFECTS ON THE GENOTOXICITY OF 4-NITROSTILBENE DERIVATIVES, MUTAT.RES. 341(1): 57-69, 1994"
+133550-91-1,CCRIS,0,-1,,OCc1ccc2cccc3c4ccccc4c1c23,"BALL,JC, AND YOUNG,WC, AMES ASSAY MUTAGENICITY AND ELECTRONICSTRUCTURE CALCULATIONS OF BROMOMETHYLFLUORANTHENES, CHLOROMETHYLFLUORANTHENES,AND HYDROXYMETHYLFLUORANTHENES, CHEM.-BIOL. INTERACT. 77(3):291-302,1991"
+87638-04-8,CCRIS,0,-1,,NC(=O)OCC1C(NC(=O)\C(=N/OCC(=O)O)\c2csc(N)n2)C(=O)N1S(=O)(=O)O,"NAGAYABU,O, YAMAMOTO,KS AND SAKAMOTO,Y, MUTAGENICITY TESTS ONCARUMONAM (1). REC-ASSAY AND REVERSION TEST IN BACTERIA, YAKURI TO CHIRYO14(6):3887-3891, 1986"
+133591-35-2,CCRIS,1,-1,,Cc1cc(c(C)c2c3cc(ccc3[nH]c12)[N+](=O)[O-])[N+](=O)[O-],"ANDRE,V, BIOSSART,C, SICHEL,F, GAUDUCHON,P, LE TALAER,JY, LANCELOT,JC,MERCIER,C, CHEMTOB,S, RAOULT,E AND TALLEC,A, MUTAGENICITY OF NITRO- ANDAMINO-SUBSTITUTED CARBAZOLES IN SALMONELLA TYPHIMURIUM. III. METHYLATEDDERIVATIVES OF 9H-CARBAZOLE, MUTAT. RES. 389(2-3):247-260, 1997"
+53330-03-3,CCRIS,1,-1,,NC(CSC(=O)NCCCl)C(=O)O,"STAHL,W, DENKEL,E AND EISENBRAND,G, INFLUENCE OF GLUTATHIONE ON THEMUTAGENICITY OF 2-CHLOROETHYLNITROSOUREAS. MUTAGENIC POTENTIAL OF GLUTATHIONEDERIVATIVES FORMED FROM 2-CHLOROETHYLNITROSOUREAS AND GLUTATHIONE, MUTAT. RES.206(4): 459-465, 1988"
+3586-69-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc2cc3ccccc3cc2c1,"FU,PP, HEFLICH,RH, VON TUNGELN,LS, YANG,DTC, FIFER,EK AND BELAND,FA,EFFECT OF THE NITRO GROUP CONFORMATION ON THE RAT LIVER MICROSOMAL METABOLISMAND BACTERIAL MUTAGENICITY OF 2- AND 9-NITROANTHRACENE, CARCINOGENESIS7(11):1819-1827, 1986"
+112-56-1,VITIC,0,-1,,CCCCOCCOCCSC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+194-59-2,EPA1,1,-1,,c1ccc2c(c1)ccc3[nH]c4ccc5ccccc5c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109-73-9,VITIC,0,-1,"BUTYLAMIN",CCCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+33611-88-0,CCRIS,1,-1,,[O-][N+](=O)c1cc2cccc3c4ccccc4c(c1[N+](=O)[O-])c23,"SHANE,BS, SQUADRITO,GL, CHURCH,DF AND PRYOR,WA, COMPARATIVEMUTAGENICITY OF NITROFLUORANTHENES IN SALMONELLA TYPHIMURIUM TA98, TA98NR, ANDTA98/1,8DNP6,ENVIRON. MOL. MUTAGEN. 17(2):130-138, 1991"
+16495-13-9,CCRIS,1,-1,,C(OCc1ccccc1)C2CO2,"SINSHEIMER,JE, CHEN,R, DAS,SK, HOOBERMAN,BH, OSORIO,S AND YOU,Z, THEGENOTOXICITY OF ENANTIOMERIC ALIPHATIC EPOXIDES, MUTAT. RES. 298(3):197-206,1993"
+30235-27-9,CCRIS,0,-1,,Nc1nc(cs1)c2cccnc2,"JAEN,JC, KROPKO,ML, THEISS,JC, WOLD,S, CAPRATHE,BW AND WISE,LD,ASSESSMENT OF MUTAGENIC POTENTIAL IN A SERIES OF COMPOUNDS STRUCTURALLY RELATEDTO 2-AMINO-3-METHYLIMIDAZO[4,5-F]QUINOLINE (IQ), EUR. J. MED. CHEM. 28(7-8):547-553, 1993"
+102-16-9,VITIC,0,-1,,O=C(Cc1ccccc1)OCc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+64521-09-1,EPA3,1,-1,,CN(N=O)C(=O)Oc1ccc(C)c(C)c1C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+93793-83-0,EPA1,0,-1,"ACEROXATI,ACEROXHCL",CC(=O)OCC(=O)NCCCOc1cccc(CN2CCCCC2)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10353-99-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc2C=Cc3cccc1c23,"VANCE,WA AND LEVIN,DE, STRUCTURAL FEATURES OF NITROAROMATICS THATDETERMINE MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM, ENVIRON. MUTAGEN.6(6):797-811, 1984"
+6959-48-4,VITIC,1,-1,,ClCc1cccnc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+155-09-9,CCRIS,0,-1,,N[C@@H]1C[C@H]1c2ccccc2,"BALBI,A MUSCETTOLA,G STAIANO,N MARTIRE,G AND DE LORENZO,F, PSYCHOTROPIC DRUGS: EVALUATION OF MUTAGENIC EFFECT,  PHARMACOL. RES. COMMUN.12(5):423-431, 1980"
+316-49-4,EPA1,1,-1,,Cc1cccc2c1ccc3cc4ccccc4cc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-44-7,EPA1,1,-1,,ClCc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126370-97-6,CCRIS,1,-1,,FC(F)(F)c1cccc(CN2C3C2c4ccccc4c5ccccc35)c1,"ROLL,M, SHTELZER,S, STARK,AA AND BLUM,J, STRUCTURE-ACTIVITYRELATIONSHIPS IN MUTAGENICITY AND IN NUCLEOPHILIC RING OPENING OFN-(ARYLMETHYL)PHENANTHRENE 9,10-IMINES, MUTAGENESIS 5(1):25-30, 1990"
+84736-60-7,CCRIS,1,-1,,ON(C=O)c1ccc(cc1)[N+](=O)[O-],"CORBETT,MD, WEI,CI AND CORBETT,BR, NITROREDUCTASE-DEPENDENTMUTAGENICITY OF P-NITROPHENYLHYDROXYLAMINE AND ITS N-ACETYL AND N-FORMYLHYDROXAMIC ACIDS, CARCINOGENESIS 6(5):727-732, 1985"
+77287-29-7,CCRIS,1,-1,,COC(=O)C(C)Cl,"YAGUCHI,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENIC ACTIVITIESOF CHIRAL EPOXIDES, HALLIDES, AND N-NITROSAMINES, BIOL. PHARM. BULL.16(9):942-944, 1993"
+1668-19-5,CCRIS,0,-1,"DOXEPIHCL",CN(C)CC\C=C\1/c2ccccc2COc3ccccc13,"BALBI,A MUSCETTOLA,G STAIANO,N MARTIRE,G AND DE LORENZO,F, PSYCHOTROPIC DRUGS: EVALUATION OF MUTAGENIC EFFECT,  PHARMACOL. RES. COMMUN.12(5):423-431, 1980"
+NOCAS_M346,EPA1,0,-1,,C[C@H](CCc1ccccc1)NC[C@@H](O)c2ccc(O)c(c2)C(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54897-63-1,EPA3,1,-1,,CCN(CCCC(=O)O)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+21388-97-6,CCRIS,0,-1,,CC(=O)OCc1cccc(c1)[N+](=O)[O-],"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+100-27-6,VITIC,1,-1,,OCCc1ccc(cc1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107-11-9,VITIC,0,-1,"ALLYLAMIN",NCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+42028-27-3,EPA3,1,-1,,CCc1cc2C(=O)CCc2c3ccc4ccccc4c13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+517-66-8,CCRIS,1,-1,"DICENTRIN",COc1cc2CC3N(C)CCc4cc5OCOc5c(c34)c2cc1OC,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+97467-07-7,EPA1,1,-1,,C[N+]1=CC=C(CC1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134-31-6,VITIC,1,-1,"ALOXIN,HYDROXQBI,HYDROXHCL,INOQIN111,NSC158197,NSC165697,OXINE-CU,HOQUINSUL",Oc1cccc2cccnc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7417-67-6,EPA1,1,-1,,CN(N=O)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+196-77-0,EPA1,1,-1,,C1=Cc2c3ccc4cccc5ccc(c6cccc1c26)c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+34244-14-9,EPA1,1,-1,,Clc1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+40321-98-0,CCRIS,0,-1,,CCC(CCC(=O)C)COC(=O)c1ccccc1C(=O)O,"DIRVEN,HAAM, THEUWS,JLG, JONGENEELEN,FJ AND BOS,RP, NON-MUTAGENICITYOF 4 METABOLITES OF DI(2-ETHYLHEXYL)PHTHALATE (DEHP) AND 3 STRUCTURALLY RELATEDDERIVATIVES OF DI(2-ETHYLHEXYL)ADIPATE (DEHA) IN THE SALMONELLA MUTAGENICITYASSAY, MUTAT. RES. 260(1):121-130, 1991"
+134-62-3,VITIC,0,-1,"DIETHYLTO",CCN(CC)C(=O)c1cccc(C)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2379-74-0,EPA3,0,-1,,Cc1cc(Cl)cc2S\C(=C\3/Sc4cc(Cl)cc(C)c4C3=O)\C(=O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+122033-85-6,CCRIS,1,-1,,Cc1ccc(C)c2c3C4OC4C(O)C(O)c3ccc12,"SINSHEIMER,JE, GIRI,AK, MESSERLY,EA, JUNG,KY AND KOREEDA,M,MUTAGENICITY IN SALMONELLA AND SISTER CHROMATID EXCHANGE IN MICE FOR THEBAY-REGION SYN- AND ANTI-DIOL EPOXIDES OF 1,4-DIMETHYLPHENANTHRENE,CARCINOGENESIS 10(6):1123-1126, 1989"
+2381-16-0,EPA1,1,-1,,Cc1ccc2cc3c(ccc4ccccc34)cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99-54-7,VITIC,1,-1,,[O-][N+](=O)c1ccc(Cl)c(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+68941-03-7,CCRIS,0,-1,,Nc1ccc(cc1)N(c2ccc3ccccc3c2)c4ccc5ccccc5c4,"YAMAGUCHI,T, YAMAUCHI,A, YAMAZAKI,H AND KAKIUCHI,Y, MUTAGENICITY OFRUBBER ADDITIVES IN TIRE, EISEI KAGAKU 37(1):6-13, 1991"
+118499-61-9,CCRIS,0,-1,,OC1C(O)c2cc3ccc4cccc5ccc(c2C(O)C1S(=O)(=O)O)c3c45,"GREEN,JL, PAN,YHL AND REED,GA, MUTAGENICITY OF BENZO[A]PYRENEBAY-REGION SULFONATES, CARCINOGENESIS 12(7):1359-1362, 1991"
+109143-16-0,EPA1,1,-1,,[O-][N+](=O)c1oc2ccc(cc2c1)N(CCCl)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+124617-84-1,CCRIS,1,-1,,CCCCON(OC(=O)C)C(=O)c1ccccc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+224-53-3,EPA1,1,-1,,c1ccc2c(c1)ccc3cc4ccc5ccccc5c4nc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4691-65-0,CCRIS,0,-1,,OC1C(O)C(OC1COP(=O)(O)O)n2cnc3c(O)ncnc23,"FUJITA,H, SUMI,C AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVESWITH SALMONELLA TYPHIMURIUM TA97 AND TA102. VII,KENKYU NENPO - TOKYO-TORITSUEISEI KENKYUSHO 43:219-227, 1992"
+107-44-8,CCRIS,0,-1,"SARIN",CC(C)OP(=O)(C)F,"GOLDMAN,M, KLEIN,AK, KAWAKAMI,TG AND ROSENBLATT,LS, TOXICITY STUDIESON AGENTS GB (SARIN (TYPES I AND II) AND GD (SOMAN), GOV. REP. ANNOUNCE. INDEX(U.S.) 88(10):9-80, 1988"
+1794-84-9,CCRIS,1,-1,,[O-][N+](=O)CCl,"SCHNEIDER,M, QUISTAD,GB AND CASIDA,JE, GLUTATHIONE ACTIVATION OFCHLOROPICRIN IN THE SALMONELLA MUTAGENICITY TEST, MUTAT. RES. 439(2):233-238,1999"
+156215-58-6,EPA1,1,-1,,Cn1c(N)nc2nc3ccccc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+136-77-6,VITIC,0,-1,"HEXYLRESO",CCCCCCc1ccc(O)cc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+102029-81-2,CCRIS,0,-1,,CC(N)C(=O)O,"FUJITA,H, SUMI,C AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVESWITH SALMONELLA TYPHIMURIUM TA97 AND TA102. VII,KENKYU NENPO - TOKYO-TORITSUEISEI KENKYUSHO 43:219-227, 1992"
+2541-69-7,EPA1,1,-1,,Cc1c2ccccc2cc3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+589-17-3,EPA1,0,-1,,ClCc1ccc(Br)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106-93-4,VITIC,1,-1,"ETHYLEDIB",BrCCBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98-88-4,EPA1,1,-1,,ClC(=O)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94-25-7,VITIC,0,-1,"BUTOFORM",CCCCOC(=O)c1ccc(N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+87259-00-5,CCRIS,1,-1,,OC1C=Cc2cc3c(ccc4ccccc34)c(c2C1O)[N+](=O)[O-],"FU,PP, CHOU,MW, MILLER,DW, WHITE,GL, HEFLICH,RH AND BELAND,FA, THEORIENTATION OF THE NITRO SUBSTITUENT PREDICTS THE DIRECT-ACTING BACTERIALMUTAGENICITY OF NITRATED POLYCYCLIC AROMATIC HYDROCARBONS, MUTAT. RES.143(3):173-181, 1985"
+89-69-0,VITIC,1,-1,,[O-][N+](=O)c1cc(Cl)c(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3018-12-0,VITIC,1,-1,,ClC(Cl)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+574-06-1,VITIC,0,-1,,CC(=O)OC(C(=O)c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+56-75-7,EPA2,0,-1,,OCC(NC(=O)C(Cl)Cl)C(O)c1ccc(cc1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+528-53-0,CCRIS,0,-1,"DELPHINID,IDB-1056",Oc1cc(O)c2cc(O)c([o+]c2c1)c3cc(O)c(O)c(O)c3,"FERGUSON,LR, VAN ZIJL,P, HOLLOWAY,WD AND JONES,WT, CONDENSED TANNINSINDUCE MICRONUCLEI IN CULTURED V79 CHINESE HAMSTER CELLS, MUTAT. RES.158(1-2):89-95, 1985"
+202345-21-9,CCRIS,1,-1,,Cc1cc2c3ccccc3[nH]c2nc1NO,"FRANDSEN,H, DAMKJAER,S, GRIVAS,S, ANDERSSON,R, BINDERUP,ML ANDLARSEN,JC, MICROSOMAL METABOLISM AND ACTIVATION OF THE ENVIRONMENTAL CARCINOGEN2-AMINO-3-METHYL-9H-PYRIDO[2,3-B]INDOLE, MUTAGENESIS 13(2):181-185,1998"
+NOCAS_M162,EPA1,1,-1,,O=C(OC[C@H]1CO1)c2cccc(c2)C(=O)OC[C@H]3CO3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68268-00-8,CCRIS,0,-1,,CN(C(=O)CCCCl)c1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+63785-42-2,CCRIS,0,-1,,OS(=O)(=O)Oc1cccc2c3ccc4cccc5ccc(cc12)c3c45,"IRWIN,SE, KWEI,GY, BLACKBURN,GR, THURMAN,R AND KAUFFMAN,FC,MUTAGENICITY OF BENZO[A]PYRENYL-1-SULFATE IN THE AMES TEST,ENVIRON. MOL.MUTAGEN. 19(3):253- 258, 1992"
+49562-28-9,EPA1,0,-1,"FENOFIBRA,FENOFIHCL",CC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c2ccc(Cl)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+634-66-2,VITIC,0,-1,,Clc1ccc(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98105-99-8,CCRIS,0,-1,"A-56620,SARAFLHCL",OC(=O)C1=CN(c2ccc(F)cc2)c3cc(N4CCNCC4)c(F)cc3C1=O,"SHEN,J SHEN,C XIAO,X LI,J LIU,J ZHANG,S ZHOU,Z AND FU,J, STUDY ONMUTAGENICITY AND TERATOGENICITY OF SARAFLOXACIN, ZHONGGUO NONGYE KEXUE (BEIJING)34(2):210-215, 2001"
+298-02-2,EPA1,0,-1,"PHORATE",CCOP(=S)(OCC)SCSCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-70-0,VITIC,0,-1,,COC(C)(C)CC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+128350-00-5,CCRIS,1,-1,,CC(\C=C(/C#N)\c1ccc(Cl)c(Cl)c1)C(C(C#N)c2ccc(Cl)c(Cl)c2)c3ccccc3,"AL-ARAB,MM, GHANEM,BS AND MASLAT,AO, SYNTHESIS, SPECTROSCOPY, ANDMUTAGENICITY OF NOVEL HEPTENEDINITRILES, TOXICOL. ENVIRON. CHEM. 27(4):267-275,1990"
+84-15-1,EPA1,0,-1,,c1ccc(cc1)c2ccccc2c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50-45-3,VITIC,0,-1,,OC(=O)c1cccc(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+140-53-4,CCRIS,0,-1,,Clc1ccc(CC#N)cc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION  CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING  CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF  THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL),1997"
+548-62-9,EPA2,0,-1,"METHROSAN,MEROSANIL",CN(C)c1ccc(cc1)C(=C2C=CC(=[N+](C)C)C=C2)c3ccc(cc3)N(C)C,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+5802-60-8,EPA1,0,-1,,NN(Cc1ccccc1)Cc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106532-64-3,CCRIS,1,-1,,CC(C)C(=O)\N=C\1/SN(C(=O)C(C)C)c2ccc(cc12)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+611-09-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2NC(=O)C(=O)c2c1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y92"
+59-49-4,EPA1,0,-1,"BENZOXAZ2",Oc1oc2ccccc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2358-84-1,EPA1,0,-1,,CC(=C)C(=O)OCCOCCOC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98025-31-1,CCRIS,1,-1,,NC(CSC(=C(Cl)Cl)Cl)C(=O)O,"GREEN,T AND ODUM,J, STRUCTURE/ACTIVITY STUDIES OF THE NEPHROTOXIC ANDMUTAGENIC ACTION OF CYSTEINE CONJUGATES OF CHLORO AND FLUOROALKENES, CHEM. BIOL.INTERACT. 54(1):15-31, 1985"
+120812-51-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c3CCCCc3c4c(ccc5ccc1c2c45)[N+](=O)[O-],"FU,PP, NI,YC, ZHANG,YM, HEFLICH,RH, WANG,YK AND LAI,JS, EFFECT OF THEORIENTATION OF NITRO SUBSTITUENT ON THE BACTERIAL MUTAGENICITY OFDINITROBENZO[E]PYRENES, MUTAT. RES. 225(3):121-125, 1989"
+86-88-4,EPA2,1,-1,"NAPHTHIUR",NC(=S)Nc1cccc2ccccc12,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+20562-02-1,EPA1,0,1,,C[C@H]1CC[C@@H]2[C@@H](C)[C@H]3[C@@H](C[C@H]4[C@@H]5CC=C6C[C@H](CC[C@]6(C)[C@H]5CC[C@]34C)O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O[C@@H]8O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]8O)[C@@H]7O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)N2C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26049-69-4,CCRIS,1,-1,,CN(C)Nc1nc(cs1)c2oc(cc2)[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+872-05-9,EPA1,0,-1,,CCCCCCCCC=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+58658-11-0,EPA1,1,-1,,Nc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+74-11-3,VITIC,0,-1,"CLBZOATEP,CHLORBZNA",OC(=O)c1ccc(Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+84174-20-9,EPA1,0,-1,,COc1ccc(CN(C)N=O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+536-33-4,VITIC,0,-1,"ETHIONAMI,ETHIONHCL",CCc1cc(ccn1)C(=S)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1528-74-1,CCRIS,1,-1,,[O-][N+](=O)c1ccc(cc1)c2ccc(cc2)[N+](=O)[O-],"HIRAYAMA,T, WATANABE,T, AKITA,M, SHIMOMURA,S, FUJIOKA,Y, OZASA,S ANDFUKUI,S, RELATIONSHIPS BETWEEN STRUCTURE OF NITRATED ARENES AND THEIRMUTAGENICITY IN SALMONELLA TYPHIMURIUM, 2- AND 2,7-NITRO SUBSTITUTED FLUORENE,PHENANTHRENE AND PYRENE, MUTAT. RES. 209(1-2):67-74, 1988"
+508-71-4,CCRIS,0,-1,,CC1(CCC2(C)C(C1)C(=O)CC3C4(C)CCCC23OC4=O)C=C,"HENGSTLER,JG, LOEFFLER,S, SCHAEFER,M, GLATT,HR, FUCHS,J, FLESCH,P ANDOESCH,F, DNA STRAND BREAK INDUCTION, MUTAGENICITY, AND CYTOTOXICITY OF THEMYCOTOXINS 11BETA-HYDROXY-7-DEOXYROSENONOLACTONE, ROSENONOLACTONE, ANDTRICHOTHECIN, MYCOTOXIN RES. 8(2):77-83, 1992"
+NOCAS_M261,EPA1,1,-1,,Cl[C@@H](Br)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97055-37-3,EPA1,1,-1,,OC(=O)C(=C(C(Cl)Cl)C(Cl)Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78967-07-4,EPA1,0,-1,"N-22",COc1ccc(cc1)c2noc(CC(=O)O)c2c3ccc(OC)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M195,EPA1,1,-1,,[O-][N+](=O)c1ccc2[C@H]3O[C@H]3c4cccc5ccc1c2c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+58071-32-2,CCRIS,1,-1,,C[C@H](O)[C@H](NC(=O)[C@@H](C)[C@H](O)[C@@H](C)NC(=O)[C@@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@H](N)C(=O)N)[C@@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCNCCCNC(=N)CC7CCC(Cl)CC7,"UMEZAWA,K, HARESAKU,M, MURAMATSU,M AND MATSUSHIMA,T, MUTAGENICITY OFANTHRACYCLINE GLYCOSIDES AND BLEOMYCINS IN A SALMONELLA ASSAY SYSTEM, BIOMED.PHARMACOTHER. 41(5):214-218, 1987"
+NOCAS_M143,EPA1,1,-1,,Cc1c2[C@H]3N[C@H]3c4ccccc4c2cc5ccccc15,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1072-52-2,VITIC,1,-1,,OCCN1CC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5307-14-2,EPA2,1,-1,,Nc1ccc(N)c(c1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+75-69-4,VITIC,0,-1,"TCFMETHAN",FC(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7661-55-4,EPA3,1,-1,,Cc1cccc2ncccc12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+145569-98-8,CCRIS,1,-1,,COC(=O)\C(=C/CO)\C=C(/C)\C=C(/C)\C=C\C=C(/C)\C(=O)C12OC1C(O)(CCO)NC2=O,"ZHU,B AND JEFFREY,AM, FUSARIN C: ISOLATION AND IDENTIFICATION OF TWOMICROSOMAL METABOLITES, CHEM. RES. TOXICOL. 6(1):97-101, 1993"
+NOCAS_M241,EPA1,1,-1,,C(Oc1ccccc1)[C@H]2CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+72917-35-2,EPA1,1,-1,,Cc1cc(c(C)c2c3cc(O)ccc3[nH]c12)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-74-3,EPA1,1,-1,,CCN1CCOCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126983-61-7,EPA1,1,-1,,COC1=CC(=O)c2c(nc(C)c3c4c[nH]ccc4nc23)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+85-41-6,VITIC,0,-1,"PHTHALIMI",O=C1NC(=O)c2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13855-74-8,CCRIS,0,-1,,OCNC(=O)c1ccc(Cl)cc1,"OVERTON,M, THREADGILL,MD, CHIPMAN,JK, GESCHER,A AND HICKMAN,JA, THEFORMATION AND METABOLISM OF N-HYDROXYMETHYL COMPOUNDS. IX.N-(ACETOXYMETHYL)-4-CHLOROBENZAMIDE, AN ELECTROPHILE BUT NOT A MUTAGEN INSALMONELLA TYPHIMURIUM, BIOCHEM. PHARMACOL. 35(23):4161-4165, 1986"
+145627-69-6,CCRIS,1,-1,,Cc1cc2CCCc2c3ccc4C(O)C(O)C=Cc4c13,"PAPAPARASKEVA-PETRIDES,C, IOANNIDES,C, BOYD,GW, YOUNG,RJ, HARVEY,RGAND COOMBS, MM, THE MUTAGENICITY OF CHEMICALLY SYNTHESIZED METABOLITES OF16,17-DIHYDRO-15H-CYCLOPENTA[A]PHENANTHRENE AND ITS CARCINOGENIC 11-METHYLHOMOLOG, MUTAGENESIS 8(4):307-310, 1993"
+NOCAS_M12,EPA1,1,-1,,C[C@H](COc1ccccc1)N(CCCl)Cc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+69231-25-0,CCRIS,0,-1,,COC(=O)C1=C(C(C)OC1=O)c2ccccc2,"KIM,IS, AND BJELDANES,LF, SYNTHESES AND MUTAGENICITY OF FUSARIN C RINGANALOGS, J. AGRIC. FOOD CHEM. 40(9):1625-1630, 1992"
+75-88-7,EPA2,0,-1,,FC(F)(F)CCl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+135-68-2,EPA1,1,-1,,Nc1ccc(cc1)c2ccc(Cl)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+42978-43-8,EPA1,1,-1,,CC(=O)OCc1c2ccccc2c3ccc4cccc5ccc1c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80-70-6,EPA1,0,-1,,CN(C)C(=N)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3682-19-7,VITIC,1,-1,,[O-][N+](=O)c1ccc2C(=O)NNC(=O)c2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+129-09-9,EPA1,0,-1,,O=C1c2ccc3nc(sc3c2C(=O)c4ccc5nc(sc5c14)c6ccccc6)c7ccccc7,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+37841-91-1,CCRIS,1,-1,,CC1(C)CC2C=C(C=O)C3(CC3(C)C2C1)C=O,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+85-86-9,EPA1,1,-1,"SUDAN-3",Oc1ccc2ccccc2c1N=Nc3ccc(cc3)N=Nc4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+951-78-0,CCRIS,0,-1,,OCC1OC(CC1O)N2C=CC(=O)NC2=O,"MARQUADT,H, WESTENDORF,J, SCHAEFER,A, BOLDT,J, DE CLERCQ,E ANDMARQUARDT,H, MUTAGENIC AND ANTIMUTAGENIC EFFECTS OF 5-SUBSTITUTED2'-DEOXYURIDINES DEPENDING ON THE NATURE OF THE 5-SUBSTITUENT, ARZNEIM.-FORSCH.38(12):1820-1824, 1988"
+104535-30-0,CCRIS,1,-1,,Nc1cc(CCO)c(N)c(c1)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+527-85-5,VITIC,0,-1,,Cc1ccccc1C(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+17987-99-4,CCRIS,1,-1,,OC(=O)c1c[n+]([O-])c2ccccc2[n+]1[O-],"NUNOSHIBA,T AND NISHIOKA,H, GENOTOXICITY OF QUINOXALINE 1,4-DIOXIDEDERIVATIVES IN ESCHERICHIA COLI AND SALMONELLA TYPHIMURIUM, MUTAT. RES.217(3):203-209, 1989"
+142438-65-1,CCRIS,1,-1,,COC(=O)C1=C(C)C(OC1=O)C(C)C,"KIM,IS, AND BJELDANES,LF, SYNTHESES AND MUTAGENICITY OF FUSARIN C RINGANALOGS, J. AGRIC. FOOD CHEM. 40(9):1625-1630, 1992"
+123-42-2,VITIC,0,-1,,CC(=O)CC(C)(C)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3577-63-7,VITIC,0,-1,,Nc1ccc(cc1C(=O)O)S(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95741-56-3,EPA1,1,-1,,Cc1c2c3cccc4cccc(c2c(C)c5ccccc15)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1397-89-3,EPA1,0,-1,,C[C@@H]1OC(=O)C[C@H](O)C[C@H](O)CC[C@@H](O)[C@H](O)C[C@H](O)C[C@]2(O)C[C@H](O)[C@@H]([C@@H](C[C@@H](O[C@H]3O[C@H](C)[C@H](O)[C@H](N)[C@@H]3O)\C=C\C=C\C=C\C=C\C=C\C=C\C=C\[C@H](C)[C@@H](O)[C@H]1C)O2)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+952-97-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc(Sc2ccccc2)cc1,"JUNEJA,TR, KAUR,B AND GUPTA,RL, MUTAGENICITY OF 4-NITRODIPHENYLTHIOETHER- DERIVED PRODUCTS AND THEIR POTENTIAL METABOLITES, MUTAT. RES.263(1):13-19, 1991"
+35572-78-2,CCRIS,1,-1,,Cc1c(N)cc(cc1[N+](=O)[O-])[N+](=O)[O-],"GEORGE,SE HUGGINS-CLARK,G AND BROOKS,LR, USE OF A SALMONELLAMICROSUSPENSION BIOASSAY TO DETECT THE MUTAGENICITY OF MUNITIONS COMPOUNDS ATLOW CONCENTRATIONS, MUTAT. RES. 490(1):45-56, 2001"
+2431-50-7,VITIC,1,-1,,ClCC(Cl)C(=C)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+614-95-9,EPA2,1,-1,,CCOC(=O)N(CC)N=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+55706-57-5,CCRIS,0,-1,,Cc1cc(C(=O)O)c2ncccc2c1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+2598-99-4,VITIC,0,-1,,CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+102-71-6,VITIC,0,-1,"MEDARSEN,SALICYLTR,TROLAMINE,TROLAMIHI",OCCN(CCO)CCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1330-78-5,EPA3,0,-1,,Cc1ccc(O)cc1O[P@](=O)(Oc2ccc(O)cc2C)Oc3c(C)cccc3O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+79-15-2,EPA1,0,-1,,NC(=O)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+130040-14-1,EPA1,1,-1,,CC(=O)N(O)c1ccc(Sc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+118-52-5,VITIC,0,-1,"DAKTIN",CC1(C)N(Cl)C(=O)N(Cl)C1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+69655-05-6,EPA3,1,-1,,OC[C@H]1CC[C@H](O1)n2cnc3c(O)ncnc23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+142382-11-4,CCRIS,0,-1,,OC(=O)c1ccc(\C=C\C(=O)CCC#N)cc1,"TATSUMI,K, KITAMURA,S, KATO,M AND HIRAOKA,K, METABOLISM OF SODIUMNIFURSTYRENATE, A VETERINARY ANTIMICROBIAL NITROFURAN IN ANIMALS AND FISH, DRUGMETAB. DISPOS. 20(2):226-233, 1992"
+30835-65-5,EPA3,1,-1,,Cc1cc2ccccc2c3ccc4C(=O)CCc4c13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+618-46-2,EPA1,1,-1,,ClC(=O)c1cccc(Cl)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+127045-41-4,CCRIS,0,-1,,CC1COc2c3N1C=C(C(=O)O)C(=O)c3cc(F)c2C4(N)CC4,"NAKAMURA,S, HAYASHI,T, NOJIMA,Y, NISHIDA,N, KAWAMURA,Y AND KODAMA,T,CYTOTOXICITY AND MUTAGENICITY STUDIES OF T-3761, JPN. J. ANTIBIOT. 48(6):868-877, 1995"
+4655-34-9,VITIC,0,-1,,CC(C)OC(=O)C(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+89-86-1,VITIC,0,-1,"RESORCYLB",OC(=O)c1ccc(O)cc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+371-40-4,EPA1,1,-1,,Nc1ccc(F)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-15-9,VITIC,1,-1,,CCOCCOC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2322-45-4,EPA1,0,-1,,CC(C)(Br)C(=O)Nc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+79642-25-4,CCRIS,1,-1,,Nn1c2ccccc2c3cnccc13,"LIN,JK, WU,SS AND CHEN,JT, MUTAGENICITIES OF NITROSATED CARBOLINEDERIVATIVES, PROC. NATL. SCI. COUNC., REPUB. CHINA, PART B: LIFE SCI.10(4):280-286, 1986"
+185-72-8,EPA1,1,-1,,C1CC2(CCO1)CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+52253-69-7,VITIC,1,-1,"PHENTHIAZ",Nc1nc(cs1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111712-50-6,CCRIS,1,-1,,CC(Br)C(Br)CCl,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+6452-71-7,CCRIS,0,-1,"OXPRENOLO,OXPRENHCL",CC(C)NCC(O)COc1ccccc1OCC=C,"OKINE,LKN, IOANNIDES,C AND PARKE,DV, STUDIES ON THE POSSIBLEMUTAGENICITY OF BETA-ADRENERGIC BLOCKER DRUGS, TOXICOL. LETT. 16(3-4):167-174,1983"
+486-66-8,EPA1,0,-1,"DAIDZEIN",Oc1ccc(cc1)C2=COc3cc(O)ccc3C2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+79-34-5,VITIC,0,-1,"TECLETHAN",ClC(Cl)C(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+37878-54-9,CCRIS,1,-1,,CCCOc1ccc(N)cc1N,"SHAHIN,MM, CHOPY,C AND LEQUESNE,N, COMPARISONS OF MUTATION INDUCTIONBY SIX MONOCYCLIC AROMATIC AMINES IN SALMONELLA TYPHIMURIUM TESTER STRAINS TA97,TA1537, AND TA1538, ENVIRON. MUTAGEN. 7(4):535-546, 1985"
+88-72-2,VITIC,0,-1,,Cc1ccccc1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106-47-8,VITIC,1,-1,"CLANILINP",Nc1ccc(Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+91-84-9,VITIC,0,-1,"MEPYRACEF,MEPYRAMIN,PYRABROM",COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98601-01-5,CCRIS,1,-1,,Cc1cc2ccccc2c3cc4C(O)C(O)C=Cc4cc13,"MUSHTAQ,M, FU,PP, MILLER,DW AND YANG,SK, METABOLISM OF6-METHYLBENZ[A]ANTHRACENE BY RAT LIVER MICROSOMES AND MUTAGENICITY OFMETABOLITES, CANCER RES. 45(9): 4006-4014, 1985"
+546-88-3,EPA1,1,-1,"ACETOHYDR",CC(=O)NO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5447-11-0,CCRIS,0,-1,,CSCCC(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C(=O)O,"RASHID,KA, BABISH,JG AND MUMMA,RO, TESTING OF 2,4,5-T-AMINO ACIDCONJUGATES FOR MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM STRAINS, MUTAT. RES.136(3):217- 221, 1984"
+27208-37-3,EPA3,1,-1,,C1=Cc2cc3cccc4ccc5ccc1c2c5c34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+20643-71-4,CCRIS,0,-1,"CONFUSAME",COc1c2ccoc2nc3cc(O)ccc13,"KLIER,B AND SCHIMMER,O, MICROSOMAL METABOLISM OF DICTAMNINE:IDENTIFICATION OF METABOLITES AND EVALUATION OF THEIR MUTAGENICITY IN SALMONELLATYPHIMURIUM: MUTAGENESIS 14(2):181-185, 1999"
+7297-53-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc(\C=C\c2cccc(Cl)c2)cc1,"HOOBERMAN,BH, BREZZELL,MD, DAS,SK, YOU,Z AND SINSHEIMER,JE,SUBSTITUENT EFFECTS ON THE GENOTOXICITY OF 4-NITROSTILBENE DERIVATIVES, MUTAT.RES. 341(1): 57-69, 1994"
+2373-51-5,CCRIS,1,-1,,CSCCl,"VITO,M, ESPOSITO,G, VICARI,L, LEMBO,S, IMPERATRICE,ML AND DEMARINIS,E,MUTAGENIC ACTIVITY OF CHLORODIMETHYL SULFIDE AND SOME OF ITS ANILINEDERIVATIVES, BOLL.- SOC. ITAL. BIOL. SPER. 61(6):917-923, 1985"
+3717-88-2,EPA1,0,-1,"FLAVOXATE",CC1=C(Oc2c(cccc2C1=O)C(=O)OCCN3CCCCC3)c4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61702-44-1,EPA2,1,-1,,Nc1ccc(NOS(=O)(=O)O)cc1Cl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+43192-07-0,EPA1,1,-1,,Cc1ccc(NO)cc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16664-45-2,EPA1,1,-1,,Cc1cc(C)c2ccc3ccccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+149573-80-8,EPA1,1,-1,,ONC(=O)Cc1cn(cn1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1187-42-4,EPA1,0,-1,,N\C(=C(\N)/C#N)\C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+299-75-2,EPA1,1,-1,,CS(=O)(=O)OC[C@@H](O)[C@H](O)COS(=O)(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+104-98-3,CCRIS,0,-1,"UROCANATE",OC(=O)\C=C\c1c[nH]cn1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y91"
+59-14-3,CCRIS,0,-1,,OCC1OC(CC1O)N2C=C(Br)C(=O)NC2=O,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+134514-27-5,EPA1,1,-1,,Nc1cc(c(N)cc1F)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+82389-38-6,EPA1,1,-1,,CC(=O)Nc1ccc(cc1)C(=O)[C@@H]2O[C@H]2c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91-17-8,VITIC,0,-1,"DECALIN",C1CC[C@@H]2CCCC[C@H]2C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3351-32-4,EPA1,1,-1,,Cc1ccc2c(ccc3c4ccccc4ccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+150446-01-8,CCRIS,0,-1,,Cc1c(\C=N\OCc2ccc(Cl)cc2Cl)c3cc(ccc3n1Cc4ccc(Cl)cc4)[N+](=O)[O-],"HRELIA,P, MOROTTI,M, VIGAGNI,F, BURNELLI,S, GARUTI,L, SABATINO,P ANDCANTELLI-FORTI,G, SYNTHESIS OF A SERIES OF 5-NITRO-(BENZIMIDAZOLES AND INDOLES)AS NOVEL ANTIMYCOTICS AND EVALUATION AS GENOTOXINS IN THE AMES TEST, MUTAGENESIS8(3):183-188, 1993"
+215245-16-2,CCRIS,1,-1,,CCN(CCC#N)c1cc(NC(=O)C)c(cc1OC)n2nc3c(Br)cc(N)c(Cl)c3n2,"OHE,T, SHAUGHNESSY,DT, LANDI,S, TERAO,Y, SAWANISHI,H, NUKAYA,H,WAKABAYASHI,K AND DEMARINI,DM, MUTATION SPECTRA IN SALMONELLA TA98, TA100, ANDTA104 OF TWO PHENYLBENZOTRIAZOLE MUTAGENS (PBTA-1 AND PBTA-2) DETECTED IN THENISHITAKASE RIVER IN KYOTO, JAPAN, MUTAT. RES. 429(2):189-198, 1999"
+97483-08-4,CCRIS,0,-1,,COP(=O)(OC)Oc1c(Cl)cc(C)cc1Cl,"ONODERA,S, MAEDA,S AND SAITOH,T, MUTAGENIC AND MASS SPECTROMETRICCHARACTERIZATION OF OXYGEN ANALOGS (P=0) DERIVATIZED FROM ORGANOTHIOPHOSPHORUSPESTICIDES, KANKYO KAGAKU 5(3):617-624, 1995"
+527-62-8,EPA1,0,-1,,Nc1cc(Cl)cc(Cl)c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96383-86-7,EPA1,1,-1,,O[C@@H]1C=Cc2c(ccc3c2ccc4ccc(O)cc34)[C@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22603-58-3,CCRIS,1,-1,,Cc1c(cc(c(N)c1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"WHONG,WZ AND EDWARDS,GS, GENOTOXIC ACTIVITY OF NITROAROMATICEXPLOSIVES AND RELATED COMPOUNDS IN SALMONELLA TYPHIMURIUM, MUTAT. RES.136(3):209-215, 1984"
+86334-95-4,CCRIS,0,-1,,OC1CCC(O)(CN(CC(=O)O)N=O)C(O)C1O,"POOL,BL, ROEPER,H, ROEPER,S AND ROMRUEN,K, MUTAGENICITY STUDIES ONN-NITROSATED PRODUCTS OF THE MAILLARD BROWNING REACTION:N-NITROSO-FRUCTOSE-AMINO ACIDS, FOOD CHEM. TOXICOL. 22(10):797-801,1984"
+162022-92-6,CCRIS,0,-1,,Clc1nncc2cnccc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+52101-39-0,CCRIS,1,-1,,COC(=O)c1oc(c(c2ccccc2)c1c3ccccc3)[N+](=O)[O-],"SWAMINATHAN,S, HATCHER,JF, YAMAMOTO,K, TANAKA,A, ICHIKAWA,M ANDBRYAN,GT, MUTAGENICITY OF N- AND O-ACETYL DERIVATIVES OF METHYL 3,4-DIPHENYL-5-HYDROXYLAMINO-2-FUROATE AND N-HYDROXY-4-AMINOBIPHENYL IN SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 17(2):84-92, 1991"
+610-49-1,EPA1,1,-1,"AMINOANT1",Nc1cccc2cc3ccccc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1187-84-4,CCRIS,0,-1,,CSCC(N)C(=O)O,"VAMVAKAS,S, BERTHOLD,K, DEKANT,W AND HENSCHLER,D, BACTERIAL CYSTEINECONJUGATE BETA-LYASE AND THE METABOLISM OF CYSTEINE S-CONJUGATES. STRUCTURALREQUIREMENTS FOR THE CLEAVAGE OF S-CONJUGATES AND THE FORMATION OF REACTIVEINTERMEDIATES, CHEM.-BIOL. INTERACT. 65(1):59-71, 1988"
+5522-43-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3cccc4ccc1c2c34,"YU,S, HERRENO-SAENZ,D, MILLER,DW, KADLUBAR,FF AND FU,PP, MUTAGENICITYOF NITRO- POLYCYCLIC AROMATIC HYDROCARBONS WITH THE NITRO SUBSTITUENT SITUATEDAT THE LONGEST MOLECULAR AXIS, MUTAT. RES. 283(1):45-52, 1992"
+NOCAS_M428,EPA1,0,-1,,C[C@@H](O)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+512-04-9,CCRIS,0,1,,CC1CCC2(OC1)OC3CC4C5CC=C6CC(O)CCC6(C)C5CCC4(C)C3C2C,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y95"
+121-91-5,CCRIS,0,-1,"ISOPHTHAL",OC(=O)c1cccc(c1)C(=O)O,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+68140-48-7,CCRIS,0,-1,,CC(C)C1C(C)C(C)(C)c2cc(C)c(cc12)C(=O)C,"MERSCH-SUNDERMANNO,V, KEVEKORDESO,S AND JENTERO,C, LACK OFMUTAGENICITY OF POLYCYCLIC MUSK FRAGRANCES IN SALMONELLA TYPHIMURIUM, TOXICOL.IN VITRO 12(4):389-393, 1998"
+74-31-7,VITIC,1,-1,"DPPD",N(c1ccccc1)c2ccc(Nc3ccccc3)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+524-89-0,EPA1,1,-1,"MACULINE",COc1c2ccoc2nc3cc4OCOc4cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+202-03-9,EPA1,1,-1,,C1=Cc2c3ccccc3cc4cccc1c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155164-65-1,CCRIS,0,-1,,CCCCC(=O)N1N=CC(=C(Cl)C1=O)Cl,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+830-07-9,CCRIS,1,-1,"NITROFURY",[O-][N+](=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+106532-66-5,CCRIS,1,-1,,CCCCC(=O)\N=C\1/SN(C(=O)CCCC)c2ccc(cc12)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+5307-00-6,EPA1,0,-1,,COc1cc(N)c(C)cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+36791-04-5,VITIC,0,-1,"RIBAVIRIN",NC(=O)c1ncn(n1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+537-92-8,VITIC,0,-1,"ACETOTOLM",CC(=O)Nc1cccc(C)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+162022-90-4,CCRIS,0,-1,,COc1nncc2cnccc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+700-00-5,EPA1,1,-1,,Cn1cnc2c(N)ncnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+161697-04-7,EPA1,1,-1,,CN(C)c1ccc2nc(C)c(C)nc2c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+76113-31-0,CCRIS,1,-1,,[O-][N+](=O)c1cc2c3ccccc3sc2c4ccccc14,"KING,LC KOHAN,MJ BROOKS,L NELSON,GB ROSS,JA ALLISON,J ADAMS,L DESAI,DAMIN,S PADGETT,W LAMBERT,GR RICHARD,AM AND NESNOW,S, AN EVALUATION OF THEMUTAGENICITY, METABOLISM, AND DNA ADDUCT FORMATION OF5-NITROBENZO[B]NAPHTHO[2,1-D]THIOPHENE, CHEM. RES. TOXICOL. 14(6):661-671,2001"
+119613-69-3,CCRIS,0,-1,,CCCc1cc2ccccc2c3ccc4C(O)C(O)C5OC5c4c13,"AMIN,S, HUIE,K, BALANIKAS,G AND HECHT,SS, SYNTHESIS AND MUTAGENICITYOF 5-ALKYL-SUBSTITUTED CHRYSENE-1,2-DIOL-3,4-EPOXIDES,CARCINOGENESIS 9(12):2305-2308, 1988"
+15121-84-3,VITIC,1,-1,,OCCc1ccccc1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6138-79-0,VITIC,0,-1,"TRIPROLID,TRIPROHCL",Cc1ccc(cc1)\C(=C/CN2CCCC2)\c3ccccn3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98447-35-9,CCRIS,0,-1,,CC(C)C(=O)Nc1snc2cc(Cl)ccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+NOCAS_M118,EPA1,1,-1,,C[C@H]1CN1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+611-36-9,EPA1,0,-1,"DR9807027,DR9501399",Oc1ccnc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92072-10-1,EPA1,1,-1,,[O-][N+](=O)c1ccc2c3c1cccc3c4cccc5ccc(c2c45)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89021-88-5,EPA1,1,-1,,N[C@@H](CCC(=O)N[C@@H](CS\C(=C(\Cl)/C(=C(Cl)Cl)Cl)\Cl)C(=O)NCC(=O)O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+121-61-9,EPA1,0,-1,"ACSULFANI",CC(=O)Nc1ccc(cc1)S(=O)(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67019-32-3,CCRIS,0,-1,,CC(=O)Nc1snc2c(Cl)cc(Cl)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+110408-52-1,CCRIS,0,-1,,Oc1cccc2ccc3[nH]c4ccc5ccccc5c4c3c12,"SCHOENY,R AND WARSHAWSKY,D, MUTAGENICITY OF 7H-DIBENZO[C,G]CARBAZOLEAND METABOLITES IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 188(4):275-286,1987"
+67-97-0,EPA3,0,-1,,CC(C)CCC[C@@H](C)[C@@H]1CC[C@@H]2\C(=C/C=C/3\C(CC[C@@H](C3)O)=C)\CCC[C@@]12C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+629-14-1,VITIC,1,-1,,CCOCCOCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+37962-27-9,EPA1,1,-1,,[O-][N+](=O)c1oc(\C=C\C(=O)N\N=C\c2oc(cc2)[N+](=O)[O-])cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128946-65-6,CCRIS,0,-1,"HONONENA4",CCCCCC(O)\C=C\C=O,"CHUNG,FL, CHEN,HJC, GUTTENPLAN,JB, NISHIKAWA,A AND HARD,GC,2,3-EPOXY-4- HYDROXYNONANAL AS A POTENTIAL TUMOR-INITIATING AGENT OF LIPIDPEROXIDATION, CARCINOGENESIS 14(10):2073-2077, 1993"
+2784-94-3,EPA2,1,-1,,CNc1ccc(cc1[N+](=O)[O-])N(CCO)CCO,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+38246-95-6,EPA1,1,-1,,CCOc1ccc(NO)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+129927-33-9,CCRIS,0,-1,"DR9702109,DR9714343",CCN(CC)CC#CC(C)(C)OC(=O)C(O)(C1CCCCC1)c2ccccc2,"OTSUKA,M, KAJIWARA,Y, AJIMI,S, SHIMAZAKI,H, KIKUNO,T, OGURA,S, INAI,T,KAKIMOTO,K, TAMURA,H, WATANABE,M AND SUMI,N, MUTAGENICITY STUDIES OF(+/-)-4-DIETHYLAMINO-1,1-DIMETHYLBUT-2-YN-1-YL2-CYCLOHEXYL-2-HYDROXY-2-PHENYLACETATE MONOHYDROCHLORIDE MONOHYDRATE (NS-21), ANOVEL DRUG FOR URINARY FREQUENCY AND INCONTINENCE, J. TOXICOL. SCI.22(SUPPL.1):251-261, 1997"
+464-49-3,EPA3,0,-1,,CC1(C)[C@H]2CC[C@]1(C)C(=O)C2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M124,EPA1,1,-1,,O=C(OC[C@H]1CO1)[C@H]2CCCC[C@@H]2C(=O)OC[C@H]3CO3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+82-86-0,EPA1,1,-1,,O=C1C(=O)c2cccc3cccc1c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+487-99-0,CCRIS,0,-1,,CC(C)C(O)(C(C)O)C(=O)OCC1CCN2CCCC12,"YAMANAKA,H NAGAO,M AND SUGIMURA,T, MUTAGENICITY OF PYRROLIZIDINEALKALOIDS IN THE SALMONELLA/MAMMALIAN-MICROSOME TEST, MUTAT. RES. 68(3):211-216,1979"
+260-94-6,EPA1,1,-1,"ACRIDINE",c1ccc2nc3ccccc3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56183-24-5,CCRIS,0,-1,,OC1C(O)c2c(ccc3ccccc23)c4ccccc14,"GLATT,H, SEIDEL,A, BOCHNITSCHEK,W, MARQUARDT,H, MARQUARDT,H,HODGSON,RM, GROVER,PL AND OESCH,F, MUTAGENIC AND CELL-TRANSFORMING ACTIVITIES OFTRIOL-EPOXIDES AS COMPARED TO OTHER CHRYSENE METABOLITES, CANCER RES. 46(9):4556-4565, 1986"
+106532-62-1,CCRIS,1,-1,,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)CCCl)\c2c1)C(=O)CCCl,"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+21802-46-0,CCRIS,1,-1,,Nc1ncnc2c1ncn2C(c3ccccc3)(c4ccccc4)c5ccccc5,"GORROD,JW, IOANNIDES,C, LAM,SP AND NEVILLE,S, MUTAGENICITY TESTING OF9-N-SUBSTITUTED ADENINES AND THEIR N-OXIDATION PRODUCTS, ENVIRON. HEALTHPERSPECT. 101(SUPPL. 3):21-26, 1993"
+1214-32-0,CCRIS,1,-1,,Nc1ccc2c(Cc3cc(ccc23)[N+](=O)[O-])c1,"VANCE,WA, WANG,YY AND OKAMOTO,HS, BIFUNCTIONAL NITROFLUORENES:STRUCTURE-ACTIVITY RELATIONSHIPS IN SALMONELLA TYPHIMURIUM, MUTAT. RES.143(4):213-218, 1985"
+98897-14-4,CCRIS,1,-1,,OCNc1ncnc2c1ncn2C3OC(CO)C(O)C3O,"MCCARTNEY,M, MCCOY,EC, ROSENKRANZ,HS AND GINER-SOROLLA,A, CARCINOGENICN-HYDROXYLAMINOPURINE DERIVATIVES DO NOT ACT AS BASE ANALOG MUTAGENS INSALMONELLA TYPHIMURIUM, MUTAT. RES. 144(4):231-237, 1985"
+61-76-7,EPA3,0,-1,,CNC[C@@H](O)c1cccc(O)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+124076-67-1,CCRIS,0,-1,,NC(CSC(F)(F)C(Cl)Cl)C(=O)O,"FINKELSTEIN,MB, VAMVAKAS,S, BITTNER,D AND ANDERS,MW,STRUCTURE-MUTAGENICITY AND STRUCTURE-CYTOTOXICITY STUDIES ON BROMINE-CONTAININGCYSTEINE S-CONJUGATES AND RELATED COMPOUNDS, CHEM. RES. TOXICOL. 7(2):157-163,1994"
+82-68-8,EPA2,0,-1,"QUINTOZEN",[O-][N+](=O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+6232-91-3,CCRIS,0,-1,,COc1ccc2[nH]c(N)nc2c1,"SMITH,C, PAYNE,V, DOOLITTLE,DJ, DEBNATH,AK, LAWLOR,T AND HANSCH,C,MUTAGENIC ACTIVITY OF A SERIES OF SYNTHETIC AND NATURALLY OCCURRING HETEROCYCLICAMINES IN SALMONELLA, MUTAT. RES. 279(1):61-73, 1992"
+133830-97-4,CCRIS,0,-1,"DEMEINDEA",CCC1C(=C(C)c2cc(O)ccc12)c3ccc(O)cc3,"ISHIKAWA,S, ODA,T, SATO,Y AND MOCHIZUKI,M, LACK OF MUTAGENICITY OFDIETHYLSTILBESTROL METABOLITE AND ANALOG, (+/-)-INDENESTROLS A AND B, INBACTERIAL ASSAYS, MUTAT. RES. 368(3-4):261-265, 1996"
+92-93-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc(cc1)c2ccccc2,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+23445-00-3,EPA1,1,-1,,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c3C(=O)c4c(O)ccc(O)c4Oc3c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1146-04-9,CCRIS,1,-1,,CC1=C2C(O)C(C)(C)C=C2C(=O)C(C)(O)C13CC3,"NAGAO,T, SAITO,K, HIRAYAMA,E, UCHIKOSHI,K, KOYAMA,K, NATORI,S,MORISAKI,N, IWASAKI,S AND MATSUSHIMA,T, MUTAGENICITY OF PTAQUILOSIDE, THECARCINOGEN IN BRACKEN, AND ITS RELATED ILLUDANE-TYPE SESQUITERPENES. I.MUTAGENICITY IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 215(2):173-8,1989"
+106400-44-6,CCRIS,1,-1,,NC(CCS\C(=C\Cl)\Cl)C(=O)O,"VAMVAKAS,S, ELFARRA,AA, DEKANT,W, HENSCHLER,D AND ANDERS,MW,MUTAGENICITY OF AMINO ACID AND GLUTATHIONE S-CONJUGATES IN THE AMES TEST, MUTAT.RES. 206(1): 83-90, 1988"
+75584-89-3,CCRIS,0,-1,,CCOC(=O)C[n+]1csc2ccccc12,"VLCKOVA,V, VLCEK,D, PODSTAVKOVA,S, MIADOKOVA,E, KUNIKOVA,I ANDKIJOVSKA,L, TESTING OF MUTAGENIC EFFECT OF THE GROWTH REGULATOR3-ETHOXYCARBONYLMETHYLBENZOTHIAZOLIUM BROMIDE (H-66) ON PROKARYOTIC ANDEUKARYOTIC TEST"
+1163-05-9,EPA1,0,-1,,[O-][n+]1c2ccc3ccccc3c2cc4c5ccccc5ccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105-58-8,VITIC,0,-1,,CCOC(=O)OCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+153-98-0,EPA1,0,-1,"SEROTONIN,SEROCRESU",NCCc1c[nH]c2ccc(O)cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6533-68-2,EPA3,0,-1,,CN1[C@@H]2C[C@@H](C[C@H]1[C@H]3O[C@@H]23)OC(=O)[C@@H](CO)c4ccccc4,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+126222-34-2,CCRIS,0,-1,,CC(C)(C)S(=O)(=O)CC(Cc1ccccc1)C(=O)NC(Cc2c[nH]cn2)C(=O)NC(CC3CCCCC3)C(O)C(O)C4CC4,"ALBERTINI,S AND GOCKE,E, RENIN INHIBITORS AS AN EXAMPLE OF PRESUMPTIVEIRRELEVANT POSITIVE FINDINGS IN THE SALMONELLA/MAMMALIAN MICROSOME ASSAY (AMESTEST), MUTAT. RES. 298(4):237-246, 1993"
+55557-00-1,EPA2,1,-1,,O=NN1CCCN(CC1)N=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+95050-14-9,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c3cc4cccc5ccc6ccc(c12)c3c6c45,"MINABE,M AND SHIBUYA,N, NITRATION OF INDENO[1,2,3-CD]PYRENE ANDMUTAGENIC ACTIVITIES OF RELATED COMPOUNDS, CHEM. RES. TOXICOL. 2(6):357-358,1989"
+4584-57-0,EPA1,1,-1,,CN(C)c1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+114607-46-4,EPA1,0,-1,"WP-871",OC(=O)C(=O)Nc1cccc(c1)c2nn[nH]n2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+30517-66-9,CCRIS,0,-1,,Oc1cccc2Oc3c4C5CCOC5Oc4cc(O)c3C(=O)c12,"MORI,H, SUGIE,S, YOSHIMI,N, KITAMURA,J, NIWA,M, HAMASAKI,T ANDKAWAI,K, GENOTOXIC EFFECTS OF A VARIETY OF STERIGMATOCYSTIN-RELATED COMPOUNDS INTHE HEPATOCYTE/DNA-REPAIR TEST AND THE SALMONELLA MICROSOME ASSAY, MUTAT. RES.173(3):217-222, 1986"
+146795-28-0,CCRIS,1,-1,,COc1ccccc1NC(=O)c2csc(c2)[N+](=O)[O-],"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+202-33-5,EPA1,1,-1,,C1=Cc2c3ccc4ccccc4c3cc5cccc1c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+645-12-5,CCRIS,1,-1,,OC(=O)c1oc(cc1)[N+](=O)[O-],"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+NOCAS_M286,EPA1,1,-1,,C1O[C@H]1c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13365-37-2,EPA1,1,-1,,CN(C)CCCNc1c2ccccc2nc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1456-28-6,CCRIS,1,-1,,CC1CN(CC(C)O1)N=O,"MORI,Y, YAMAZAKI,H, TOYOSHI,K, DENDA,A AND KONISHI,Y, MUTAGENICACTIVATION OF CARCINOGENIC N-NITROSOPROPYLAMINES BY LIVER S9 FRACTIONS FROMMICE, RATS AND HAMSTERS. EVIDENCE FOR A CYTOCHROME P-450-DEPENDENT REACTION,CARCINOGENESIS 7(3):375-379, 1986"
+29128-23-2,CCRIS,1,-1,,[O-][N+](=O)c1cc(c(c2ccccc2)c(c1)[N+](=O)[O-])[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K"
+1613-37-2,CCRIS,0,-1,,[O-][n+]1cccc2ccccc12,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+19770-52-6,EPA1,1,-1,,C1=Cc2c3ccccc3cc4cc5ccccc5c1c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+76-14-2,VITIC,0,-1,"CRYOFLUOR",FC(F)(Cl)C(F)(F)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13849-08-6,CCRIS,1,-1,"MARMESIN",CC(C)(O)C1Cc2cc3C=CC(=O)Oc3cc2O1,"UWAIFO,AO, THE MUTAGENICITIES OF SEVEN COUMARIN DERIVATIVES AND AFURAN DERIVATIVE (NIMBOLIDE) ISOLATED FROM THREE MEDICINAL PLANTS, J. TOXICOL.ENVIRON. HEALTH 13(4-6):521-530, 1984"
+24245-99-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2nscc2c1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+120-40-1,VITIC,0,-1,"DR9606752",CCCCCCCCCCCC(=O)N(CCO)CCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+145241-75-4,CCRIS,1,-1,,Fc1cc(F)c2ncccc2c1,"KATO,T, SAEKI,K, KAWAZOE,Y AND HAKURA,A, EFFECTS OF OLIGOFLUORINESUBSTITUTION ON THE MUTAGENICITY OF QUINOLINE: A STUDY WITH TWELVEFLUOROQUINOLINE DERIVATIVES, MUTAT. RES. 439(2):149-157, 1999"
+101821-44-7,CCRIS,0,-1,"314-44",NC(=N)c1cc2ccc(Br)cc2[nH]1,"STAUFFERT,I, PAULINI,H, STEINMANN,U, SIPPEL,H AND ESTLER,CJ,INVESTIGATIONS ON MUTAGENICITY AND GENOTOXICITY OF PENTAMIDINE AND SOME RELATEDTRYPANOCIDAL DIAMIDINES, MUTAT. RES. 245(2):93-98, 1990"
+621-31-8,VITIC,1,-1,,CCNc1cccc(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5831-16-3,EPA3,1,-1,,C[C@@H]1CCc2c1cc(C)c3c2ccc4ccccc34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+128753-88-8,CCRIS,1,-1,,COc1cccc2c1OC3(C)OOC23C,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+6691-68-5,EPA1,1,-1,"C-265",CN(C)CCCNc1c2ccccc2nc3c(cccc13)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M99,EPA1,1,-1,,CC[C@@]12O[C@]1(C(=O)OC)C(=O)N[C@]2(C)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+77314-23-9,CCRIS,1,-1,,Cn1c(NO)nc2c3cccnc3ccc12,"SNYDERWINE,EG, WIRTH,PJ, ROLLER,PP, ADAMSON,RH, SATO,S ANDTHORGEIRSSON,SS, MUTAGENICITY AND IN VITRO COVALENT DNA BINDING OF2-HYDROXYAMINO-3-METHYLIMIDAZOLO[4,5-F]QUINOLINE, CARCINOGENESIS 9(3):411-418,1988"
+59-31-4,CCRIS,0,-1,,Oc1ccc2ccccc2n1,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+67199-66-0,CCRIS,1,-1,"NSC320846",Nc1ccc2N=C3N(Cc2c1)C(=O)c4ccccc34,"STEVENS,GJ, LAVOIE,EJ AND MCQUEEN,CA, THE ROLE OF ACETYLATION IN THEMUTAGENICITY OF THE ANTITUMOR AGENT, BATRACYLIN, CARCINOGENESIS 17(1):115-119,1996"
+2835-98-5,EPA1,1,-1,,Cc1ccc(N)c(O)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+73-24-5,EPA1,1,-1,"ADENINE,ADENINHCL,ADENINEPH,ADENINSUL",Nc1[nH]cnc2ncnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+496-72-0,VITIC,1,-1,,Cc1ccc(N)c(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M234,EPA1,1,-1,,O1[C@@H]2[C@H]1c3cc4c(ccc5ccccc45)cc3c6ccccc26,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1070-70-8,EPA1,0,-1,,C=CC(=O)OCCCCOC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13154-57-9,CCRIS,0,-1,,CC(C)(C)OOC1(C)C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C,"YOSHIDA,Y, STUDY ON MUTAGENICITY AND ANTIMUTAGENICITY OF BHT AND ITSDERIVATIVES IN A BACTERIAL ASSAY, MUTAT. RES. 242(3):209-217, 1990"
+5208-87-7,EPA3,0,-1,,O[C@H](C=C)c1ccc2OCOc2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+39013-93-9,EPA1,1,-1,,CCN(CCCl)CCCNc1c2ccccc2nc3c1ccc4cccnc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112077-92-6,CCRIS,0,-1,,CC(=O)ON(C(=O)C)c1ccccc1C,"GUPTA,RL, GUPTA,AK, PATHAK,DP AND JUNEJA,TR, MUTAGENIC STUDIES OFORTHO-TOLUIDINE AND ITS POTENTIAL METABOLITES, INDIAN J. EXP. BIOL.25(9):618-622, 1987"
+124-64-1,EPA1,0,-1,,OCP(CO)(CO)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+20562-03-2,CCRIS,0,1,,CC1CCC2C(C)C3C(CC4C5CC=C6CC(CCC6(C)C5CCC34C)OC7OC(CO)C(OC8OC(C)C(O)C(O)C8O)C(O)C7OC9OC(C)C(O)C(O)C9O)N2C1,"FRIEDMAN,M AND HENIKA,PR, ABSENCE OF GENOTOXICITY OF POTATO ALKALOIDSALPHA- CHACONINE, ALPHA-SOLANINE, AND SOLANIDINE IN THE AMES SALMONELLA ANDADULT AND FETAL ERYTHROCYTE MICRONUCLEUS ASSAYS, FOOD CHEM. TOXICOL.30(8):689-694, 1992"
+481-49-2,EPA1,1,-1,,COc1ccc2C[C@H]3N(C)CCc4cc(OC)c(Oc5c6OCOc6cc7CCN(C)[C@@H](Cc8ccc(Oc1c2)cc8)c57)cc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+462-60-2,EPA1,0,-1,,NC(=O)NCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109-83-1,VITIC,0,-1,"DR0040968",CNCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1709-39-3,EPA1,0,-1,,CCN(CC)S(=O)(=O)c1ccc(N)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54484-91-2,EPA3,1,-1,,CC[N+]([O-])(CC)CCn1nc2c3ccc(Cl)cc3Sc4c(CO)ccc1c24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+97-54-1,EPA3,0,-1,,COc1cc(\C=C/C)ccc1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+616-40-0,CCRIS,0,-1,,CCN(N)CC,"AAGAARD NIELSEN,P, LAGERSTED,A, DANIELSEN,S, JENSEN,AA, HART,J ANDLARSEN,JC, MUTAGENIC ACTIVITY OF NINE N,N-DISUBSTITUTED HYDRAZINES IN THESALMONELLA/ MAMMALIAN MICROSOME ASSAY, MUTAT. RES. 278(4):215-226,1992"
+60262-87-5,CCRIS,0,-1,,OC1C(Oc2ccc3cc4ccc5cccc6ccc(c3c2)c4c56)OC(C(O)C1O)C(=O)O,"IRWIN,SE, KWEI,GY, BLACKBURN,GR, THURMAN,R AND KAUFFMAN,FC,MUTAGENICITY OF BENZO[A]PYRENYL-1-SULFATE IN THE AMES TEST,ENVIRON. MOL.MUTAGEN. 19(3):253- 258, 1992"
+1633-83-6,EPA3,1,-1,,O=S1(=O)CCCCO1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+57309-38-3,CCRIS,0,-1,,CC1(N(O)c2ccccc2/C/1=N\c3ccccc3)c4ccccc4,"DAMIANI,E GRECI,L AND HRELIA,P, CYTO- AND GENOTOXIC EFFECTS OF NOVELAROMATIC NITROXIDE RADICALS IN VITRO, FREE RADICAL BIOL. MED. 28(3):330-336,2000"
+112653-29-9,EPA1,0,-1,,OCC(CO)N[C@@H]1C[C@](O)(CO)[C@H](O)[C@@H](O)[C@@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120-78-5,VITIC,1,-1,,S(Sc1nc2ccccc2s1)c3nc4ccccc4s3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M120,EPA1,1,-1,,C[C@H]1C[C@H](OC(=O)C)O[C@H](C)O1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13088-34-1,EPA1,1,-1,,ClC(=C1OC(=O)C=C1)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51-30-9,CCRIS,0,-1,"ISOPRENAL,ISOPREBIT,ISOPREHCL,ISOPRENAS",CC(C)NCC(O)c1ccc(O)c(O)c1,"HAWORTH,S, LAWLOR,T MORTELMANS,K, SPECK,W AND ZEIGER,E, SALMONELLAMUTAGENICITY TEST RESULTS FOR 250 CHEMICALS, ENVIRON. MUTAGEN. 5(SUPPL. 1):3-142, 1983"
+17700-09-3,VITIC,1,-1,,[O-][N+](=O)c1ccc(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+29082-75-5,CCRIS,0,-1,,ClC(=Cc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl)Cl,"TARKPEA,M, HAGEN,I, CARLBERG,GE, KOLSAKER,P AND STORFLOR,H,MUTAGENICITY, ACUTE TOXICITY, AND BIOACCUMULATION POTENTIAL OF SIX CHLORINATEDSTYRENES, BULL. ENVIRON. CONTAM. TOXICOL. 35(4):525-530, 1985"
+67-21-0,EPA1,0,-1,,CCSCC[C@H](N)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+36504-67-3,EPA3,1,-1,,C1Cc2c(cc3ccc4cccc5ccc2c3c45)[C@@H]6O[C@H]16,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+97055-38-4,CCRIS,1,-1,,COC1OC(=O)C(=C1C(Cl)Cl)Cl,"ISHIGURO,Y, LALONDE,RT, DENCE,CW AND SANTODONATO,J, MUTAGENICITY OFCHLORINE-SUBSTITUTED FURANONES AND THEIR INACTIVATION BY REACTION WITHNUCLEOPHILES,ENVIRON. TOXICOL. CHEM. 6(12):935-946, 1987"
+65445-61-6,EPA3,1,-1,,ClC1CCN(CC1)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+118-96-7,CCRIS,1,-1,"TRINITROT",Cc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"GEORGE,SE HUGGINS-CLARK,G AND BROOKS,LR, USE OF A SALMONELLAMICROSUSPENSION BIOASSAY TO DETECT THE MUTAGENICITY OF MUNITIONS COMPOUNDS ATLOW CONCENTRATIONS, MUTAT. RES. 490(1):45-56, 2001"
+5667-20-9,EPA1,1,-1,,ONc1[nH]cnc2ncnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84-66-2,VITIC,0,-1,"DIETPHTHA",CCOC(=O)c1ccccc1C(=O)OCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+116374-65-3,CCRIS,1,-1,,CN(C)CCCNc1c2ccccc2nc3c(Cl)ccc(c13)[N+](=O)[O-],"FERGUSON,LR, DENNY,WA AND O'ROURKE,SM, MUTAGENIC ACTIVITY OFNITRACRINE DERIVATIVES IN SALMONELLA TYPHIMURIUM: RELATIONSHIP TO DRUGPHYSICOCHEMICAL PARAMETERS, AND TO BACTERIAL UVRB AND RECA GENES AND PLASMIDPKM101, MUTAT. RES. 223(1):13-22, 1989"
+24496-65-9,EPA1,1,-1,,c1ccc2c(c1)cc3ccc4cccc5ncc2c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3397-62-4,EPA1,0,-1,,Nc1nc(N)nc(Cl)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134-32-7,VITIC,1,-1,"NAPHTHYLA",Nc1cccc2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+15110-74-4,VITIC,1,-1,,[O-][N+](=O)c1ccc2c(Cc3cccc(c23)[N+](=O)[O-])c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+501-53-1,EPA1,0,-1,,ClC(=O)OCc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+605-94-7,EPA1,0,-1,"UBIQUIN-0",COC1=C(OC)C(=O)C(=CC1=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+157996-59-3,CCRIS,1,-1,,Nc1c2ccccc2nc3ccc(Br)cc13,"TOMOSAKA,H, OMATA,S, HASEGAWA,E AND ANZAI,K, THE EFFECTS OFSUBSTITUENTS INTRODUCED INTO 9-AMINOACRIDINE ON FRAMESHIFT MUTAGENICITY AND DNABINDING AFFINITY, BIOSCI., BIOTECHNOL., BIOCHEM. 61(7):1121-1125,1997"
+72-33-3,EPA2,0,1,,COc1ccc2C3CCC4(C)C(CCC4(O)C#C)C3CCc2c1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+13177-29-2,CCRIS,1,-1,,[O-][N+](=O)c1cc2c3ccccc3c4cccc(c1)c24,"WATANABE,T, TAKASHIMA,M, KASAI,T AND HIRAYAMA,T, COMPARISON OF THEMUTATIONAL SPECIFICITY INDUCED BY ENVIRONMENTAL GENOTOXIN NITRATED POLYCYCLICAROMATIC HYDROCARBONS IN SALMONELLA TYPHIMURIUM HIS GENES, MUTAT. RES.394(1-3):103-112, 1997"
+29916-56-1,CCRIS,1,-1,,[O-][N+](=O)C1CCCC1,"CONAWAY,CC, HUSSAIN,NS, WAY,BM AND FIALA,ES, EVALUATION OF SECONDARYNITROALKANES, THEIR NITRONATES, PRIMARY NITROALKANES, NITROCARBINOLS, AND OTHERALIPHATIC NITRO COMPOUNDS IN THE AMES SALMONELLA ASSAY, MUTAT. RES.261(3):197-207, 1991"
+483-65-8,EPA1,0,-1,,CC(C)c1ccc2c(ccc3c(C)cccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+81424-67-1,EPA1,1,-1,"CARACEMID",CNC(=O)ON(C(=O)C)C(=O)NC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+434-13-9,EPA3,0,1,,C[C@@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+66-75-1,EPA1,1,-1,"URAMUSTIN",Oc1ncc(N(CCCl)CCCl)c(O)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-70-9,CCRIS,0,-1,"TRIDECAOL",CCCCCCCCCCCCCO,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+162022-89-1,CCRIS,1,-1,,NNc1nncc2ccncc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+102-13-6,EPA1,0,-1,,CC(C)COC(=O)Cc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108171-26-2,VITIC,0,-1,,CCCCCCCCCCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+14191-22-1,EPA1,1,-1,,[O-][N+](=O)c1ccc2c(c1)[nH]c3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26741-53-7,EPA1,0,-1,,CC(C)(C)c1ccc(OP2OCC3(COP(Oc4ccc(cc4C(C)(C)C)C(C)(C)C)OC3)CO2)c(c1)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15386-58-0,CCRIS,0,-1,,Clc1ccc(cc1Cl)N2C(=O)CCC2=O,"RASHID,KA, ARJMAND,M, SANDERMANN,H AND MUMMA,RO, MUTAGENICITY OFCHLOROANILINE/LIGNIN METABOLITES IN THE SALMONELLA/MICROSOME ASSAY, J. ENVIRON.SCI. HEALTH, PART B B22(6):721-729, 1987"
+75-36-5,VITIC,0,-1,,CC(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2402-77-9,EPA1,1,-1,,Clc1cccnc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+33229-34-4,EPA2,1,-1,,OCCNc1ccc(cc1[N+](=O)[O-])N(CCO)CCO,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+518-82-1,VITIC,1,-1,"EMODIN",Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+523-66-0,EPA1,1,-1,"DR0007558",COc1ccc2c(OC)c3ccoc3nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22608-53-3,EPA1,0,-1,,COP(=O)(SC)SC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-77-3,VITIC,0,-1,,COCCOCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+771-97-1,EPA1,1,-1,,Nc1cc2ccccc2cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56257-59-1,CCRIS,1,-1,,Oc1ccc2c3C(C4OC4C(=O)c13)C5(O)CCC(=O)c6c(O)ccc2c56,"STACK,ME AND PRIVAL,MJ, MUTAGENICITY OF THE ALTERNARIA METABOLITESALTERTOXINS I, II AND III, APPL. ENVIRON. MICROBIOL. 52(4):718-722,1986"
+77-81-6,CCRIS,0,-1,"TABUN",CCOP(=O)(C#N)N(C)C,"GOLDMAN,M, NASR,M, CONE,N, ROSENBLATT,LS AND WILSON,BW, TOXICITYSTUDIES ON AGENT GA. MUTAGENICITY OF TABUN (GA) IN THE AMES MUTAGENICITY ASSAY,U.S. ARMY MEDICAL RESEARCH AND DEVELOPMENT COMMAND, NTIS AD-A224672,1989"
+345667-02-9,CCRIS,1,-1,,CC(C)(C)c1ccc(cc1)c2ccc(NO)cc2,"HAACHK,T ERDINGER,L AND BOCHE,G, MUTAGENICITY IN SALMONELLATYPHIMURIUM TA98 AND TA100 OF NITROSO AND RESPECTIVE HYDROXYLAMINE COMPOUNDS,MUTAT. RES. 491(1-2):183-193, 2001"
+115-86-6,VITIC,0,-1,,O=P(Oc1ccccc1)(Oc2ccccc2)Oc3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M201,EPA1,1,-1,,OC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+610-15-1,VITIC,1,-1,,NC(=O)c1ccccc1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+57011-48-0,CCRIS,1,-1,,OC(CN=N#N)CN=N#N,"JURICEK,M, GRUZ,P, VELEMINSKY,J, STANEK,J, KEFURT,K, MORAVCOVA,J ANDJARY,J, MUTAGENIC ACTIVITY OF 6-AZIDO DEOXYHEXOSES AND AZIDO ALCOHOLS INSALMONELLA TYPHIMURIUM AND ITS INHIBITION BY A STRUCTURE-SIMILAR CARBON SOURCEIN THE MEDIUM, MUTAT. RES. 251(1):13-20, 1991"
+194590-84-6,CCRIS,1,-1,,COCCN(CCOC)c1cc(NC(=O)C)c(cc1OC)n2nc3c(Br)cc(N)c(Cl)c3n2,"OHE,T, SHAUGHNESSY,DT, LANDI,S, TERAO,Y, SAWANISHI,H, NUKAYA,H,WAKABAYASHI,K AND DEMARINI,DM, MUTATION SPECTRA IN SALMONELLA TA98, TA100, ANDTA104 OF TWO PHENYLBENZOTRIAZOLE MUTAGENS (PBTA-1 AND PBTA-2) DETECTED IN THENISHITAKASE RIVER IN KYOTO, JAPAN, MUTAT. RES. 429(2):189-198, 1999"
+159092-84-9,CCRIS,1,-1,,[O-][N+](=O)c1ccc2cc(c3ccc(cc3c2c1)[N+](=O)[O-])[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+939-99-1,EPA1,0,-1,,FC(F)(F)c1ccc(CCl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70-30-4,VITIC,0,-1,"HEXACLPHE",Oc1c(Cl)cc(Cl)c(Cl)c1Cc2c(O)c(Cl)cc(Cl)c2Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+28622-66-4,CCRIS,1,-1,,OC1C=Cc2c(ccc3ccccc23)C1O,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+20268-52-4,EPA1,1,-1,,Clc1c2ccccc2cc3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14064-58-5,CCRIS,1,-1,,COc1cccc(\C=C\c2ccc(cc2)[N+](=O)[O-])c1,"HOOBERMAN,BH, BREZZELL,MD, DAS,SK, YOU,Z AND SINSHEIMER,JE,SUBSTITUENT EFFECTS ON THE GENOTOXICITY OF 4-NITROSTILBENE DERIVATIVES, MUTAT.RES. 341(1): 57-69, 1994"
+128349-98-4,CCRIS,0,-1,,CC(\C=C(\C#N)/c1ccc(Br)cc1)C(C(C#N)c2ccc(Br)cc2)c3ccccc3,"AL-ARAB,MM, GHANEM,BS AND MASLAT,AO, SYNTHESIS, SPECTROSCOPY, ANDMUTAGENICITY OF NOVEL HEPTENEDINITRILES, TOXICOL. ENVIRON. CHEM. 27(4):267-275,1990"
+5709-68-2,CCRIS,1,-1,,Cn1c(nc2ccccc12)[N+](=O)[O-],"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+NOCAS_M283,EPA1,1,-1,,BrC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68268-12-2,CCRIS,0,-1,,CCN(C(=O)CCCCl)c1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+98499-59-3,CCRIS,1,-1,,CSCNc1ccccc1,"VITO,M, ESPOSITO,G, VICARI,L, LEMBO,S, IMPERATRICE,ML AND DEMARINIS,E,MUTAGENIC ACTIVITY OF CHLORODIMETHYL SULFIDE AND SOME OF ITS ANILINEDERIVATIVES, BOLL.- SOC. ITAL. BIOL. SPER. 61(6):917-923, 1985"
+134998-77-9,CCRIS,1,-1,,[O-][N+](=O)c1cc2cccc3c4ccccc4c5cccc1c5c23,"JUNG,H, SHAIKH,AU, HEFLICH,RH AND FU,PP, NITRO GROUP ORIENTATION,REDUCTION POTENTIAL, AND DIRECT-ACTING MUTAGENICITY OF NITRO-POLYCYCLIC AROMATICHYDRO- CARBONS, ENVIRON. MOL. MUTAGEN. 17(3):169-180, 1991"
+627-11-2,EPA3,0,-1,,ClCCOC(=O)Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+67019-22-1,CCRIS,0,-1,,CC(C)C(=O)Nc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+77376-01-3,CCRIS,0,-1,,CC(=O)OCc1ccccc1[N+](=O)[O-],"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+7227-91-0,EPA2,1,-1,,CN(C)N=Nc1ccccc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+2578-75-8,EPA2,1,-1,,CC(=O)Nc1nnc(s1)c2oc(cc2)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+82389-34-2,CCRIS,0,-1,,O=C(C1OC1c2ccc(cc2)c3ccccc3)c4ccccc4,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+6428-94-0,EPA1,0,-1,,Oc1ccc(N=Nc2ccc(cc2)[N+](=O)[O-])c(O)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38848-76-9,VITIC,0,-1,,CCCCCCCCCCCCCC(=O)[N-][N+](C)(C)CC(C)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+115664-51-2,EPA1,1,-1,,Oc1ccc2ccc3ccc(c4c5ccccc5c1c2c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55520-40-6,CCRIS,0,-1,"DR9900621",NC(Cc1ccc(O)cc1)C(=O)O,"DE VEER,I, MORISKE,HJ AND RUEDEN,H, PHOTOCHEMICAL DECOMPOSITION OFORGANIC COMPOUNDS IN WATER AFTER UV-IRRADIATION: INVESTIGATION OF POSITIVEMUTAGENIC EFFECTS, TOXICOL. LETT. 72(1-3):113-119, 1994"
+77109-49-0,CCRIS,1,-1,,COC(=O)C(CSCCBr)NC(=O)C,"ZOETEMELK,CEM, MOHN,GR, VAN DER GEN,A AND BREIMER,DD, 1,2-DIBROMOCOMPOUNDS. THEIR MUTAGENICITY IN SALMONELLA STRAINS DIFFERING IN GLUTATHIONECONTENT AND THEIR ALKYLATING POTENTIAL, BIOCHEM. PHARMACOL. 36(11):1829-1835,1987"
+135-73-9,EPA1,1,-1,,BrCC(=O)c1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19213-10-6,CCRIS,0,-1,"HOACETOAC",CC(=O)CC(=O)Nc1ccc(O)cc1,"NOHMI,T, ISHIDATE,M,JR, HIRATSUKA,A AND WATABE,T, MECHANISM OFMETABOLIC ACTIVATION"
+86854-03-7,CCRIS,0,-1,,O=C1c2ccccc2c3ccc4ccc5ccccc5c4c13,"MARROCCHI,A, MINUTI,L, MOROZZI,G, PAMPANELLA,L AND TATICCHI,A,SYNTHESIS AND MUTAGENICITY OF SOME CYCLO[C]PHENANTHRENES ANDINDENO[C]PHENANTHRENES, CARCINOGENESIS 17(9):2009-2012, 1996"
+79748-81-5,EPA1,1,-1,,COC(=O)\C(=C\C)\C=C(/C)\C=C(/C)\C=C\C=C(/C)\C(=O)[C@@]12O[C@@H]1[C@](O)(CCO)NC2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+123098-37-3,CCRIS,0,-1,,CC(=O)N1CNC(=O)N(C(=O)C)C1=O,"EL-TERRAS,A, BRAUN,R, STENZ,E AND SCHUSTER,G, MUTAGENICITY OFANTIVIRAL SUBSTANCES OF NUCLEOBASE ANALOG TYPE IN SALMONELLA TYPHIMURIUMEMPLOYING METABOLIC"
+61477-94-9,CCRIS,0,-1,"PIRMENOL,PIRMENHCL",CC1CCCC(C)N1CCCC(O)(c2ccccc2)c3ccccn3,"CIARAVINO,V, KROPKO,ML, KRISHNA,G, MONTEITH,DK AND THEISS,JC,GENOTOXICITY ASSESSMENT OF PIRMENOL A NEW ANTIARRHYTHMIC DRUG, MUTAT. RES.280(3): 205-214, 1992"
+54567-09-8,CCRIS,1,-1,,OCCN(CCO)c1ccc(cc1)N=Nc2ccc(cc2C#N)[N+](=O)[O-],"ELLIOTT,BM, JACKH,R AND JUNG,R, EVALUATION OF THE GENOTOXICITY OF4-DIETHYLAMINO-4'-NITROAZOBENZENE AND SEVEN ANALOGUES, MUTAGENESIS 9(6):517-521, 1994"
+1088-11-5,CCRIS,0,-1,"NORDAZEPA",Clc1ccc2NC(=O)CN=C(c3ccccc3)c2c1,"BALBI,A MUSCETTOLA,G STAIANO,N MARTIRE,G AND DE LORENZO,F, PSYCHOTROPIC DRUGS: EVALUATION OF MUTAGENIC EFFECT,  PHARMACOL. RES. COMMUN.12(5):423-431, 1980"
+13360-61-7,EPA1,0,-1,,CCCCCCCCCCCCCC=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90745-27-0,CCRIS,1,-1,,Cc1cccc2cccc(c12)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+142-46-1,VITIC,0,-1,"DTHIOBIUR",NC(=S)NNC(=S)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6530-27-4,EPA1,1,-1,,ONc1ccc(cc1)N=Nc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M259,EPA1,1,-1,,CC(C)(C)CCCCCC(=O)OC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134-58-7,CCRIS,0,-1,"AZAGUANIN",Nc1nc(O)c2[nH]nnc2n1,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+59405-72-0,CCRIS,1,-1,,CCCCOc1ccc(cn1)N=Nc2ccc(cc2)N(CC)CC,"SHAHIN,MM, MUTAGENICITY OF STRUCTURALLY RELATED PHENYLAZO-3-PYRIDINESIN SALMONELLA TYPHIMURIUM, CELL BIOL. TOXICOL. 9(1):33-47, 1993"
+98447-34-8,CCRIS,0,-1,,CCCC(=O)Nc1snc2cc(Cl)ccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+115314-17-5,EPA1,1,-1,,[O-][N+](=O)c1cccc(c1)S(=O)(=O)OC[C@H]2CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7300-59-6,CCRIS,0,-1,,NC(CCC(=O)Nc1ccc(cc1)[N+](=O)[O-])C(=O)O,"KEREN,R AND STARK,AA, GAMMA-GLUTAMYL TRANSPEPTIDASE-DEPENDENTMUTAGENICITY AND CYTOTOXICITY OF GAMMA-GLUTAMYL DERIVATIVES: A MODEL FORBIOCHEMICAL TARGETING OF CHEMOTHERAPEUTIC AGENTS, ENVIRON. MOL. MUTAGEN.32(4):377-386, 1998"
+478-43-3,VITIC,1,-1,"RHEIN",OC(=O)c1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+110-54-3,VITIC,0,-1,"HEXANE",CCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+58718-48-2,CCRIS,1,-1,,[O-][N+](=O)c1cccc2nc3cccc(c3nc12)[N+](=O)[O-],"WATANABE,T, HANASAKI,Y, HIRAYAMA,T AND FUKUI,S, MUTAGENICITY OF NITRO-AND AMINO-SUBSTITUTED PHENAZINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.225(3):75-82, 1989"
+103393-72-2,EPA1,1,-1,,ClCc1ccc2c3cccc4cccc(c2c1)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+598-38-9,EPA3,1,-1,"DICLETHAN",OCC(Cl)Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+159714-86-0,CCRIS,1,-1,,CCc1c2C3NC3c4ccccc4c2cc5ccccc15,"GLATT,H, ABU-SHQARA,E, MARTINE,U, BAIDOSSI,W, HARVEY,RG AND BLUM,J,K-REGION OXIDES AND IMINES DERIVED FROM ALKYLATED BENZ[A]ANTHRACENE CONGENERS:SYNTHESIS, STABILITY IN AQUEOUS MEDIA AND MUTAGENICITY, MUTAGENESIS 9(2):83-92,1994"
+92-31-9,EPA1,1,-1,"TOLONIUCL",CN(C)c1ccc2nc3cc(C)c(N)cc3[s+]c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108529-37-9,EPA1,1,-1,,CC(=O)Nc1nc2c3cccnc3ccc2n1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78-59-1,VITIC,0,-1,,CC1=CC(=O)CC(C)(C)C1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6382-01-0,EPA1,0,-1,"GLUTAMATE",N[C@@H](CCC(=O)O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22089-22-1,CCRIS,1,-1,"TROFOSFAM",ClCCN(CCCl)P1(=O)OCCCN1CCCl,"OESCH-BARTLOMOWICZ,B, VOGEL,S, ARENS,HJ AND OESCH,F, MODULATION OF THECONTROL OF MUTAGENIC METABOLITES DERIVED FROM CYCLOPHOSPHAMIDE AND IFOSFAMIDE BYSTIMULATION OF PROTEIN KINASE A, MUTAT. RES. 232(2):305-312, 1990"
+18234-46-3,EPA1,1,-1,"BALDRINAL",CC(=O)OCc1cocc2c(C=O)ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111712-51-7,CCRIS,0,-1,,CC(C)(Br)C(Br)CCl,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+32959-60-7,EPA1,0,-1,,Cc1ccccc1c2oc3ccccc3n2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+52-28-8,EPA1,0,-1,,COc1ccc2C[C@@H]3[C@@H]4C=C[C@H](O)[C@H]5Oc1c2[C@]45CCN3C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+937-40-6,EPA1,1,-1,,CN(Cc1ccccc1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M173,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3cccc4[C@H]5O[C@H]5c1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+42794-87-6,EPA3,1,-1,,Nc1c(F)cc(cc1F)c2cc(F)c(N)c(F)c2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+85-82-5,EPA1,0,-1,,Cc1cc(C)cc(c1)N=Nc2c(O)ccc3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+77191-36-7,EPA1,0,-1,"DM-9384",Cc1cccc(C)c1NC(=O)CN2CCCC2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M381,EPA1,0,-1,,CC(=CCC[C@@](C)(O)C=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91575-28-9,EPA1,1,-1,,CC(=O)Nc1ccc(Cc2ccc(N)c(Cl)c2)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2221-41-2,EPA1,1,-1,"DR0032852",COc1ccc2nc3occc3c(OC)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22008-60-2,CCRIS,0,-1,,CSCCC(NC=O)C(=O)NC(Cc1ccccc1)C(=O)O,"ALLEN,JS AND PANFILI,J, AMES SALMONELLA/MAMMALIAN-MICROSOME TESTING OFPEPTIDES AND PEPTIDE SYNTHESIS REAGENTS, MUTAT. RES. 170(1-2):23-29,1986"
+53-70-3,VITIC,1,-1,,c1ccc2c(c1)ccc3cc4c(ccc5ccccc45)cc23,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105708-79-0,CCRIS,1,-1,,CC(=O)OCc1ccc2ccc3cccc4ccc1c2c34,"SURH,YJ, BLOMQUIST,JC,"
+113163-23-8,CCRIS,0,-1,,C1Cc2c(ccc3cccnc23)C4OC14,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+151-50-8,VITIC,0,-1,,[C-]#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+83-66-9,VITIC,0,-1,,COc1c(c(C)c(cc1C(C)(C)C)[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6473-13-8,EPA1,1,-1,,Nc1ccc(N=Nc2ccc3cc(c(N=Nc4ccc(Nc5ccc(cc5S(=O)(=O)O)N=Nc6c(O)c7cc(ccc7cc6S(=O)(=O)O)N=Nc8ccc(N)cc8N)cc4)c(O)c3c2)S(=O)(=O)O)c(N)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101126-65-2,CCRIS,1,-1,,[O-][N+](=O)c1c(Cl)c(Cl)c2Oc3c(Cl)c(Cl)ccc3Oc2c1Cl,"DONNELLY,KC, JONES,DH AND SAFE,S, THE BACTERIAL MUTAGENICITY OFNITROPOLYCHLORINATED DIBENZO-P-DIOXINS, MUTAT. RES. 169(1-2):17-22,1986"
+32534-81-9,EPA3,0,-1,,Brc1ccc(Oc2cc(Br)c(Br)cc2Br)c(Br)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+612-22-6,CCRIS,0,-1,,CCc1ccccc1[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+2912-62-1,CCRIS,1,-1,,ClC(C(=O)Cl)c1ccccc1,"OHKUBO,T, GOTO,S, ENDO,O, HAYASHI,T, WATANABE,E AND ENDO,H,MUTAGENICITY OF CHLORINATED AROMATIC HYDROCARBONS CONTAINING OXYGEN, KANKYOKAGAKU 6(4):533-540, 1996"
+1197-55-3,EPA1,1,-1,,Nc1ccc(CC(=O)O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13889-92-4,VITIC,1,-1,,CCCSC(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4245-76-5,GENETOX,1,-1,,CNC(=N)N[N+](=O)[O-],"PROC NATL ACAD SCI USA 72:5135-5139,1975"
+1934-20-9,EPA1,0,-1,"DR0034249",Oc1ccc2cc(ccc2c1N=Nc3ccccc3)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24279-91-2,CCRIS,1,-1,"CARBOQUON",COC(COC(=O)N)C1=C(N2CC2)C(=O)C(=C(N3CC3)C1=O)C,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+128753-95-7,CCRIS,1,-1,,COCC12OOC1(C)c3ccccc3O2,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+126420-93-7,CCRIS,1,-1,,Brc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,"ROLL,M, SHTELZER,S, STARK,AA AND BLUM,J, STRUCTURE-ACTIVITYRELATIONSHIPS IN MUTAGENICITY AND IN NUCLEOPHILIC RING OPENING OFN-(ARYLMETHYL)PHENANTHRENE 9,10-IMINES, MUTAGENESIS 5(1):25-30, 1990"
+110-88-3,VITIC,0,-1,"TRIOXANE",C1OCOCO1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7085-55-4,CCRIS,0,-1,,CC1OC(OCC2OC(OC3=C(Oc4cc(OCCO)cc(O)c4C3=O)c5ccc(OCCO)c(OCCO)c5)C(O)C(O)C2O)C(O)C(O)C1O,"MARZIN,D, VO PHI,H, OLIVIER,P AND SAUZIERES,J, STUDY OF MUTAGENICACTIVITY OF TROXERUTIN, A FLAVONOID DERIVATIVE, TOXICOL. LETT. 35(2-3):297-305,1987"
+63018-94-0,EPA1,1,-1,,Cc1ccc2c(C)c3ccccc3c(C)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14346-19-1,CCRIS,1,-1,,Nc1snc2ccc(cc12)[N+](=O)[O-],"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+81407-76-3,CCRIS,1,-1,,C\C=C\C1=CC(=O)C23CC2C(C)(C)OC3(O)C1=O,"STADLER,M, ANKE,H AND STERNER,O, METABOLITES WITH NEMATICIDAL ANDANTIMICROBIAL ACTIVITIES FROM THE ASCOMYCETE LACHNUM PAPYRACEUM (KARST.) KARST.V. PRODUCTION, ISOLATION AND BIOLOGICAL ACTIVITIES OF BROMINE-CONTAININGMYCORRHIZIN AND LACHNUMON DERIVATIVES AND FOUR ADDITIONAL NEW BIOACTIVEMETABOLITES, J. ANTIBIOT. 48(2):149-153, 1995"
+NOCAS_M470,EPA1,0,-1,,FC(F)(F)[C@H](Cl)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-24-3,VITIC,1,-1,"TRIENTINE,TRIENTHCL",NCCNCCNCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60-11-7,VITIC,1,-1,"DIMEAMINO",CN(C)c1ccc(cc1)N=Nc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5786-21-0,CCRIS,0,-1,"CLOZAPINE",CN1CCN(CC1)C2=Nc3cc(Cl)ccc3Nc4ccccc24,"BALBI,A MUSCETTOLA,G STAIANO,N MARTIRE,G AND DE LORENZO,F, PSYCHOTROPIC DRUGS: EVALUATION OF MUTAGENIC EFFECT,  PHARMACOL. RES. COMMUN.12(5):423-431, 1980"
+NOCAS_M288,EPA1,1,-1,,C=CCCCC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109-76-2,VITIC,0,-1,"DIAMPRO13",NCCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+62690-96-4,CCRIS,1,-1,,C1CC=C2C(C1)CCc3ccccc23,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+616-72-8,EPA1,1,-1,,Cc1cc(C)c(cc1[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+612-12-4,EPA1,0,-1,,ClCc1ccccc1CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111380-10-0,CCRIS,0,-1,,Cn1cnc(c1c2ccccc2)[N+](=O)[O-],"EHLHARDT,WJ, BEAULIEU,BB AND GOLDMAN,P, MAMMALIAN CELL TOXICITY ANDBACTERIAL MUTAGENICITY OF NITROSOIMIDAZOLES, BIOCHEM. PHARMACOL.37(13):2603-2606, 1988"
+4612-63-9,CCRIS,0,-1,,Cc1cc2Cc3ccccc3c2cc1C,"LAVOIE,EJ, COLEMAN,DT, GEDDIE,NG AND RICE,JE, STUDIES ON THEMUTAGENICITY AND TUMOR-INITIATING ACTIVITY OF METHYLATED FLUORENES, CHEM.-BIOL.INTERACT. 52(3):301-309, 1985"
+2508-20-5,EPA1,1,-1,,O=Nc1ccc2c(Cc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4947-27-7,EPA1,1,-1,,Cc1ccc2C(=O)c3ccccc3C(=O)c2c1Nc4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-80-4,VITIC,1,-1,,Nc1ccc(Oc2ccc(N)cc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+81-25-4,CCRIS,1,1,,CC(CCC(=O)O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C,"WATABE,J AND BERNSTEIN,H, THE MUTAGENICITY OF BILE ACIDS USING AFLUCTUATION TEST, MUTAT. RES. 158(1-2):45-51, 1985"
+13107-39-6,EPA3,1,-1,,Cc1ccc(cc1)[C@@H]2CO2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+81-63-0,EPA1,1,-1,,Oc1c2C(=N)CCC(=N)c2c(O)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6385-62-2,CCRIS,0,-1,"DIQUAT,DIQUADIBR",C1C[n+]2ccccc2c3cccc[n+]13,"WATANABE,K, SAKAMOTO,K AND SASAKI,T, COMPARISONS ON CHEMICALLY-INDUCEDMUTATION AMONG FOUR STRAINS, SALMONELLA TYPHIMURIUM TA102 AND TA2638, ANDESCHERICHIA COLI WP2/PKM101 AND WP2 UVRA/PKM101: COLLABORATIVE STUDY II, MUTAT.RES. 412(1):17-31, 1998"
+59-67-6,EPA1,0,-1,"BETAINNIC,DR9509392,CUNICOTIN,HISTAMNIC,LINICOTIN,NICOTALDE,NICOTINBI,NICOTINMG,NICOTINOL,NICOTINZN,NICOTINAT,NICOTOLNI,NICOTINNA",OC(=O)c1cccnc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2303-16-4,EPA1,1,-1,,CC(C)N(C(C)C)C(=O)SC\C(=C\Cl)\Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+37571-88-3,GENETOX,1,-1,,OC1C(O)c2cc3ccccc3c4ccc5cccc1c5c24,"MUTAT RES 168:69-240,1986"
+115453-71-9,CCRIS,1,-1,,NC(CS\C=C\Cl)C(=O)O,"VAMVAKAS,S, BERTHOLD,K, DEKANT,W AND HENSCHLER,D, BACTERIAL CYSTEINECONJUGATE BETA-LYASE AND THE METABOLISM OF CYSTEINE S-CONJUGATES. STRUCTURALREQUIREMENTS FOR THE CLEAVAGE OF S-CONJUGATES AND THE FORMATION OF REACTIVEINTERMEDIATES, CHEM.-BIOL. INTERACT. 65(1):59-71, 1988"
+37574-48-4,GENETOX,1,-1,,Oc1cc2cc3ccccc3c4ccc5cccc1c5c24,"MUTAT RES 168:69-240,1986"
+1445-69-8,EPA1,0,-1,,O=C1NNC(=O)c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17024-18-9,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(ccc3ccccc23)c1,"WATANABE,T, TAKASHIMA,M, KASAI,T AND HIRAYAMA,T, COMPARISON OF THEMUTATIONAL SPECIFICITY INDUCED BY ENVIRONMENTAL GENOTOXIN NITRATED POLYCYCLICAROMATIC HYDROCARBONS IN SALMONELLA TYPHIMURIUM HIS GENES, MUTAT. RES.394(1-3):103-112, 1997"
+548-42-5,EPA1,1,-1,,CN1CC(=C[C@@H]2[C@H]1Cc3c[nH]c4cccc2c34)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99520-58-8,EPA1,1,-1,,Oc1ccc2c3ccc4ccc5cccc6cc(c2c1)c3c4c56,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51868-46-3,CCRIS,1,-1,,COc1cc(N=Nc2c(Br)cc(cc2[N+](=O)[O-])[N+](=O)[O-])c(NC(=O)C)cc1N(CC=C)CC=C,"UMBUZEIRO,GDA FREEMAN,HS WARREN,SH PALMA DE OLIVEIRA,D TEARO,YWATANABE,T AND CLAXTON,LD, THE CONTRIBUTION OF AZO DYES TO THE MUTAGENICACTIVITY OF THE CRISTAIS RIVER, CHEMOSPHERE 60(1):55-64, 2005"
+92-84-2,VITIC,0,-1,"PHENOTHIA",N1c2ccccc2Sc3ccccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+193-54-4,CCRIS,1,-1,,C1=Cc2ccc3c4ccccc4c5ccc1c2c35,"OTERO-LOBATO,MJ JENNESKENS,LW SEINEN,W,  CYCLOPENTA[CD]FLUORANTHENEAND ITS PRECURSORS IN COMBUSTION  EXHAUSTS: A SURVEY OF THEIR BACTERIALMUTAGENIC ACTIVITY,  ENVIRON. MOL. MUTAGEN. 44(4):304-312, 2004"
+53693-66-6,EPA1,1,-1,,CCN(CC)c1ccc(cc1)c2ccc(cc2)c3ccc(cc3)N(CC)CC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+224-42-0,EPA1,1,-1,,c1ccc2c(c1)ccc3nc4ccc5ccccc5c4cc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+586-78-7,EPA1,1,-1,,[O-][N+](=O)c1ccc(Br)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-06-2,VITIC,1,-1,"DR9800739",ClCCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+17070-45-0,EPA1,1,-1,"ICR-191",COc1ccc2nc3cc(Cl)ccc3c(NCCCNCCCl)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+43218-55-9,EPA3,1,-1,,CCN(CC)CCn1nc2ccc(C)c3c4ccc(Cl)cc4Sc1c23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+86640-16-6,CCRIS,1,-1,,COc1cc2nc3ccccc3c(O)c2cc1OC,"TANAKA,M, CSURI,K, MUCSI,I, MOLNAR,J, GALY,JP AND BARBE,J,MUTAGENICITY OF SYNTHETIC ACRIDINONES AND THIOACRIDINES IN DIRECT AMESSALMONELLA MUTAGENICITY ASSAY, HETEROCYCL. COMMUN. 2(5):463-467, 1996"
+215226-71-4,CCRIS,1,-1,,C\C(=C(\Cl)/C(=O)O)\C=O,"FRANZEN,R, GOTO,S, TANABE,K AND MORITA,M, GENOTOXIC ACTIVITY OFCHLORINATED BUTENOIC ACIDS IN SALMONELLA TYPHIMURIUM STRAINS TA98, TA100 ANDTA104, MUTAT. RES. 417(1):31-37, 1998"
+103-76-4,EPA1,0,-1,,OCCN1CCNCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+316-14-3,EPA1,1,-1,,Cc1cc2ccccc2c3cc4ccccc4cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+52748-34-2,CCRIS,0,-1,,O=CC1C=COC=C1,"STARK,AA AND RASTETTER,WH, STRUCTURE-ACTIVITY RELATIONSHIPS IN THEMUTAGENICITY AND CYTOTOXICITY OF PUTATIVE METABOLITES AND RELATED ANALOGS OFBENZENE DERIVED FROM THE VALENCE TAUTOMERS BENZENE OXIDE AND OXEPIN, ENVIRON.MOL. MUTAGEN. 28(3):284-293, 1996"
+758-17-8,EPA1,0,-1,,CN(N)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+619-80-7,EPA3,1,-1,,NC(=O)c1ccc(cc1)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+107-92-6,VITIC,0,-1,"BUTYRATE,JM-223,JM-229,JM-260,POLYVACCR",CCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+68-26-8,EPA3,1,-1,,C\C(=C\CO)\C=C/C=C(/C)\C=C/C1=C(C)CCCC1(C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+2611-82-7,EPA1,0,-1,"NEWCOCCIN",Oc1ccc2cc(cc(c2c1N=Nc3ccc(c4ccccc34)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61166-04-9,EPA1,1,-1,,Cn1c2ccccc2c3cc(N)ccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+123-77-3,VITIC,1,-1,"DR9604115",NC(=O)N=NC(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+594-72-9,VITIC,1,-1,,CC(Cl)(Cl)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1955-45-9,VITIC,1,-1,,CC1(C)COC1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+59-30-3,EPA1,0,-1,"FOLATENA,FOLATE",Nc1nc(O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)cnc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97-02-9,VITIC,1,-1,,Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+112-57-2,VITIC,1,-1,"COLESTIPO,COLESTHCL",NCCNCCNCCNCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+97284-34-9,CCRIS,0,-1,,Oc1ncc2ccc3cccc4ccc1c2c34,"TANGA,MJ, MIAO,RM AND REIST,EJ, BACTERIAL MUTAGENICITY ANDCARCINOGENIC POTENTIAL OF SOME AZAPYRENE DERIVATIVES, MUTAT. RES. 172(1):11-17,1986"
+4648-33-3,EPA1,1,-1,,COc1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131862-21-0,CCRIS,1,-1,,CN(C)CCNC(=O)c1cccn2cc(nc12)c3ccccc3,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+72273-04-2,EPA1,1,-1,,C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](CC[C@]34C)OC(=O)COc5ccc(cc5)N(CCCl)CCCl)[C@@H]1CCC(=O)N2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+81-07-2,VITIC,0,-1,"SACCHARIN,SACCHANH4,SACCHARCA,SACCHARIK,SACCHARNA",O=C1NS(=O)(=O)c2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4426-50-0,EPA3,1,-1,,C[C@H]1CCOS(=O)(=O)O1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+146795-38-2,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccc(Cl)cc2,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+NOCAS_M491,EPA1,0,-1,,CCCC[C@@H](CC)COC(=O)CCCCC(=O)OC[C@H](CC)CCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51576-10-4,CCRIS,0,-1,,CC(=O)OC12CCC3[C@](CCC4[C@@]3(C)CCC[C@@]4(C)C(=O)O)(CC1=C)C2,"PEZZUTO,JM, NANAYAKKARA,NPD, COMPADRE,CM, SWANSON,SM, KINGHORN,AD,GUENTHNER,TM, SPARNINS,VL AND LAM,LKT, CHARACTERIZATION OF BACTERIALMUTAGENICITY MEDIATED BY 13-HYDROXY-ENT-KAURENOIC ACID (STEVIOL) AND SEVERALSTRUCTURALLY-RELATED DERIVATIVES AND EVALUATION OF POTENTIAL TO INDUCEGLUTATHIONE S-TRANSFERASE IN MICE, MUTAT. RES. 169(3):93-103, 1986"
+613-65-0,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2ccc3ccccc3c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3031-73-0,CCRIS,1,-1,,COO,"BALL,JC, YOUNG,WC, WALLINGTON,TJ AND JAPAR,SM, MUTAGENIC PROPERTIES OFA SERIES OF ALKYL HYDROPEROXIDES, ENVIRON. SCI. TECHNOL. 26(2):397-399,1992"
+NOCAS_M317,EPA1,0,-1,,N[C@@H](CSCc1ccccc1)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+9006-42-2,CCRIS,0,-1,,SC(=N\C=C\N=C(S)S)S,"SIMMON,VF, RICCIO,ES, ROBINSON,DE AND MITCHELL,AD, IN VITROMICROBIOLOGICAL MUTAGENICITY AND UNSCHEDULED DNA SYNTHESIS STUDIES OF FIFTEENPESTICIDES, EPA/600/1-85/006, NTIS PB85-193761, 1985"
+88266-67-5,EPA1,1,-1,,C[C@@H](O)[C@H](NC(=O)[C@@H](C)[C@H](O)[C@H](C)NC(=O)[C@@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@H](N)C(=O)N)[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCN(C)CCC(N(C)c7ccc(OCc8ccccc8)c(OCc9ccccc9)c7)N(C)c%10ccc(OCc%11ccccc%11)c(OCc%12ccccc%12)c%10,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24325-70-0,EPA1,1,-1,,Cc1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59820-43-8,EPA2,1,-1,,OCCN(CCO)c1ccc(cc1O)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+69657-88-1,EPA3,1,-1,,CN(C)c1ccc(N(C)C)c2C(=O)c3c(O)ccc(O)c3C(=O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+138805-31-9,CCRIS,0,-1,,CC(=O)Nc1cc(ccc1C)N=Nc2ccc(C)c(NC(=O)C)c2,"SAYAMA,M, MORI,M, NAKADA,Y, KAGAMIMORI,S AND KOZUKA,H, METABOLISM OF2,4-DINITROTOLUENE BY SALMONELLA TYPHIMURIUM STRAINS TA98, TA98NR ANDTA98/1,8-DNP6, AND MUTAGENICITY OF THE METABOLITES OF 2,4-DINITROTOLUENE ANDRELATED COMPOUNDS TO STRAINS TA98 AND TA100, MUTAT. RES. 264(3):147-153,1991"
+115781-41-4,CCRIS,0,-1,,Cn1c(NS(=O)(=O)O)nc2c3nc(CO)cnc3ccc12,"TURESKY,RJ, AESCHBACHER,HU, WUERZNER,HP, SKIPPER,PL ANDTANNENEBAUM,SR, MAJOR ROUTES OF METABOLISM OF THE FOOD-BORNE CARCINOGEN2-AMINO-3,8-DIMETHYLIMIDAZO [4,5-F]QUINOXALINE IN THE RAT CARCINOGENESIS9(6):1043-1048, 1988"
+16423-19-1,CCRIS,0,-1,,CC1CCCC2(C)CCCCC12O,"DIONIGI,CP, LAWLOR,TE, MCFARLAND,JE AND JOHNSEN,PB, EVALUATION OFGEOSMIN AND 2-METHYLISOBORNEOL ON THE HISTIDINE DEPENDENCE OF TA98 AND TA100SALMONELLA TYPHIMURIUM TESTER STRAINS, WATER RES. 27(11):1615-1618,1993"
+6041-94-7,EPA3,1,-1,,Oc1c(cc2ccccc2c1N=Nc3cc(Cl)ccc3Cl)C(=O)Nc4ccccc4,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+23045-12-7,EPA1,1,-1,,Cc1ccc2nc3ccccc3c(N)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+146177-63-1,CCRIS,0,-1,,Cn1c(N)nc2c1ccc3nc(c4ccccc4)c(nc23)c5ccccc5,"VIKSE,R, KNAPSTAD,A, KLUNGSOEYR,L AND GRIVAS,S, MUTAGENIC ACTIVITY OFTHE METHYL AND PHENYL DERIVATIVES OF THE FOOD MUTAGEN 2-AMINO-3-METHYLIMIDAZO[4,5-F]QUINOXALINE (IQX) IN THE AMES TEST, MUTAT. RES. 298(3):207-214,1993"
+76-38-0,VITIC,0,-1,"METHOXYFL",COC(F)(F)C(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+97931-39-0,EPA1,1,-1,,[O-][N+](=O)c1c2CCc3cccc4ccc(c5ccccc15)c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+298-12-4,CCRIS,1,-1,"GLYOXYLAT",OC(=O)C=O,"SAYATO,Y, NAKAMURO,K AND UENO,H, MUTAGENICITY OF PRODUCTS FORMED BYOZONATION OF NAPHTHORESORCINOL IN AQUEOUS SOLUTIONS, MUTAT. RES. 189(3):217-222,1987"
+14861-17-7,VITIC,1,-1,,Nc1ccc(Oc2ccc(Cl)cc2Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1338-23-4,EPA3,0,-1,,CC(=O)CCOOCCC(=O)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+519-73-3,EPA1,0,-1,,c1ccc(cc1)C(c2ccccc2)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4097-22-7,EPA3,1,-1,,Nc1ncnc2c1ncn2[C@@H]3CC[C@H](CO)O3,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+72782-13-9,CCRIS,0,-1,,CN(Cc1ccc(cc1)C(=O)O)N=O,"SINGER,GM, ANDREWS,AW AND GUO,SM, QUANTITATIVE STRUCTURE-ACTIVITYRELATIONSHIP OF THE MUTAGENICITY OF SUBSTITUTED N-NITROSO-N-BENZYLMETHYLAMINES:POSSIBLE IMPLICATIONS FOR CARCINOGENICITY, J. MED. CHEM. 29(1):40-44,1986"
+18810-04-3,CCRIS,0,-1,,NC(CCCCNCC(N)C(=O)O)C(=O)O,"PINTAURO,SJ, PHILIPPSSIAN,G, FINOT,PA AND LEE,TC, LYSINOALANINE:ABSENCE OF MUTAGENIC RESPONSE IN THE SALMONELLA/MAMMALIAN-MICROSOME MUTAGENICITYASSAY, FOOD CHEM. TOXICOL. 23(8):763-765, 1985"
+96910-71-3,CCRIS,1,-1,,CC1(C)CC2C3(C)CC3(C=O)C(=CC2(O)C1)C=O,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+90-13-1,EPA1,1,-1,"CLNAPHTH1",Clc1cccc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+366-70-1,VITIC,0,-1,"PROCARBAZ,PROCARHCL",CNNCc1ccc(cc1)C(=O)NC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+59702-31-7,CCRIS,0,-1,"T-1982C",CCN1CCNC(=O)C1=O,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+86-57-7,EPA2,1,-1,"DR9508017",[O-][N+](=O)c1cccc2ccccc12,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+555-68-0,EPA1,1,-1,"DR9806622",OC(=O)\C=C\c1cccc(c1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+87812-99-5,CCRIS,1,-1,,[O-][N+](=O)c1cccc2oc3ccccc3c12,"WATANABE,T, KAJI,H, KASAI,T AND HIRAYAMA,T,MUTAGENICITY AND METABOLICACTIVATION OF NITRODIBENZOFURANS AND NITRODIBENZO-P-DIOXINS, HEN'IGENSEI SHIKEN2(4):226-233, 1993"
+58-55-9,EPA1,0,-1,"AMBUPHYLL,AMINOPHYL,AMIPHYHYD,THEOPCASA,CHOLTHEOP,THEOSODAN,THEOPHGLY,TPNAGLYCA,THEOSODSA,THEOCHOLI,THEOPHYLL,THEOPHEPH,THEOPIPRO,THEOPACNA,THEOPHYLN,THEOPHYOL,THEOPHLYS",CN1C(=O)N(C)c2[nH]cnc2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+33685-60-8,CCRIS,0,-1,,[O-][N+](=O)c1c2ccccc2c(c3ccccc13)[N+](=O)[O-],"MOELLER,M, HAGEN,I AND RAMDAHL,T, MUTAGENICITY OF POLYCYCLIC AROMATICCOMPOUNDS (PAC) IDENTIFIED IN SOURCE EMISSIONS AND AMBIENT AIR, MUTAT. RES.157(2-3): 149-156, 1985"
+571-60-8,CCRIS,1,-1,,Oc1ccc(O)c2ccccc12,"HAKURA,A, TSUTSUI,Y, MOCHIDA,H, SUGIHARA,Y, MIKAMI,T AND SAGAMI,F,MUTAGENICITY OF DIHYDROXYBENZENES AND DIHYDROXYNAPHTHALENES FOR AMES SALMONELLATESTER STRAINS, MUTAT. RES. 371(3-4):293-299, 1996"
+62-73-7,VITIC,1,-1,"DICHLORVO,DICHLORCA",COP(=O)(OC)OC=C(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+121-54-0,VITIC,0,-1,"BENZETHON,USNATEBEN",CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+191-26-4,EPA1,1,-1,,c1cc2ccc3cc4cccc5ccc6cc(c1)c2c3c6c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142184-78-9,CCRIS,0,-1,,O1C2C3OC3c4ncccc4C12,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+94-13-3,VITIC,0,-1,"PROPYLPAR,PROPARANA",CCCOC(=O)c1ccc(O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+50700-49-7,EPA1,0,-1,"ACIMIDOQU",CC(=O)N=C1C=CC(=O)C=C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+811-97-2,EPA1,0,-1,"NORFLURAN",FCC(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+116-71-2,EPA3,1,-1,,O=C1c2ccccc2c3ccc4c5ccc6c7ccccc7C(=O)c8ccc(c9ccc1c3c49)c5c68,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+626-43-7,EPA1,0,-1,"DR9807258",Nc1cc(Cl)cc(Cl)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14098-44-3,EPA1,0,-1,,C1COCCOc2ccccc2OCCOCCO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59282-34-7,CCRIS,0,-1,,COc1cc(c(O)c(c1)C(C)(C)C)[N+](=O)[O-],"KALUS,WH, MUENZNER,R AND FILBY,WG, ISOLATION AND CHARACTERIZATION OFSOME PRODUCTS OF THE BHA-NITRITE REACTION: EXAMINATION OF THEIR MUTAGENICITY,FOOD ADDIT. CONTAM. 7(2):223-233, 1990"
+31430-15-6,CCRIS,0,-1,"FLUBENDAZ",COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3ccc(F)cc3,"SINSHEIMER,JE, GIRI,AK, OSORIO,S, WISE,DS AND TOWNSEND,LB, COMPARATIVEMUTAGENICITY AND GENOTOXICITY OF THE ANTIPARASITIC DRUGS, MEBENDAZOLE,FLUBENDAZOLE AND FLUBENDAZOLE OXIME, PROG. CLIN. BIOL. RES. 340E(MUTAT.ENVIRON., PT.E):225-234, 1990"
+29752-43-0,CCRIS,0,-1,,COc1cc(O)c2C(=O)OC3(C)CC(O)C(O)C=C3c2c1,"SCHRADER,TJ CHERRY,W SOPER,K LANGLOIS,I AND VIJAY,HM, EXAMINATION OFALTERNARIA ALTERNATA MUTAGENICITY AND EFFECTS OF NITROSYLATION USING THE AMESSALMONELLA TEST, TERATOG., CARCINOG., MUTAGEN. 21(4):261-274, 2001"
+117661-13-9,CCRIS,0,-1,,[O-][N+]1=C2C=CC(=O)C=C2\C(=N/c3ccccc3)\C1(c4ccccc4)c5ccccc5,"DAMIANI,E GRECI,L AND HRELIA,P, CYTO- AND GENOTOXIC EFFECTS OF NOVELAROMATIC NITROXIDE RADICALS IN VITRO, FREE RADICAL BIOL. MED. 28(3):330-336,2000"
+125974-06-3,CCRIS,1,-1,,OC1OC(=O)C=C1CCl,"LALONDE,RT, COOK,GP, PERAKYLA,H AND DENCE,CW, EFFECT ON MUTAGENICITYOF THE STEPWISE REMOVAL OF HYDROXYL GROUP AND CHLORINE ATOMS FROM 3-CHLORO-4-(DICHLOROMETHYL)-5-HYDROXY-2(5H)-FURANONE: CARBON-13 NMR CHEMICAL SHIFTS ASDETERMINANTS OF MUTAGENICITY, CHEM. RES. TOXICOL. 4(1):35-40, 1991"
+173216-43-8,CCRIS,1,-1,,CC(CCN=N#N)c1ccccc1,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+19315-64-1,EPA1,1,-1,"HOPHENACN",CCOc1ccc(cc1)N(O)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56355-17-0,CCRIS,0,-1,"480156-S",CC(C(=O)O)c1ccc(Oc2nccs2)cc1,"WAKISAKA,Y AND SHINOURA,Y, MUTAGENICITY STUDY ON A NEW ANALGESIC ANDANTI-INFLAMMATORY SUBSTANCE, 2-[4-(2-THIAZOLYLOXY)PHENYL]PROPIONIC ACID(480156-S), IN BACTERIA, IYAKUHIN KENKYU 18(1):21-24, 1987"
+79-09-4,VITIC,0,-1,"CAPROPION,POLYACRVA,AMMONPROP,PROPIONIC,PROPIONAT,ZNPROPION",CCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+73747-10-1,CCRIS,0,-1,,CCOC(=O)c1ccc(cc1)N(O)C=O,"WEI,CI, COHEN,MD, SWARTZ,DD, FERNANDO,SY AND CORBETT,MD, MUTAGENICITYOF SOME MONOAROMATIC HYDROXAMIC ACIDS, TOXICOL. LETT. 24(1):111-116,1985"
+542-85-8,EPA1,0,-1,"ETISOTHIO",CCN=C=S,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+233-88-5,CCRIS,0,-1,,c1cnc2c(c1)ccc3cc[nH]c23,"FERLIN,MG, CHIARELOTTO,G, BACCICHETTI,F, CARLASSARE,F, TONIOLO,L ANDBORDIN,F, 2-SUBSTITUTED 1H-PYRROLO[3,2-H]QUINOLINE DERIVATIVES: SYNTHESIS ANDASPECTS OF THEIR BIOLOGICAL ACTIVITY, FARMACO 47(12):1513-1528, 1992"
+NOCAS_M277,EPA1,1,-1,,OO[C@@H]1CCCc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+513-31-5,EPA1,1,-1,,BrCC(=C)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50-35-1,CCRIS,0,-1,"DR9608621",O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1,"ASHBY,J, TINWELL,H, CALLANDER,RD, KIMBER,I, CLAY,P, GALLOWAY,SM,HILL,RB, GREENWOOD,SK, GAULDEN,ME, FERGUSON,MJ, VOGEL,E, NIVARD,M, PARRY,JM ANDWILLIAMSON,J, THALIDOMIDE: LACK OF MUTAGENIC ACTIVITY ACROSS PHYLA AND GENETICENDPOINTS, MUTAT. RES. 396(1-2):45-64, 1997"
+552-16-9,CCRIS,1,-1,"DR9802145",OC(=O)c1ccccc1[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+452-86-8,VITIC,0,-1,"DR9509347",Cc1ccc(O)c(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+26761-40-0,VITIC,0,-1,,CC(C)CCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+145-39-1,EPA1,0,-1,,Cc1c(C)c(c(c(c1C)[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-42-9,VITIC,0,-1,,Nc1cccc(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+139953-97-2,CCRIS,1,-1,,CC\C=C\C=C\C=C\C=C\C=C\OCC(C)O,"VERTEGAAL,LBJ, VOOGD,CE, MOHN,GR AND VAN DER GEN,A, FURTHER STUDIES ONTHE MUTAGENIC ACTIVITY OF FECAPENTAENE-12 ANALOGS AND CONCLUSIONS ABOUT THEIRMOLECULAR MODE OF ACTION, MUTAT. RES. 281(2):93-98, 1992"
+23246-96-0,EPA3,1,-1,,C\C=C/1\CC(=C)[C@](O)(CO)C(=O)OCC2=CCN3CC[C@H](OC1=O)[C@@H]23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+116-83-6,EPA3,1,-1,,COc1ccc(N)c2C(=O)c3ccccc3C(=O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+101-59-7,CCRIS,1,-1,,Nc1ccc(Sc2ccc(cc2)[N+](=O)[O-])cc1,"JUNEJA,TR, KAUR,B AND GUPTA,RL, MUTAGENICITY OF 4-NITRODIPHENYLTHIOETHER- DERIVED PRODUCTS AND THEIR POTENTIAL METABOLITES, MUTAT. RES.263(1):13-19, 1991"
+21794-55-8,EPA1,1,-1,"DAUNORUBN",COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O)c4c(O)c3C(=O)c12)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4648-54-8,CCRIS,1,-1,,C[Si](C)(C)N=N#N,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+20930-10-3,EPA1,1,-1,,CC#CC(OC(=O)NC1CCCCC1)(c2ccccc2)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+603-35-0,VITIC,0,-1,"SKF-40738",c1ccc(cc1)P(c2ccccc2)c3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+10335-79-2,EPA3,1,-1,,ONC(=O)c1ccc2ccccc2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+63655-40-3,EPA1,1,-1,,Nc1nc2cc(ccc2[nH]1)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128753-83-3,CCRIS,1,-1,,CC12OOC1Oc3ccccc23,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+15950-66-0,VITIC,0,-1,,Oc1ccc(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+481-74-3,EPA1,1,-1,"CHRYSOPHA",Cc1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+150445-97-9,CCRIS,0,-1,,[O-][N+](=O)c1cccc(CO\N=C\c2nc3cc(ccc3n2Cc4ccc(Cl)cc4)[N+](=O)[O-])c1,"HRELIA,P, MOROTTI,M, VIGAGNI,F, BURNELLI,S, GARUTI,L, SABATINO,P ANDCANTELLI-FORTI,G, SYNTHESIS OF A SERIES OF 5-NITRO-(BENZIMIDAZOLES AND INDOLES)AS NOVEL ANTIMYCOTICS AND EVALUATION AS GENOTOXINS IN THE AMES TEST, MUTAGENESIS8(3):183-188, 1993"
+112380-30-0,CCRIS,1,-1,,CCCCN(N=O)\C(=N\O)\C=O,"SUZUKI,E, OSABE,M, MOCHIZUKI,M, WAKABAYASHI,Y AND OKADA,M,CHARACTERIZATION OF DIRECTLY ACTING MUTAGENS PRODUCED FROMN-NITROSO-N-(FORMYLMETHYL)ALKYLAMINES. THEIR POSSIBLE INVOLVEMENT IN THECARCINOGENESIS OF N-NITROSAMINES HAVING A 2-HYDROXYETHYL GROUP,CHEM. PHARM.BULL. 35(10):4022-4030, 1987"
+100-15-2,VITIC,1,-1,,CNc1ccc(cc1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M17,EPA1,1,-1,,C(CC[C@H]1CO1)C[C@H]2CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+590-86-3,EPA1,0,-1,,CC(C)CC=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132832-27-0,CCRIS,1,-1,,OC1C2OC2c3c(ccc4c5ccccc5c6ccccc6c34)C1O,"GLATT,H, PIEE,A, PAULY,K, STEINBRECHER,T, SCHRODE,R, OESCH,F ANDSEIDEL,A, FJORD- AND BAY-REGION DIOL-EPOXIDES INVESTIGATED FOR STABILITY, SOSINDUCTION IN ESCHERICHIA COLI, AND MUTAGENICITY IN SALMONELLA TYPHIMURIUM ANDMAMMALIAN CELLS,CANCER RES. 51(6):1659-1667, 1991"
+60516-11-2,CCRIS,1,-1,,CC(=O)Nc1ccc(Nc2ccc(cc2)[N+](=O)[O-])cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, MUTAGENICITY OF THE ANTISCHISTOSOMALAGENT AMOSCANATE AND ITS HYDROLYTIC AND RELATED PARA SUBSTITUTED4-NITRODIPHENYLAMINE PRODUCTS, MED. SCI. RES. 20(10):365-368, 1992"
+67-63-0,VITIC,0,-1,"PROPANOL2",CC(C)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+74-87-3,VITIC,1,-1,,CCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+461-72-3,EPA1,0,-1,"HYDANTOIN",O=C1CNC(=O)N1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+81-61-8,EPA1,1,-1,"QUINALIZA",Oc1ccc2C(=O)c3c(O)ccc(O)c3C(=O)c2c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M257,EPA1,1,-1,,COC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98982-99-1,CCRIS,0,-1,,COc1ccc(CN(CC[N+](C)(C)[O-])c2ccccn2)cc1,"HANSEN,EB, CERNIGLIA,CE, KORFMACHER,WA, MILLER,DW AND HEFLICH,RH,MICROBIAL TRANSFORMATION OF THE ANTIHISTAMINE PYRILAMINE MALEATE. FORMATION OFPOTENTIAL MAMMALIAN METABOLITES, DRUG METAB. DISPOS. 15(1):97:106,1987"
+27758-60-7,EPA1,1,-1,,Cc1ccc(cc1)N(N)c2ccc(C)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+168010-55-7,CCRIS,1,-1,,Cc1cc(cc(C)n1)c2cc3N(C4CC4)C5=CC(=O)NC(=O)N5c3cc2F,"ALBERTINI,S, CHETELAT,AA, MILLER,B, MUSTER,W, PUJADAS,E, STROBEL,R ANDGOCKE,E,GENOTOXICITY OF 17 GYRASE- AND FOUR MAMMALIAN TOPOISOMERASE II-POISONSIN PROKARYOTIC"
+79-11-8,VITIC,0,-1,"CLACETATE",OC(=O)CCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+51483-39-7,EPA1,1,-1,,ClCC(Br)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117467-28-4,CCRIS,0,-1,,CO\N=C(/C(=O)NC1C2SCC(=C(N2C1=O)C(=O)OCOC(=O)C(C)(C)C)\C=C\c3scnc3C)\c4csc(N)n4,"SHINDO,Y, HAYASHI,H, ANDO,M AND TATEBAYASHI,T, MUTAGENICITY STUDY OFTHE NEW CEPHALOSPORIN ANTIBIOTIC CEFDITOREN PIVOXIL, ARZNEIM.-FORSCH.46(8):815-821, 1996"
+145438-97-7,EPA1,1,-1,,CN(N=O)C(=O)c1c(ncn1C)N(C)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+203-33-8,EPA1,1,-1,,c1ccc2c(c1)c3cccc4cc5ccccc5c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+146795-31-5,CCRIS,1,-1,,Cc1ccccc1NC(=O)c2csc(c2)[N+](=O)[O-],"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+62-55-5,VITIC,0,-1,"TIOACETAM",CC(=N)S,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+148193-33-3,EPA1,1,-1,,COc1nsc2cc(N)ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88-75-5,VITIC,0,-1,"NITROPHOO",Oc1ccccc1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+103139-94-2,EPA1,1,-1,,Cc1cnc2c(C)cc3c(nc(N)n3C)c2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4309-66-4,EPA1,1,-1,,Nc1ccc(\C=C\c2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24684-42-2,EPA3,1,-1,,Cc1cc2CCC(=O)c2c3ccc4ccccc4c13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+120014-85-9,CCRIS,1,-1,,OC1CCCc2c1cc3ccc4ccc(c5ccc2c3c45)[N+](=O)[O-],"JUNG,H, SHAIKH,AU, HEFLICH,RH AND FU,PP, NITRO GROUP ORIENTATION,REDUCTION POTENTIAL, AND DIRECT-ACTING MUTAGENICITY OF NITRO-POLYCYCLIC AROMATICHYDRO- CARBONS, ENVIRON. MOL. MUTAGEN. 17(3):169-180, 1991"
+2984-50-1,CCRIS,0,-1,,CCCCCCC1CO1,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+226-36-8,EPA1,1,-1,,c1ccc2c(c1)ccc3nc4c(ccc5ccccc45)cc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+563-41-7,VITIC,0,-1,"SEMICARBA",NNC(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+129134-96-9,CCRIS,1,-1,,CC1CC2C(Cc3cn(C4CCCC4)c5cccc2c35)N(C)C1,"GLATT,H, PERTZ,H, KASPER,R AND EICH,E, CLAVINE ALKALOIDS ANDDERIVATIVES AS MUTAGENS DETECTED IN THE AMES TEST, ANTI-CANCER DRUGS3(6):609-614, 1992"
+135086-97-4,CCRIS,1,-1,,Nn1nnc2c3ccccc3nc2c1O,"LOPEZ-DE-CERAIN,A, GARCIA,E AND GULLON,A, INFLUENCE OF THE TRIAZINERING ON THE MUTAGENICITY OF TRIAZINOINDOLES AND SOME CONGENERS, MUTAGENESIS7(1):37-39, 1992"
+138245-74-6,CCRIS,1,-1,,OCC(O)C(O)C(O)C(O)CN=N#N,"JURICEK,M, GRUZ,P, VELEMINSKY,J, STANEK,J, KEFURT,K, MORAVCOVA,J ANDJARY,J, MUTAGENIC ACTIVITY OF 6-AZIDO DEOXYHEXOSES AND AZIDO ALCOHOLS INSALMONELLA TYPHIMURIUM AND ITS INHIBITION BY A STRUCTURE-SIMILAR CARBON SOURCEIN THE MEDIUM, MUTAT. RES. 251(1):13-20, 1991"
+59-87-0,EPA2,1,-1,,NC(=O)N\N=C\c1oc(cc1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+139953-79-0,CCRIS,0,-1,,C1N(\N=C\c2ccc(Oc3ccccc3)cc2)N=Nc4c1[nH]c5ccccc45,"GARCIA,E, LOPEZ-DE-CERAIN,A, MARTINEZ-MERINO,V AND MONGE,A,QUANTITATIVE STRUCTURE-MUTAGENIC ACTIVITY RELATIONSHIPS OF TRIAZINOINDOLEDERIVATIVES, MUTAT. RES. 268(1):1-9, 1992 & GARCIA,E, LOPEZ-DE-CERAIN,A,GULLON,A, ARRARAS,JA AND MONGE,A, BACTERIAL MUTAGENIC EVALUATION OF A SERIES OF4'-SUBSTITUTED DERIVATIVES OF3-BENZYLIDENAMINO-5H-1,2,3-TRIAZIN[5,4-B]INDOL-4-ONE, MUTAGENESIS 7(1):31-35,1992"
+108618-28-6,EPA1,1,-1,,Nc1ccc(\C=C\c2cccc(c2)C#N)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106063-42-7,EPA1,1,-1,,COc1cc(O)ccc1Nc2c3ccccc3nc4ccccc24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71382-46-2,CCRIS,1,-1,,Cc1c2C3NC3c4ccccc4c2c(C)c5ccccc15,"GLATT,H, ABU-SHQARA,E, MARTINE,U, BAIDOSSI,W, HARVEY,RG AND BLUM,J,K-REGION OXIDES AND IMINES DERIVED FROM ALKYLATED BENZ[A]ANTHRACENE CONGENERS:SYNTHESIS, STABILITY IN AQUEOUS MEDIA AND MUTAGENICITY, MUTAGENESIS 9(2):83-92,1994"
+91-64-5,VITIC,1,-1,"CUMARIN",O=C1Oc2ccccc2C=C1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+23590-58-1,CCRIS,0,-1,,Clc1nncc2ncccc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+50285-71-7,EPA1,1,-1,,CCN(N=O)C(=O)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+40580-89-0,EPA2,1,-1,,O=NN1CCCCCCCCCCCC1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+97629-28-2,CCRIS,1,-1,,Cc1c(C)c(N)c(cc1N)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+62783-50-0,CCRIS,0,-1,,CN(Cc1ccc(C)cc1)N=O,"SINGER,GM, ANDREWS,AW AND GUO,SM, QUANTITATIVE STRUCTURE-ACTIVITYRELATIONSHIP OF THE MUTAGENICITY OF SUBSTITUTED N-NITROSO-N-BENZYLMETHYLAMINES:POSSIBLE IMPLICATIONS FOR CARCINOGENICITY, J. MED. CHEM. 29(1):40-44,1986"
+82414-02-6,CCRIS,1,-1,,Cc1ccc(cc1N=O)[N+](=O)[O-],"COUCH,DB, ABERNETHY,DJ AND ALLEN,PF, THE EFFECT OF BIOTRANSFORMATIONOF 2,4-DINITROTOLUENE ON ITS MUTAGENIC POTENTIAL, MUTAGENESIS 2(6):415-418,1987"
+87-62-7,EPA3,1,-1,"DR0006218",Cc1cccc(C)c1N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+99-52-5,VITIC,1,-1,,Cc1cc(ccc1N)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+42017-89-0,EPA1,0,-1,"PROCETOFE",CC(C)(Oc1ccc(cc1)C(=O)c2ccc(Cl)cc2)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2687-41-4,EPA1,1,-1,,CC(=O)Nc1ccc(Oc2ccc(N)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-63-0,VITIC,1,-1,"PHENYLHYD,PHHYDRHCL",NNc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1210-35-1,EPA1,0,-1,,O=C1c2ccccc2CCc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-64-9,VITIC,0,-1,,CC(C)(C)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+108-31-6,VITIC,0,-1,"MALEICANH,MVE-4,PVM-MA,WSP-2",O=C1OC(=O)C=C1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+96918-24-0,EPA1,1,-1,,o1ccc2c1cc3ccc4cccc5ccc2c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+611-32-5,VITIC,1,-1,,Cc1cccc2cccnc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+137-89-3,EPA3,0,-1,,CCCC[C@H](CC)COC(=O)c1cccc(c1)C(=O)OC[C@@H](CC)CCCC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+79526-11-7,CCRIS,1,-1,,C1OC1Oc2ccccc2,"PARK,KK, KIM,HW, PARK,MK AND AHN,YH, CARCINOGENICITY OF PHENYL VINYLETHER AND ITS EPOXIDE, ENVIRON. MUTAGENS CARCINOG. 17(2):109-119,1997"
+1948-33-0,VITIC,0,-1,"TENOXTBHQ",CC(C)(C)c1cc(O)ccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7224-61-5,CCRIS,0,-1,,COc1cc2c(CC3c4c(CC[N+]3(C)C)cc(OC)c(O)c24)cc1O,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+108670-78-6,CCRIS,1,-1,,CC\C=C\C=C\C=C\C=C\OCC(O)CO,"GOVINDAN,SV, KINGSTON,DGI, GUNATILAKA,AAL, VAN TASSELL,RL, WILKINS,TD,DE WIT,PP, VAN DER STEEG,M AND VAN DER GEN,A, SYNTHESIS AND BIOLOGICAL ACTIVITYOF ANALOGS OF FECAPENTAENE-12, J. NAT. PROD. 50(1):75-83, 1987"
+105361-86-2,EPA1,1,-1,,O=Nc1cccc(c1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68268-11-1,CCRIS,1,-1,,CCN(C(=O)CCCl)c1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+145679-85-2,CCRIS,1,-1,,Cc1cc2CCCc2c3ccc4C(O)C(O)C5OC5c4c13,"PAPAPARASKEVA-PETRIDES,C, IOANNIDES,C, BOYD,GW, YOUNG,RJ, HARVEY,RGAND COOMBS, MM, THE MUTAGENICITY OF CHEMICALLY SYNTHESIZED METABOLITES OF16,17-DIHYDRO-15H-CYCLOPENTA[A]PHENANTHRENE AND ITS CARCINOGENIC 11-METHYLHOMOLOG, MUTAGENESIS 8(4):307-310, 1993"
+479-92-5,EPA1,0,-1,"PROPYPHEN",CC(C)C1=C(C)N(C)N(C1=O)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+150-60-7,EPA1,1,-1,,C(SSCc1ccccc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+135-49-9,EPA1,1,-1,"ACRIDINEY",Cc1cc2cc3cc(C)c(N)cc3nc2cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88598-56-5,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3cc4CCCCc4c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60784-46-5,EPA1,1,-1,"ELMUSTINE",OCCNC(=O)N(CCCl)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18137-96-7,CCRIS,0,-1,,[CH2-][N+](=O)[O-],"DAYAL,R, GESCHER,A, HARPUR,ES, PRATT,I AND CHIPMAN,JK, COMPARISON OFTHE HEPATOTOXICITY IN MICE AND THE MUTAGENICITY OF THREE NITROALKANES, FUNDAM.APPL. TOXICOL. 13(2):341-348, 1989"
+5042-54-6,EPA1,1,-1,,Cc1cc(N=Nc2ccccc2)c(N)cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125-31-5,VITIC,0,-1,,Cc1cc(c(C)cc1O)C2(OS(=O)(=O)c3ccccc23)c4cc(C)c(O)cc4C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2080-32-2,EPA1,0,-1,,CCN(CC)S(=O)(=O)c1ccc(NC(=O)C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+65-61-2,EPA1,1,-1,"ACRORANGE",CN(C)c1ccc2cc3ccc(cc3nc2c1)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117-05-5,EPA1,1,-1,,Clc1cccc2C(=O)c3c(NC(=O)c4ccccc4)cccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+69322-61-8,CCRIS,0,-1,,OC(=O)C1CC=C(OP2(NP(NP(N2)(Oc3ccc(cc3)C(=O)O)Oc4ccc(cc4)C(=O)O)(Oc5ccc(cc5)C(=O)O)Oc6ccc(cc6)C(=O)O)Oc7ccc(cc7)C(=O)O)C=C1,"ALLCOCK,HR, PUCHER,SR, FITZPATRICK,RJ AND RASHID,K, ANTIBACTERIALACTIVITY AND MUTAGENICITY STUDIES OF WATER-SOLUBLE PHOSPHAZENE HIGH POLYMERS,BIOMATERIALS 13(12):857-862, 1992"
+9014-90-8,CCRIS,0,-1,,CCCCCCCCCc1ccccc1C(CO)OS(=O)(=O)O,"HACHIYA,N AND TAKIZAWA,Y, MUTAGENICITY OF PLASTIC ADDITIVES,HEN'IGENSEI SHIKEN 3(3):147-154, 1994"
+842-19-3,EPA1,0,-1,,Oc1ccc2cc(cc(c2c1)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-47-8,VITIC,1,-1,"IODOFORM",IC(I)I,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+74-97-5,VITIC,1,-1,,ClCBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2784-27-2,CCRIS,0,-1,"HOPHENYTO",Oc1ccc(cc1)C2(NC(=O)NC2=O)c3ccccc3,"LEONARD,A, DE MEESTER,C, FABRY,L, DE SAINT-GEORGES,L AND DUMONT,P,LACK OF MUTAGENICITY OF DIPHENYLHYDANTOIN IN IN VITRO SHORT-TERM TESTS, MUTAT.RES. 137(2-3):79-88, 1984"
+91991-22-9,CCRIS,0,-1,,CCCCC(=O)Nc1snc2ccc(Cl)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+36840-85-4,EPA1,0,-1,,C=CC(=O)OCCCCCOC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+316-42-7,EPA1,0,-1,,CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@H]2C[C@H]1C[C@H]4NCCc5cc(OC)c(OC)cc45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120-37-6,VITIC,1,-1,,CCNc1cc(O)ccc1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+70644-19-8,EPA1,1,-1,,Cc1ccc2cc3ccc4cccc5ccc(c2c1)c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120-72-9,EPA1,0,-1,"INDOLE",c1ccc2[nH]ccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+150-78-7,VITIC,0,-1,,COc1ccc(OC)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M256,EPA1,1,-1,,O=NN1CCC[C@@H]1c2cccnc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-87-5,CCRIS,0,-1,"OCTANOL",CCCCCCCCO,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION  CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING  CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF  THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL),1997"
+3209-22-1,CCRIS,0,-1,,[O-][N+](=O)c1cccc(Cl)c1Cl,"HAWORTH,S, LAWLOR,T MORTELMANS,K, SPECK,W AND ZEIGER,E, SALMONELLAMUTAGENICITY TEST RESULTS FOR 250 CHEMICALS, ENVIRON. MUTAGEN. 5(SUPPL. 1):3-142, 1983"
+3675-13-6,CCRIS,1,-1,,O=C\C=C\C=O,"PETERSON,LA NARUKO,KC AND PREDECKI,DP, A REACTIVE METABOLITE OF FURAN,CIS-2-BUTENE-1,4-DIAL, IS MUTAGENIC IN THE AMES ASSAY, CHEM. RES. TOXICOL.13(7):531-534, 2000"
+95-54-5,VITIC,1,-1,"NSC170895,PHENYLENO",Nc1ccccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+52171-92-3,EPA3,1,-1,,Cc1cccc2c1cc(C)c3c4ccccc4ccc23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+132742-05-3,CCRIS,0,-1,,[O-][N+](=O)c1c2CCC=Cc2c3ccc4cccc5ccc1c3c45,"FU,PP, JUNG,H, VON TUNGELN,LS AND HEFLICH,RH, MUTAGENICITY OFMONONITRODIHYDROBENZO[A]PYRENES, MUTAT. RES. 245(4):277-285, 1990"
+21626-89-1,EPA1,0,-1,"DIFTALONE",O=C1N2Cc3ccccc3C(=O)N2Cc4ccccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38178-41-5,EPA1,1,-1,,[O-][N+](=O)c1ccc2Oc3ccccc3Oc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1072-43-1,CCRIS,0,-1,,CC1CS1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y88"
+36050-09-6,CCRIS,1,-1,,NC(=O)c1csc(c1)[N+](=O)[O-],"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+66-71-7,VITIC,0,-1,"PHENANTHR",c1cnc2c(c1)ccc3cccnc23,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16683-64-0,EPA1,1,-1,,C1=Cc2c3cc4ccccc4cc3cc5cccc1c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107-01-7,CCRIS,0,-1,,C\C=C\C,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+59901-91-6,EPA3,1,-1,,O[C@H]([C@@H]1CO1)c2ccc3OCOc3c2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+93673-31-5,CCRIS,1,-1,,O1C2C1c3c4ccc5ccccc5c4cc6cccc2c36,"BARTCZAK,AW, SANGAIAH,R, BALL,LM, WARREN,SH AND GOLD,A, SYNTHESIS ANDBACTERIAL MUTAGENICITY OF THE CYCLOPENTA OXIDES OF THE FOUR CYCLOPENTA-FUSEDISOMERS OF BENZANTHRACENE, MUTAGENESIS 2(2):101-105, 1987"
+24367-94-0,EPA1,0,-1,,CC(=O)Nc1ccc(Cc2ccc(N)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14088-71-2,EPA1,0,-1,"PROCLONOL",OC(C1CC1)(c2ccc(Cl)cc2)c3ccc(Cl)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+30747-87-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2snc(Cl)c2c1,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+94223-88-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc2nc3c(cc2c1)c4cccc5cccc3c45,"RAY,JK AND KAR,GK, ASSESSMENT OF THE MUTAGENIC ACTIVITY OF SOMEACENAPHTHO(1,2-B)QUINOLINES, CANCER LETT. 71(1-3):1-3, 1993"
+90-44-8,EPA1,1,-1,"DR0032419",O=C1c2ccccc2Cc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5131-60-2,VITIC,1,-1,,Nc1ccc(Cl)c(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+372-48-5,EPA1,1,-1,,Fc1ccccn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+577-33-3,EPA1,1,-1,"ANTHRAROB",Oc1ccc2c(O)c3ccccc3cc2c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3070-86-8,EPA1,0,-1,,CC(=O)Nc1ccc(Oc2ccc(NC(=O)C)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+137-05-3,VITIC,1,-1,"MECRYLATE",COC(=O)C(=C)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+52671-42-8,EPA1,1,-1,,O=Nc1ccc(Oc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-95-3,VITIC,0,-1,"NITROBEN",[O-][N+](=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+463-58-1,EPA3,1,-1,"COS",O=C=S,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+142628-08-8,CCRIS,1,-1,,NC(CSC(F)(F)C(Cl)Br)C(=O)O,"FINKELSTEIN,MB, VAMVAKAS,S, BITTNER,D AND ANDERS,MW,STRUCTURE-MUTAGENICITY AND STRUCTURE-CYTOTOXICITY STUDIES ON BROMINE-CONTAININGCYSTEINE S-CONJUGATES AND RELATED COMPOUNDS, CHEM. RES. TOXICOL. 7(2):157-163,1994"
+NOCAS_M492,EPA1,0,-1,,C[C@@H](O)CN(C[C@@H](C)O)C[C@@H](C)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2449-49-2,CCRIS,0,-1,,CC(N(C)C)c1ccccc1,"TAKAHASHI,A AND ONO,H, MUTAGENICITY ASSESSMENT IN 44 EPOXY RESINHARDENERS IN SALMONELLA TYPHIMURIUM TESTER STRAINS, CHEM. EXPRESS 8(9):785-788,1993"
+NOCAS_M192,EPA1,1,-1,,COC[C@@H](O)Cn1cc(nc1Cl)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+159092-85-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(cc3cccc(c3c2c1)[N+](=O)[O-])[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+33804-48-7,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2ccc(cc2)N(C)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107673-67-6,CCRIS,1,-1,,[O-][N+](=O)C1=Cc2cccc3c4cc5ccccc5cc4cc1c23,"GOLDRING,JM, BALL,LM, SANGAIAH,R AND GOLD,A, MUTAGENIC ACTIVITY OFNITRO-SUBSTITUTED CYCLOPENTA-FUSED POLYCYCLIC AROMATIC HYDROCARBONS TOWARDSSALMONELLA TYPHIMURIUM, MUTAT. RES. 187(2):67-77, 1987"
+NOCAS_M479,EPA1,0,-1,,CCCC[C@@H](CC)COC(=O)c1ccccc1C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26049-71-8,CCRIS,1,-1,,NNc1nc(cs1)c2ccc(N)cc2,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+17683-09-9,EPA1,1,-1,,Cc1ccc(NN=NCc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78113-36-7,CCRIS,0,-1,,CCCCCCCCCCCCCCCCCC(=O)NCCCCC(NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)OC(C(O)C(O)CO)C(NC(=O)C)C=O)C(=O)N)C(=O)O,"SHIMADA,H, HATTORI,C AND SATO,T, MUTAGENICITY STUDIES OF MUROCTASIN,ARZNEIM.-FORSCH. 38(7A):1031-1033, 1988"
+NOCAS_M91,EPA1,1,-1,,C[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+220042-15-9,CCRIS,1,-1,,OC1=C\C(=N/c2ccc(cc2)[N+](=O)[O-])\C(=O)C=C1c3nnc(NC(=O)c4ccccc4)s3,"HASSAN,MA, MASLAT,AO, ABUSSAUD,M, AHMED,IC AND ALKOFAHI,AS, SYNTHESISOF 2,5-DISUBSTITUTED-1,4-BENZOQUINONE DERIVATIVES AS POTENTIAL ANTIMICROBIAL ANDCYTOTOXIC AGENTS, ARCH. PHARM. 331(12):385-388, 1998"
+606-20-2,CCRIS,1,-1,,Cc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+13098-39-0,VITIC,0,-1,,FC(F)(F)C(=O)C(F)(F)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2164-17-2,VITIC,0,-1,"FLUOMETUR",CN(C)C(=O)Nc1cccc(c1)C(F)(F)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+37350-58-6,CCRIS,0,-1,"METOPROLO,METOPRBES,METOPRFUM,METOPRSUC,METOPRTRT",COCCc1ccc(OCC(O)CNC(C)C)cc1,"OKINE,LKN, IOANNIDES,C AND PARKE,DV, STUDIES ON THE POSSIBLEMUTAGENICITY OF BETA-ADRENERGIC BLOCKER DRUGS, TOXICOL. LETT. 16(3-4):167-174,1983"
+26651-23-0,EPA1,1,-1,,OS(=O)(=O)c1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64371-62-6,CCRIS,1,-1,,CC1(CO1)c2ccc(cc2)c3ccccc3,"ROSMAN,LB, BEYLIN,VG, GADDAMIDI,V, HOOBERMAN,BH AND SINSHEIMER,JE,MUTAGENICITY OF PARA-SUBSTITUTED ALPHA-METHYLSTYRENE OXIDE DERIVATIVES WITHSALMONELLA, MUTAT. RES. 171(2-3):63-70, 1986"
+87-56-9,EPA1,1,-1,,OC(=O)\C(=C(/Cl)\C=O)\Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142-62-1,EPA1,0,-1,"CAPROATE,CAPRYLANA,JM-299",CCCCCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+33857-26-0,VITIC,0,-1,,Clc1ccc2Oc3cc(Cl)ccc3Oc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99-30-9,EPA2,1,-1,"DICHLORON",Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+50-34-0,VITIC,0,-1,"PROPANTBR,PROPANTHE",CC(C)[N+](C)(CCOC(=O)C1c2ccccc2Oc3ccccc13)C(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+84-54-8,EPA1,0,-1,"DR9607166",Cc1ccc2C(=O)c3ccccc3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54818-87-0,EPA1,1,-1,,CC(=O)Nc1ccc(Sc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92887-88-2,CCRIS,1,-1,,CN(CCC#N)c1ccc(cc1)N=Nc2ccc3ncsc3c2,"ASHBY,J, CALLANDER,RD, LEFEVRE,PA, PATON,D AND FISHWICK,B,MUTAGENICITY TO SALMONELLA OF THE MONOMETHYLAMINO AND N-CYANOETHYL ANALOGS OF 4-DIMETHYLAMINOAZOBENZENE (DAB) AND 6-DIMETHYLAMINOPHENYLAZOBENZTHIAZOLE (6BT),MUTAT. RES. 128(1):11-16, 1984"
+72-55-9,VITIC,0,-1,"DDE",ClC(=C(c1ccc(Cl)cc1)c2ccc(Cl)cc2)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+55792-21-7,EPA1,0,-1,"HEPTACAIN",CCCCCCCOc1ccccc1NC(=O)OCCN2CCCCC2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2923-68-4,CCRIS,0,-1,,OC(=O)C(F)(F)C(F)(Cl)C(F)(F)C(F)(Cl)C(F)(F)C(F)(Cl)C(F)(F)Cl,"GODIN,CS, MYHR,BC, LAWLOR,TE, YOUNG,RR, MURLI,H AND CIFONE,MA,ASSESSMENT OF THE POTENTIAL GENOTOXICITY OF PERFLUORODECANOIC ACID ANDCHLOROTRIFLUOROETHYLENE TRIMER AND TETRAMER ACIDS, FUNDAM. APPL. TOXICOL.18(4):557-569, 1992"
+1229-55-6,EPA1,1,-1,,COc1ccccc1N=Nc2c(O)ccc3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1707-31-9,CCRIS,1,-1,,ON(C=O)c1ccc2ccccc2c1,"WANG,CY, LINSMAIER-BEDNAR,EM, LEE,MS AND KING,CM, MUTAGENICITIES OFN-ACYL-N-ARYLHYDROXYLAMINES FOR SALMONELLA, CHEM-BIOL. INTERACT.67(3-4):215-223, 1988"
+1192-62-7,EPA1,1,-1,,CC(=O)c1occc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13360-63-9,VITIC,0,-1,,CCCCNCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13177-28-1,CCRIS,1,-1,,[O-][N+](=O)c1ccc2cccc3c4ccccc4c1c23,"VANCE,WA AND LEVIN,DE, STRUCTURAL FEATURES OF NITROAROMATICS THATDETERMINE MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM, ENVIRON. MUTAGEN.6(6):797-811, 1984"
+5381-78-2,CCRIS,0,-1,,Cn1cnc2cc(ccc12)[N+](=O)[O-],"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+86-26-0,EPA3,0,-1,,COc1ccccc1c2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+108-83-8,VITIC,0,-1,,CC(C)CC(=O)CC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1774-66-9,CCRIS,0,-1,,Brc1ccc(\C=C\C(=O)c2ccccc2)cc1,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+1635-63-8,CCRIS,0,-1,,CNP1(NC)NP(NC)(NC)NP(NC)(NC)N1,"ALLCOCK,HR, PUCHER,SR, FITZPATRICK,RJ AND RASHID,K, ANTIBACTERIALACTIVITY AND MUTAGENICITY STUDIES OF WATER-SOLUBLE PHOSPHAZENE HIGH POLYMERS,BIOMATERIALS 13(12):857-862, 1992"
+13024-49-2,EPA1,1,-1,,Nc1ccc(CCc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+79642-33-4,CCRIS,0,-1,,CCOC(=O)Nc1cccc2c3c[nH]ccc3nc12,"LIN,JK, WU,SS AND CHEN,JT, MUTAGENICITIES OF NITROSATED CARBOLINEDERIVATIVES, PROC. NATL. SCI. COUNC., REPUB. CHINA, PART B: LIFE SCI.10(4):280-286, 1986"
+96563-11-0,CCRIS,1,-1,,CC1c2ccccc2c3ccc(F)cc13,"LAVOIE,EJ, COLEMAN,DT, GEDDIE,NG AND RICE,JE, STUDIES ON THEMUTAGENICITY AND TUMOR-INITIATING ACTIVITY OF METHYLATED FLUORENES, CHEM.-BIOL.INTERACT. 52(3):301-309, 1985"
+129-44-2,EPA1,1,-1,,Nc1cccc2C(=O)c3c(N)cccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6109-97-3,VITIC,1,-1,,CCn1c2ccccc2c3cc(N)ccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+125157-97-3,CCRIS,1,-1,,CC1C2C(=Nc3ccccc23)N(C)c4c(C)cccc14,"RAHDEN-STARON,I, PECZYNSKA-CZOCH,W AND KACZMAREK,L, MUTAGENICITY OFCARBOLINE METHYL DERIVATIVES IN SALMONELLA, ACTA MICROBIOL. POL. 43(2):247-250,1994"
+2475-46-9,EPA1,1,-1,,CNc1ccc(NCCO)c2C(=O)c3ccccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51938-21-7,CCRIS,1,-1,,CCCCN(CCC(=O)OC)N=O,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+1635-61-6,CCRIS,1,-1,,Nc1cc(Cl)ccc1[N+](=O)[O-],"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+10312-83-1,EPA1,1,-1,,COCC=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53757-29-2,EPA3,1,-1,,Cc1nc(cs1)c2oc(cc2)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+7227-92-1,CCRIS,1,-1,,CN(C)N=Nc1ccc(cc1)[N+](=O)[O-],"CERNA,M, LEPSI,P, ROSSNER,P AND POHLOVA,H, MUTAGENICITY OF SOMESUBSTITUTED 1-PHENYL-3,3-DIMETHYLTRIAZENES. I. THE SALMONELLA/MAMMALIANMICROSOME ASSAY AND REPAIR TEST, MUTAT. RES. 190(3):177-182, 1987"
+3096-64-8,EPA1,1,-1,,Cc1ccc(C)c(NO)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M281,EPA1,1,-1,,N1[C@@H]2[C@H]1c3c(ccc4ccccc34)c5ccccc25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-25-7,CCRIS,1,-1,,O=NN1CN2CN(CN(C2)N=O)C1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+181256-48-4,CCRIS,1,-1,,NNc1nc2ccc3nc4ccccc4c(O)c3c2s1,"TANAKA,M, CSURI,K, MUCSI,I, MOLNAR,J, GALY,JP AND BARBE,J,MUTAGENICITY OF SYNTHETIC ACRIDINONES AND THIOACRIDINES IN DIRECT AMESSALMONELLA MUTAGENICITY ASSAY, HETEROCYCL. COMMUN. 2(5):463-467, 1996"
+NOCAS_M74,EPA1,1,-1,,OC(=O)[C@@H](Cl)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5694-00-8,CCRIS,1,-1,,NC(=O)C1CO1,"HASHIMOTO,K AND TANII,H, MUTAGENICITY OF ACRYLAMIDE AND ITS ANALOGUESIN SALMONELLA TYPHIMURIUM, MUTAT. RES. 158(3):129-133, 1985"
+21340-68-1,EPA1,0,-1,"CLOFENAPA",COC(=O)C(C)(C)Oc1ccc(cc1)c2ccc(Cl)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+581-64-6,EPA1,1,-1,"THIONINE",Nc1ccc2nc3ccc(N)cc3[s+]c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+31551-45-8,VITIC,1,-1,,[O-][N+](=O)c1ccc2c3ccc(cc3C(=O)c2c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+17413-41-1,CCRIS,0,-1,"ARISTOGLU",COc1cccc2c1cc3N([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C(=O)c5cc6OCOc6c2c35,"PEZZUTO,JM, SWANSON,SM, MAR,W, CHE,CT, CORDELL,GA AND FONG,HHS,EVALUATION OF THE MUTAGENIC AND CYTOSTATIC POTENTIAL OF ARISTOLOCHIC ACID(3,4-METHYLENEDIOXY-8-METHYOXY-10-NITROPHENANTHRENE-1-CARBOXYLIC ACID) ANDSEVERAL OF ITS DERIVATIVES, MUTAT. RES. 206(4):447-454, 1988"
+616-91-1,EPA1,1,-1,"ACCYSTEIN",CC(=O)N[C@@H](CS)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+160637-29-6,CCRIS,1,-1,,CC1=Cc2nc3c(ccc4ccccc34)c(C)c2C(O)C1O,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+544-16-1,EPA1,1,-1,,CCCCON=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1129-52-8,EPA3,1,-1,,ClC[C@@H]1O[C@H](CCl)O[C@H](CCl)O1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+580-21-2,CCRIS,0,-1,,Fc1ccc2ccccc2n1,"LAVOIE,EJ, DEFAUW,J, FEALY,M, WAY,BM AND MCQUEEN,CA, GENOTOXICITY OFFLUOROQUINOLINES AND METHYLQUINOLINES, CARCINOGENESIS 12(2):217-220,1991"
+92-54-6,EPA1,0,-1,"PHPIPERAZ",C1CN(CCN1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1634-04-4,VITIC,0,-1,"MTBE",COC(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+158729-31-8,CCRIS,0,-1,,CN(C)CCNS(=O)(=O)c1cccc2cccnc12,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+548-83-4,EPA1,0,-1,"GALANGIN",OC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1806-29-7,EPA1,0,-1,,Oc1ccccc1c2ccccc2O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120-14-9,VITIC,0,-1,"VERATRALD",COc1ccc(C=O)cc1OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+623-25-6,EPA1,0,-1,,ClCc1ccc(CCl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+130005-62-8,EPA1,1,-1,,Cc1cc(N)c(C)c2c3cc(O)ccc3[nH]c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155164-58-2,CCRIS,0,-1,,Cc1ccc(cc1)S(=O)(=O)N2N=CC(=C(Cl)C2=O)Cl,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+36239-01-7,CCRIS,1,-1,,CN(COC(=O)C)[N+](=O)[O-],"FREI,E, POOL,BL, PLESCH,W AND WIESSLER,M, BIOCHEMICAL AND BIOLOGICALPROPERTIES OF PROSPECTIVE N-NITRODIALKYLAMINE METABOLITES AND THEIR DERIVATIVES,IARC SCI. PUBL. 57(N-NITROSO COMPD: OCCURRENCE, BIOL. EFF. RELEVANCE HUM.CANCER):491-497, 1984"
+389104-57-8,CCRIS,1,-1,,CC(C)c1c(N)ccc2c1Cc3ccccc23,"GLENDE,C SCHMITT,H ERDINGER,L ENGELHARDT,G AND BOCHE,G, TRANSFORMATIONOF MUTAGENIC AROMATIC AMINES INTO NON-MUTAGENIC SPECIES BY ALKYL SUBSTITUENTS.PART I. ALKYLATION ORTHO TO THE AMINO FUNCTION. MUTAT. RES. 498(1-2):19-37,2001"
+17057-98-6,CCRIS,1,-1,,CC1c2ccccc2c3cccc(C)c13,"LAVOIE,EJ, COLEMAN,DT, GEDDIE,NG AND RICE,JE, STUDIES ON THEMUTAGENICITY AND TUMOR-INITIATING ACTIVITY OF METHYLATED FLUORENES, CHEM.-BIOL.INTERACT. 52(3):301-309, 1985"
+55-63-0,EPA1,1,-1,"NITROGLYC",[O-][N+](=O)OCC(CO[N+](=O)[O-])O[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115-90-2,EPA3,0,-1,"FENSULFOT",CCOP(=S)(OCC)Oc1ccc(cc1)S(=O)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+131229-60-2,CCRIS,1,-1,,CCCCON(OC(=O)C)C(=O)c1ccc(OC)cc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+NOCAS_M423,EPA1,0,-1,,Br[C@@H]1CC[C@H](Br)[C@H](Br)CC[C@@H](Br)[C@@H](Br)CC[C@H]1Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6755-13-1,CCRIS,1,-1,,CN(C)C(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+4533-39-5,CCRIS,1,-1,"NITRACRIN,NITRACHCL",CN(C)CCCNc1c2ccccc2nc3cccc(c13)[N+](=O)[O-],"FERGUSON,LR, TURNER,PM AND DENNY,WA, MUTAGENICITY OF NITRACRINEANALOGUES IN SALMONELLA TYPHIMURIUM. MUTATIONAL SPECIFICITY AND ACTIVATION BYBACTERIAL ENZYMES AND RAT-LIVER S9 MUTAT. RES. 187(1):1-9, 1987"
+15131-84-7,CCRIS,1,-1,,O1C2C1c3c(ccc4ccccc34)c5ccccc25,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+13171-21-6,EPA1,1,-1,"PHOSPHAMI",CCN(CC)C(=O)\C(=C(\C)/OP(=O)(OC)OC)\Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+87619-82-7,CCRIS,1,-1,,NC(CS\C(=C(/Cl)\C(=C(Cl)Cl)Cl)\Cl)C(=O)O,"DEKANT,W, VAMVAKAS,S, BERTHOLD,K, SCHMIDT,S, WILD,D AND HENSCHLER,D,BACTERIAL BETA-LYASE-MEDIATED CLEAVAGE AND MUTAGENICITY OF CYSTEINE CONJUGATESDERIVED FROM THE NEPHROCARCINOGENIC ALKENES TRICHLOROETHYLENE,TETRACHLOROETHYLENE AND HEXACHLOROBUTADIENE, CHEM.-BIOL. INTERACT. 60(1):31-45,1986"
+114231-14-0,EPA1,0,-1,"DR9600627",COc1cc(OC)c(Cl)c(c1)N2C(=CC(=O)C(=C2c3ccc(F)cc3)C)c4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+194479-75-9,CCRIS,1,-1,,Cc1ccc2nc3ccc(C)cc3c(N)c2c1,"TOMOSAKA,H, OMATA,S, HASEGAWA,E AND ANZAI,K, THE EFFECTS OFSUBSTITUENTS INTRODUCED INTO 9-AMINOACRIDINE ON FRAMESHIFT MUTAGENICITY AND DNABINDING AFFINITY, BIOSCI., BIOTECHNOL., BIOCHEM. 61(7):1121-1125,1997"
+431-63-0,CCRIS,0,-1,,FC(F)C(F)C(F)(F)F,"BROCK,WJ KELLY,DP MUNLEY,SM BENTLEY,KS MCGOWN,KM AND VALENTIN,R,INHALATION TOXICITY AND GENOTOXICTY OF HYDROFLUOROCARBON (HFC)-236FA ANDHFC-236EA, INT. J. TOXICOL. 19(2):69-83, 2000"
+149396-91-8,CCRIS,0,-1,,Cc1ccc(c(O)c1C(O)c2ncc([N+](=O)[O-])n2C)C(C)(C)C,"DUBINI,F, RIVIERA,L, SCALTRITO,MM AND BELLOTTI,MG, SUSCEPTIBILITY OFHELICOBACTER PYLORI AND PHARMACOKINETIC PROPERTIES IN MICE OF NEW5-NITROIMIDAZOLE DERIVATIVES DEVOID OF MUTAGENIC ACTIVITY IN THE AMES TEST, J.CHEMOTHER. (FLORENCE) 5(3):168-173, 1993"
+7220-79-3,VITIC,1,-1,"METHTHION,METHIONUM",CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+127072-58-6,CCRIS,1,-1,,CC\C=C\C=C\C=C\C=C\C=C\C=C\OCC(O)CO,"VOOGD,CE, VERTEGAAL,LBJ, VAN DER STEEG,M, VAN DER GEN,A, MOHN,GR,STUCTURE, CHEMICAL REACTIVITY, AND IN VITRO MUTAGENIC ACTIVITY IN A SERIES OFFECAPENTAENE ANALOGS, MUTAT. RES. 243(3):195-9, 1990"
+143922-99-0,CCRIS,0,-1,,CC(=O)Nc1cccc(N=Nc2cccc(NC(=O)C)c2C)c1C,"SAYAMA,M, INOUE,M, MORI,MA, MARUYAMA,Y AND KOZUKA,H, BACTERIALMETABOLISM OF 2,6-DINITROTOLUENE WITH SALMONELLA TYPHIMURIUM AND MUTAGENICITY OFTHE METABOLITES OF 2,6-DINITROTOLUENE AND RELATED COMPOUNDS, XENOBIOTICA 22(6):633-640, 1992"
+96-31-1,VITIC,0,-1,"DIMEUREA",CNC(=O)NC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M359,EPA1,0,-1,,CCCC[C@@H](CC)COCCC#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+173106-65-5,CCRIS,0,-1,,CC1(C)CC(C(=O)NCCCCCCCCCCCC(=O)O)C(C)(C)N1O,"GALLEZ,B, DE MEESTER,C, DEBUYST,R, DEJEHET,F AND DUMONT,P,MUTAGENICITY OF NITROXYL COMPOUNDS: STRUCTURE-ACTIVITY RELATIONSHIPS, TOXICOL.LETT. 63(1): 35-45, 1992"
+27343-29-9,EPA3,1,-1,,Cc1cc2C(=O)CCCc2c3ccc4ccccc4c13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+121-33-5,VITIC,0,-1,"VANILLIN",COc1cc(C=O)ccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+80-39-7,VITIC,0,-1,,CCNS(=O)(=O)c1ccc(C)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4553-62-2,EPA3,1,-1,,C[C@H](CCC#N)C#N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+3340-94-1,EPA1,1,-1,,Cc1c2ccccc2nc3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80734-02-7,CCRIS,0,-1,,CC1=C(COC(=O)C2N3C(SC2(C)C)C(NC(=O)C(N)c4ccccc4)C3=O)OC(=O)O1,"IWATA,T, KOKUBA,S, ARIGA,F, HIRAMATSU,Y, NOSE,T AND AOYAMA,T,MUTAGENICITY OF LENAMPICILLIN HYDROCHLORIDE (KBT-1585)B AND ITS METABOLITES,CHEMOTHERAPY 32(SUPPL. 8):153-160, 1984"
+26091-73-6,CCRIS,0,-1,"OXYPEUCED",CC1(C)OC1COc2c3C=CC(=O)Oc3cc4occc24,"UWAIFO,AO, THE MUTAGENICITIES OF SEVEN COUMARIN DERIVATIVES AND AFURAN DERIVATIVE (NIMBOLIDE) ISOLATED FROM THREE MEDICINAL PLANTS, J. TOXICOL.ENVIRON. HEALTH 13(4-6):521-530, 1984"
+50-47-5,CCRIS,0,-1,"DESIPRAMI,DESIPRHCL",CNCCCN1c2ccccc2CCc3ccccc13,"BALBI,A MUSCETTOLA,G STAIANO,N MARTIRE,G AND DE LORENZO,F, PSYCHOTROPIC DRUGS: EVALUATION OF MUTAGENIC EFFECT,  PHARMACOL. RES. COMMUN.12(5):423-431, 1980"
+20983-67-9,EPA1,1,-1,,[O-][N+](=O)c1ccc(Nc2ccc(Cl)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103124-62-5,CCRIS,0,-1,,CCOC(=O)C(=NNc1ccc(cc1)c2ccc(NN=C(C(=O)OCC)C(=O)OCC)cc2)C(=O)OCC,"DE FRANCE,BF, CARTER,MH AND JOSEPHY,PD, COMPARATIVE METABOLISM ANDMUTAGENICITY OF AZO AND HYDRAZONE DYES IN THE AMES TEST, FOOD CHEM. TOXICOL.24(2):165-169, 1986"
+488-23-3,EPA1,0,-1,,Cc1ccc(C)c(C)c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112725-15-2,CCRIS,1,-1,,CN(N=O)C(OC(=O)C)C(=O)C,"NAGEL,DL, MIRVISH,SS, WALLCAVE,L AND WALKER,B, ALPHA-ACETOXYDERIVATIVES OF METHYL-2-OXOPROPYLNITROSAMINE. SYNTHESIS, HYDROLYSIS RATE ANDBACTERIAL MUTAGENICITY,CANCER LETT. 36(3):325-332, 1987"
+107673-66-5,EPA1,1,-1,,[O-][N+](=O)C1=Cc2cc3cc4ccccc4cc3c5cccc1c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+41267-76-9,EPA1,1,-1,,CC1=CC(=O)Oc2c3CCCN4CCCc(cc12)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3736-59-2,CCRIS,0,-1,"DR9507955",Oc1cc2C(=O)c3ccccc3C(=O)c2c(O)c1C=O,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+55028-70-1,CCRIS,0,-1,,CCCCCC(C)(O)\C=C\C1C(O)CC(=O)C1C\C=C\CCCC(=O)O,"INOUE,M, OHNO,M, SATO,T AND NIKI,R, MUTAGENICITY TEST ON15(R)-15-METHYLPROSTAGLANDIN E2 (ARAPROSTIL). REVERSION TEST IN BACTERIA, YAKURITO CHIRYO 16(SUPPL. 4):995-998, 1988"
+103-90-2,VITIC,0,-1,"PARACETAM",CC(=O)Nc1ccc(O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+509-14-8,EPA2,1,-1,"DR9804702",[O-][N+](=O)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+108283-48-3,CCRIS,1,-1,,CC(C)(C)OC(=O)NC(CN=N#N)C(=O)OC(C)(C)C,"LAVELLE,JM AND MANGOLD,JB, STRUCTURE-ACTIVITY RELATIONSHIPS OF THEAZIDE METABOLITE, AZIDOALANINE, IN S. TYPHIMURIUM, MUTAT. RES. 177(1):27-33,1987"
+123447-62-1,CCRIS,0,-1,"NM-441",CC1SC2=C(C(=O)O)C(=O)c3cc(F)c(cc3N12)N4CCN(CC5=C(C)OC(=O)O5)CC4,"IWAKURA,K, TAMURA,H, YAMASHITA,Y, WATANABE,M, SUMI,N, SHINDO,Y, ANDO,MAND KOJIMA,M, MUTAGENICITY STUDIES OF PRULIFLOXACIN (NM441) AND THE ACTIVEMETABOLITE (NM394), J. TOXICOL. SCI. 21(SUPPL. 1):241-257, 1996"
+1877-73-2,CCRIS,0,-1,,OC(=O)Cc1cccc(c1)[N+](=O)[O-],"SHIMIZU,M AND YANO,E, MUTAGENICITY OF MONO-NITROBENZENE DERIVATIVES INTHE AMES TEST AND REC ASSAY, MUTAT. RES. 170(1-2):11-22, 1986"
+527-53-7,VITIC,0,-1,,Cc1cc(C)c(C)c(C)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60-35-5,VITIC,0,-1,"ACETAMIDE,PLATINUMR",CC(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+215226-70-3,CCRIS,1,-1,,OC(=O)\C(=C(/CCl)\C=O)\Cl,"FRANZEN,R, GOTO,S, TANABE,K AND MORITA,M, GENOTOXIC ACTIVITY OFCHLORINATED BUTENOIC ACIDS IN SALMONELLA TYPHIMURIUM STRAINS TA98, TA100 ANDTA104, MUTAT. RES. 417(1):31-37, 1998"
+155164-63-9,CCRIS,0,-1,,CC(=O)N1N=CC(=C(Cl)C1=O)Cl,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+98447-32-6,CCRIS,1,-1,,ClCC(=O)Nc1snc2cc(Cl)ccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+117-18-0,CCRIS,0,-1,"TECNAZENE",[O-][N+](=O)c1c(Cl)c(Cl)cc(Cl)c1Cl,"HAWORTH,S, LAWLOR,T MORTELMANS,K, SPECK,W AND ZEIGER,E, SALMONELLAMUTAGENICITY TEST RESULTS FOR 250 CHEMICALS, ENVIRON. MUTAGEN. 5(SUPPL. 1):3-142, 1983"
+NOCAS_M61,EPA1,1,-1,,CC(C)(C)c1ccc(OC[C@H]2CO2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63408-86-6,EPA3,1,-1,,ONc1cc2ccccc2[nH]1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+146177-61-9,EPA1,1,-1,,Cc1cnc2c(n1)c(C)c(C)c3c2nc(N)n3C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61034-40-0,EPA2,0,-1,,CC1CN(CC(C)N1C(=O)c2ccccc2)N=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+98-33-9,EPA1,0,-1,,Cc1cc(ccc1N)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+478-06-8,CCRIS,0,-1,,OC(=O)c1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+97629-64-6,CCRIS,0,-1,,Cc1cc(N)c(c(C)c1N)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+75-65-0,VITIC,0,-1,"BUTANOLTE",CC(C)(C)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+91991-23-0,CCRIS,0,-1,,CC(C)CC(=O)Nc1snc2ccc(Cl)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+NOCAS_M86,EPA1,1,-1,,CC(=C[C@H]1[C@H](C(=O)OCN2C(=O)C3=C(CCCC3)C2=O)C1(C)C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57166-92-4,VITIC,1,-1,,NCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2550-75-6,CCRIS,0,-1,"CHLORBICY",ClCC1C(CCl)C2(Cl)C(=C(Cl)C1(Cl)C2(Cl)Cl)Cl,"MERSCH-SUNDERMANN,V, DICKGIESSER,N, HABLIZEL,U AND GRUBER,B,EXAMINATION OF MUTAGENICITY OF ORGANIC MICROCONTAMINATIONS ON THE ENVIRONMENT.PART 1. THE MUTAGENICITY OF SELECTED HERBICIDES AND INSECTICIDES WITH THESALMONELLA-MICROSOME TEST (AMES TEST) IN CONSIDERATION OF THE PATHOGENICITY OFCONTAMINATED GROUND- AND DRINKING-WATER, ZENTRALBL. BAKTERIOL., MIKROBIOL. HYG.,SER. B 186(3):247-260, 1988"
+643-22-1,EPA1,0,-1,,CC[C@@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-34-5,VITIC,0,-1,,CCCCOCCOCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+32766-75-9,EPA3,1,-1,,CCCCCCCCCCCCCC(=O)N(O)c1ccc2c(Cc3ccccc23)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+5412-25-9,CCRIS,1,-1,,OP(=O)(OCC(Br)CBr)OCC(Br)CBr,"LYNN,RK, GARVIE-GOULD,C, WONG,K AND KENNISH,JM, METABOLISM,DISTRIBUTION, AND EXCRETION OF THE FLAME RETARDANT,TRIS(2,3-DIBROMOPROPYL)PHOSPHATE (TRIS-BP) IN THE RAT: IDENTIFICATION OFMUTAGENIC AND NEPHROTOXIC METABOLITES, TOXICOL. APPL. PHARMACOL. 63:105-119,1982"
+67-47-0,EPA1,1,-1,"HOMEFURFA",OCc1oc(C=O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+114460-38-7,EPA1,1,-1,,Cn1ccc2ccc3ccc4ccc(O)cc4c3c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6422-86-2,CCRIS,0,-1,,CCCCC(CC)COC(=O)c1ccc(cc1)C(=O)OCC(CC)CCCC,"BARBER,ED, GENETIC TOXICOLOGY TESTING OFDI(2-ETHYLHEXYL)TEREPHTHALATE, ENVIRON. MOL. MUTAGEN. 23(3):228-233,1994"
+NOCAS_M18,EPA1,1,-1,,C[C@@H](O)CN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+81593-15-9,CCRIS,1,-1,,ClN1C2C1c3ccccc3c4ccccc24,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+146-59-8,EPA1,1,-1,"ICR-170",CCN(CCCl)CCCNc1c2ccc(Cl)cc2nc3ccc(OC)cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+957-52-8,EPA1,1,-1,,ClCc1ccc2c3ccccc3c4cccc1c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+82017-48-9,CCRIS,0,-1,"SA-981",CC1(C)SSCC(NC1=O)C(=O)O,"MORIKAWA,K, YAMAUCHI,H AND ISO,T, MUTAGENICITY TESTS ON N-(2-MERCAPTO-2-METHYLPROPIONYL)-L-CYSTEINE (SA96), IYAKUHIN KENKYU 16(4):784-792,1985"
+86607-81-0,EPA1,1,-1,,[O-][N+](=O)c1cccc2c1oc3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7220-81-7,CCRIS,1,-1,"AFLATOXB2",COc1cc2OC3OCCC3c2c4OC(=O)C5=C(CCC5=O)c14,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+122-04-3,VITIC,1,-1,,[O-][N+](=O)c1ccc(cc1)C(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+57775-29-8,CCRIS,0,-1,"CARAZOLOL",CC(C)NCC(O)COc1cccc2[nH]c3ccccc3c12,"HUSSAIN,SS, AL-DAKAN,AA, ABOUL-ENEIN,HY AND HANNAN,MA, DNA STRANDBREAKS AND MUTATIONS CAUSED BY PENBUTOLOL, A BETA BLOCKER, MUTAT. RES.204(4):675-682, 1988"
+143-50-0,VITIC,0,-1,"CHLORDECO",ClC1(Cl)C2(Cl)C3(Cl)C4(Cl)C(=O)C5(Cl)C(Cl)(C1(Cl)C35Cl)C24Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+90-02-8,EPA1,0,-1,"SALICYALD",Oc1ccccc1C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53797-18-5,EPA3,1,-1,,OC[C@H]1O[C@@H](Oc2cccc3C(=O)c4cccc(O)c4C(=O)c23)[C@H](O)[C@@H](O)[C@@H]1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+621-33-0,EPA3,1,-1,"PHENETIDM",CCOc1cccc(N)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M501,EPA1,0,-1,,CCOC[C@@H](O)COc1ccc(NC(=O)CC[S+](C)C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117-39-5,VITIC,1,-1,"QUERCETIN",OC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)c(O)c3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4513-36-4,EPA1,0,-1,,CC(C)(C)COC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60564-31-0,CCRIS,1,-1,,Nc1cc2c(cc1[N+](=O)[O-])[nH]c3ccccc23,"ANDRE,V, BOISSART,C, SICHEL,F, GAUDUCHON,P, LE TALAEER,JY,LANCELOT,JC, ROBBA,M, MERCIER,C, CHEMTOB,S, RAOULT,E AND TALLEC,A, MUTAGENICITYOF NITRO- AND AMINO-SUBSTITUTED CARBAZOLES IN SALMONELLA TYPHIMURIUM. II.ORTHO-AMINONITRO DERIVATIVES OF 9H-CARBAZOLE, MUTAT. RES. 345(1,2):11-25,1995"
+129-15-7,EPA2,1,-1,,Cc1ccc2C(=O)c3ccccc3C(=O)c2c1[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+95-77-2,VITIC,0,-1,,Oc1ccc(Cl)c(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+103-50-4,VITIC,0,-1,,C(OCc1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M266,EPA1,1,-1,,Cc1ccc(CC[C@H]2CO2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132769-75-6,CCRIS,1,-1,,OC1C2OC2c3c(ccc4ccc5c6ccccc6ccc5c34)C1O,"GLATT,H, PIEE,A, PAULY,K, STEINBRECHER,T, SCHRODE,R, OESCH,F ANDSEIDEL,A, FJORD- AND BAY-REGION DIOL-EPOXIDES INVESTIGATED FOR STABILITY, SOSINDUCTION IN ESCHERICHIA COLI, AND MUTAGENICITY IN SALMONELLA TYPHIMURIUM ANDMAMMALIAN CELLS,CANCER RES. 51(6):1659-1667, 1991"
+552-30-7,VITIC,0,-1,,OC(=O)c1ccc2C(=O)OC(=O)c2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5776-38-5,EPA1,1,-1,,C[n+]1c2ccccc2c(N)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117760-92-6,EPA1,1,-1,,O[C@@H]1C=Cc2c([C@H]1O)c3ccc4ccccc4c3cc2[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4450-68-4,CCRIS,1,-1,,Cc1ccc(cc1)S(=O)(=O)OCc2ccc(cc2)[N+](=O)[O-],"BALL,JC, FOXALL-VANAKEN,S AND JENSEN,TE, MUTAGENICITY STUDIES OFP-SUBSTITUTED BENZYL DERIVATIVES IN THE AMES SALMONELLA PLATE-INCORPORATIONASSAY, MUTAT. RES. 138(2-3):145-151, 1984"
+90811-87-3,CCRIS,0,-1,,O=C(\C=C\c1ccc(Oc2ccccc2)cc1)c3ccccc3,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+120-71-8,VITIC,1,-1,,COc1ccc(C)cc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+592-41-6,VITIC,0,-1,,CCCCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+841-18-9,EPA3,1,-1,,CC(=O)Nc1ccc(\C=C/c2ccccc2)cc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+76-12-0,EPA3,1,-1,,FC(Cl)(Cl)C(F)(Cl)Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+557-48-2,CCRIS,0,-1,,CC\C=C\CC\C=C\C=O,"EDER,E, DEININGER,C, NEUDECKER,T AND DEININGER,D, MUTAGENICITY OFBETA-ALKYL SUBSTITUTED ACROLEIN CONGENERS IN THE SALMONELLA TYPHIMURIUM STRAINTA100 AND GENOTOXICTY TESTING IN THE SOS CHROMOTEST, ENVIRON. MOL. MUTAGEN.19(4):338-345, 1992"
+114416-29-4,CCRIS,0,-1,,OC1C=Cc2c(ccc3ncccc23)C1O,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+NOCAS_M169,EPA1,1,-1,,CCCC[C@@H](CC)COC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+479-13-0,EPA1,0,-1,"COUMESTRO",Oc1ccc2c(OC(=O)c3c2oc4cc(O)ccc34)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92-59-1,VITIC,0,-1,,CCN(Cc1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+72-43-5,VITIC,0,-1,"METHOXYCL",COc1ccc(cc1)C(c2ccc(OC)cc2)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M171,EPA1,1,-1,,CCCCN(C[C@@H](O)C1=CC(=[N+]=[N-])C(=O)C=C1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+87-66-1,VITIC,1,-1,"PYROGALLO",Oc1cccc(O)c1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+77-78-1,VITIC,1,-1,"DIMESULFA",COS(=O)(=O)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+18463-85-9,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2ccc3ncsc3c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+530-50-7,EPA1,0,-1,,NN(c1ccccc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96337-40-5,CCRIS,0,-1,,CCN=[N+](C)[O-],"LIJINSKY,W, ANDREWS,AW, ELESPURU,RK AND FARRELLY,JG, LACK OF GENETICAND IN VITRO METABOLIC ACTIVITY OF POTENTLY CARCINOGENIC AZOXYALKANES, MUTAT.RES. 157(1):23-27, 1985"
+141511-30-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(CCc3cc4c(CCc5ccccc45)cc23)c1,"YU,S, HERRENO-SAENZ,D, MILLER,DW, KADLUBAR,FF AND FU,PP, MUTAGENICITYOF NITRO- POLYCYCLIC AROMATIC HYDROCARBONS WITH THE NITRO SUBSTITUENT SITUATEDAT THE LONGEST MOLECULAR AXIS, MUTAT. RES. 283(1):45-52, 1992"
+80-47-7,EPA3,1,-1,,C[C@@H]1CC[C@H](CC1)C(C)(C)OO,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+505-70-4,EPA1,0,-1,"MUCONATE",OC(=O)\C=C\C=C\C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109910-98-7,CCRIS,0,-1,,OC1C(O)c2cc3cc(ccc3cc2CC1=O)[N+](=O)[O-],"FU,PP, HEFLICH,RH, VON TUNGELN,LS, YANG,DTC, FIFER,EK AND BELAND,FA,EFFECT OF THE NITRO GROUP CONFORMATION ON THE RAT LIVER MICROSOMAL METABOLISMAND BACTERIAL MUTAGENICITY OF 2- AND 9-NITROANTHRACENE, CARCINOGENESIS7(11):1819-1827, 1986"
+110-46-3,EPA1,1,-1,"AMYLNITRI",CC(C)CCON=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3081-61-6,CCRIS,0,-1,,CCNC(=O)CCC(N)C(=O)O,"FUJITA,H, AOKI,N AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVESWITH SALMONELLA TYPHIMURIUM TA97 AND TA102. IX, TOKYO-TORITSU EISEI KENKYUSHOKENKYU NENPO 45:191-199, 1994"
+25152-84-5,EPA3,0,-1,,CCCCC\C=C/C=C\C=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+816-57-9,EPA1,1,-1,,CCCN(N=O)C(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-62-9,VITIC,0,-1,"MEOLEATE",CCCCCCCC\C=C/CCCCCCCC(=O)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+367-25-9,VITIC,1,-1,,Nc1ccc(F)cc1F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+393-75-9,VITIC,0,-1,"DR9603767",[O-][N+](=O)c1cc(cc(c1Cl)[N+](=O)[O-])C(F)(F)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+81789-85-7,CCRIS,0,-1,"INDENOLOL,INDENOHCL",CC(C)NCC(O)COc1cccc2CC=Cc12,"HUSSAIN,SS, AL-DAKAN,AA, ABOUL-ENEIN,HY AND HANNAN,MA, DNA STRANDBREAKS AND MUTATIONS CAUSED BY PENBUTOLOL, A BETA BLOCKER, MUTAT. RES.204(4):675-682, 1988"
+218-19-9,EPA1,1,-1,,c1ccc2c(c1)ccc3c2ccc4cccnc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68267-98-1,CCRIS,0,-1,,CN(C(=O)CCl)c1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+120-62-7,EPA3,0,-1,,CCCCCCCCS(=O)[C@H](C)Cc1ccc2OCOc2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1070-66-2,CCRIS,1,-1,,CCCCC(=C)C=O,"EDER,E AND DEININGER,C, MUTAGENICITY OF 2-ALKYLPROPENALS IN SALMONELLATYPHIMURIUM STRAIN TA 100:STRUCTURAL INFLUENCES, ENVIRON. MOL. MUTAGEN.37(4):324-328, 2001"
+139-65-1,VITIC,1,-1,,Nc1ccc(Sc2ccc(N)cc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+54150-69-5,VITIC,1,-1,,COc1ccc(N)c(OC)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+127-19-5,VITIC,0,-1,"DIMEACAMI",CN(C)C(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+58209-98-6,EPA3,1,-1,,COc1cc2O[C@H]3OC=C[C@H]3c2c4OC(=O)C5=C([C@@H](Cl)[C@@H](Cl)C5=O)c14,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+114454-59-0,CCRIS,1,-1,,OC1C(O)c2ccc(c3c4ccccc4c5cccc1c5c23)[N+](=O)[O-],"FU,PP, HEFLICH,RH, VON TUNGELN,LS, MIRANDA,HZ AND EVANS,FE, MICROSOMALMETABOLISM OF 1-NITROBENZO[E]PYRENE TO A HIGHLY MUTAGENIC K-REGION DIHYDRODIOL,CARCINOGENESIS 9(6):951-958, 1988"
+82298-37-1,CCRIS,0,-1,,OC1C(Oc2cccc3c4ccc5cccc6ccc(cc23)c4c56)OC(C(O)C1O)C(=O)O,"IRWIN,SE, KWEI,GY, BLACKBURN,GR, THURMAN,R AND KAUFFMAN,FC,MUTAGENICITY OF BENZO[A]PYRENYL-1-SULFATE IN THE AMES TEST,ENVIRON. MOL.MUTAGEN. 19(3):253- 258, 1992"
+27591-97-5,EPA3,1,-1,"IC-32,TILORDHCL",CCN(CC)CCOc1ccc2c(c1)C(=O)c3cc(OCCN(CC)CC)ccc23,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+17455-13-9,EPA1,0,-1,"18CROWN6",C1COCCOCCOCCOCCOCCO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1634-78-2,EPA3,0,-1,,CCOC(=O)C[C@@H](SP(=O)(OC)OC)C(=O)OCC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+8003-22-3,EPA1,1,-1,"QUINOLINY",O=C1C(C(=O)c2ccccc12)c3ccc4ccccc4n3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64-19-7,VITIC,0,-1,"ACETATE,ALACETATE,AMMONACET,CAACETATE,CUACETATE,RH2TETRAA,PBACETATE,LI-ACETAT,MGACETATE,K-ACETATE,AGACETATE,NAACETATE,TL-ACETAT,ZNACETATE",CC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+119631-00-4,EPA1,1,-1,,Cc1ccc(cc1N)N=Nc2ccc(C)c(N)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+77-47-4,VITIC,0,-1,,ClC1=C(Cl)C(Cl)(Cl)C(=C1Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+121-44-8,VITIC,0,-1,"TRIETAMIN",CCN(CC)CC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+77061-07-5,CCRIS,1,-1,,BrCc1cccc2c3cccc4cccc(c12)c34,"BALL,JC, AND YOUNG,WC, AMES ASSAY MUTAGENICITY AND ELECTRONICSTRUCTURE CALCULATIONS OF BROMOMETHYLFLUORANTHENES, CHLOROMETHYLFLUORANTHENES,AND HYDROXYMETHYLFLUORANTHENES, CHEM.-BIOL. INTERACT. 77(3):291-302,1991"
+133762-79-5,CCRIS,1,-1,,Nc1nc(N)c2ncn(CC(O)CN=N#N)c2n1,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+3173-53-3,VITIC,0,-1,"CYCHEXISO",O=C=NC1CCCCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13048-33-4,VITIC,0,-1,"HXDIOLDAC",C=CC(=O)OCCCCCCOC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+148193-38-8,CCRIS,1,-1,,O=C1N(CC2CO2)Sc3cc(OCC4CO4)ccc13,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+94-20-2,VITIC,0,-1,"CLPROPAMI,CLPROPMET",CCCNC(=O)NS(=O)(=O)c1ccc(Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+123-08-0,CCRIS,0,-1,"HOBENZALP",Oc1ccc(C=O)cc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+2179-59-1,VITIC,0,-1,,CCCSSCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60905-56-8,CCRIS,0,-1,,OC(Nc1snc2ccccc12)C(Cl)(Cl)Cl,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+28860-95-9,CCRIS,1,-1,,CC(Cc1ccc(O)c(O)c1)(NN)C(=O)O,"KITAMURA,J, MORI,H, SUGIE,S AND KAWAI,K, GENETIC TOXICITY OF SEVERALANTIHYPERTENSIVE DRUGS POSSESSING A HYDRAZINE GROUP, RES. COMMUN. CHEM. PATHOL.PHARMACOL. 49(3):415-422, 1985"
+1163-19-5,VITIC,0,-1,,Brc1c(Br)c(Br)c(Oc2c(Br)c(Br)c(Br)c(Br)c2Br)c(Br)c1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+88-23-3,VITIC,0,-1,,Nc1cc(Cl)cc(c1O)S(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+193-40-8,EPA1,0,-1,,c1ccc2c(c1)c3nc4ccccc4c5c6ccccc6nc2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+287-92-3,VITIC,0,-1,"CYCLOPENA",C1CCCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+76-01-7,VITIC,0,-1,,ClC(Cl)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+70853-94-0,EPA1,1,-1,,Cc1ccc(NO)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+624-92-0,VITIC,0,-1,"DIMEDISUL",CSSC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+524-15-2,EPA1,1,-1,"FAGARINEG",COc1cccc2c(OC)c3ccoc3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+526-73-8,EPA1,1,-1,,Cc1cccc(C)c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55256-49-0,CCRIS,0,-1,,Oc1cccc2Oc3cc4OC5OC=CC5c4c(O)c3C(=O)c12,"MORI,H, SUGIE,S, YOSHIMI,N, KITAMURA,J, NIWA,M, HAMASAKI,T ANDKAWAI,K, GENOTOXIC EFFECTS OF A VARIETY OF STERIGMATOCYSTIN-RELATED COMPOUNDS INTHE HEPATOCYTE/DNA-REPAIR TEST AND THE SALMONELLA MICROSOME ASSAY, MUTAT. RES.173(3):217-222, 1986"
+NOCAS_M368,EPA1,0,-1,,N[C@H](Cc1ccc(F)cc1)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126637-65-8,CCRIS,1,-1,,NC(CSC(F)(F)C(Br)Br)C(=O)O,"FINKELSTEIN,MB, VAMVAKAS,S, BITTNER,D AND ANDERS,MW,STRUCTURE-MUTAGENICITY AND STRUCTURE-CYTOTOXICITY STUDIES ON BROMINE-CONTAININGCYSTEINE S-CONJUGATES AND RELATED COMPOUNDS, CHEM. RES. TOXICOL. 7(2):157-163,1994"
+476-66-4,VITIC,0,-1,"ELLAGATE",Oc1cc2C(=O)Oc3c(O)c(O)cc4C(=O)Oc(c1O)c2c34,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+171866-15-2,EPA1,1,-1,,C[C@@H]1O[C@@H](O[C@H]2C[C@](O)(CO)Cc3c(O)c4C(=O)c5ccccc5C(=O)c4c(O)c23)[C@H](I)[C@H](O)[C@@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56525-94-1,CCRIS,0,-1,,COc1nncc2cccnc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+54779-53-2,EPA1,1,-1,"AMINOELLI",Cc1c2ccncc2c(C)c3c4cc(N)ccc4[nH]c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6449-35-0,EPA1,1,-1,,COc1cc(ccc1N=Nc2cc(c3ccccc3c2O)S(=O)(=O)O)c4ccc(N=Nc5c(O)c6ccc(N)cc6cc5S(=O)(=O)O)c(OC)c4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133762-85-3,CCRIS,1,-1,,CSc1ncnc2c1ncn2CC(O)CN=N#N,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+61-25-6,VITIC,0,-1,"PAPAVERIN,PAPAVADEN,PAPAVCODE,PAPAVERCR,PAPAVEHBR,PAPAVEHCL,PAPAVERMA,PAPAVENIC,PAPAVERNI,PAPAVERPH,PAPAVERSA,PAPAVERSU,PAPAVETEP",COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+54-91-1,EPA1,1,-1,"PIPOBROMA",BrCCC(=O)N1CCN(CC1)C(=O)CCBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1141-35-1,EPA1,0,-1,,Clc1ccc(cc1)c2oc3ccccc3n2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-93-0,VITIC,0,-1,"CYCLOHNOL",OC1CCCCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+28166-06-5,CCRIS,1,-1,,[O-][N+](=O)c1cc(ccc1F)N=N#N,"SHUBBER,EK, JACOBSON-KRAM,D AND WILLIAMS,JR, COMPARISON OF THE AMESASSAY AND THE INDUCTION OF SISTER CHROMATID EXCHANGES: RESULTS WITH TENPHARMACEUTICALS AND FIVE SELECTED AGENTS, CELL BIOL. TOXICOL. 2(3):379-399,1986"
+475-80-9,EPA1,1,-1,"ARISTOLO2",OC(=O)c1cc2OCOc2c3c4ccccc4cc(c13)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4444-68-2,VITIC,0,-1,,CCCCN(CC)CC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+97-86-9,VITIC,0,-1,,CC(C)COC(=O)C(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13014-18-1,VITIC,1,-1,,Clc1ccc(c(Cl)c1)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+56892-33-2,EPA3,1,-1,,Oc1cc2c3ccccc3cc4ccc5cccc1c5c24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+122088-20-4,EPA1,1,-1,,O[C@H]1C=Cc2ccc3nc4ccc5ccccc5c4cc3c2[C@@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99152-10-0,CCRIS,1,-1,,CC(C)C(NC(=O)C)C(=O)N(CC(=O)O)N=O,"CHALLIS,BC, HOPKINS,AR, MILLIGAN,JR, MASSEY,RC, ANDERSON,D ANDBLOWERS,SD, THE MUTAGENIC PROPERTIES OF N-NITROSOPEPTIDES IN THE AMES TEST,TOXICOL. LETT. 26(2-3):89-93, 1985"
+119-75-5,VITIC,0,-1,,[O-][N+](=O)c1ccccc1Nc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120-83-2,VITIC,0,-1,"DICLPHE24",Oc1ccc(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+55556-88-2,EPA3,1,-1,,C[C@@H]1CN(N=O)[C@@H](C)CN1N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+122-01-0,CCRIS,0,-1,,ClC(=O)c1ccc(Cl)cc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+118-58-1,VITIC,0,-1,"BZSALICYL",Oc1ccccc1C(=O)OCc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+56120-28-6,CCRIS,0,-1,,OS(=O)(=O)c1ccc(NN=Nc2ccc(cc2)S(=O)(=O)O)cc1,"YAMADA,M, KATO,Y, NAKAMURA,M AND ITO,Y, MUTAGENICITY STUDY OF SUNSETYELLOW FCF AND IT'S IMPURITY, FOODS FOOD INGREDIENTS J. JPN. 164:93-99,1995"
+645-45-4,EPA1,1,-1,,ClC(=O)CCc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+951-80-4,EPA1,1,-1,,Nc1ccc2c(N)c3ccccc3nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7097-60-1,EPA1,0,-1,,NCC(=O)NCC(=O)NCC(=O)NCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56600-58-9,EPA1,1,-1,,CCc1ccc2C(=O)c3ccccc3C(=O)c2c1[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+431-89-0,CCRIS,0,-1,"DR9600302",FC(C(F)(F)F)C(F)(F)F,"DODD,DE, LEDBETTER,AD AND MITCHELL,AD, GENOTOXICITY TESTING OF THEHALON REPLACEMENT CANDIDATES TRIFLUOROIODOMETHANE (CF3I) AND1,1,1,2,3,3,3-HEPTAFLUOROPROPANE (HFC-227EA) USING THE SALMONELLA TYPHIMURIUMAND L5178Y MOUSE LYMPHOMA MUTATION ASSAYS AND THE MOUSE MICRONUCLEUS TEST,INHALATION TOXICOL. 9(2):111-131, 1997"
+10474-14-3,CCRIS,0,-1,,CC(Br)(CCl)CBr,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+538-41-0,EPA1,1,-1,,Nc1ccc(cc1)N=Nc2ccc(N)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+102-01-2,VITIC,0,-1,,CC(=O)CC(=O)Nc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+193-39-5,EPA1,1,-1,,c1ccc2c(c1)c3ccc4ccc5cccc6cc2c3c4c56,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+146795-37-1,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2F,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+138835-33-3,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3c4c(ccc1c24)c5ccccc5[n+]3[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+146795-41-7,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccc(Br)cc2,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+110-57-6,EPA1,1,-1,,ClC\C=C\CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53-94-1,EPA1,1,-1,,ONc1ccc2c(Cc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-46-5,VITIC,0,-1,,Cc1ccccc1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1517-05-1,CCRIS,1,-1,,OCCN=N#N,"JURICEK,M, GRUZ,P, VELEMINSKY,J, STANEK,J, KEFURT,K, MORAVCOVA,J ANDJARY,J, MUTAGENIC ACTIVITY OF 6-AZIDO DEOXYHEXOSES AND AZIDO ALCOHOLS INSALMONELLA TYPHIMURIUM AND ITS INHIBITION BY A STRUCTURE-SIMILAR CARBON SOURCEIN THE MEDIUM, MUTAT. RES. 251(1):13-20, 1991"
+624-18-0,VITIC,1,-1,"PHENDIAMP",Nc1ccc(N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+37850-99-0,CCRIS,0,-1,,CC(=O)c1c(O)cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c12,"KRIVOBOK,S, SEIGLE-MURANDI,F, STEIMAN,R, MARZIN,DR AND BETINA,V,MUTAGENICITY OF SUBSTITUTED ANTHRAQUINONES IN THE AMES/SALMONELLA MICROSOMESYSTEM, MUTAT. RES. 279(1):1-8, 1992"
+885-82-5,CCRIS,0,-1,,Oc1ccc(cc1[N+](=O)[O-])c2ccccc2,"SUZUKI,J, SATO,T AND SUZUKI,S, HYDROXYNITROBIPHENYLS PRODUCED BYPHOTOCHEMICAL REACTION OF BIPHENYL IN AQUEOUS NITRATE SOLUTION AND THEIRMUTAGENICITIES, CHEM. PHARM. BULL. 33(6):2507-2515, 1985"
+84174-24-3,EPA1,1,-1,,CN(Cc1ccc(cc1)[N+](=O)[O-])N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2475-45-8,VITIC,1,-1,"DR9600858",Nc1ccc(N)c2C(=O)c3c(N)ccc(N)c3C(=O)c12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+576-24-9,VITIC,0,-1,,Oc1cccc(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+610-14-0,VITIC,1,-1,,[O-][N+](=O)c1ccccc1C(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+57470-96-9,CCRIS,0,-1,,CCNC(=O)Nc1ccc(OCC(O)CNC(C)(C)C)c(c1)C(=O)C,"IWAKURA,K, TAMURA,H, SUMI,N AND NOMURA,A, MUTAGENICITY STUDIES OFMETABOLITES, DEGRADATION PRODUCTS AND IMPURITIES OF CELIPROLOL, OYO YAKURI38(4):305-312, 1989"
+19952-47-7,EPA3,0,-1,,Nc1nc2c(Cl)cccc2s1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+82856-97-1,CCRIS,1,-1,,CC(C)c1cc(N)c(cc1N)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+146795-40-6,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2Cl,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+99601-30-6,EPA1,1,-1,,CCn1c(N)nc2c3ncc(C)nc3ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35089-70-4,CCRIS,1,-1,,CCCCCCN(N=O)C(=N)N[N+](=O)[O-],"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+4629-58-7,CCRIS,1,-1,,Nc1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,"YOU,Z, BREZZELL,MD, DAS,SK, HOOBERMAN,BH AND SINSHEIMER,JE,SUBSTITUENT EFFECTS ON THE IN VITRO AND IN VIVO GENOTOXICITY OF 4-AMINOBIPHENYLAND 4-AMINOSTILBENE DERIVATIVES, MUTAT. RES. 320(1-2):45-58, 1994"
+7040-57-5,CCRIS,0,-1,,CC(OP(=O)(C)Cl)C(C)(C)C,"IVANOVIC,V, RAPIC,V AND BOSKOVIC,B, PINACOLYLMETHYLPHOSPHONOCHLORIDATE: IN VITRO COVALENT BINDING TO DNA AND MUTAGENICITY INTHE AMES TEST, MUTAT. RES. 142(1-2):9-12, 1985"
+3602-55-9,EPA1,1,-1,,CC(C)(C)C1=CC(=O)C=CC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131229-63-5,CCRIS,1,-1,,CCCCON(OC(=O)C)C(=O)c1ccc(Br)cc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+96563-08-5,CCRIS,1,-1,,CC1c2ccccc2c3c(C)cccc13,"LAVOIE,EJ, COLEMAN,DT, GEDDIE,NG AND RICE,JE, STUDIES ON THEMUTAGENICITY AND TUMOR-INITIATING ACTIVITY OF METHYLATED FLUORENES, CHEM.-BIOL.INTERACT. 52(3):301-309, 1985"
+86827-66-9,CCRIS,1,-1,,Cc1cc2ccccc2c3ccc4C(=O)C(=O)C=Cc4c13,"FLOWERS-GEARY,L, BLECZINSKI,W, HARVEY,RG AND PENNING,TM, CYTOTOXICITYAND MUTAGENICITY OF POLYCYCLIC AROMATIC HYDROCARBON O-QUINONES PRODUCED BYDIHYDRODIOL DEHYDROGENASE, CHEM.- BIOL. INTERACT. 99(1-3):55-72, 1995"
+105-59-9,VITIC,0,-1,"DR9700887",CN(CCO)CCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+110-44-1,EPA3,0,-1,,C\C=C/C=C\C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+549-38-2,EPA3,1,-1,,C[C@@H]1CCc2c1ccc3c2ccc4ccccc34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+583-39-1,EPA3,0,-1,"MERBENZIM",Sc1nc2ccccc2[nH]1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+136196-46-8,CCRIS,0,-1,,[O-][N+](=O)c1ccc(N\N=C(\N=Nc2ccc(I)cc2)/c3ccccc3)cc1,"CATALLO,WJ, GALE,RJ, WONG,RL AND BENDER,ME,REDUCIBLE DYE2-(P-IODOPHENYL)-3- (P-NITROPHENYL)-5-(PHENYL)-2H-TETRAZOLIUM CHLORIDE (INT) FORUSE IN AQUATIC TOXICOLOGY: NOTES ON CHEMICAL STRUCTURE, ELECTROCHEMISTRY, ANDTOXICITY, ASTM SPEC. TECH. PUBL. 1096(AQUAT. TOXICOL. RISK ASSESS.: 13 THVOL.):222-236, 1990"
+142044-39-1,CCRIS,0,-1,,[O-][n+]1cccc2C=CC3OC3c12,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+57309-30-5,CCRIS,0,-1,,ON1c2ccccc2\C(=N/c3ccccc3)\C1(c4ccccc4)c5ccccc5,"DAMIANI,E GRECI,L AND HRELIA,P, CYTO- AND GENOTOXIC EFFECTS OF NOVELAROMATIC NITROXIDE RADICALS IN VITRO, FREE RADICAL BIOL. MED. 28(3):330-336,2000"
+139493-54-2,CCRIS,1,-1,,Cc1ccc2cc(C)c3c4C5OC5C(O)C(O)c4ccc3c2c1,"MISRA,B, AMIN,S AND HECHT,SS, DIMETHYLCHRYSENEDIOL EPOXIDES:MUTAGENICITY IN SALMONELLA TYPHIMURIUM, TUMORIGENICITY IN NEWBORN MICE, ANDREACTIVITY WITH DEOXYADENOSINE IN DNA, CHEM. RES. TOXICOL. 5(2):248-254,1992"
+76144-81-5,EPA1,0,-1,"MILDRONAT",C[N+](C)(C)NCCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105052-38-8,EPA1,1,-1,"R-7780",[O-][N+](=O)C1=Cc2cccc3cccc(O1)c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23511-78-6,CCRIS,1,-1,,BrCCC(Br)Br,"BELITSKY,GA, LYTCHEVA,TA, KHITROVO,IA, SAFAEV,RD, ZHURKOV,VS,VYSKUBENKO,IF, SYTSHOVA,LP, SALAMATOVA,OG, FOLDT,EG, KHUDOLEY,VV, MIZGIREV,IV,KHOVANOVA,EM, UGNIVENKO,EG, TANIRBERGENOV,TB, MALINOVSKAYA,KI, REVAZOVA,YA,INGEL,FI, BRATSLAVSKY,VA, TERENTYEV,AB, SHAPIRO,AA AND WILLIAMS,GM, GENOTOXICITYAND CARCINOGENICITY TESTING OF 1,2-DIBROMOPROPANE AND 1,1,3-TRIBROMOPROPANE INCOMPARISON TO 1,2-DIBROMO-3-CHLOROPROPANE, CELL BIOL. TOXICOL. 10(4):265-279,1994"
+137-18-8,EPA1,0,-1,"DR9601111",CC1=CC(=O)C(=CC1=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3054-60-2,CCRIS,1,-1,,Cc1ccc(NC2OC[C@@H](O)[C@H](O)[C@H]2O)cc1,"MERSCH-SUNDERMANN,V AND KRAEMER,H, THE INFLUENCE OF CULTURE CONDITIONSON THE SUSCEPTIBILITY OF SALMONELLA TYPHIMURIUM IN THE SALMONELLA MUTAGENICITYTEST, ZENTRALBL. HYG. UMWELTMED. 193(5):471-480, 1993"
+127923-99-3,CCRIS,1,-1,,OC(CC(=O)OCCBr)C(=O)OCCBr,"MIN,S, CHAIGNEAU,M, CALLAIS,F AND FESTY,B, MUTAGENIC ACTIVITY OFORGANIC ESTERS LIKELY TO BE FORMED FROM THE 2-BROMOETHANOL GENERATED DURINGFUMIGATION WITH ETHYLENE OXIDE, ANN. PHARM. FR. 47(5):266-275, 1990"
+2564-64-9,CCRIS,1,-1,,CC(=O)OCc1c2ccccc2c(C)c3ccc4ccccc4c13,"ROGAN,EG, CAVALIERI,EL, WALKER,BA, BALASUBRAMANIAN,R, WISLOCKI,PG,ROTH,RW AND SAUGIER,RK, MUTAGENICITY OF BENZYLIC ACETATES, SULFATES AND BROMIDESOF POLYCYCLIC AROMATIC HYDROCARBONS, CHEM.-BIOL. INTERACT. 58(3):253-275,1986"
+2941-64-2,VITIC,0,-1,,CCSC(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+91-66-7,VITIC,0,-1,,CCN(CC)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+485-47-2,VITIC,0,-1,"NINHYDRIN",OC1(O)C(=O)c2ccccc2C1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+869-01-2,EPA1,1,-1,"NITROSOBU",CCCCN(N=O)C(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+28289-54-5,EPA1,0,-1,"MPTP",CN1CCC(=CC1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109143-17-1,CCRIS,1,-1,,[O-][N+](=O)c1oc2cc(ccc2c1)N(CCCl)CCCl,"CASTELAIN,P, HENDRICKX,B, TROMELIN,A, DEMERSEMAN,P AND MOENS,W,MUTAGENIC ACTIVITY OF DICHLOROETHYLAMINO DERIVATIVES OF NITRONAPHTHOFURAN ANDSOME NITROBENZOFURANS IN THE SALMONELLA/MICROSOME ASSAY, MUTAT. RES.280(1):9-15, 1992"
+33089-61-1,EPA1,0,-1,,CN(\C=N\C=N\c1ccc(C)cc1C)c2ccc(C)cc2C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60504-57-6,CCRIS,1,-1,,CCC1(O)CC(OC2CC(C(O)C(C)O2)N(C)C)c3c(O)c4C(=O)c5c(O)cccc5C(=O)c4cc3C1C(=O)OC,"THOMAS,HF, MUTAGENIC AND CYTOTOXIC POTENCIES OF A SERIES OFANTHRACYCLINE DERIVATIVES AS MEASURED BY HIS+ REVERSION, 8-AZAGUANINE RESISTANCEAND DIRECT PLATING CYTOTOXICITY TESTS IN SALMONELLA TYPHIMURIUM, TERATOG.,CARCINOG., MUTAGEN. 6(3):219-235, 1986"
+6358-31-2,EPA3,0,-1,,COc1ccccc1NC(=O)[C@H](N=Nc2ccc(cc2OC)[N+](=O)[O-])C(=O)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+109897-78-1,CCRIS,1,-1,,OC1C=Cc2cc3ccc(cc3cc2C1O)[N+](=O)[O-],"FU,PP, HEFLICH,RH, VON TUNGELN,LS, YANG,DTC, FIFER,EK AND BELAND,FA,EFFECT OF THE NITRO GROUP CONFORMATION ON THE RAT LIVER MICROSOMAL METABOLISMAND BACTERIAL MUTAGENICITY OF 2- AND 9-NITROANTHRACENE, CARCINOGENESIS7(11):1819-1827, 1986"
+89837-94-5,EPA1,1,-1,,CC(=O)CN(COC(=O)C)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+21739-91-3,EPA1,1,-1,,COc1ccc(cc1)\C(=C/C(=O)O)\Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-60-1,EPA3,1,-1,,C[C@H](CCl)O[C@H](C)CCl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+98809-36-0,CCRIS,0,-1,,Cc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+99-75-2,VITIC,0,-1,,COC(=O)c1ccc(C)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+623-17-6,VITIC,1,-1,,CC(=O)OCc1occc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+25155-25-3,EPA1,0,-1,,CC(C)(C)OOC(C)(C)c1cccc(c1)C(C)(C)OOC(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1709-52-0,EPA1,0,-1,,CNS(=O)(=O)c1ccc(N)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+32740-01-5,EPA1,1,-1,,Cc1cccc2c(C)c3ccc4ccccc4c3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+578-54-1,EPA1,0,-1,,CCc1ccccc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132172-56-6,CCRIS,1,-1,,O1C=CC=Cc2c1c3ccccc3c4cc5ccccc5cc24,"KUMAR,S, KOLE,PL AND SIKKA,HC, MUTAGENICITY OF DIBENZ[A,C]ANTHRACENEAND ITS DERIVATIVES IN SALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 242(4):337-343,1990"
+17573-23-8,EPA1,1,-1,,C1Cc2cc3ccc4cccc5ccc(c2C=C1)c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2491-52-3,EPA3,1,-1,,[O-][N+](=O)c1ccc(cc1)N=Nc2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+123-35-3,VITIC,0,-1,"MYRCENEB",CC(=CCCC(=C)C=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99-12-7,VITIC,1,-1,,Cc1cc(C)cc(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+81-54-9,EPA1,1,-1,"PURPURIN",Oc1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+121-79-9,VITIC,0,-1,"GALLATEPR",CCCOC(=O)c1cc(O)c(O)c(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+494-03-1,EPA1,1,-1,"CHLORNAPH",ClCCN(CCCl)c1ccc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111858-68-5,CCRIS,1,-1,,Cc1ccc(cc1)N(CC2(O)OCC(O)C(O)C2O)N=O,"MERSCH-SUNDERMANN,V AND KRAEMER,H, THE INFLUENCE OF CULTURE CONDITIONSON THE SUSCEPTIBILITY OF SALMONELLA TYPHIMURIUM IN THE SALMONELLA MUTAGENICITYTEST, ZENTRALBL. HYG. UMWELTMED. 193(5):471-480, 1993"
+584-84-9,VITIC,1,-1,,Cc1ccc(cc1N=C=O)N=C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+920-37-6,EPA1,0,-1,,ClC(=C)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6027-98-1,EPA1,0,-1,"HARMALINE",COc1ccc2c3CCN=C(C)c3[nH]c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+154028-32-7,EPA1,1,-1,,COc1cccc(\C=C\c2ccc(N)cc2)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13147-25-6,EPA3,1,-1,,CCN(CCO)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+103748-25-0,EPA1,1,-1,,Cn1c(N)nc2cc(Cl)ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1975-50-4,VITIC,1,-1,,Cc1c(cccc1[N+](=O)[O-])C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+118995-83-8,CCRIS,1,-1,,NC(CCC(=O)NC(CSC(=O)NCCCCl)C(=O)NCC(=O)O)C(=O)O,"STAHL,W, DENKEL,E AND EISENBRAND,G, INFLUENCE OF GLUTATHIONE ON THEMUTAGENICITY OF 2-CHLOROETHYLNITROSOUREAS. MUTAGENIC POTENTIAL OF GLUTATHIONEDERIVATIVES FORMED FROM 2-CHLOROETHYLNITROSOUREAS AND GLUTATHIONE, MUTAT. RES.206(4): 459-465, 1988"
+106449-56-3,CCRIS,0,-1,,Nc1nc(O)nc2c1ncn2C3CC(O)C(CO)O3,"ARASHIDANI,K, IWAMOTO-TANAKA,N, MURAOKA,M AND KASAI,H, GENOTOXICITY OFRIBO- AND DEOXYRIBONUCLEOSIDES OF 8-HYDROXYGUANINE, 5-HYDROXYCYTOSINE, AND2-HYDROXYADENINE: INDUCTION OF SCE IN HUMAN LYMPHOCYTES AND MUTAGENICITY INSALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 403(1-2):223-227, 1998"
+491-36-1,CCRIS,0,-1,,Oc1ncnc2ccccc12,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y95"
+14129-84-1,EPA1,1,-1,,ClC(Cl)C(=C(Cl)Cl)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+326-61-4,VITIC,0,-1,,CC(=O)OCc1ccc2OCOc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+126572-79-0,CCRIS,1,-1,,OC(=O)\C(=C(\C(Cl)Cl)/C(=O)O)\Cl,"CHRISTMAN,RF, KRONBERG,K, SINGH,R, BALL,LM AND JOHNSON,JD,IDENTIFICATION OF MUTAGENIC BY-PRODUCTS FROM AQUATIC HUMIC CHLORINATION, WATERRESOURCES RESEARCH INSTITUTE, RALEIGH, N.C., REPORT NO. 259, NTIS PB92-183755,1991"
+481-72-1,EPA1,1,-1,"ALOEEMODI",OCc1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53473-85-1,EPA1,1,-1,,Nc1ccc2sncc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109875-50-5,CCRIS,1,-1,,Nc1[nH]c(nc2ncnc12)c3ccc(cc3)[N+](=O)[O-],"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+149-30-4,VITIC,0,-1,"MERCAPBEN",Sc1nc2ccccc2s1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+35691-65-7,EPA3,0,-1,,BrC[C@](Br)(CCC#N)C#N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1562-94-3,EPA3,1,-1,,COc1ccc(cc1)N=[N+]([O-])c2ccc(OC)cc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+122-14-5,CCRIS,1,-1,"FENITROTH",COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-],"MORIYA,M OHTA,T WATANABE,K MIYAZAWA,T KATO,K AND SHIRASU,Y, FURTHERMUTAGENICITY STUDIES ON PESTICIDES IN BACTERIAL REVERSION ASSAY SYSTEMS, MUTAT.RES. 116(3-4):185-216,1982"
+100-29-8,VITIC,1,-1,"NITROPHEP",CCOc1ccc(cc1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+76547-98-3,EPA1,0,-1,"LISINOPRI",NCCCC[C@H](N[C@@H](CCc1ccccc1)C(=O)O)C(=O)N2CCC[C@H]2C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15721-02-5,EPA2,1,-1,,Nc1cc(Cl)c(cc1Cl)c2cc(Cl)c(N)cc2Cl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+13010-47-4,EPA1,1,-1,"LOMUSTINE",ClCCN(N=O)C(=O)NC1CCCCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3731-39-3,EPA1,0,-1,,CN(C)c1ccc(cc1)N=Nc2ccccc2C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128714-75-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3c(c4ccccc4c5ccc1c2c35)[N+](=O)[O-],"FUKUHARA,K, HAKURA,A, SERA,N, TOKIWA,H AND MIYATA,N, 1- AND 3-NITRO-6-AZABENZO[A]PYRENES AND THEIR N-OXIDES: HIGHLY MUTAGENIC NITRATED AZAARENES,CHEM. RES. TOXICOL. 5(2):149-153, 1992"
+71400-34-5,EPA1,1,-1,,[O-][N+](=O)c1ccc2Oc3ccc(cc3Oc2c1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+151378-34-6,EPA1,1,-1,,O[C@@H]1[C@@H]2O[C@@H]2c3c(ccc4c5cccc6cccc(c34)c56)[C@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84-68-4,EPA1,1,-1,,Nc1ccc(c(Cl)c1)c2ccc(N)cc2Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+471-80-7,CCRIS,1,-1,,CC12CCCC(C)(C1CCC34CC(=C)C(O)(CCC23)C4)C(=O)O,"PEZZUTO,JM, NANAYAKKARA,NPD, COMPADRE,CM, SWANSON,SM, KINGHORN,AD,GUENTHNER,TM, SPARNINS,VL AND LAM,LKT, CHARACTERIZATION OF BACTERIALMUTAGENICITY MEDIATED BY 13-HYDROXY-ENT-KAURENOIC ACID (STEVIOL) AND SEVERALSTRUCTURALLY-RELATED DERIVATIVES AND EVALUATION OF POTENTIAL TO INDUCEGLUTATHIONE S-TRANSFERASE IN MICE, MUTAT. RES. 169(3):93-103, 1986"
+13676-54-5,EPA1,0,-1,,O=C1C=CC(=O)N1c2ccc(Cc3ccc(cc3)N4C(=O)C=CC4=O)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M549,EPA1,0,-1,,CCCC[C@H](CC)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25155-23-1,EPA1,0,-1,,Cc1ccc(OP(=O)(Oc2ccc(C)cc2C)Oc3ccc(C)cc3C)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+69458-17-9,CCRIS,0,-1,,CCCCCCCCCCCCCOC(=O)C[N+](CC)(CC)CC,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+1571-08-0,VITIC,0,-1,,COC(=O)c1ccc(C=O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+122547-49-3,CCRIS,0,-1,,CC(O)C1C2SC(=C(N2C1=O)C(=O)O)C3CCCO3,"NAKANISHI,Y, OHNISHI,S AND OTAKA,T, MUTAGENICITY STUDY OF FROPENEMSODIUM (SY5555), OYO YAKURI 47(2):133-137, 1994"
+88552-47-0,CCRIS,1,-1,,ClC1=CC(=O)C(Cl)(Cl)C1=O,"SMEDS,A, FRANZEN,R AND KRONBERG,L, OCCURRENCE OF SOME CHLORINATED ENOLLACTONES AND CYCLOPENTENE-1,3-DIONES IN CHLORINE-TREATED WATERS, ENVIRON. SCI.TECHNOL. 29(9):1839-1844, 1995"
+84807-61-4,CCRIS,0,-1,,CC1(C)CCCC2(C)C1CCC3(C)C2CC=C(C=O)C3C=O,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+1516-73-0,CCRIS,1,-1,,Cn1c(N=N#N)nc2ccccc12,"WILD,D, AND DIRR,A, MUTAGENIC NITRENES/NITRENIUM IONS FROMAZIDO-IMIDAZOARENES AND THEIR STRUCTURE-ACTIVITY RELATIONSHIP, MUTAGENESIS4(6):446-52, 1989"
+57830-29-2,CCRIS,0,-1,,CN(C)CCN(Cc1ccc(O)cc1)c2ccccn2,"HANSEN,EB, CERNIGLIA,CE, KORFMACHER,WA, MILLER,DW AND HEFLICH,RH,MICROBIAL TRANSFORMATION OF THE ANTIHISTAMINE PYRILAMINE MALEATE. FORMATION OFPOTENTIAL MAMMALIAN METABOLITES, DRUG METAB. DISPOS. 15(1):97:106,1987"
+4825-86-9,CCRIS,0,-1,,CC1Cc2ccc(C(=O)NC(Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1,"WUERGLER,FE, FRIEDERICH,U AND SCHLATTER,J, LACK OF MUTAGENICITY OFOCHRATOXIN A AND B, CITRININ, PATULIN AND CNESTINE IN SALMONELLA TYPHIMURIUMTA102, MUTAT. RES. 261(3):209-216, 1991"
+77-92-9,EPA1,0,-1,"ALCITRATE,NH4CITRAT,BENZALKCI,BETAINECI,BICITRATE,CACITRATE,CANCNCITR,CHOLIDHCL,CITRABIAM,CITRATDNA,CITRAMGNA,CITRATE,DE-NOL,ERCITRATE,FE-CITRAT,FERROCHOL,CITRACAFE,FECITRATE,FECITFE59,GD-CITRAT,GACITRATE,FEAMMCITR,ISOMETHCI,CITRATELI,LYCAMED,MGCITRATE,METHENCIT,PIPERAZCI,PUCITRATE,KMGCITRAT,DR0004090,SANUMGERM,CITRATEAG,NAK-CITRA,KCITRATE,TROMETACI,ZNCITRATE",OC(=O)CC(O)(CC(=O)O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+58139-52-9,EPA3,1,-1,,[O-][N+](=O)c1csc(c1)c2csc(NC=O)n2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+7779-30-8,VITIC,0,-1,,CCC(=O)\C=C\C1C(=CCCC1(C)C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+122-66-7,VITIC,1,-1,"DR9900752",N(Nc1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+104485-01-0,CCRIS,0,-1,,CCCCCOc1cccc(NC(=O)OC2CCCCC2N3CCCC3)c1,"SIEKEL,P, A GENOTOXICOLOGICAL STUDY OF THE NEW LOCAL ANESTHETICCARBAMATE DERIVATIVES CARBISOCAINE, HEPTACAINE AND PENTACAINE, J. APPL. TOXICOL.10(4):239-243, 1990"
+102-69-2,VITIC,0,-1,,CCCN(CCC)CCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+170660-62-5,CCRIS,1,-1,,ClC(=C1CC(=O)NC1=O)Cl,"HADDON,WF, BINDER,RG, WONG,RY, HARDEN,LA, WILSON,RE, BENSON,M ANDSTEVENS KL, POTENT BACTERIAL MUTAGENS PRODUCED BY CHLORINATION OF SIMULATEDPOULTRY CHILLER WATER, J. AGRIC. FOOD CHEM. 44(1):256-263, 1996"
+516-06-3,CCRIS,0,-1,,CC(C)C(N)C(=O)O,"WU,X, SKOG,K AND JAEGERSTAD,M, TRIGONELLINE, A NATURALLY OCCURRINGCONSTITUENT OF GREEN COFFEE BEANS BEHIND THE MUTAGENIC ACTIVITY OF ROASTEDCOFFEE?, MUTAT. RES. 391(3):171-177, 1997"
+123-68-2,EPA1,0,-1,,CCCCCC(=O)OCC=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-16-8,VITIC,0,-1,,Nc1cccc(c1)C(F)(F)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+93-27-6,EPA1,1,-1,,COc1cc(ccc1NC(=O)C)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133331-34-7,EPA1,1,1,,CC(C)CCC[C@@H](C)[C@@H]1CC[C@@H]2[C@@H]3CC4([C@@H]5C[C@@H](Br)CC[C@]5(C)[C@@H]3CC[C@]12C)S(=O)(=O)CCS4(=O)=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6884-87-3,EPA1,0,-1,,CNS(=O)(=O)c1ccc(NC(=O)C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+30516-87-1,EPA1,1,-1,,CC1=CN([C@@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)C(=O)NC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120812-50-2,CCRIS,1,-1,,[O-][N+](=O)c1cc(c2c3CCCCc3c4cccc5ccc1c2c45)[N+](=O)[O-],"FU,PP, NI,YC, ZHANG,YM, HEFLICH,RH, WANG,YK AND LAI,JS, EFFECT OF THEORIENTATION OF NITRO SUBSTITUENT ON THE BACTERIAL MUTAGENICITY OFDINITROBENZO[E]PYRENES, MUTAT. RES. 225(3):121-125, 1989"
+16219-99-1,EPA2,0,-1,,CN(N=O)c1ccncc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+115-53-7,EPA1,0,-1,,COC1=C[C@@H]2[C@@H]3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+116-06-3,EPA3,0,-1,,CNC(=O)O\N=C/C(C)(C)SC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+34250-70-9,CCRIS,1,-1,,CC(=O)Nc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+106686-68-4,CCRIS,0,-1,,C=CCN(CC=C)C1C(N2C3C2c4ccccc4c5ccccc35)c6ccccc6c7ccccc17,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+122587-20-6,CCRIS,1,-1,,CC(=O)c1oc(c(Cl)c1Cl)[N+](=O)[O-],"HATCHER,JF, YAMAMOTO,K, ICHIKAWA,M, BRYAN,GT AND SWAMINATHAN,S,METABOLIC REDUCTION OF NOVEL 3,4-DICHLORO-5-NITROFURANS IN SALMONELLATYPHIMURIUM, ENVIRON. MOL. MUTAGEN. 25(1):58-66, 1995"
+62960-69-4,CCRIS,1,-1,,CC(O)C(NC(=O)C(C)C(O)C(C)NC(=O)C(NC(=O)c1nc(nc(N)c1C)C(CC(=O)N)NCC(N)C(=O)N)C(OC2OC(CO)C(O)C(O)C2OC3OC(CO)C(O)C(OC(=O)N)C3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCc7c[nH]cn7,"UMEZAWA,K, HARESAKU,M, MURAMATSU,M AND MATSUSHIMA,T, MUTAGENICITY OFANTHRACYCLINE GLYCOSIDES AND BLEOMYCINS IN A SALMONELLA ASSAY SYSTEM, BIOMED.PHARMACOTHER. 41(5):214-218, 1987"
+146795-35-9,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccc(F)cc2,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+215226-74-7,CCRIS,0,-1,,OC(=O)\C(=C(/CCl)\C(=O)O)\Cl,"FRANZEN,R, GOTO,S, TANABE,K AND MORITA,M, GENOTOXIC ACTIVITY OFCHLORINATED BUTENOIC ACIDS IN SALMONELLA TYPHIMURIUM STRAINS TA98, TA100 ANDTA104, MUTAT. RES. 417(1):31-37, 1998"
+708-42-9,CCRIS,0,-1,,CCCNc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+141691-41-0,EPA1,1,-1,,Cn1c(N)nc2cc(ccc12)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105427-02-9,CCRIS,1,-1,,O=C(NCc1ccccc1)C2CO2,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+3034-42-2,EPA3,1,-1,,Cn1cncc1[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1073-05-8,EPA3,1,-1,,O=S1(=O)OCCCO1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1878-66-6,EPA1,0,-1,"DR9504575",OC(=O)Cc1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99-07-0,VITIC,1,-1,,CN(C)c1cccc(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+779-03-3,EPA1,1,-1,,Nc1c2ccccc2cc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-74-8,VITIC,1,-1,,[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+579-66-8,EPA1,1,-1,,CCc1cccc(CC)c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1204-72-4,CCRIS,0,-1,,Cc1cc2ccccc2cc1[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+109527-10-8,CCRIS,1,-1,,CC(=O)OC1COC(Nc2ccc(cc2)[N+](=O)[O-])C(OC(=O)C)C1OC(=O)C,"MERSCH-SUNDERMANN,V AND KRAEMER,H, THE INFLUENCE OF CULTURE CONDITIONSON THE SUSCEPTIBILITY OF SALMONELLA TYPHIMURIUM IN THE SALMONELLA MUTAGENICITYTEST, ZENTRALBL. HYG. UMWELTMED. 193(5):471-480, 1993"
+38966-21-1,CCRIS,0,-1,,CC1(CO)C(O)CCC2(C)C1CCC3CC4CC23CCC4(O)CO,"SUTER,W AND ROMAGNA,F, DNA REPAIR INDUCED BY VARIOUS MUTAGENS IN RATHEPATOCYTE PRIMARY CULTURES MEASURED IN THE PRESENCE OF HYDROXYUREA, GUANAZOLEOR APHIDICOLIN, MUTAT. RES. 231(2):251-64, 1990"
+10264-12-7,CCRIS,0,-1,,CCC(=O)NCc1ccccc1,"DOLZANI,L, TAMARO,M, LAGATOLLA,C, MONTI-BRAGADIN,C, CAVICCHIONI,G,MARCHETTI,P AND D'ANGELI,F, STRUCTURE-ACTIVITY RELATIONSHIP IN THE MUTAGENICEFFECT OF CHIRAL OR RACEMIC 2-BROMOPROPANAMIDES ON SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 19(4):311-315, 1992"
+NOCAS_M87,EPA1,1,-1,,C[C@@H](Cl)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M343,EPA1,0,-1,,OC(=O)[C@H]1[C@@H](C(=O)O)[C@@]2(Cl)C(=C(Cl)[C@]1(Cl)C2(Cl)Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101328-96-5,CCRIS,1,-1,,ClC1(Cl)C(=O)C=CC1=O,"SMEDS,A, FRANZEN,R AND KRONBERG,L, OCCURRENCE OF SOME CHLORINATED ENOLLACTONES AND CYCLOPENTENE-1,3-DIONES IN CHLORINE-TREATED WATERS, ENVIRON. SCI.TECHNOL. 29(9):1839-1844, 1995"
+24966-35-6,CCRIS,0,-1,,CNC(=O)N(O)C(=O)NC,"LEE,MS, LIN,DP AND WANG,CY, MUTAGENICITY OF THE ANTICANCER DRUG,CARACEMIDE, AND RELATED COMPOUNDS FOR SALMONELLA, MUTAT. RES. 172(3):199-209,1986"
+590-17-0,VITIC,0,-1,,BrCC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+58139-48-3,EPA2,1,-1,,[O-][N+](=O)c1ccc(s1)c2nc(N3CCOCC3)c4ccccc4n2,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+107-29-9,EPA3,1,-1,,C\C=N/O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+126420-92-6,CCRIS,1,-1,,Fc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,"ROLL,M, SHTELZER,S, STARK,AA AND BLUM,J, STRUCTURE-ACTIVITYRELATIONSHIPS IN MUTAGENICITY AND IN NUCLEOPHILIC RING OPENING OFN-(ARYLMETHYL)PHENANTHRENE 9,10-IMINES, MUTAGENESIS 5(1):25-30, 1990"
+2224-15-9,CCRIS,1,-1,"DR9900305",C(COCC1CO1)OCC2CO2,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+3567-66-6,EPA1,0,-1,"DR9607817",Nc1cc(cc2cc(c(N=Nc3ccccc3)c(O)c12)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+836-30-6,CCRIS,0,-1,,[O-][N+](=O)c1ccc(Nc2ccccc2)cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, MUTAGENICITY OF THE ANTISCHISTOSOMALAGENT AMOSCANATE AND ITS HYDROLYTIC AND RELATED PARA SUBSTITUTED4-NITRODIPHENYLAMINE PRODUCTS, MED. SCI. RES. 20(10):365-368, 1992"
+2304-83-8,EPA1,0,-1,,O=C1C=Cc2c(ccc3c2ccc4ccccc34)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6098-45-9,EPA1,1,-1,,CC(=O)N(OC(=O)c1ccccc1)c2ccc3c(Cc4ccccc34)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+82085-94-7,EPA1,0,-1,"ROTRAXHCL,TEI-5103",NC[C@@H]1CC[C@H](CC1)C(=O)c2ccc(CCC(=O)O)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92557-61-4,CCRIS,1,-1,,Cn1cc(CC2(O)C(=O)CC3C(O)COC23O)c4ccccc14,"MUSK,SRR, PREOBRAZHENSKAYA,MN, BELITSKY,GA, KOROLEV,AM, LYTCHEVA,TA,KHITROVO, IA AND JOHNSON,IT, THE CLASTOGENIC AND MUTAGENIC EFFECTS OF ASCORBIGENAND 1'-METHYLASCORBIGEN, MUTAT. RES. 323(1-2):69-74, 1994"
+4437-51-8,EPA1,1,-1,,CCC(=O)C(=O)CC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+505-60-2,EPA1,1,-1,"SULFURMUS",ClCCSCCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110021-94-8,CCRIS,1,-1,,CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc4ccc(cc24)N=N#N)cc1,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+13593-03-8,EPA1,0,-1,"QUINALPHO",CCOP(=S)(OCC)Oc1cnc2ccccc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+93-79-8,VITIC,0,-1,,CCCCOC(=O)COc1cc(Cl)c(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M315,EPA1,0,-1,,CCCC(=O)Nc1ccc(OC[C@H](O)CNC(C)C)c(c1)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51042-51-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc(\C=C\c2cccc(c2)[N+](=O)[O-])cc1,"HOOBERMAN,BH, BREZZELL,MD, DAS,SK, YOU,Z AND SINSHEIMER,JE,SUBSTITUENT EFFECTS ON THE GENOTOXICITY OF 4-NITROSTILBENE DERIVATIVES, MUTAT.RES. 341(1): 57-69, 1994"
+54992-23-3,CCRIS,1,-1,"NIFURSTNA",OC(=O)c1ccc(\C=C\c2oc(cc2)[N+](=O)[O-])cc1,"TATSUMI,K, KITAMURA,S, KATO,M AND HIRAOKA,K, METABOLISM OF SODIUMNIFURSTYRENATE, A VETERINARY ANTIMICROBIAL NITROFURAN IN ANIMALS AND FISH, DRUGMETAB. DISPOS. 20(2):226-233, 1992"
+132-86-5,EPA1,1,-1,,Oc1cc(O)c2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-39-3,EPA3,0,-1,,C\C(=C\c1ccccc1)\C=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+114460-40-1,CCRIS,1,-1,,Cc1cc2[nH]c(C)nc2c3c1ccc4ccc(O)cc34,"FRIESEN,M, O'NEILL,IK, MALAVEILLE,C, GARREN,L, HAUTEFEUILLE,A ANDBARTSCH,H, SUBSTITUTED HYDROXYPHENANTHRENES IN OPIUM PYROLYSATES IMPLICATED INOESOPHAGEAL CANCER"
+476-43-7,EPA3,1,-1,,Cc1cc(O)c2C(=O)c3c(O)ccc(O)c3C(=O)c2c1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+22204-53-1,CCRIS,0,-1,"NAPROXEN,NAPROAMBU,DR9703651,NAPROXPIP,NAPROXENA,NAPROXLYS",COc1ccc2cc(ccc2c1)C(C)C(=O)O,"KUBOYAMA,N AND FUJII,A, MUTAGENICITY OF ANALGESICS, THEIR DERIVATIVES,AND ANTI-INFLAMMATORY DRUGS WITH S9 MIX OF SEVERAL ANIMAL SPECIES, J. NIHONUNIV. SCH. DENT. 34(3):183-195, 1992"
+118-08-1,VITIC,0,-1,"HYDRASTIE",COc1ccc2[C@H](OC(=O)c2c1OC)[C@@H]3N(C)CCc4cc5OCOc5cc34,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+161708-24-3,CCRIS,0,-1,,C\C(=C(\Cl)/C(=O)O)\C(=O)O,"FRANZEN,R, GOTO,S, TANABE,K AND MORITA,M, GENOTOXIC ACTIVITY OFCHLORINATED BUTENOIC ACIDS IN SALMONELLA TYPHIMURIUM STRAINS TA98, TA100 ANDTA104, MUTAT. RES. 417(1):31-37, 1998"
+1570-64-5,VITIC,0,-1,,Cc1cc(Cl)ccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+570-74-1,CCRIS,0,1,,CC(C)CCCC(C)C1CCC2C3CC=C4CCCCC4(C)C3CCC12C,"ISLAM,S AND AHMAD,M, MUTAGENIC ACTIVITY OF AZIRIDINYL STEROIDS ANDTHEIR MECHANISM OF ACTION IN BIOLOGICAL SYSTEMS, MUTAGENESIS 6(4):271-278,1991"
+31272-21-6,EPA1,1,-1,,Cc1nn(C)c(N)c1C(=O)c2ccccc2F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+943-93-1,CCRIS,0,-1,,C1C\C=C\CCC2OC2CC\C=C/1,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+700-02-7,EPA1,1,-1,,Nc1c2[nH]cnc2nc[n+]1[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+565-20-8,EPA1,0,-1,"MONOACDAP",CC(=O)Nc1ccc(cc1)S(=O)(=O)c2ccc(N)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60223-52-1,EPA3,1,-1,,COc1ccc2c(c1)c3cc(OC)ccc3c4c5ccc(OC)cc5c6cc(OC)ccc6c24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+554-00-7,EPA3,1,-1,,Nc1ccc(Cl)cc1Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+557-61-9,VITIC,0,-1,"DR9509941",CCCCCCCCCCCCCCCCCCCCCCCCCCCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+126-98-7,VITIC,0,-1,,CC(=C)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+74-89-5,VITIC,0,-1,"JM-3,METHYLAM",CN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+343-94-2,EPA1,0,-1,"TRYPTAMIN",NCCc1c[nH]c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1640-39-7,EPA1,0,-1,,CC1=Nc2ccccc2C1(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64894-90-2,CCRIS,1,-1,,CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc4cc(ccc24)N=N#N)cc1,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+821-06-7,EPA3,1,-1,,BrC\C=C/CBr,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+64188-66-5,CCRIS,1,-1,,CCCCN1C2C1c3ccccc3c4ccccc24,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+700-86-7,CCRIS,1,-1,,Nc1snc2cc(Cl)ccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+113359-04-9,CCRIS,0,-1,,CO\N=C(/C(=O)NC1C2SCC(=C(N2C1=O)C(=O)O)C[n+]3ccn4ncccc34)\c5nsc(N)n5,"SAKAMOTO,Y, YAMAMOTO,KS AND MAKINO,T, MUTAGENICITY STUDY OF SCE-2787(HYDROCHLORIDE). REVERSION TEST IN BACTERIA, YAKURI TO CHIRYO 20(SUPPL. 11):S2765-S2770, 1992"
+NOCAS_M1,EPA1,1,-1,,CC[C@@H](C)ON=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4406-41-1,EPA1,0,-1,,CC(C)C(=O)Nc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+235760-36-8,VITIC,1,-1,,Cc1cc(C)c2nsnc2c1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95-82-9,VITIC,0,-1,,Nc1cc(Cl)ccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+50385-24-5,VITIC,1,-1,,[O-][N+](=O)c1ccccc1\C=C\c2ccccn2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98033-25-1,EPA1,1,-1,,Cc1nc2c(ccc3ccc4ccc(O)cc4c23)n1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+46817-91-8,CCRIS,0,-1,"ICI115338,VILOXAHCL",CCOc1ccccc1OCC2CNCCO2,"BALBI,A MUSCETTOLA,G STAIANO,N MARTIRE,G AND DE LORENZO,F, PSYCHOTROPIC DRUGS: EVALUATION OF MUTAGENIC EFFECT,  PHARMACOL. RES. COMMUN.12(5):423-431, 1980"
+119525-97-2,CCRIS,1,-1,,CCC\C=C\C(=O)OC1C(C)(C)CC2C1(O)C=C(C=O)C34CC23C(=O)OC4O,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+61740-00-9,EPA1,1,-1,,COc1cc2O[C@H]3OC=C[C@H]3c2c4OC(=O)C5=C(CC[C@@H]5O)c14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35281-25-5,EPA3,1,-1,,C1c2ccccc2Cc3c1c4ccccc4c5ccccc35,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+104527-49-3,CCRIS,1,-1,,OCC12COC(N1C(OC2)c3ccc(cc3)[N+](=O)[O-])c4ccc(cc4)[N+](=O)[O-],"VANELLE,P, DE MEO,MP, MALDONADO,J, NOUGUIER,R, CROZET,MP, LAGET,M ANDDUMENIL,G, GENOTOXICITY IN OXAZOLIDINE DERIVATIVES: INFLUENCE OF THE NITROGROUP, EUR. J. MED. CHEM. 25(3):241-250, 1990"
+85068-73-1,EPA1,1,-1,,CCN(CCO[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+528-74-5,VITIC,0,-1,"DICLMETHO",CN(Cc1cnc2nc(N)nc(N)c2n1)c3c(Cl)cc(cc3Cl)C(=O)N[C@@H](CCC(=O)O)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+62625-14-3,VITIC,1,-1,,Nc1cc(cc(Cl)c1O)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+641-90-7,EPA1,1,-1,,Cc1cc2C(=O)c3cc(O)cc(O)c3C(=O)c2c(O)c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2381-31-9,EPA1,1,-1,,Cc1cccc2cc3c(ccc4ccccc34)cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24684-41-1,EPA1,0,-1,,Cc1cc2CCCc2c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3060-89-7,EPA1,0,-1,"METOBROMU",CON(C)C(=O)Nc1ccc(Br)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125579-40-0,CCRIS,0,-1,,CC(=O)c1cc(NC(=O)Nc2ccc(OCC(O)CNC(C)(C)C)c(c2)C(=O)C)ccc1OCC(O)CNC(C)(C)C,"IWAKURA,K, TAMURA,H, SUMI,N AND NOMURA,A, MUTAGENICITY STUDIES OFMETABOLITES, DEGRADATION PRODUCTS AND IMPURITIES OF CELIPROLOL, OYO YAKURI38(4):305-312, 1989"
+121-87-9,EPA1,1,-1,,Nc1ccc(cc1Cl)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+27093-62-5,EPA1,1,-1,,Cn1c2ccc3ccccc3c2c4c5ccccc5ccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+612-59-9,EPA1,0,-1,,Clc1cnc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+298-00-0,EPA2,1,-1,"PARATHIOM",COP(=S)(OC)Oc1ccc(cc1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+7125-53-3,CCRIS,0,-1,,C1CCC2CC3(CCC2C1)CO3,"SINSHEIMER,JE, CHAKRABORTY,PK, MESSERLY,EA AND GADDAMIDI,V,MUTAGENICITY OF OXASPIRO COMPOUNDS WITH SALMONELLA, MUTAT. RES. 224(2):171-5,1989"
+71461-13-7,CCRIS,1,-1,,Oc1ccc(cc1)C2Oc3ccc4cc3C2C(=O)N5CCCCNCCCNC4CC(=O)NCCC5,"AHMAD,VU AND SULTANA,V, SPERMINE ALKALOIDS FROM SCHWEINFURTHIAPAPILIONACEA, J. NAT. PROD. 53(5):1162-1167, 1990"
+932-53-6,EPA1,0,-1,,Cc1nnc(O)nc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134959-57-2,CCRIS,0,-1,,Clc1ccc(COC(=O)c2cccc3cccnc23)c(Cl)c1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+50-99-7,CCRIS,0,-1,,OCC(O)C(O)C(O)C(O)C=O,"WU,X, SKOG,K AND JAEGERSTAD,M, TRIGONELLINE, A NATURALLY OCCURRINGCONSTITUENT OF GREEN COFFEE BEANS BEHIND THE MUTAGENIC ACTIVITY OF ROASTEDCOFFEE?, MUTAT. RES. 391(3):171-177, 1997"
+484-17-3,EPA1,1,-1,,Oc1cc2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2855-13-2,CCRIS,0,-1,,CC1(C)CC(N)CC(C)(CN)C1,"TAKAHASHI,A AND ONO,H, MUTAGENICITY ASSESSMENT IN 44 EPOXY RESINHARDENERS IN SALMONELLA TYPHIMURIUM TESTER STRAINS, CHEM. EXPRESS 8(9):785-788,1993"
+111-20-6,EPA1,0,-1,"PIPERASEB,DR9801946",OC(=O)CCCCCCCCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+137-09-7,VITIC,1,-1,,Nc1ccc(O)c(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+94470-50-5,CCRIS,0,-1,,OC1CCC(O)(CN(N=O)C(C(=O)O)C(=O)O)C(O)C1O,"POOL,BL, ROEPER,H, ROEPER,S AND ROMRUEN,K, MUTAGENICITY STUDIES ONN-NITROSATED PRODUCTS OF THE MAILLARD BROWNING REACTION:N-NITROSO-FRUCTOSE-AMINO ACIDS, FOOD CHEM. TOXICOL. 22(10):797-801,1984"
+87480-50-0,CCRIS,0,-1,,OC1C(O)c2c(Br)c3ccccc3cc2c4ccccc14,"FU,PP, VON TUNGELN,LS, UNRUH,LE, NI,Y AND CHOU,MW, COMPARATIVEREGIOSELECTIVE AND STEREOSELECTIVE METABOLISM OF 7-CHLOROBENZ[A]ANTHRACENE AND7-BROMOBENZ[A]-ANTHRACENE BY MOUSE AND RAT LIVER MICROSOMES, CARCINOGENESIS12(3):371-378, 1991"
+91549-70-1,CCRIS,0,-1,,CN(C)CCNC(=O)c1ccc2nc3ccccc3c(N)c2c1,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+6285-68-3,EPA1,1,-1,,Cc1ccc2[nH]c(N)nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60719-84-8,EPA1,0,-1,"AMRINLACT,AMRINONE",Nc1cc(cnc1O)c2ccncc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+309-00-2,EPA1,0,-1,,ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@H]4C[C@H](C=C4)[C@@H]3[C@]1(Cl)C2(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17096-47-8,EPA1,1,-1,,CN(CCO[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59230-81-8,EPA1,1,-1,,Cc1c2ccccc2c(CBr)c3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22349-59-3,EPA1,1,-1,,Cc1ccc(C)c2c1ccc3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105467-77-4,EPA1,1,-1,,C1CCc2c(C1)ccc3nc4ccc5ccccc5c4cc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M540,EPA1,0,-1,,CC(=O)[C@@H](N=Nc1ccc(cc1Cl)c2ccc(N=N[C@H](C(=O)C)C(=O)Nc3ccccc3)c(Cl)c2)C(=O)Nc4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18691-97-9,VITIC,0,-1,"MEBENZTHI",CNC(=O)N(C)c1nc2ccccc2s1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1728-32-1,EPA1,1,-1,,COC1=CC=CC=CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25057-89-0,EPA1,0,-1,,CC(C)N1C(=O)c2ccccc2NS1(=O)=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+74669-74-2,CCRIS,1,-1,,CC(CN=N#N)c1ccccc1,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+10159-53-2,EPA1,1,-1,"PHOSPHORA",NP(=O)(O)N(CCCl)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55610-00-9,EPA1,1,-1,"ARISTOLA2",O=C1Nc2cc3ccccc3c4c5OCOc5cc1c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6237-24-7,EPA1,1,-1,"C-257",CN(C)CCCNc1c2ccccc2nc3cc(ccc13)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115066-03-0,CCRIS,0,-1,,CCc1cccc2c3CCOC(C)(CC)c3[nH]c12,"IWAKURA,K, TAMURA,H, SUMI,N AND NOMURA,A, MUTAGENICITY STUDIES OFMETABOLITES, DEGRADATION PRODUCTS AND IMPURITY OF ETODOLAC, OYO YAKURI40(6):747-757, 1990"
+529-20-4,VITIC,0,-1,,Cc1ccccc1C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+90-33-5,VITIC,0,-1,"HYMECROMO,HYMECRONA",CC1=CC(=O)Oc2cc(O)ccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+67-71-0,EPA1,0,-1,"DIMESULFN",CS(=O)(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7090-25-7,EPA3,1,-1,,CN(N=O)C(=O)Oc1cccc2ccccc12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+51461-16-6,EPA3,1,-1,,Cc1ccc2C(=O)c3c(cccc3[N+](=O)[O-])C(=O)c2c1[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+28657-80-9,EPA1,1,-1,"CINOXACIN",CCN1N=C(C(=O)O)C(=O)c2cc3OCOc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6219-89-2,EPA1,1,-1,,Cc1cc(N)ccc1c2ccc(O)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134959-56-1,CCRIS,0,-1,,Clc1ccc(COC(=O)c2cccc3cccnc23)cc1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+25148-26-9,EPA1,1,-1,,Cc1c2ccccc2c(CCl)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+27975-19-5,CCRIS,0,-1,"ISOSTEVIO",C[C@@]12CCC3[C@@](CCC4[C@@]3(C)CCC[C@@]4(C)C(=O)O)(CC1=O)C2,"PEZZUTO,JM, COMPADRE,CM, SWANSON,SM, NANAYAKKARA,NPD AND KINGHORN,AD,METABOLICALLY ACTIVATED STEVIOL, THE AGLYCONE OF STEVIOSIDE, IS MUTAGENIC, PROC.NATL. ACAD. SCI. U. S. A. 82(8):2478-2482, 1985"
+5385-75-1,CCRIS,1,-1,,c1ccc2c(c1)c3cc4ccccc4c5cc6ccccc6c2c35,"MALAVEILLE,C, HAUTEFEUILLE,A, PERIN-ROUSSEL,O, SAGUEM,S,CROISY-DELCEY,M, ZAJDELA,F AND BARTSCH,H, POSSIBLE INVOLVEMENT OF A VICINAL,NON-BAY-REGION DIHYDRODIOL EPOXIDE IN THE ACTIVATION OF DIBENZO[A,E]FLUORANTHENEINTO BACTERIAL MUTAGENS, CARCINOGENESIS 5(10):1263-1266, 1984"
+143922-98-9,CCRIS,0,-1,,CC(=O)Nc1cccc(N=[N+]([O-])c2cccc(NC(=O)C)c2C)c1C,"SAYAMA,M, INOUE,M, MORI,MA, MARUYAMA,Y AND KOZUKA,H, BACTERIALMETABOLISM OF 2,6-DINITROTOLUENE WITH SALMONELLA TYPHIMURIUM AND MUTAGENICITY OFTHE METABOLITES OF 2,6-DINITROTOLUENE AND RELATED COMPOUNDS, XENOBIOTICA 22(6):633-640, 1992"
+97136-66-8,CCRIS,1,-1,,Cc1ccc(\C=C\c2ccc(N)cc2)cc1,"YOU,Z, BREZZELL,MD, DAS,SK, HOOBERMAN,BH AND SINSHEIMER,JE,SUBSTITUENT EFFECTS ON THE IN VITRO AND IN VIVO GENOTOXICITY OF 4-AMINOBIPHENYLAND 4-AMINOSTILBENE DERIVATIVES, MUTAT. RES. 320(1-2):45-58, 1994"
+619-15-8,CCRIS,1,-1,,Cc1cc(ccc1[N+](=O)[O-])[N+](=O)[O-],"DELLARCO,VL AND PRIVAL,MJ, MUTAGENICITY OF NITRO COMPOUNDS INSALMONELLA TYPHIMURIUM IN THE PRESENCE OF FLAVIN MONONUCLEOTIDE IN APREINCUBATION ASSAY, ENVIRON. MOL. MUTAGEN. 13(2):116-127, 1989"
+116-29-0,EPA1,0,-1,"TETRADIFO",Clc1ccc(cc1)S(=O)(=O)c2cc(Cl)c(Cl)cc2Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105837-00-1,CCRIS,1,-1,,[O-][N+](=O)c1ccc2nc3ccc(cc3nc2c1)[N+](=O)[O-],"WATANABE,T, HANASAKI,Y, HIRAYAMA,T AND FUKUI,S, MUTAGENICITY OF NITRO-AND AMINO-SUBSTITUTED PHENAZINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.225(3):75-82, 1989"
+506-77-4,VITIC,0,-1,,ClC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+214-17-5,EPA1,0,-1,,c1ccc2cc3c(ccc4c5ccccc5ccc34)cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70140-82-8,CCRIS,0,-1,,CC(C)COP(=S)(OCC(C)C)SCCl,"VLCEK,D, PODSTAVKOVA,S, MIADOKOVA,E AND SISKOVA,A, TESTING OF THEPOTENTIAL MUTAGENIC EFFECT OF CHLORIZOFOS ON BACTERIA, ACTA FAC. RERUM NAT.UNIV. COMENIANAE, GENET. 17:31-36, 1986"
+96918-17-1,CCRIS,1,-1,,[O-][N+](=O)c1oc2c(c1)cc3ccc4cccc5ccc2c3c45,"QUILLARDET,P, JENEK,J, DEMERSEMAN,P, ROYER,R AND HOFNUNG,M, GENOTOXICACTIVITY OF TWO FURAN ANALOGS OF BENZO[A]PYRENE AND THEIR 2-NITRO DERIVATIVES,MUTAT. RES. 172(3):223-230, 1986"
+680-31-9,VITIC,0,-1,"HEMPA",CN(C)P(=O)(N(C)C)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+88598-60-1,CCRIS,1,-1,,OC1C=Cc2cc3ccc4ccc(c5ccc(c2C1O)c3c45)[N+](=O)[O-],"CHOU,MW, HEFLICH,RH AND FU,PP, METABOLISM OF 1-NITROBENZO[A]PYRENE BYRAT LIVER MICROSOMES TO POTENT MUTAGENIC METABOLITES,CARCINOGENESIS7(11):1837-1844, 1986"
+17573-21-6,EPA3,1,-1,,Oc1ccc2cc3ccc4cccc5ccc(c2c1)c3c45,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+623-15-4,EPA1,0,-1,,CC(=O)\C=C\c1occc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2489-77-2,VITIC,0,-1,,CNC(=S)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+83621-06-1,EPA1,0,-1,,C\C(=C(\OCCOc1ccc(Cl)cc1)/c2ccc(Cl)cc2Cl)\n3ccnc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+160637-30-9,CCRIS,1,-1,,Cc1ccc2c(C)c3ccc4C(O)C(O)C=Cc4c3nc2c1,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+84-61-7,VITIC,0,-1,,O=C(OC1CCCCC1)c2ccccc2C(=O)OC3CCCCC3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+82389-37-5,CCRIS,0,-1,,O=C(C1OC1c2ccccc2)c3ccc(cc3)c4ccccc4,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+61166-05-0,CCRIS,1,-1,,Cn1c2ccccc2c3cc(ccc13)[N+](=O)[O-],"ANDRE,V, BIOSSART,C, SICHEL,F, GAUDUCHON,P, LE TALAER,JY, LANCELOT,JC,MERCIER,C, CHEMTOB,S, RAOULT,E AND TALLEC,A, MUTAGENICITY OF NITRO- ANDAMINO-SUBSTITUTED CARBAZOLES IN SALMONELLA TYPHIMURIUM. III. METHYLATEDDERIVATIVES OF 9H-CARBAZOLE, MUTAT. RES. 389(2-3):247-260, 1997"
+1818-71-9,CCRIS,0,-1,,Nc1nc(O)nc2c1ncn2C3OC(CO)C(O)C3O,"ARASHIDANI,K, IWAMOTO-TANAKA,N, MURAOKA,M AND KASAI,H, GENOTOXICITY OFRIBO- AND DEOXYRIBONUCLEOSIDES OF 8-HYDROXYGUANINE, 5-HYDROXYCYTOSINE, AND2-HYDROXYADENINE: INDUCTION OF SCE IN HUMAN LYMPHOCYTES AND MUTAGENICITY INSALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 403(1-2):223-227, 1998"
+612-60-2,VITIC,1,-1,,Cc1ccc2cccnc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+104-03-0,EPA1,1,-1,,OC(=O)Cc1ccc(cc1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134523-00-5,CCRIS,0,-1,,CC(C)c1c(C(=O)Nc2ccccc2)c(c3ccccc3)c(c4ccc(F)cc4)n1CCC(O)CC(O)CC(=O)O,"CIARAVINO,V, KROPKO,ML, ROTHWELL,CE, HOVEY,CA AND THEISS,JC, THEGENOTOXICITY PROFILE OF ATORVASTATIN, A NEW DRUG IN THE TREATMENT OFHYPERCHOLESTEROLEMIA, MUTAT. RES. 343(2-3):95-107, 1995"
+135086-96-3,EPA1,1,-1,,CC(=O)Nc1ccc(\C=N\n2nnc3ccnc3c2O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M113,EPA1,1,-1,,CC(=O)c1cc(NC(=O)N)ccc1OC[C@H](O)CNC(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111858-64-1,CCRIS,1,-1,,OC1COC(C(O)C1O)N(N=O)c2ccc(cc2)C(=O)O,"MERSCH-SUNDERMANN,V AND KRAEMER,H, THE INFLUENCE OF CULTURE CONDITIONSON THE SUSCEPTIBILITY OF SALMONELLA TYPHIMURIUM IN THE SALMONELLA MUTAGENICITYTEST, ZENTRALBL. HYG. UMWELTMED. 193(5):471-480, 1993"
+56362-05-1,CCRIS,0,-1,,CCOP(=O)(NC(C)CC)Oc1cc(C)ccc1[N+](=O)[O-],"ONODERA,S, MAEDA,S AND SAITOH,T, MUTAGENIC AND MASS SPECTROMETRICCHARACTERIZATION OF OXYGEN ANALOGS (P=0) DERIVATIZED FROM ORGANOTHIOPHOSPHORUSPESTICIDES, KANKYO KAGAKU 5(3):617-624, 1995"
+1199-18-4,EPA1,1,-1,"OXIDOPAMI",NCCc1cc(O)c(O)cc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+122-59-8,VITIC,0,-1,"PHENOXYAC",OC(=O)COc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+591-87-7,VITIC,1,-1,"ALLYLACET",CC(=O)OCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+577-19-5,EPA1,1,-1,,[O-][N+](=O)c1ccccc1Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2212-67-1,EPA1,0,-1,"MOLINATE",CCSC(=O)N1CCCCCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+21829-25-4,CCRIS,0,-1,,COC(=C1C(C(=C(C)N=C1C)C(=O)OC)c2ccccc2[N+](=O)[O-])O,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T AND MORTELMANS,K, SALMONELLAMUTAGENICITY TESTS. V. RESULTS FROM THE TESTING OF 311 CHEMICALS, ENVIRON. MOL.MUTAGEN. 19(SUPPL.21):2-141, 1992"
+109875-45-8,CCRIS,1,-1,,Nc1nc(nc2c1ncn2C3CC(O)C(CO)O3)c4ccc(cc4)[N+](=O)[O-],"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+874-86-2,EPA1,0,-1,,ClCc1ccc(cc1)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+140-08-9,EPA1,1,-1,,ClCCOP(OCCCl)OCCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90-94-8,VITIC,1,-1,,CN(C)c1ccc(cc1)C(=O)c2ccc(cc2)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+139953-76-7,CCRIS,1,-1,,Oc1ccc(\C=N\n2nnc3c4ccccc4nc3c2O)cc1,"GARCIA,E, LOPEZ-DE-CERAIN,A, MARTINEZ-MERINO,V AND MONGE,A,QUANTITATIVE STRUCTURE-MUTAGENIC ACTIVITY RELATIONSHIPS OF TRIAZINOINDOLEDERIVATIVES, MUTAT. RES. 268(1):1-9, 1992 & GARCIA,E, LOPEZ-DE-CERAIN,A,GULLON,A, ARRARAS,JA AND MONGE,A, BACTERIAL MUTAGENIC EVALUATION OF A SERIES OF4'-SUBSTITUTED DERIVATIVES OF3-BENZYLIDENAMINO-5H-1,2,3-TRIAZIN[5,4-B]INDOL-4-ONE, MUTAGENESIS 7(1):31-35,1992"
+2118-39-0,CCRIS,0,-1,,Nc1cc2c(O)c(N=Nc3ccc(N=Nc4ccc(cc4)S(=O)(=O)O)c5ccc(cc35)S(=O)(=O)O)c(cc2cc1S(=O)(=O)O)S(=O)(=O)O,"JOACHIM,F, BURRELL,A AND ANDERSON,J, MUTAGENICITY OF AZO DYES IN THESALMONELLA/MICROSOME ASSAY USING IN VITRO AND IN VIVO ACTIVATION, MUTAT. RES.156(3):131-138, 1985"
+301-12-2,VITIC,1,-1,"OXYDEMEME",CCS(=O)CCSP(=O)(OC)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2540-82-1,CCRIS,0,-1,"FORMOTHIO",COP(=S)(OC)SCC(=O)N(C)C=O,"GROVER,IS, DHINGRA,AK, ADHIKARI,N AND LADHAR,SS, GENOTOXICITY OFPESTICIDES AND PLANT SYSTEMS, PROG. CLIN. BIOL. RES. 340E(MUTAT. ENVIRON.,PT.E):91-106, 1990"
+520-36-5,EPA1,0,-1,"APIGENIN",Oc1ccc(cc1)C2=CC(=O)c3c(O)cc(O)cc3O2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1975-52-6,VITIC,1,-1,,Cc1ccc(cc1C(=O)O)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+109897-79-2,CCRIS,1,-1,,OC1C=Cc2cc3cc(ccc3cc2C1O)[N+](=O)[O-],"FU,PP, HEFLICH,RH, VON TUNGELN,LS, YANG,DTC, FIFER,EK AND BELAND,FA,EFFECT OF THE NITRO GROUP CONFORMATION ON THE RAT LIVER MICROSOMAL METABOLISMAND BACTERIAL MUTAGENICITY OF 2- AND 9-NITROANTHRACENE, CARCINOGENESIS7(11):1819-1827, 1986"
+13306-69-9,EPA1,1,-1,,COP(=S)(OC)Oc1ccc(N)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25590-58-3,CCRIS,0,-1,,C[CH-][N+](=O)[O-],"DAYAL,R, GESCHER,A, HARPUR,ES, PRATT,I AND CHIPMAN,JK, COMPARISON OFTHE HEPATOTOXICITY IN MICE AND THE MUTAGENICITY OF THREE NITROALKANES, FUNDAM.APPL. TOXICOL. 13(2):341-348, 1989"
+97461-39-7,CCRIS,1,-1,,CC(C)(C)OC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+123-11-5,EPA1,0,-1,"ANISALDEP",COc1ccc(C=O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+313-80-4,EPA1,1,-1,,c1cc2ccc3ccnc4ccc(c1)c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+961-11-5,EPA2,0,-1,,COP(=O)(OC)O\C(=C/Cl)\c1cc(Cl)c(Cl)cc1Cl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+612-58-8,EPA1,1,-1,,Cc1cnc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3544-23-8,EPA1,1,-1,,COc1cc(ccc1N)N=Nc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+881-03-8,VITIC,1,-1,,Cc1ccc2ccccc2c1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+52-51-7,VITIC,0,-1,"BRONOPOL",OCC(Br)(CO)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6281-23-8,EPA1,1,-1,,OC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90-00-6,VITIC,0,-1,"DR0005498",CCc1ccccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+52559-52-1,CCRIS,1,-1,,CCc1cccc(CC)c1NC(=O)CO,"TESSIER,DM AND CLARK,JM, QUANTITATIVE ASSESSMENT OF THE MUTAGENICPOTENTIAL OF ENVIRONMENTAL DEGRADATIVE PRODUCTS OF ALACHLOR, J. AGRIC. FOODCHEM. 43(9): 2504-2512, 1995"
+90421-79-7,CCRIS,1,-1,,C(Oc1nsc2ccccc12)C3CO3,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+89213-87-6,EPA1,0,-1,,CC[C@H](C)[C@@H]1NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](CCC(=O)N)NC(=O)[C@@H](C)NC(=O)CNC1=O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@H](Cc3ccccc3)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc4ccc(O)cc4)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+503-30-0,VITIC,1,-1,,C1COC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+50283-78-8,EPA3,1,-1,,CCN(CC)CCNc1ccc(COC(=O)c2occc2)c3Sc4ccccc4C(=O)c13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+78-88-6,VITIC,1,-1,,ClCC(=C)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+87633-43-0,CCRIS,1,-1,,COCC1CN(C)C2Cc3cn(C)c4cccc(C2=C1)c34,"GLATT,H, PERTZ,H, KASPER,R AND EICH,E, CLAVINE ALKALOIDS ANDDERIVATIVES AS MUTAGENS DETECTED IN THE AMES TEST, ANTI-CANCER DRUGS3(6):609-614, 1992"
+NOCAS_M358,EPA1,0,-1,,C[C@@H](CCN(C)C)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53219-95-7,CCRIS,0,-1,,OC(=O)CCC(=O)Nc1cc(Cl)cc(Cl)c1,"RASHID,KA, ARJMAND,M, SANDERMANN,H AND MUMMA,RO, MUTAGENICITY OFCHLOROANILINE/LIGNIN METABOLITES IN THE SALMONELLA/MICROSOME ASSAY, J. ENVIRON.SCI. HEALTH, PART B B22(6):721-729, 1987"
+6164-98-3,CCRIS,0,-1,"CLPHENAMD",CN(C)\C=N\c1ccc(Cl)cc1C,"SIMMON,VF, RICCIO,ES, ROBINSON,DE AND MITCHELL,AD, IN VITROMICROBIOLOGICAL MUTAGENICITY AND UNSCHEDULED DNA SYNTHESIS STUDIES OF FIFTEENPESTICIDES, EPA/600/1-85/006, NTIS PB85-193761, 1985"
+143922-95-6,CCRIS,0,-1,,Cc1c(cccc1[N+](=O)[O-])N=O,"SAYAMA,M, INOUE,M, MORI,MA, MARUYAMA,Y AND KOZUKA,H, BACTERIALMETABOLISM OF 2,6-DINITROTOLUENE WITH SALMONELLA TYPHIMURIUM AND MUTAGENICITY OFTHE METABOLITES OF 2,6-DINITROTOLUENE AND RELATED COMPOUNDS, XENOBIOTICA 22(6):633-640, 1992"
+6271-79-0,EPA1,1,-1,,Nc1ccc(cc1[N+](=O)[O-])c2ccc(N)c(c2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57576-44-0,CCRIS,1,-1,,CCC1(O)CC(OC2CC(C(OC3CC(O)C(OC4CCC(=O)C(C)O4)C(C)O3)C(C)O2)N(C)C)c5c(O)c6C(=O)c7c(O)cccc7C(=O)c6cc5C1C(=O)OC,"THOMAS,HF, MUTAGENIC AND CYTOTOXIC POTENCIES OF A SERIES OFANTHRACYCLINE DERIVATIVES AS MEASURED BY HIS+ REVERSION, 8-AZAGUANINE RESISTANCEAND DIRECT PLATING CYTOTOXICITY TESTS IN SALMONELLA TYPHIMURIUM, TERATOG.,CARCINOG., MUTAGEN. 6(3):219-235, 1986"
+1455-77-2,VITIC,0,-1,"GUANAZOLE",Nc1n[nH]c(N)n1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+581-29-3,EPA1,1,-1,,Nc1ccc2cc3ccccc3nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14698-29-4,EPA1,1,-1,"OXOLINHCL,OXOLINATE",CCN1C=C(C(=O)O)C(=O)c2cc3OCOc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+135086-90-7,CCRIS,0,-1,,Oc1c2nc3ccccc3c2nnn1\N=C\c4ccc(cc4)c5ccccc5,"GARCIA,E, LOPEZ-DE-CERAIN,A, MARTINEZ-MERINO,V AND MONGE,A,QUANTITATIVE STRUCTURE-MUTAGENIC ACTIVITY RELATIONSHIPS OF TRIAZINOINDOLEDERIVATIVES, MUTAT. RES. 268(1):1-9, 1992 & GARCIA,E, LOPEZ-DE-CERAIN,A,GULLON,A, ARRARAS,JA AND MONGE,A, BACTERIAL MUTAGENIC EVALUATION OF A SERIES OF4'-SUBSTITUTED DERIVATIVES OF3-BENZYLIDENAMINO-5H-1,2,3-TRIAZIN[5,4-B]INDOL-4-ONE, MUTAGENESIS 7(1):31-35,1992"
+124-18-5,VITIC,0,-1,"DR9503830",CCCCCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6237-22-5,CCRIS,1,-1,"C-264",CN(C)CCCNc1c2ccccc2nc3ccc(cc13)[N+](=O)[O-],"FERGUSON,LR, TURNER,PM AND DENNY,WA, MUTAGENICITY OF NITRACRINEANALOGUES IN SALMONELLA TYPHIMURIUM. MUTATIONAL SPECIFICITY AND ACTIVATION BYBACTERIAL ENZYMES AND RAT-LIVER S9 MUTAT. RES. 187(1):1-9, 1987"
+NOCAS_M71,EPA1,1,-1,,COc1cc(N[C@H](C)CCCN)c2ncccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+74550-97-3,EPA1,1,-1,"BIMOLANE",O=C1CN(CCN2CC(=O)N(CN3CCOCC3)C(=O)C2)CC(=O)N1CN4CCOCC4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+87-84-3,CCRIS,0,-1,,ClC1C(Br)C(Br)C(Br)C(Br)C1Br,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T AND MORTELMANS,K, SALMONELLAMUTAGENICITY TESTS. V. RESULTS FROM THE TESTING OF 311 CHEMICALS, ENVIRON. MOL.MUTAGEN. 19(SUPPL.21):2-141, 1992"
+4067-16-7,VITIC,1,-1,,NCCNCCNCCNCCNCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+502-44-3,VITIC,0,-1,"DR0036971,POLYLACCA",O=C1CCCCCO1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+108-43-0,VITIC,0,-1,,Oc1cccc(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+39834-38-3,CCRIS,1,-1,,Cc1c2C3OC3c4ccccc4c2c(C)c5ccccc15,"GLATT,H, ABU-SHQARA,E, MARTINE,U, BAIDOSSI,W, HARVEY,RG AND BLUM,J,K-REGION OXIDES AND IMINES DERIVED FROM ALKYLATED BENZ[A]ANTHRACENE CONGENERS:SYNTHESIS, STABILITY IN AQUEOUS MEDIA AND MUTAGENICITY, MUTAGENESIS 9(2):83-92,1994"
+73077-95-9,CCRIS,1,-1,,Oc1cc2OCOc2cc1N=O,"KIKUGAWA,K, HIRAMOTO,K, OJIMA,N, NI-IYAMA,H AND KATO,T, MUTAGENICITYAND DNA STRAND BREAKING ACTIVITY OF NITROSOSESAMOL DERIVED FROM SESAMOL,YUKAGAKU 44(12):1041-1049, 1995"
+103-85-5,VITIC,0,-1,"PHENYLTHU",NC(=S)Nc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1477-55-0,EPA1,0,-1,,NCc1cccc(CN)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+539-48-0,VITIC,0,-1,,NCc1ccc(CN)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+122-40-7,CCRIS,0,-1,,CCCCC\C(=C\c1ccccc1)\C=O,"FUJITA,H AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVES WITHSALMONELLA TYPHIMURIUM TA97 AND TA102. II., KENKYU NENPO - TOKYO-TORITSU EISEIKENKYUSHO 38:423-430, 1987"
+80556-89-4,EPA1,1,-1,,OCCN(CC(=O)O)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+129286-37-9,CCRIS,1,-1,,Fc1cccc2c3c(ccc12)c4cccc5cccc3c45,"WEYLAND,EH, HE,ZM, GHODRATI,F, WU,Y, MARSHALL,MV AND LAVOIE,EJ, EFFECTOF FLUORINE SUBSTITUTION ON BENZO[J]FLUORANTHENE GENOTOXICITY, CHEM.- BIOL.INTERACT. 84(1):37-53, 1992"
+113-92-8,VITIC,0,-1,"CLPHENAMN,CHLOROPMA",CN(C)CCC(c1ccc(Cl)cc1)c2ccccn2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+65089-17-0,EPA1,0,-1,,Cc1cccc(C)c1Nc2cc(Cl)nc(SCC(=O)NCCO)n2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1126-61-0,CCRIS,1,-1,"HOCHAVICO",Oc1ccc(CC=C)cc1O,"LEE-CHEN,SF, CHEN,CL, HO,LY, HSU,PC, CHANG,JT, SUN,CM, CHI,CW ANDLIU,TY, ROLE OF OXIDATIVE DNA DAMAGE IN HYDROXYCHAVICOL-INDUCED GENOTOXICITY,MUTAGENESIS 11(5):519-523, 1996"
+105-48-6,EPA1,0,-1,,CC(C)OC(=O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2818-69-1,VITIC,1,-1,,Cc1nc2cc(Cl)ccc2[nH]1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+108-95-2,VITIC,0,-1,"PHENOL,PHENOLANA",Oc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M489,EPA1,0,-1,,CC[C@@H]([C@@H](C)O)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3296-90-0,VITIC,1,-1,,OCC(CO)(CBr)CBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6285-57-0,VITIC,1,-1,,Nc1nc2ccc(cc2s1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+19387-91-8,CCRIS,1,-1,"TINIDAZOL",CCS(=O)(=O)CCn1c(C)ncc1[N+](=O)[O-],"ESPINOSA-AGUIRRE,JJ, DE LA TORRE,RA, LARES-ASSEFF,I, RUBIO,J,DORADO,V, WONG,M AND HERNANDEZ,JM, BACTERIAL MUTAGENS IN THE URINE OF PATIENTSUNDER TINIDAZOLE TREATMENT, MUTAT. RES. 359(2):133-140, 1996"
+58152-03-7,CCRIS,0,-1,,CNC1C(O)C(CCC1(C)O)OC2C(O)C(OC3CC(CN)C(O)C(O)C3O)C(N)CC2NC(=O)C(O)CN,"OYAIDE,K, SONO,A, KOBAYASHI,Y AND YAMAMOTO,H, MUTATION FREQUENCY TESTFOR ISEPAMICIN (HAPA-B), JPN. J. ANTIBIOT. 39(12):3349-3352, 1986"
+36712-34-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc(cc1)c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K"
+5857-92-1,EPA1,1,-1,,Cc1ccc(cc1N)N=[N+]([O-])c2ccc(C)c(N)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+874-89-5,CCRIS,0,-1,,OCc1ccc(cc1)C#N,"BALL,JC, FOXALL-VANAKEN,S AND JENSEN,TE, MUTAGENICITY STUDIES OFP-SUBSTITUTED BENZYL DERIVATIVES IN THE AMES SALMONELLA PLATE-INCORPORATIONASSAY, MUTAT. RES. 138(2-3):145-151, 1984"
+104-90-5,EPA3,0,-1,,CCc1ccc(C)nc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+60877-99-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc(\C=N\c2snc3ccccc23)cc1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+159092-70-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(c1)cc(c3ccccc23)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+477-84-9,CCRIS,0,-1,"DAMNACANT",COc1c(C=O)c(O)cc2C(=O)c3ccccc3C(=O)c12,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+102-96-5,EPA1,1,-1,,[O-][N+](=O)\C=C\c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2244-16-8,EPA1,0,-1,,CC(=C)[C@@H]1CC=C(C)C(=O)C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+522-40-7,CCRIS,0,-1,"FOSFESTRO,FOSFESTET",CC\C(=C(\CC)/c1ccc(OP(=O)(O)O)cc1)\c2ccc(OP(=O)(O)O)cc2,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+568-75-2,EPA1,1,-1,,Cc1c2ccccc2c(CO)c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+163275-57-8,CCRIS,0,-1,,Fc1cnc2c(ccc3ccccc23)c1,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+1874-12-0,CCRIS,1,-1,,CCOC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+114480-41-0,EPA1,1,-1,,CC(=O)Nc1nc2c3cccnc3cc(C)c2n1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96-23-1,VITIC,1,-1,,OC(CCl)CCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100490-36-6,CCRIS,1,-1,"A-60969,PROTOSUFL,TOSYFTOSY",NC1CCN(C1)c2nc3N(C=C(C(=O)O)C(=O)c3cc2F)c4ccc(F)cc4F,"MAMBER,SW, KOLEK,B, BROOKSHIRE,KW, BONNER,DP AND FUNG-TOMC,J, ACTIVITYOF QUINOLONES IN THE AMES SALMONELLA TA102 MUTAGENICITY TEST AND OTHER BACTERIALGENOTOXICITY ASSAYS, ANTIMICROB. AGENTS CHEMOTHER. 37(2):213-217,1993"
+5002-47-1,EPA1,0,-1,"FLUPHEDEC",CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+141-75-3,VITIC,1,-1,,CCCC(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1456-55-9,CCRIS,0,-1,,COc1c(Cl)cc2c(N(C)C3N4C(=O)C5(C)SSC4(C(O)C23O)C(=O)N5C)c1OC,"FERGUSON,LR, BERRIMAN,J, PEARSON,A, MUNDAY,R, FOWKE,EA AND TOWERS,NR,IN VITRO AND IN VIVO MUTAGENICITY STUDIES ON SPORIDESMIN, THE TOXIN ASSOCIATEDWITH FACIAL ECZEMA IN RUMINANTS, MUTAT. RES. 268(2):199-210, 1992"
+1928-43-4,CCRIS,0,-1,,CCCCC(CC)COC(=O)COc1ccc(Cl)cc1Cl,"CHARLES,JM CUNNY,HC WILSON,RD BUS,JS LAWLOR,TE CIFONE,MA FELLOWS,M ANDGOLAPUDI,B, AMES ASSAYS AND UNSCHEDULED DNA SYNTHESIS ASSAYS ON2,4-DICHLOROPHENOXYACETIC ACID AND ITS DERIVATIVES, MUTAT. RES. 444(1):207-216,1999"
+2349-67-9,CCRIS,0,-1,,Nc1nnc(S)s1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y95"
+70634-28-5,CCRIS,0,-1,,CC(C)(C)c1cc(ccc1[N+](=O)[O-])c2ccccc2,"HAACHK,T ERDINGER,L AND BOCHE,G, MUTAGENICITY IN SALMONELLATYPHIMURIUM TA98 AND TA100 OF NITROSO AND RESPECTIVE HYDROXYLAMINE COMPOUNDS,MUTAT. RES. 491(1-2):183-193, 2001"
+83-07-8,EPA3,0,-1,"AMINOANTI,AMINOPHEB",CN1N(C(=O)C(=C1C)N)c2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+302-17-0,VITIC,1,-1,"CHLORALHY",OC(O)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+73-31-4,EPA1,0,-1,"MELATONIN",COc1ccc2[nH]cc(CCNC(=O)C)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60599-38-4,EPA1,1,-1,,CC(=O)CN(CC(=O)C)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126371-00-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,"ROLL,M, SHTELZER,S, STARK,AA AND BLUM,J, STRUCTURE-ACTIVITYRELATIONSHIPS IN MUTAGENICITY AND IN NUCLEOPHILIC RING OPENING OFN-(ARYLMETHYL)PHENANTHRENE 9,10-IMINES, MUTAGENESIS 5(1):25-30, 1990"
+91991-19-4,CCRIS,1,-1,,ClCC(=O)Nc1snc2ccc(Cl)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+60-56-0,EPA2,0,-1,"THIAMAZOL",Cn1ccnc1S,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+120302-30-9,EPA1,1,-1,,OCCc1c[nH]c2cc(ccc12)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-65-6,VITIC,0,-1,,OCC#CCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+501-52-0,EPA1,0,-1,"HYDROCINN",OC(=O)CCc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86674-51-3,EPA1,1,-1,,O=Nc1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90866-04-9,CCRIS,0,-1,,Cc1ccc(NCC2(O)OCC(O)C(O)C2O)cc1,"PIGNATELLI,B, MALAVEILLE,C, FRIESEN,M, HAUTEFEUILLE,A AND BARTSCH,H,SYNTHESIS, STRUCTURE-ACTIVITY RELATIONSHIPS AND A REACTION MECHANISM FORMUTAGENIC N-NITROSO DERIVATIVES OF GLYCOSYLAMINES AND AMADORI COMPOUNDS - MODELSUBSTANCES FOR N-NITROSATED EARLY MAILLARD REACTION PRODUCTS, FOOD CHEM.TOXICOL. 25(9):669-680, 1987"
+10595-95-6,EPA1,1,-1,,CCN(C)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+141-04-8,EPA1,0,-1,,CC(C)COC(=O)CCCCC(=O)OCC(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+65-86-1,EPA3,0,-1,"CAOROTATE,CHOLINEOR,DEANOOROT,FERROUSOR,LIOROTATE,LYSINOROT,MGOROTATE,ORAZAMIDE,OROTATE,OROTATEME,K-OROTATE,ZNOROTATE",OC(=O)c1cc(O)nc(O)n1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M70,EPA1,1,-1,,C(CCOC[C@H]1CO1)COC[C@H]2CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+148193-34-4,CCRIS,1,-1,,COc1nsc2ccc(OCC3CO3)cc12,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+16301-26-1,CCRIS,0,-1,,CCN=[N+]([O-])CC,"LIJINSKY,W, ANDREWS,AW, ELESPURU,RK AND FARRELLY,JG, LACK OF GENETICAND IN VITRO METABOLIC ACTIVITY OF POTENTLY CARCINOGENIC AZOXYALKANES, MUTAT.RES. 157(1):23-27, 1985"
+91991-21-8,CCRIS,0,-1,,CCCC(=O)Nc1snc2ccc(Cl)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+98-15-7,VITIC,0,-1,,FC(F)(F)c1cccc(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+155379-81-0,CCRIS,0,-1,,CC(C)c1cc(N)cc(c1N)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+121-90-4,VITIC,1,-1,,[O-][N+](=O)c1cccc(c1)C(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+607-91-0,VITIC,0,-1,"MYRISTICI",COc1cc(CC=C)cc2OCOc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+57491-68-6,EPA1,1,-1,,Nc1ccccc1SCSc2ccccc2N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16219-98-0,EPA2,1,-1,,CN(N=O)c1ccccn1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+6344-66-7,EPA1,1,-1,"AMINFLUO2",Nc1ccc2Cc3ccccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+136587-13-8,EPA1,1,-1,,NCCCNCCCCN(CCCN)N(O)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4003-94-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc(\C=C\c2ccccc2)cc1,"MULLEN,CA, RASHID,KA AND MUMMA,RO, MUTAGENIC POTENCY OF SOMECONJUGATED NITROAROMATIC COMPOUNDS AND ITS RELATIONSHIP TO STRUCTURE, MUTAT.RES. 188(4): 267-274, 1987"
+513-37-1,VITIC,1,-1,,CC(=CCl)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78914-74-6,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2ccccc2COC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+462-95-3,EPA1,0,-1,,CCOCOCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M366,EPA1,0,1,,C[C@@H]1CC[C@H]2[C@@H](C)[C@H]3[C@@H](C[C@H]4[C@H]5CC=C6C[C@H](CC[C@]6(C)[C@@H]5CC[C@]34C)O[C@@H]7O[C@H](CO)[C@@H](O[C@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O[C@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)[C@H](O)[C@H]7O)N2C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59865-13-3,VITIC,0,-1,"CICLOSPOR,DR9602620",CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+101-02-0,VITIC,0,-1,,O(P(Oc1ccccc1)Oc2ccccc2)c3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+123-28-4,EPA1,0,-1,,CCCCCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92-55-7,CCRIS,1,-1,,CC(=O)OC(OC(=O)C)c1oc(cc1)[N+](=O)[O-],"NI,Y, HEFLICH,RH, KADLUBAR,FF AND FU,PP, MUTAGENICITY OF NITROFURANSIN SALMONELLA TYPHIMURIUM TA98, TA98NR AND TA98/1,8DNP, MUTAT. RES.192(1):15-22, 1987"
+2160-93-2,EPA1,0,-1,,CC(C)(C)N(CCO)CCO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+199536-64-6,CCRIS,1,-1,,OC1OC(=O)C(=C1CBr)Br,"LALONDE,RT, BU,L, HENWOOD,A, FIUMANO,J AND ZHANG,L, BROMINE-,CHLORINE-, AND MIXED HALOGEN-SUBSTITUTED 4-METHYL-2(5H)-FURANONES: SYNTHESIS ANDMUTAGENIC EFFECTS OF HALOGEN AND HYDROXYL GROUP REPLACEMENTS,CHEM. RES. TOXICOL.10(12):1427-1436, 1997"
+220168-41-2,CCRIS,1,-1,,COc1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+85-60-9,EPA1,0,-1,,CCCC(c1cc(c(O)cc1C)C(C)(C)C)c2cc(c(O)cc2C)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120693-41-6,CCRIS,1,-1,,CCc1c2ccccc2cc3c4C5OC5C(O)C(O)c4ccc13,"GLATT,H, HARVEY,RG, PHILLIPS,DH, HEWER,A AND GROVER,PL, INFLUENCE OFTHE ALKYL SUBSTITUENT ON MUTAGENICITY AND COVALENT DNA BINDING OF BAY REGIONDIOL-EPOXIDES OF 7-METHYL- AND 7-ETHYLBENZ[A]ANTHRACENE IN SALMONELLA AND V79CHINESE HAMSTER CELLS, CANCER RES. 49(7):1778-1782, 1989"
+125-33-7,VITIC,1,-1,"PRIMIDONE",CCC1(C(=O)NCNC1=O)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+138835-34-4,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3c4ccccc4[n+]([O-])c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89786-04-9,CCRIS,0,-1,,CC1(Cn2ccnn2)C(N3C(CC3=O)S1(=O)=O)C(=O)O,"OHUCHIDA,A, TANIGUTI,A, KOUCHI,Y, MAEDA,Y, KASHIHARA,A AND OMAE,S,MUTAGENICITY TESTS OF TAZOBACTAM/PIPERACILLIN, TAZOBACTAM AND PIPERACILLIN, J.TOXICOL. SCI. 19(SUPPL. 2):263-280, 1994"
+13603-07-1,EPA3,1,-1,,C[C@H]1CCCN(C1)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1947-37-1,CCRIS,0,-1,,CSCCC(NC(=O)C(N)Cc1c[nH]c2ccccc12)C(=O)NC(CC(=O)O)C(=O)NC(Cc3ccccc3)C(=O)N,"ALLEN,JS AND PANFILI,J, AMES SALMONELLA/MAMMALIAN-MICROSOME TESTING OFPEPTIDES AND PEPTIDE SYNTHESIS REAGENTS, MUTAT. RES. 170(1-2):23-29,1986"
+637-92-3,VITIC,0,-1,,CCOC(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+33372-39-3,CCRIS,1,-1,,OCCN(CCO)c1nc(nc2ccccc12)c3ccc(s3)[N+](=O)[O-],"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+103-80-0,EPA1,1,-1,,ClC(=O)Cc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101901-08-0,CCRIS,0,-1,,CCC1(CC(=O)O)OCCc2c1[nH]c3c(cccc23)C(C)O,"IWAKURA,K, TAMURA,H, SUMI,N AND NOMURA,A, MUTAGENICITY STUDIES OFMETABOLITES, DEGRADATION PRODUCTS AND IMPURITY OF ETODOLAC, OYO YAKURI40(6):747-757, 1990"
+70-11-1,EPA1,0,-1,,BrCC(=O)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54755-21-4,CCRIS,1,-1,,Cc1ccc2cccc(c2c1)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+611-22-3,EPA1,1,-1,,Cc1ccccc1NO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1135-24-6,CCRIS,0,-1,"FERULATMG",COc1cc(\C=C\C(=O)O)ccc1O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y96"
+21416-67-1,CCRIS,0,-1,"ICRF-186",CC(CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2,"ALBANESE,R AND WATKINS,PA, THE MUTAGENIC ACTIVITY OF RAZOXANE (ICRF159): AN ANTICANCER AGENT, BR. J. CANCER 52(5):725-731, 1985"
+77996-03-3,CCRIS,1,-1,,CN1c2ccccc2C(=O)c3c(O)cc4OC(Cc4c13)C5(C)CO5,"PAULINI,H AND SCHIMMER,O, MUTAGENICITY TESTING OF RUTACRIDONE EPOXIDEAND RUTACRIDONE, ALKALOIDS IN RUTAGRAVEOLENS L., USING THE SALMONELLA/MICROSOMEASSAY, MUTAGENESIS 4(1):45-50, 1989"
+112575-91-4,EPA1,1,-1,,O=C1C=C2c3cc4ccccc4cc3c5cccc(C1=O)c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57-63-6,CCRIS,0,1,,CC12CCC3C(CCc4cc(O)ccc34)C1CCC2(O)C#C,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+75-83-2,VITIC,0,-1,,CCC(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+213-46-7,EPA1,1,-1,"PICENE",c1ccc2c(c1)ccc3c2ccc4c5ccccc5ccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+159092-76-9,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c1cc(c3cccc(c23)[N+](=O)[O-])[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+NOCAS_M21,EPA1,1,-1,,C[C@@H](O)CN(C[C@H](O)CO)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7779-77-3,VITIC,0,-1,,CC(C)COC(=O)c1ccccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+357204-49-0,CCRIS,1,-1,,COc1cccc(c1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+509-93-3,CCRIS,0,-1,,CC1CCC2C(OC(=O)C2=C)C3(C)C1C=CC3=O,"ALARD,F, STIEVENART,C, VANPARYS,P, THILEMANS,L AND GREERTS,S, TOXICITYAND MUTAGENICITY OF THE MOLLUSCICIDAL PLANT AMBROSIA MARITIMA L., DRUG CHEM.TOXICOL. 14(4):353-373, 1991"
+70021-98-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3c4ccccc4cc5ccc1c2c35,"JUNG,H, SHAIKH,AU, HEFLICH,RH AND FU,PP, NITRO GROUP ORIENTATION,REDUCTION POTENTIAL, AND DIRECT-ACTING MUTAGENICITY OF NITRO-POLYCYCLIC AROMATICHYDRO- CARBONS, ENVIRON. MOL. MUTAGEN. 17(3):169-180, 1991"
+139347-89-0,CCRIS,1,-1,,Cc1c(C)c2c3C4OC4C(O)C(O)c3ccc2c5ccccc15,"MISRA,B, AMIN,S AND HECHT,SS, DIMETHYLCHRYSENEDIOL EPOXIDES:MUTAGENICITY IN SALMONELLA TYPHIMURIUM, TUMORIGENICITY IN NEWBORN MICE, ANDREACTIVITY WITH DEOXYADENOSINE IN DNA, CHEM. RES. TOXICOL. 5(2):248-254,1992"
+120812-48-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c3ccccc3c4c(ccc5ccc1c2c45)[N+](=O)[O-],"FU,PP, NI,YC, ZHANG,YM, HEFLICH,RH, WANG,YK AND LAI,JS, EFFECT OF THEORIENTATION OF NITRO SUBSTITUENT ON THE BACTERIAL MUTAGENICITY OFDINITROBENZO[E]PYRENES, MUTAT. RES. 225(3):121-125, 1989"
+23434-96-0,CCRIS,0,-1,"FENCLONME",COC(=O)C(N)Cc1ccc(Cl)cc1,"STRAUKAS,J AND CHAUSTOVA,L, EVALUATION OF GENOTOXITY AND MUTAGENICITYOF DL-P-CHLOROPHENYLALANINE, ITS METHYL ESTER AND SOME N-ACYL DERIVATIVES, ACTABIOL. HUNG. 52(1):171-178, 2001"
+NOCAS_M290,EPA1,1,-1,,N1[C@@H]2[C@H]1c3c(c4ccccc24)c5ccccc5c6ccccc36,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61434-48-8,CCRIS,0,-1,,COc1cc2C(=O)c3ccccc3C(=O)c2c(OC)c1CO,"KAWASAKI,Y, GODA,Y AND YOSHIHIRA,K, THE MUTAGENIC CONSTITUENTS OFRUBIA TINCTORUM, CHEM. PHARM. BULL. 40(6):1504-1509, 1992"
+114460-39-8,EPA1,1,-1,,Cc1nc2ccc3ccc4ccc(O)cc4c3c2n1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+42924-53-8,EPA1,0,-1,"BRL-18725",COc1ccc2cc(CCC(=O)C)ccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16156-53-9,CCRIS,1,-1,,CC(C)COS(=O)(=O)C,"GLOWIENKE,S, FRIAUFF,W, ALLMENDINGER,T, MARTUS,HJ, SUTER,W ANDMUELLER,L, STRUCTURE-ACTIVITY CONSIDERATIONS AND IN VITRO APPROACHES TO ASSESSTHE GENOTOXICTY OF 19 METHANE-, BENZENE- AND TOLUENESULFONIC ACID ESTERS, MUTAT.RES. 581(1-2):23-34, 2005"
+528-45-0,EPA1,1,-1,,OC(=O)c1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89784-39-4,EPA1,1,-1,,CC(=O)N[C@@H](CS\C(=C(/Cl)\C(=C(Cl)Cl)Cl)\Cl)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2381-21-7,VITIC,1,-1,,Cc1ccc2ccc3cccc4ccc1c2c34,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4164-28-7,EPA1,1,-1,,CN(C)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-14-4,VITIC,1,-1,,Nc1ccc(Cc2ccc(N)c(Cl)c2)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+88847-41-0,CCRIS,1,-1,,OC1C2OC2c3c(ccc4c3ccc5ccc(O)cc45)C1O,"GLATT,H, SEIDEL,A, BOCHNITSCHEK,W, MARQUARDT,H, MARQUARDT,H,HODGSON,RM, GROVER,PL AND OESCH,F, MUTAGENIC AND CELL-TRANSFORMING ACTIVITIES OFTRIOL-EPOXIDES AS COMPARED TO OTHER CHRYSENE METABOLITES, CANCER RES. 46(9):4556-4565, 1986"
+153117-10-3,CCRIS,1,-1,,CCCCN(CC(CO)OCc1ccccc1)N=O,"YAGUCHI,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENIC ACTIVITIESOF CHIRAL EPOXIDES, HALLIDES, AND N-NITROSAMINES, BIOL. PHARM. BULL.16(9):942-944, 1993"
+146795-29-1,CCRIS,1,-1,,Cc1ccc(NC(=O)c2csc(c2)[N+](=O)[O-])cc1,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+64920-31-6,EPA1,1,-1,,O[C@@H]1C=Cc2c(ccc3c2ccc4ccccc34)[C@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2892-51-5,EPA1,0,-1,"SQUARATE",OC1=C(O)C(=O)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107534-94-1,EPA1,1,-1,,C[C@]12CC[C@H]3[C@@H](CC=C4NC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2OC(=O)CCCc5ccc(cc5)N(CCCl)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+20846-00-8,EPA1,1,-1,,CC(=[N+]([O-])[O-])C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60883-97-8,CCRIS,1,-1,,Cc1ccc(cc1)S(=O)(=O)N2C3C2c4ccccc4c5ccccc35,"STARK,AA, ZEIGER,E, SHTELZER,S, SHERADSKY,T, LIFSHITZ,Y AND BLUM,J,STRUCTURE-ACTIVITY RELATIONSHIPS IN THE MUTAGENICITY OF N-SUBSTITUTEDDERIVATIVES OF PHENANTHRENE-9,10-IMINE, MUTAGENESIS 1(1):35-39, 1986"
+4637-56-3,EPA3,1,-1,"HOAMINQUI",ONc1cc[n+]([O-])c2ccccc12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+138580-46-8,CCRIS,1,-1,,CC1=CC(=O)c2[nH]c(C)c3c4ccccc4nc3c2C1=O,"MIN,S, HELISSEY,P, CALLAIS,F, GIORGI-RENAULT,S AND FESTY,B, STRUCTURE-MUTAGENICITY RELATIONSHIPS IN A SERIES OF INDOLO[3,2-C]QUINOLINE-1,4-DIONES THATHAVE SHOWN CYTOTOXIC PROPERTIES ON LEUKEMIA CELLS, MUTAT. RES. 280(4):225-231,1992"
+159092-72-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3cccc(c3c2c1)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+510-15-6,VITIC,0,-1,"CHLOROBEN",CCOC(=O)C(O)(c1ccc(Cl)cc1)c2ccc(Cl)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+109380-31-6,CCRIS,1,-1,,CCOC(=O)C(C#N)c1snc2c(cccc12)[N+](=O)[O-],"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+66789-80-8,CCRIS,0,-1,,OC(=O)CC(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C(=O)O,"RASHID,KA, BABISH,JG AND MUMMA,RO, TESTING OF 2,4,5-T-AMINO ACIDCONJUGATES FOR MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM STRAINS, MUTAT. RES.136(3):217- 221, 1984"
+4251-89-2,EPA1,1,-1,"ICR-292",CCN(CCCl)CCCNc1c2ccccc2nc3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1194-65-6,EPA1,0,-1,,Clc1cccc(Cl)c1C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57835-92-4,CCRIS,1,-1,,[O-][N+](=O)c1cc2cccc3ccc4cccc1c4c23,"WATANABE,T, TAKASHIMA,M, KASAI,T AND HIRAYAMA,T, COMPARISON OF THEMUTATIONAL SPECIFICITY INDUCED BY ENVIRONMENTAL GENOTOXIN NITRATED POLYCYCLICAROMATIC HYDROCARBONS IN SALMONELLA TYPHIMURIUM HIS GENES, MUTAT. RES.394(1-3):103-112, 1997"
+65445-60-5,EPA3,1,-1,,Cl[C@H]1CCCN(C1)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+30489-67-9,CCRIS,1,-1,,Cn1c(N)nc2cc3ccccc3cc12,"VIKSE,R, HATCH,FT, WINTER,NW, KNIZE,MG, GRIVA,S AND FELTON,JS,STRUCTURE-MUTAGENICITY RELATIONSHIPS OF FOUR AMINO-IMIDAZONAPHTHYRIDINES ANDIMIDAZOQUINOLINES, ENVIRON. MOL. MUTAGEN. 26(1):79-85, 1995"
+192705-54-7,CCRIS,1,-1,,CC(=O)Nc1ccc2c3cc(O)ccc3c4cccc1c24,"SANGAIAH,R, RAMACHANDRAN,P, ZHANG,J AND BALL,LM, SYNTHESIS ANDBIOLOGICAL ACTIVITY OF METABOLITES OF ENVIRONMENTAL NITROARENES, POLYCYCLICAROMAT. COMPD. 11(1-4):283-290, 1996"
+13195-64-7,CCRIS,0,-1,,CC(C)OC(=O)CC(=O)OC(C)C,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+1193-24-4,EPA3,0,-1,,Oc1cc(O)ncn1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+84434-45-7,EPA1,1,-1,,Cc1ccccc1N=Nc2ccc(N)c(C)c2N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35203-91-9,EPA1,0,-1,,NS(=O)(=O)c1cccc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+349-95-1,EPA1,0,-1,,OCc1ccc(cc1)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+634-90-2,VITIC,0,-1,,Clc1cc(Cl)c(Cl)c(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6112-76-1,EPA1,1,-1,"MERCAPURI,MERCAPTNA",Sc1[nH]cnc2ncnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139627-44-4,CCRIS,1,-1,,Cc1cccc2c1cc(C)c3c4C5OC5C(O)C(O)c4ccc23,"MISRA,B, AMIN,S AND HECHT,SS, DIMETHYLCHRYSENEDIOL EPOXIDES:MUTAGENICITY IN SALMONELLA TYPHIMURIUM, TUMORIGENICITY IN NEWBORN MICE, ANDREACTIVITY WITH DEOXYADENOSINE IN DNA, CHEM. RES. TOXICOL. 5(2):248-254,1992"
+645-00-1,VITIC,0,-1,,[O-][N+](=O)c1cccc(I)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120-61-6,VITIC,0,-1,,COC(=O)c1ccc(cc1)C(=O)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+20970-16-5,CCRIS,1,-1,,NNc1nncc2ncccc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+860-22-0,EPA2,0,-1,"INDIGO-CA,METHEINDI",Oc1c([nH]c2ccc(cc12)S(=O)(=O)O)C3=Nc4ccc(cc4C3=O)S(=O)(=O)O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+56413-75-3,CCRIS,1,-1,,NNc1ccccc1[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+87-60-5,VITIC,0,-1,,Cc1c(N)cccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107-87-9,VITIC,0,-1,,CCCC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+160543-02-2,CCRIS,1,-1,,Cc1c2ccc3ccccc3c2nc4ccc(CO)cc14,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+1195-92-2,CCRIS,0,-1,"LIMONENOX",CC(=C)C1CCC2(C)OC2C1,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+51-12-7,EPA3,1,-1,"NIALAMIDE",O=C(CCNNC(=O)c1ccncc1)NCc2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+134874-62-7,CCRIS,1,-1,,[O-][N+](=O)c1cc(c2c3ccccc3c4cccc5ccc1c2c45)[N+](=O)[O-],"JUNG,H, SHAIKH,AU, HEFLICH,RH AND FU,PP, NITRO GROUP ORIENTATION,REDUCTION POTENTIAL, AND DIRECT-ACTING MUTAGENICITY OF NITRO-POLYCYCLIC AROMATICHYDRO- CARBONS, ENVIRON. MOL. MUTAGEN. 17(3):169-180, 1991"
+120-58-1,EPA2,0,-1,"ISOSAFROL",C\C=C\c1ccc2OCOc2c1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+80984-67-4,CCRIS,1,-1,,N1C2C1c3cc4c(cc3c5ccccc25)C6NC6c7ccccc47,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+80-56-8,EPA1,0,-1,,CC1=CC[C@H]2C[C@@H]1C2(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119143-41-8,CCRIS,0,-1,,OC1C=Cc2ccc3ncccc3c2C1O,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+18708-70-8,VITIC,0,-1,,[O-][N+](=O)c1c(Cl)cc(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16069-36-6,CCRIS,0,-1,"DICY18CR6",C1CCC2OCCOCCOC3CCCCC3OCCOCCOC2C1,"ARENAZ,P, BITTICKS,L, PANNELL,K AND GARCIA,S, GENOTOXIC POTENTIAL OFCROWN ETHERS IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 4(6), 437-8, 1989"
+136911-37-0,CCRIS,1,-1,,CN1CCN=N1,"SMITH,RH,JR, WLADKOWSKI,BD, TAYLOR,JE, THOMPSON,EJ, PRUSKI,B,KLOSE,JR, ANDREWS,AW AND MICHEJDA,CJ, ACID-CATALYZED DECOMPOSITION OF1-ALKYLTRIAZOLINES: A MECHANISTIC STUDY, J. ORG. CHEM. 58(8):2097-2103,1993"
+5332-73-0,EPA1,0,-1,,COCCCN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+612-62-4,EPA1,0,-1,,Clc1ccc2ccccc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105777-13-7,CCRIS,1,-1,,OC1C=CC2=C(C1O)c3cccc4cccc2c34,"BABSON,JR, RUSSO-RODRIGUEZ,SE, WATTLEY,RV, BERGSTEIN,PL, RASTETTER,WH,LIBER,HL, ANDON,BM, THILLY,WG AND WOGAN,GN, MICROSOMAL ACTIVATION OFFLUORANTHENE TO MUTAGENIC METABOLITES, TOXICOL. APPL. PHARMACOL. 85(3):355-366,1986"
+67019-21-0,CCRIS,0,-1,,CCCC(=O)Nc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+5989-27-5,EPA1,0,-1,,CC(=C)[C@H]1CCC(=CC1)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134-81-6,EPA1,0,-1,"BENZIL",O=C(C(=O)c1ccccc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13177-27-0,EPA1,1,-1,,Nc1cccc2c3cccc4cccc(c12)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139259-96-4,CCRIS,1,-1,,CC(=O)ON(OCc1ccc(Cl)cc1)C(=O)c2ccccc2,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+120-23-0,EPA1,0,-1,,OC(=O)COc1ccc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2177-18-6,EPA1,0,-1,,C=COC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119-64-2,VITIC,0,-1,"TETRALIN",C1CCc2ccccc2C1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7235-40-7,VITIC,1,-1,"CAROTENEB",C\C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C)\C=C\C=C(/C)\C=C\C2=C(C)CCCC2(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24602-86-6,VITIC,0,-1,"TRIDEMORP",CCCCCCCCCCCCCN1CC(C)OC(C)C1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+580-19-8,EPA1,1,-1,,Nc1ccc2cccnc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+772-43-0,CCRIS,1,-1,,N\C(=N/O)\c1oc(cc1)[N+](=O)[O-],"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+191-24-2,EPA1,1,-1,,c1cc2ccc3ccc4ccc5cccc6c(c1)c2c3c4c56,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+126831-76-3,CCRIS,1,-1,,BrCc1ccc2c3cccc4cccc(c2c1)c34,"BALL,JC, AND YOUNG,WC, AMES ASSAY MUTAGENICITY AND ELECTRONICSTRUCTURE CALCULATIONS OF BROMOMETHYLFLUORANTHENES, CHLOROMETHYLFLUORANTHENES,AND HYDROXYMETHYLFLUORANTHENES, CHEM.-BIOL. INTERACT. 77(3):291-302,1991"
+106-94-5,CCRIS,0,-1,,CCCBr,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+61-57-4,CCRIS,1,-1,"NIRIDAZOL",[O-][N+](=O)c1cnc(s1)N2CCNC2=O,"SHUBBER,EK, JACOBSON-KRAM,D AND WILLIAMS,JR, COMPARISON OF THE AMESASSAY AND THE INDUCTION OF SISTER CHROMATID EXCHANGES: RESULTS WITH TENPHARMACEUTICALS AND FIVE SELECTED AGENTS, CELL BIOL. TOXICOL. 2(3):379-399,1986"
+633-96-5,EPA1,0,-1,"ACIDORANG",Oc1ccc2ccccc2c1N=Nc3ccc(cc3)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M587,EPA1,0,-1,,CCCC[C@@H](CC)COC(=O)c1ccccc1C(=O)OC[C@H](CC)CCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+141-43-5,VITIC,0,-1,"ETHANOLAM",NCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+143-27-1,VITIC,0,-1,"HETAFLUR,HEXADECYL",CCCCCCCCCCCCCCCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16169-17-8,EPA1,1,-1,,ONc1ccccc1c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125239-65-8,EPA1,1,-1,,COc1cc2nc3cc(N)ccc3nc2cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16757-82-7,EPA1,1,-1,,Cc1cc2ccc3cc4ccccc4c5ccc(c1)c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50474-48-1,CCRIS,1,-1,,ONc1ncnc2c1ncn2Cc3ccccc3,"GORROD,JW, IOANNIDES,C, LAM,SP AND NEVILLE,S, MUTAGENICITY TESTING OF9-N-SUBSTITUTED ADENINES AND THEIR N-OXIDATION PRODUCTS, ENVIRON. HEALTHPERSPECT. 101(SUPPL. 3):21-26, 1993"
+141890-75-7,CCRIS,1,-1,,Nc1nc2c(ccc3ncccc23)s1,"KROPKO,ML, JAEN,JC, THEISS,JC, WOLD,S, CAPRATHE,BW AND WISE,LD,CHEMICAL PURITY AND MUTAGENICITY: CASE STUDY OF A DRUG IN DEVELOPMENT, MUTAT.RES. 281(4):233-238, 1992"
+220168-56-9,CCRIS,1,-1,,CC(C)(C)c1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+125276-71-3,CCRIS,0,-1,,OC1C2OC2c3c(ccc4nc5c(ccc6ccccc56)cc34)C1O,"WOOD,AW, CHANG,RL, KATZ,M, CONNEY,AH, JERINA,DM, SIKKA,HC, LEVIN,W ANDKUMAR,S, MUTAGENICITY OF DIHYDRODIOLS AND DIOL EXPOXIDES OF DIBENZ[A,H]ACRIDINEIN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 49(24, PT.1):6981-4,1989"
+476-57-3,EPA1,1,-1,,COc1cc(O)c2C(=O)c3c(O)cc(C)c(O)c3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84-75-3,VITIC,0,-1,,CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3351-31-3,EPA1,1,-1,,Cc1ccc2ccc3c4ccccc4ccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+113163-22-7,CCRIS,1,-1,,OC1C2OC2c3c(ccc4cccnc34)C1O,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+126572-78-9,EPA1,1,-1,,OC\C(=C(\Cl)/C(=O)O)\C(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51-18-3,VITIC,1,-1,"TRETAMINE",C1CN1c2nc(nc(n2)N3CC3)N4CC4,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+146795-48-4,CCRIS,1,-1,,CN(C(=O)c1csc(c1)[N+](=O)[O-])c2ccccc2,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+111-14-8,VITIC,0,-1,"HEPTANOAT,JM-300",CCCCCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3468-63-1,EPA3,1,-1,,Oc1ccc2ccccc2c1N=Nc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+102421-85-2,CCRIS,0,-1,,OC1=C(O)C23CCCCC2(O3)c4cc5ccc6ccccc6c5nc14,"WOOD,AW, CHANG,RL, KATZ,M, CONNEY,AH, JERINA,DM, SIKKA,HC, LEVIN,W ANDKUMAR,S, MUTAGENICITY OF DIHYDRODIOLS AND DIOL EXPOXIDES OF DIBENZ[A,H]ACRIDINEIN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 49(24, PT.1):6981-4,1989"
+90-46-0,EPA1,1,-1,"XANTHYDRO",OC1c2ccccc2Oc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25953-06-4,VITIC,0,-1,,CCN(CC)c1ccc(N=O)c(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+64099-25-8,CCRIS,1,-1,,COc1nsc2c(cccc12)[N+](=O)[O-],"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+115688-97-6,CCRIS,1,-1,"PD-128483",CN1CCC=C2C1CCc3sc(N)nc23,"KROPKO,ML, JAEN,JC, THEISS,JC, WOLD,S, CAPRATHE,BW AND WISE,LD,CHEMICAL PURITY AND MUTAGENICITY: CASE STUDY OF A DRUG IN DEVELOPMENT, MUTAT.RES. 281(4):233-238, 1992"
+NOCAS_M487,EPA1,0,-1,,CC(C)(N)[C@@H]1CC[C@](C)(N)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132742-03-1,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3cc4CCC=Cc4c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+29964-84-9,VITIC,0,-1,,CC(C)CCCCCCCOC(=O)C(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+129-03-3,EPA1,0,-1,"CYPROHEPT,CYPROHCYC,CYPROHHCL,CYPROHPYP,CYRROHACE",CN1CCC(=C2c3ccccc3C=Cc4ccccc24)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99-57-0,EPA2,1,-1,,Nc1cc(ccc1O)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+106626-55-5,EPA1,1,-1,,CN(C)CCNC(=O)c1cccc2nc3ccccc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-12-7,VITIC,0,-1,"FORMAMIDE",NC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3025-42-1,CCRIS,1,-1,,CCN(CC)c1ccc(cc1)N=Nc2ccc(cc2Cl)[N+](=O)[O-],"ELLIOTT,BM, JACKH,R AND JUNG,R, EVALUATION OF THE GENOTOXICITY OF4-DIETHYLAMINO-4'-NITROAZOBENZENE AND SEVEN ANALOGUES, MUTAGENESIS 9(6):517-521, 1994"
+52-52-8,VITIC,0,-1,"CYCLOLEUC",NC1(CCCC1)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+207-08-9,VITIC,1,-1,,c1ccc2cc3c(cc2c1)c4cccc5cccc3c45,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5737-13-3,EPA1,1,-1,,O=C1c2cccc3ccc4cccc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19727-83-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc2CCNc2c1,"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+135086-94-1,EPA1,1,-1,,COc1ccc(\C=N\n2nnc3c4ccccc4nc3c2O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109-99-9,VITIC,0,-1,"TETRAHYFU",C1CCOC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+72755-25-0,CCRIS,0,-1,,CC1C(C)C(C)(O)C(=O)OCC2=CCN3CCC(OC(=O)C1=C)C23,"RUBIOLO,P, PIETERS,L, CALOMME,M, BICCHI,C, VLIETINCK,A AND VANDENBERGHE,D, MUTAGENICITY OF PYRROLIZIDINE ALKALOIDS IN THE SALMONELLATYPHIMURIUM/MAMMALIAN MICROSOME SYSTEM, MUTAT. RES. 281(2):143-147,1992"
+104226-21-3,CCRIS,0,-1,,Cc1cc(ccc1N=Nc2ccc(N)cc2)N(CCO)CCO,"SHAHIN,MM, EVALUATION OF THE MUTAGENICITY OF AZO DYES IN SALMONELLATYPHIMURIUM: A STUDY OF STRUCTURE-ACTIVITY RELATIONSHIPS, MUTAGENESIS 4(2):115-125, 1989"
+99-73-0,EPA1,0,-1,"BRPHENBRP",BrCC(=O)c1ccc(Br)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99523-61-2,CCRIS,0,-1,,CCCC(=O)Nc1snc2ccc(C)cc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+33956-49-9,CCRIS,0,-1,,C\C=C\C=C\CCCCCCCO,"ABDEL-GHANI,SB, MARTINEZ-LOPEZ,E, PEREZ-PERTEJO,Y, BAYOUMI,AE,GARCIA-FERNANDEZ,A, BALANA-FOUCE,R AND ORDONEZ,D, CYTOTOXICITY AND MUTAGENICITYOF FOUR INSECT PHEROMONES IN CHO-K1 CELLS, BULL. ENVIRON. CONTAMIN. TOXICOL.73(6):963-970, 2004"
+111712-48-2,CCRIS,0,-1,,CC(C)(Br)C(Br)COP(=O)(OCC(Br)C(C)(C)Br)OCC(Br)C(C)(C)Br,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+62966-21-6,CCRIS,0,-1,,CC(=O)CC(=O)\C=C\C(=O)O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y85"
+19900-72-2,CCRIS,0,-1,,CCc1cc(Cc2cc(C)c(N)c(CC)c2)cc(C)c1N,"KUGLER-STEIGMEIER,ME, FRIEDERICH,U, GRAF,U, LUTZ,WK, MAIER,P ANDSCHLATTER,CH, GENOTOXICITY OF ANILINE DERIVATIVES IN VARIOUS SHORT-TERM TESTS,MUTAT. RES. 211(2):279-289, 1989"
+NOCAS_M267,EPA1,1,-1,,CC(=C[C@H]1[C@H](C(=O)O[C@@H]2CC(=O)C(=C2C)CC=C)C1(C)C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-50-1,VITIC,0,-1,"DICLBENZO",Clc1ccccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+94-62-2,CCRIS,0,-1,"PIPERINE",O=C(\C=C\C=C\c1ccc2OCOc2c1)N3CCCCC3,"KAREKAR,VR, MUJUMDAR,AM, JOSHI,SS, DHULEY,J, SHINDE,SL ANDGHASKADBI,S, ASSESSMENT OF GENOTOXIC EFFECT OF PIPERINE USING SALMONELLATYPHIMURIUM AND SOMATIC AND GERM CELLS OF SWISS ALBINO MICE, ARZNEIM.-FORSCH.46(1):972-975, 1996"
+67019-19-6,CCRIS,1,-1,,ClCC(=O)Nc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+107-99-3,EPA1,1,-1,,CN(C)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109-77-3,VITIC,0,-1,,N#CCC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99585-29-2,CCRIS,1,-1,,Oc1cccc2Cc3cc(ccc3c12)[N+](=O)[O-],"CUI,XS, BERGMAN,J AND MOLLER,L, PRENEOPLASTIC LESIONS, DNA ADDUCTFORMATION AND MUTAGENICITY OF 5-,7- AND 9-HYDROXY-2-NITROFLUORENE, METABOLITESOF THE AIR POLLUTANT 2-NITROFLUORENE, MUTAT. RES. 369(3-4):147-156,1996"
+3671-71-4,EPA1,1,-1,,ON(C(=O)c1ccccc1)c2ccc3c(Cc4ccccc34)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-46-6,VITIC,0,-1,"DIETGLYCO",OCCOCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+64-77-7,VITIC,0,-1,"TOLBUTAMI,TOLBUTPHE,TOLBUTANA",CCCCNC(=O)NS(=O)(=O)c1ccc(C)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+462-06-6,VITIC,1,-1,,Fc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2371-42-8,CCRIS,0,-1,"MEISOBNOR",CC1(C)C2CCC1(C)C(C)(O)C2,"DIONIGI,CP, LAWLOR,TE, MCFARLAND,JE AND JOHNSEN,PB, EVALUATION OFGEOSMIN AND 2-METHYLISOBORNEOL ON THE HISTIDINE DEPENDENCE OF TA98 AND TA100SALMONELLA TYPHIMURIUM TESTER STRAINS, WATER RES. 27(11):1615-1618,1993"
+115781-40-3,CCRIS,0,-1,,Cc1cnc2ccc3c(nc(NS(=O)(=O)O)n3C)c2n1,"TURESKY,RJ, AESCHBACHER,HU, WUERZNER,HP, SKIPPER,PL ANDTANNENEBAUM,SR, MAJOR ROUTES OF METABOLISM OF THE FOOD-BORNE CARCINOGEN2-AMINO-3,8-DIMETHYLIMIDAZO [4,5-F]QUINOXALINE IN THE RAT CARCINOGENESIS9(6):1043-1048, 1988"
+4074-88-8,VITIC,0,-1,,C=CC(=O)OCCOCCOC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+122-97-4,EPA1,0,-1,"PHEPROOL3",OCCCc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70249-46-6,EPA1,0,-1,,OCc1ccc2c3ccccc3c4cccc1c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+610-88-8,CCRIS,0,-1,"TENUAZONA,TENUAZONN",CCC(C)C1NC(=O)C(=C1O)C(=O)C,"SCHRADER,TJ CHERRY,W SOPER,K LANGLOIS,I AND VIJAY,HM, EXAMINATION OFALTERNARIA ALTERNATA MUTAGENICITY AND EFFECTS OF NITROSYLATION USING THE AMESSALMONELLA TEST, TERATOG., CARCINOG., MUTAGEN. 21(4):261-274, 2001"
+16757-80-5,EPA1,1,-1,,Cc1cc2cccc3ccc4cc5ccccc5c1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+759-94-4,VITIC,0,-1,,CCCN(CCC)C(=O)SCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+684-93-5,EPA1,1,-1,"MENOSOURE",CN(N=O)C(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M142,EPA1,1,-1,,C=CC(=O)N(C[C@H]1CO1)C[C@H]2CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M285,EPA1,1,-1,,C[C@@H]1CNC[C@@H](C)O1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-47-0,VITIC,0,-1,,N#Cc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106636-50-4,CCRIS,1,-1,,Cc1ccc(cc1)c2nc3SCCn3c2[N+](=O)[O-],"HRELIA,P, PAOLINI,M, BIAGI,GL AND CANTELLI-FORTI,G, THE DIRECT-ACTINGMUTAGENICITY OF NITROIMIDAZO[2,1-B]THIAZOLES IN SALMONELLA TYPHIMURIUM,TERATOG., CARCINOG., MUTAGEN. 6(6):511-519, 1986"
+159092-78-1,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(cc3c(cccc3c2c1)[N+](=O)[O-])[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+123-30-8,VITIC,0,-1,"AMINOPHEL",Nc1ccc(O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+104-83-6,EPA1,0,-1,,ClCc1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+79455-30-4,CCRIS,0,-1,"NICARAVEN",CC(CNC(=O)c1cccnc1)NC(=O)c2cccnc2,"INOUE,M, HORIUCHI,K, FUKUDA,T, FUKUDA,A AND MARUTANI,K, MUTAGENICITYSTUDY ON AVS, YAKURI TO CHIRYO 23(SUPPL. 1):207-212, 1995"
+1070-11-7,EPA1,0,-1,,CC[C@H](CO)NCCN[C@H](CC)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7467-29-0,EPA1,1,-1,,Cc1ccccc1N=Nc2cc(C)c(N)cc2N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+122-19-0,VITIC,0,-1,"BENDMAMCL",CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+36508-80-2,CCRIS,0,-1,,CN1C(CCC1=O)c2ccc[n+]([O-])c2,"DOOLITTLE,DJ, WINEGAR,R, LEE,CK, CALDWELL,WS, HAYES,AW ANDDEBETHIZY,JD, THE GENOTOXIC POTENTIAL OF NICOTINE AND ITS MAJOR METABOLITES,MUTAT. RES. 344(3,4):95-102, 1995"
+2997-92-4,EPA1,1,-1,,CC(C)(N=NC(C)(C)C(=N)N)C(=N)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155164-66-2,CCRIS,0,-1,,ClC1=C(Cl)C(=O)N(N=C1)C(=O)c2ccccc2,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+2608-48-2,VITIC,1,-1,,[O-][N+](=O)c1ccc(\C=C\C=C\C=O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+880-93-3,CCRIS,1,-1,,Cc1ccc(c2ccccc12)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+93-15-2,VITIC,0,-1,"MEEUGENOL",COc1ccc(CC=C)cc1OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+23045-35-4,CCRIS,1,-1,,Nc1c2ccccc2nc3ccc(cc13)[N+](=O)[O-],"TOMOSAKA,H, OMATA,S, HASEGAWA,E AND ANZAI,K, THE EFFECTS OFSUBSTITUENTS INTRODUCED INTO 9-AMINOACRIDINE ON FRAMESHIFT MUTAGENICITY AND DNABINDING AFFINITY, BIOSCI., BIOTECHNOL., BIOCHEM. 61(7):1121-1125,1997"
+86-73-7,VITIC,0,-1,"FLUORENE",C1c2ccccc2c3ccccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+151455-09-3,CCRIS,0,-1,,COc1cc(OC)c2cc(c3c(cc4OCOc4c3c2c1)C(=O)O)[N+](=O)[O-],"PISTELLI,L, NIERI,E, BILIA,AR, MARSILI,A AND SCARPATO,R, CHEMICALCONSTITUENTS OF ARISTOLOCHIA RIGIDA AND MUTAGENIC ACTIVITY OF ARISTOLOCHIC ACIDIV, J. NAT. PROD. 56(9):1605-1608, 1993"
+2782-57-2,EPA1,0,-1,,Oc1nc(Cl)nc(Cl)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22338-69-8,CCRIS,0,-1,,CC12CCCC(C)(C1CCC34CC(CCC23)C(=C)C4O)C(=O)O,"PEZZUTO,JM, NANAYAKKARA,NPD, COMPADRE,CM, SWANSON,SM, KINGHORN,AD,GUENTHNER,TM, SPARNINS,VL AND LAM,LKT, CHARACTERIZATION OF BACTERIALMUTAGENICITY MEDIATED BY 13-HYDROXY-ENT-KAURENOIC ACID (STEVIOL) AND SEVERALSTRUCTURALLY-RELATED DERIVATIVES AND EVALUATION OF POTENTIAL TO INDUCEGLUTATHIONE S-TRANSFERASE IN MICE, MUTAT. RES. 169(3):93-103, 1986"
+28564-83-2,CCRIS,1,-1,,CC1=C(O)C(=O)C(O)CO1,"HIRAMOTO,K, NASUHARA,A, MICHIKOSHI,K, KATO,T AND KIKUGAWA,K, DNASTRAND-BREAKING ACTIVITY AND MUTAGENICITY OF2,3-DIHYDRO-3,5-DIHYDROXY-6-METHYL-4H-PYRAN-4-ONE (DDMP), A MAILLARD REACTIONPRODUCT OF GLUCOSE AND GLYCINE, MUTAT. RES. 395(1):47-56, 1997"
+95-78-3,VITIC,1,-1,,Cc1ccc(C)c(N)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13558-31-1,CCRIS,0,-1,,Nc1ccc2c(c3ccccc3C(=O)O)c4ccc(N)cc4[o+]c2c1,"WUEBBLES,BJY AND FELTON,JS, EVALUATION OF LASER DYE MUTAGENICITY USINGTHE AMES/ SALMONELLA MICROSOME TEST, ENVIRON. MUTAGEN. 7(4):511-522,1985"
+38914-96-4,EPA1,1,-1,,ClCCNCCCNc1c2ccccc2nc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155164-57-1,CCRIS,0,-1,,ClC1=C(Cl)C(=O)N(N=C1)S(=O)(=O)c2ccccc2,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+74407-28-6,CCRIS,0,-1,"SA-672",CSCC(NC(=O)C(C)(C)SC)C(=O)O,"MORIKAWA,K, YAMAUCHI,H AND ISO,T, MUTAGENICITY TESTS ON N-(2-MERCAPTO-2-METHYLPROPIONYL)-L-CYSTEINE (SA96), IYAKUHIN KENKYU 16(4):784-792,1985"
+68688-87-9,EPA3,1,-1,,Cc1ccc2cc3c4C=C[C@@H](O)[C@H](O)c4ccc3c5CCc1c25,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+77121-90-5,CCRIS,1,-1,,COC1C(N)CC(OC2CC(O)(Cc3c(O)c4C(=O)c5cccc(OC)c5C(=O)c4c(O)c23)C(=O)CO)OC1C,"THOMAS,HF, MUTAGENIC AND CYTOTOXIC POTENCIES OF A SERIES OFANTHRACYCLINE DERIVATIVES AS MEASURED BY HIS+ REVERSION, 8-AZAGUANINE RESISTANCEAND DIRECT PLATING CYTOTOXICITY TESTS IN SALMONELLA TYPHIMURIUM, TERATOG.,CARCINOG., MUTAGEN. 6(3):219-235, 1986"
+33069-62-4,EPA1,0,-1,,CC(=O)O[C@@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(=O)C)[C@H]2[C@H](OC(=O)c4ccccc4)[C@@]5(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c6ccccc6)c7ccccc7)C(=C1C5(C)C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35212-22-7,EPA1,0,-1,"IPRIFLAVO",CC(C)Oc1ccc2C(=O)C(=COc2c1)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16156-54-0,CCRIS,1,-1,,CCC(C)OS(=O)(=O)C,"GLOWIENKE,S, FRIAUFF,W, ALLMENDINGER,T, MARTUS,HJ, SUTER,W ANDMUELLER,L, STRUCTURE-ACTIVITY CONSIDERATIONS AND IN VITRO APPROACHES TO ASSESSTHE GENOTOXICTY OF 19 METHANE-, BENZENE- AND TOLUENESULFONIC ACID ESTERS, MUTAT.RES. 581(1-2):23-34, 2005"
+594-42-3,VITIC,1,-1,,ClSC(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+581-47-5,EPA1,1,-1,,c1ccc(nc1)c2ccncc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94-36-0,VITIC,0,-1,"BENZOYLPE",O=C(OOC(=O)c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99-61-6,EPA1,1,-1,"NITROBZAL",[O-][N+](=O)c1cccc(C=O)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-51-1,VITIC,0,-1,,Cc1ccc(cc1)C(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M237,EPA1,1,-1,,C[C@@H]1CCCCN1CCCNCC(=O)Nc2c(C(=O)c3ccccc3F)c(C)nn2C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64-86-8,EPA3,0,-1,,COC1=CC=C2C(=CC1=O)[C@@H](CCc3cc(OC)c(OC)c(OC)c23)NC(=O)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+70403-81-5,EPA1,1,-1,,COc1ccc2c(c1)C(=O)c3nccc4cc(OC)c(OC)c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+52517-34-7,CCRIS,1,-1,,CN1CC(CBr)CC2C1Cc3c[nH]c4cccc2c34,"GLATT,H, PERTZ,H, KASPER,R AND EICH,E, CLAVINE ALKALOIDS ANDDERIVATIVES AS MUTAGENS DETECTED IN THE AMES TEST, ANTI-CANCER DRUGS3(6):609-614, 1992"
+81316-80-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c3cc4ccccc4cc3c5cccc1c25,"VANCE,WA AND LEVIN,DE, STRUCTURAL FEATURES OF NITROAROMATICS THATDETERMINE MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM, ENVIRON. MUTAGEN.6(6):797-811, 1984"
+145531-24-4,CCRIS,1,-1,,COc1cc(NS(=O)(=O)C)ccc1Nc2c3ccccc3nc4ccc(cc24)N=N#N,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+NOCAS_M273,EPA1,1,-1,,C[C@@H](O)c1cc2ccc3cccc4ccc(c1)c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+839-90-7,VITIC,0,-1,,OCCN1C(=O)N(CCO)C(=O)N(CCO)C1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78-95-5,EPA1,0,-1,,CC(=O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-20-2,VITIC,0,-1,"TRICLOCAR",Clc1ccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99-08-1,VITIC,0,-1,,Cc1cccc(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+50-48-6,CCRIS,0,-1,"AMITRIPTY,AMITRYHCL",CN(C)CCC=C1c2ccccc2CCc3ccccc13,"BALBI,A MUSCETTOLA,G STAIANO,N MARTIRE,G AND DE LORENZO,F, PSYCHOTROPIC DRUGS: EVALUATION OF MUTAGENIC EFFECT,  PHARMACOL. RES. COMMUN.12(5):423-431, 1980"
+105836-99-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2nc3c(cccc3nc2c1)[N+](=O)[O-],"WATANABE,T, HANASAKI,Y, HIRAYAMA,T AND FUKUI,S, MUTAGENICITY OF NITRO-AND AMINO-SUBSTITUTED PHENAZINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.225(3):75-82, 1989"
+199536-62-4,CCRIS,1,-1,,BrCC1=C(Br)C(=O)OC1,"LALONDE,RT, BU,L, HENWOOD,A, FIUMANO,J AND ZHANG,L, BROMINE-,CHLORINE-, AND MIXED HALOGEN-SUBSTITUTED 4-METHYL-2(5H)-FURANONES: SYNTHESIS ANDMUTAGENIC EFFECTS OF HALOGEN AND HYDROXYL GROUP REPLACEMENTS,CHEM. RES. TOXICOL.10(12):1427-1436, 1997"
+98046-73-2,EPA1,1,-1,,ONc1cnc2c(c1)nc3ccccn23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38514-71-5,EPA2,1,-1,,Nc1nc(cs1)c2oc(cc2)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+16529-56-9,CCRIS,0,-1,,CC(C=C)C#N,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T AND MORTELMANS,K, SALMONELLAMUTAGENICITY TESTS. V. RESULTS FROM THE TESTING OF 311 CHEMICALS, ENVIRON. MOL.MUTAGEN. 19(SUPPL.21):2-141, 1992"
+72-48-0,EPA1,1,-1,"ALIZARIN",Oc1ccc2C(=O)c3ccccc3C(=O)c2c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111574-85-7,EPA1,1,-1,,N[C@@H](CCC(=O)N[C@@H](CSC(=C(Cl)Cl)Cl)C(=O)NCC(=O)O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17423-48-2,CCRIS,0,-1,,Nc1cccc2ccc3ccccc3c12,"LATER,DW, PELROY,RA, STEWART,DL, MCFALL,T, BOOTH,GM, LEE,ML,TEDJAMULIA,M AND CASTLE,RN, MICROBIAL MUTAGENICITY OF ISOMERIC TWO-, THREE-, ANDFOUR-RING AMINO POLYCYCLIC AROMATIC HYDROCARBONS, ENVIRON. MUTAGEN.6(4):497-515, 1984"
+523-44-4,EPA3,0,-1,,Oc1ccc(N=Nc2ccc(cc2)S(=O)(=O)O)c3ccccc13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+303-34-4,VITIC,1,-1,,CO[C@@H](C)[C@](O)(C(=O)OCC1=CCN2CC[C@H](OC(=O)\C(=C/C)\C)[C@@H]12)C(C)(C)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+92072-09-8,EPA1,1,-1,,[O-][N+](=O)c1ccc2c3cccc4ccc(c(c5cccc1c25)c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+118174-26-8,CCRIS,1,-1,,CC(C)(C)OC(=O)N\N=C\C1=CN(O)c2ccccc2N1O,"NUNOSHIBA,T AND NISHIOKA,H, GENOTOXICITY OF QUINOXALINE 1,4-DIOXIDEDERIVATIVES IN ESCHERICHIA COLI AND SALMONELLA TYPHIMURIUM, MUTAT. RES.217(3):203-209, 1989"
+119-47-1,EPA1,0,-1,"DR9601912",Cc1cc(Cc2cc(C)cc(c2O)C(C)(C)C)c(O)c(c1)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95933-72-5,CCRIS,1,-1,"AMIDOX",N\C(=N/O)\c1ccc(O)c(O)c1,"MIADOKOVA,E, MACAKOVA,K, PODSTAVKOVA,S AND VLECK,D, GENOTOXICPROPERTIES OF THE NEWLY SYNTHESIZED ANTINEOPLASTIC AGENTS AMIDOX, DIDOX ANDTRIMIDOX, PHARMAZIE 52(7):540-544, 1997"
+81-77-6,VITIC,0,-1,,Oc1c2ccccc2c(O)c3c1ccc4nc5c6C(=O)c7ccccc7C(=O)c6ccc5nc34,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6375-16-2,EPA1,1,-1,,CC(=O)Nc1ccc(C)c(N)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+130536-46-8,CCRIS,0,-1,,C1Cc2cccnc2C3OC13,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+70140-81-7,CCRIS,0,-1,,CCOP(=S)(OCC(C)C)SCCl,"VLCEK,D, PODSTAVKOVA,S, MIADOKOVA,E AND SISKOVA,A, TESTING OF THEPOTENTIAL MUTAGENIC EFFECT OF CHLORIZOFOS ON BACTERIA, ACTA FAC. RERUM NAT.UNIV. COMENIANAE, GENET. 17:31-36, 1986"
+1071-83-6,VITIC,0,-1,"GLYPHOSAT",OC(=O)CNCP(=O)(O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1126-76-7,CCRIS,1,-1,,C(Cc1ccccc1)C2CO2,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+99-94-5,VITIC,0,-1,"TOLUATEPA",Cc1ccc(cc1)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+50935-04-1,CCRIS,1,-1,,CC1OC(CC(N)C1O)OC2CC(O)(Cc3c(O)c4C(=O)c5cccc(O)c5C(=O)c4c(O)c23)C(=O)C,"VASIL'EVA,SV, MAKHOVA,EV, EFREMENKOVA,OV AND BARTOSHEVICH,YE:GENOTOXIC AND MUTAGENIC EFFECTS OF ANTITUMOR ANTHRACYCLINES AND AGLYCONES:STUDIES WITH"
+108963-23-1,CCRIS,0,-1,,ClCCC(Br)CBr,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+64432-06-0,CCRIS,0,-1,,CC1OC(OC2C(O)C(O)C(CO)OC2OC34CCC5C6(C)CCCC(C)(C6CCC5(CC3=C)C4)C(=O)OC7OC(CO)C(O)C(O)C7O)C(O)C(O)C1O,"PEZZUTO,JM, COMPADRE,CM, SWANSON,SM, NANAYAKKARA,NPD AND KINGHORN,AD,METABOLICALLY ACTIVATED STEVIOL, THE AGLYCONE OF STEVIOSIDE, IS MUTAGENIC, PROC.NATL. ACAD. SCI. U. S. A. 82(8):2478-2482, 1985"
+68162-38-9,CCRIS,0,-1,,COC(=O)\C(=C\c1oc(Br)cc1)\[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+3420-97-1,EPA1,1,-1,"NOPHENETP",CCOc1ccc(cc1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128879-32-3,CCRIS,0,-1,,CN(C)CCN1C=CN(C)C1\C=N\O,"ORNER,G, NIEDING,WJ AND KORTE,DW, MUTAGENIC POTENTIAL OF1-(2'-N,N-DIMETHYLAMMONIUMETHYL)-2-HYDROXYIMINOMETHYL-3-METHYLIMIDAZOLIUMDICHLORIDE IN THE AMES SALMONELLA/MAMMALIAN MICROSOME MUTAGENICITY TEST,LETTERMAN ARMY INSTITUTE OF RESEARCH, LAIR-IR-385:TOXICOLOGYSER-241, JULY1989"
+NOCAS_M300,EPA1,1,-1,,ClC[C@H](Cl)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+585-71-7,CCRIS,0,-1,,CC(Br)c1ccccc1,"BALL,JC AND YOUNG,WC, MUTAGENICITY STUDIES OFALPHA,ALPHA'-DIHALOMETHYLBENZENES, ALPHA-METHYLBENZYL HALIDES, AND1-CHLOROMETHYLPYRENE IN THE AMES ASSAY, MUTAT. RES. 191(2):79-84,1987"
+89-98-5,VITIC,0,-1,,Clc1ccccc1C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+55090-44-3,EPA2,1,-1,,CCCCCCCCCCCCN(C)N=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+18434-08-7,CCRIS,0,-1,,CCCCCCC(CCCC)COc1ccc(cc1)c2ccc(cc2)c3ccc(cc3)c4ccc(OCC(CCCC)CCCCCC)cc4,"WUEBBLES,BJY AND FELTON,JS, EVALUATION OF LASER DYE MUTAGENICITY USINGTHE AMES/ SALMONELLA MICROSOME TEST, ENVIRON. MUTAGEN. 7(4):511-522,1985"
+119-32-4,VITIC,1,-1,,Cc1ccc(N)cc1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M268,EPA1,1,-1,,ClC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1326-03-0,VITIC,0,-1,,CCN(CC)c1ccc2C(=C3C=CC(=[N+](CC)CC)C=C3Oc2c1)c4ccccc4C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+150366-18-0,CCRIS,0,-1,,COCC1CN(C(=O)O1)c2ccc3nc(sc3c2)C(O)CCC#N,"SATO,G ASAKURA,S HAKURA,A TSUTSUI-HIYOSHI,Y KOBAYASHI,N ANDTSUKIDATE,K, ASSESSMENT OF POTENTIAL MUTAGENIC ACTIVITIES OF A NOVELBENZOTHIAZOLE MAO-A INHIBITOR E2011 USING SALMONELLA TYPHIMURIUM YG1029, MUTAT.RES. 472(1-2):163-169, 2000"
+80-63-7,VITIC,1,-1,,COC(=O)C(=C)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24954-53-8,CCRIS,0,-1,,CNC(=O)ON(C(=O)NC)C(=O)NC,"LEE,MS, LIN,DP AND WANG,CY, MUTAGENICITY OF THE ANTICANCER DRUG,CARACEMIDE, AND RELATED COMPOUNDS FOR SALMONELLA, MUTAT. RES. 172(3):199-209,1986"
+133740-20-2,CCRIS,1,-1,"DR9709873",COc1cc(O)c2c(O)c3C(=O)OC(=Cc3c(OC)c2c1)C,"VARANDA,EA, RADDI,MSG, DE LUZ,DF, ARAUJO,MCP, GIBRAN,SCA, TAKAHASHI,CSAND VILEGAS,W, MUTAGENIC AND CYTOTOXIC ACTIVITY OF AN ISOCOUMARIN (PAEPALANTINE)ISOLATED FROM PAEPALANTHUS VELLOZIOIDES, TERATOG., CARCINOG., MUTAGEN.17(2):85-95, 1997"
+2564-83-2,EPA1,0,-1,,CC1(C)CCCC(C)(C)N1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119143-42-9,CCRIS,0,-1,,C1Cc2c(ccc3ncccc23)C4OC14,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+789-47-9,EPA1,1,-1,,Nc1ccc2c(ccc3c4ccccc4ccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-76-2,VITIC,0,-1,,CCCCOCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+103124-59-0,CCRIS,0,-1,,CCOC(=O)C(=NNc1ccc(cc1OC)c2ccc(NN=C(C(=O)OCC)C(=O)OCC)c(OC)c2)C(=O)OCC,"DE FRANCE,BF, CARTER,MH AND JOSEPHY,PD, COMPARATIVE METABOLISM ANDMUTAGENICITY OF AZO AND HYDRAZONE DYES IN THE AMES TEST, FOOD CHEM. TOXICOL.24(2):165-169, 1986"
+1248-18-6,EPA1,0,-1,,Oc1ccc2ccccc2c1N=Nc3ccc4ccccc4c3S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86-59-9,EPA1,0,-1,,OC(=O)c1cccc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+83-95-4,EPA1,1,-1,,COc1ccc2c(OC)c3CCOc3nc2c1OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+303-45-7,EPA1,0,-1,"AC-1,GOSSYPOAC,GOSSYPOFO",CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)c3c(C)cc4c(C(C)C)c(O)c(O)c(C=O)c4c3O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+41934-47-8,EPA1,0,-1,,CCN(CC)c1ccc2C(=CC(=O)Oc2c1)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+192705-53-6,CCRIS,1,-1,,CC(=O)Nc1ccc2c3ccc(O)cc3c4cccc1c24,"SANGAIAH,R, RAMACHANDRAN,P, ZHANG,J AND BALL,LM, SYNTHESIS ANDBIOLOGICAL ACTIVITY OF METABOLITES OF ENVIRONMENTAL NITROARENES, POLYCYCLICAROMAT. COMPD. 11(1-4):283-290, 1996"
+106636-49-1,EPA1,1,-1,,[O-][N+](=O)c1c(nc2SCCn12)c3ccc(Cl)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+34801-16-6,EPA3,1,-1,,Nc1nc(cs1)c2ccc(s2)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+66-97-7,EPA1,0,-1,"PSORALEN",O=C1Oc2cc3occc3cc2C=C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+122587-22-8,CCRIS,1,-1,,COC(=O)c1oc(c(Cl)c1Cl)[N+](=O)[O-],"HATCHER,JF, YAMAMOTO,K, ICHIKAWA,M, BRYAN,GT AND SWAMINATHAN,S,METABOLIC REDUCTION OF NOVEL 3,4-DICHLORO-5-NITROFURANS IN SALMONELLATYPHIMURIUM, ENVIRON. MOL. MUTAGEN. 25(1):58-66, 1995"
+14064-55-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc(\C=C\c2ccc(Cl)cc2)cc1,"HOOBERMAN,BH, BREZZELL,MD, DAS,SK, YOU,Z AND SINSHEIMER,JE,SUBSTITUENT EFFECTS ON THE GENOTOXICITY OF 4-NITROSTILBENE DERIVATIVES, MUTAT.RES. 341(1): 57-69, 1994"
+NOCAS_M110,EPA1,1,-1,,COC(=O)[C@]12O[C@@]1(C)[C@@](C)(O)OC2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+924-16-3,EPA1,1,-1,,CCCCN(CCCC)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+74494-65-8,CCRIS,0,-1,,COc1cc(O)c2C(=O)c3c(OC)cc4OC5OCCC5c4c3Oc2c1OC,"MORI,H, SUGIE,S, YOSHIMI,N, KITAMURA,J, NIWA,M, HAMASAKI,T ANDKAWAI,K, GENOTOXIC EFFECTS OF A VARIETY OF STERIGMATOCYSTIN-RELATED COMPOUNDS INTHE HEPATOCYTE/DNA-REPAIR TEST AND THE SALMONELLA MICROSOME ASSAY, MUTAT. RES.173(3):217-222, 1986"
+9005-65-6,VITIC,0,-1,,CCCCCCCC\C=C\CCCCCCCC(=O)OCCOCC1(OCCOC)OCC(OCCOC)C1OCCOC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+101-61-1,VITIC,1,-1,,CN(C)c1ccc(Cc2ccc(cc2)N(C)C)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+584-48-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc(Br)c(c1)[N+](=O)[O-],"KERKLAAN,PRM, BOUTER,S, TE KOPPELE,JM, VERMEULEN,NPE, VAN BLADEREN,PJAND MOHN,GR,MUTAGENICITY OF HALOGENATED AND OTHER SUBSTITUTED DINITROBENZENES INSALMONELLA TYPHIMURIUM TA100 AND DERIVATIVES DEFICIENT IN GLUTATHIONE(TA100/GSH-) AND NITROREDUCTASE (TA100NR), MUTAT. RES. 176(2):171-180,1987"
+32861-85-1,EPA1,0,-1,,COc1cc(Oc2ccc(Cl)cc2Cl)cc(c1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2185-92-4,VITIC,1,-1,,Nc1ccccc1c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+622-96-8,EPA1,0,-1,,CCc1ccc(C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+188970-83-4,CCRIS,1,-1,,Oc1cccc2c1c(cc3[nH]c4ccc5ccccc5c4c23)[N+](=O)[O-],"XUE,W, LADOW,K AND WARSHAWSKY,D, SYNTHESIS, CHARACTERIZATION, ANDMUTAGENICITY OF NITRATED 7H-DIBENZO[C,G]CARBAZOLE AND ITS PHENOLIC DERIVATIVES,CHEM. RES. TOXICOL. 10(4):432-438, 1997"
+163275-61-4,CCRIS,1,-1,,Fc1ccc2ccc3cccnc3c2c1,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+145627-68-5,CCRIS,1,-1,,OC1C=Cc2c(ccc3c4CCCc4ccc23)C1O,"PAPAPARASKEVA-PETRIDES,C, IOANNIDES,C, BOYD,GW, YOUNG,RJ, HARVEY,RGAND COOMBS, MM, THE MUTAGENICITY OF CHEMICALLY SYNTHESIZED METABOLITES OF16,17-DIHYDRO-15H-CYCLOPENTA[A]PHENANTHRENE AND ITS CARCINOGENIC 11-METHYLHOMOLOG, MUTAGENESIS 8(4):307-310, 1993"
+106323-85-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc(c2ccc(c(c2)[N+](=O)[O-])[N+](=O)[O-])c(c1)[N+](=O)[O-],"HIRAYAMA,T, IGUCHI,K"
+NOCAS_M64,EPA1,1,-1,,CC(=C[C@H]1[C@H](C(=O)OCc2oc(CC#C)cc2)C1(C)C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133762-81-9,CCRIS,1,-1,,Nc1nc(Cl)c2ncn(CC(O)CN=N#N)c2n1,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+86-95-3,EPA3,1,-1,,Oc1cc(O)c2ccccc2n1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+102-07-8,EPA1,0,-1,"CARBANILI",O=C(Nc1ccccc1)Nc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39860-12-3,EPA1,1,-1,,Cc1ccc2c(c1)nc(N)n2C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+121-39-1,EPA3,0,-1,,CCOC(=O)[C@@H]1O[C@H]1c2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+79-08-3,VITIC,1,-1,,OC(=O)CBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+158729-29-4,CCRIS,0,-1,,Clc1cc(Cl)cc(NS(=O)(=O)c2cccc3cccnc23)c1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+109-78-4,VITIC,0,-1,,OCCC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+159092-67-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3c(cccc3c2c1)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+79-44-7,VITIC,1,-1,,CN(C)C(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+166546-19-6,CCRIS,0,-1,,CN1CCN(CC1)c2ccc3[nH]c(nc3c2)c4ccc5[nH]c(nc5c4)c6ccc(cc6)N(CCCl)CCCl,"FERGUSON,LR AND DENNY,WA, MICROBIAL MUTAGENIC EFFECTS OF THE DNA MINORGROOVE BINDER PIBENZIMOL (HOECHST 33258) AND A SERIES OF MUSTARD ANALOGS, MUTAT.RES. 329(1):19-27, 1995"
+52-86-8,EPA1,0,-1,"HALOPERID",OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c3ccc(Cl)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70458-92-3,EPA1,1,-1,"PEFLOXACI,PEFLOXMES",CCN1C=C(C(=O)O)C(=O)c2cc(F)c(cc12)N3CCN(C)CC3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18636-89-0,CCRIS,0,-1,,[O-][n+]1cc2ccccc2cn1,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+77-65-6,VITIC,0,-1,"CARBROMAL",CCC(Br)(CC)C(=O)NC(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+69658-14-6,EPA3,1,-1,,CCOC(=O)CSc1ccc2c3ccccc3C(=O)c4cccc1c24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M33,EPA1,1,-1,,CC(=O)Nc1ccc(cc1)[C@H]2O[C@H]2C(=O)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61734-88-1,EPA3,1,-1,,CCN(CCCO)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+133762-86-4,CCRIS,1,-1,,NC1=NC(=O)N(CC(O)CN=N#N)C=C1,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+25013-15-4,VITIC,0,-1,,Cc1ccc(C=C)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+108893-54-5,CCRIS,0,-1,,CC(=O)OC1C2CC(C)(C)CC2=C(C=O)C3(CC13C)C=O,"ANKE,H, STERNER,O AND STEGLICH,W, STRUCTURE-ACTIVITY RELATIONSHIPS FORUNSATURATED DIALDEHYDES. 3. MUTAGENIC, ANTIMICROBIAL, CYTOTOXIC, AND PHYTOTOXICACTIVITIES OF MERULIDIAL DERIVATIVES, J. ANTIBIOT. 42(5):738-744,1989"
+3989-90-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(ccc3c4ccccc4ccc23)c1,"YU,S, HERRENO-SAENZ,D, MILLER,DW, KADLUBAR,FF AND FU,PP, MUTAGENICITYOF NITRO- POLYCYCLIC AROMATIC HYDROCARBONS WITH THE NITRO SUBSTITUENT SITUATEDAT THE LONGEST MOLECULAR AXIS, MUTAT. RES. 283(1):45-52, 1992"
+7704-40-7,EPA1,1,-1,,Nc1ccc2nc3ccc(N)cc3nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M79,EPA1,1,-1,,C[C@@H]1c2ccccc2c3ccc(C)cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26946-33-8,CCRIS,1,-1,,Nc1ccc(Cc2ccc(N)cc2[N+](=O)[O-])c(c1)[N+](=O)[O-],"MESSERLY,EA, FEKETE,JE, WADE,DR AND SINSHEIMER,JE,STRUCTURE-MUTAGENICITY RELATIONSHIP OF BENZIDINE ANALOGUES, ENVIRON. MOL.MUTAGEN. 10:263-274, 1987"
+53-86-1,VITIC,0,-1,"CHINO-137,INDOMEARG,INDOMEMEG,INDOMETNA,IMDOMETIA,INDOMELYS",COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c3ccc(Cl)cc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+69533-68-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(CCc3cc(ccc23)[N+](=O)[O-])c1,"HIRAYAMA,T, WATANABE,T, AKITA,M, SHIMOMURA,S, FUJIOKA,Y, OZASA,S ANDFUKUI,S, RELATIONSHIPS BETWEEN STRUCTURE OF NITRATED ARENES AND THEIRMUTAGENICITY IN SALMONELLA TYPHIMURIUM, 2- AND 2,7-NITRO SUBSTITUTED FLUORENE,PHENANTHRENE AND PYRENE, MUTAT. RES. 209(1-2):67-74, 1988"
+150446-04-1,CCRIS,1,-1,,Cc1c(Cn2ccnc2)c3cc(ccc3n1Cc4ccccc4)[N+](=O)[O-],"HRELIA,P, MOROTTI,M, VIGAGNI,F, BURNELLI,S, GARUTI,L, SABATINO,P ANDCANTELLI-FORTI,G, SYNTHESIS OF A SERIES OF 5-NITRO-(BENZIMIDAZOLES AND INDOLES)AS NOVEL ANTIMYCOTICS AND EVALUATION AS GENOTOXINS IN THE AMES TEST, MUTAGENESIS8(3):183-188, 1993"
+146795-45-1,CCRIS,1,-1,,[O-][N+](=O)c1cccc(NC(=O)c2csc(c2)[N+](=O)[O-])c1,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+627-18-9,VITIC,1,-1,,OCCCBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2210-28-8,VITIC,0,-1,,CCCOC(=O)C(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105467-67-2,EPA1,0,-1,,Oc1cccc2c1ccc3nc4ccc5ccccc5c4cc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M390,EPA1,0,-1,,CCCC[C@@H](CC)COP(OC[C@H](CC)CCCC)OC[C@H](CC)CCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117929-12-1,CCRIS,1,-1,,[O-][N+](=O)c1cc2CCc3cc(cc4ccc(c1)c2c34)[N+](=O)[O-],"HIRAYAMA,T, WATANABE,T, AKITA,M, SHIMOMURA,S, FUJIOKA,Y, OZASA,S ANDFUKUI,S, RELATIONSHIPS BETWEEN STRUCTURE OF NITRATED ARENES AND THEIRMUTAGENICITY IN SALMONELLA TYPHIMURIUM, 2- AND 2,7-NITRO SUBSTITUTED FLUORENE,PHENANTHRENE AND PYRENE, MUTAT. RES. 209(1-2):67-74, 1988"
+80-46-6,VITIC,0,-1,,CCC(C)(C)c1ccc(O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+127-18-4,VITIC,0,-1,"TETRACETH",ClC(=C(Cl)Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+114717-14-5,CCRIS,1,-1,,NC(Cn1ccnc1)C(=O)O,"ZOEHRER,E, ALBERTINI,S, GOCKE,E AND KNASMUELLER,S, MUTATION INDUCTIONAND MUTATION SPECTRA OF S. TYPHIMURIUM TA100 AFTER EXPOSURE TO ISOHISTIDINES,MUTAT. RES. 356(2):155-161, 1996"
+28108-99-8,VITIC,0,-1,,CC(C)c1ccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+37574-47-3,CCRIS,1,-1,,O1C2C1c3cc4ccccc4c5ccc6cccc2c6c35,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+779-02-2,EPA1,1,-1,,Cc1c2ccccc2cc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109-43-3,EPA1,0,-1,"DIBUTSEBA",CCCCOC(=O)CCCCCCCCC(=O)OCCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50648-96-9,CCRIS,0,-1,,CC(NC(=O)COc1ccc(Cl)cc1Cl)C(=O)O,"RASHID,KA, BABISH,JG AND MUMMA,RO, POTENTIAL OF2,4-DICHLOROPHENOXYACETIC ACID COJUGATES AS PROMUTAGENS IN THESALMONELLA/MICROSOME MUTAGENICITY TEST, J. ENVIRON. SCI. HEALTH. PART BB19(8-9):689-701, 1984"
+35281-34-6,EPA3,1,-1,,C1Cc2ccc3cc4CCCc5ccc6cc(C1)c2c3c6c45,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+27113-22-0,EPA1,0,-1,"DR0027235",CCCCCCCC(=O)CCc1ccc(O)c(OC)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3311-98-6,CCRIS,1,-1,"BA-30515",[O-][N+](=O)c1cnc(NC(=O)NCCCl)s1,"HOF,H, MUTAGENIC ACTIVITIES OF NITROTHIAZOLE DERIVATIVES, ZENTRALBL.BAKTERIOL., MIKROBIOL. HYG., ABT. 1, ORIG. B 181(1-2):64-70, 1985"
+84-64-0,VITIC,0,-1,,CCCCOC(=O)c1ccccc1C(=O)OC2CCCCC2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+114460-41-2,CCRIS,1,-1,,CCc1nc2c(ccc3ccc4ccc(O)cc4c23)[nH]1,"FRIESEN,M, O'NEILL,IK, MALAVEILLE,C, GARREN,L, HAUTEFEUILLE,A ANDBARTSCH,H, SUBSTITUTED HYDROXYPHENANTHRENES IN OPIUM PYROLYSATES IMPLICATED INOESOPHAGEAL CANCER"
+88-95-9,EPA1,1,-1,,ClC(=O)c1ccccc1C(=O)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19655-56-2,CCRIS,1,-1,,CCc1cccc2cccnc12,"SMITH,CJ, HANSCH,C AND MORTON,MJ, QSAR TREATMENT OF MULTIPLETOXICITIES: THE MUTAGENICITY AND CYTOTOXICITY OF QUINOLINES, MUTAT. RES.379(2):167-175, 1997"
+330-54-1,EPA1,1,-1,"DIURON",CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-74-9,EPA3,1,-1,,Cc1ccc(N)cc1Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+602-87-9,EPA2,1,-1,,[O-][N+](=O)c1ccc2CCc3cccc1c23,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+952-23-8,VITIC,1,-1,"PROFLAVIN,PROFLAHCL,PROFLAVSU",Nc1ccc2cc3ccc(N)cc3nc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24143-08-6,CCRIS,1,-1,,CC(=O)NC1=NC(=NOC1)c2oc(cc2)[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+2255-50-7,CCRIS,1,-1,"ROBUSTINE",COc1c2ccoc2nc3c(O)cccc13,"KLIER,B AND SCHIMMER,O, MICROSOMAL METABOLISM OF DICTAMNINE:IDENTIFICATION OF METABOLITES AND EVALUATION OF THEIR MUTAGENICITY IN SALMONELLATYPHIMURIUM: MUTAGENESIS 14(2):181-185, 1999"
+75453-80-4,CCRIS,1,-1,,OC1C=CC=CC1O,"STARK,AA AND RASTETTER,WH, STRUCTURE-ACTIVITY RELATIONSHIPS IN THEMUTAGENICITY AND CYTOTOXICITY OF PUTATIVE METABOLITES AND RELATED ANALOGS OFBENZENE DERIVED FROM THE VALENCE TAUTOMERS BENZENE OXIDE AND OXEPIN, ENVIRON.MOL. MUTAGEN. 28(3):284-293, 1996"
+599-64-4,CCRIS,0,-1,,CC(C)(c1ccccc1)c2ccc(O)cc2,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+138835-36-6,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3c4ccccc4nc5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+130-26-7,VITIC,0,-1,"CLIOQUINO",Oc1c(I)cc(Cl)c2cccnc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1513-65-1,EPA1,0,-1,,Fc1cccc(F)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+149022-16-2,CCRIS,1,-1,"HARMOL",Cc1nccc2c3ccc(O)cc3[nH]c12,"PICADA,JN, DA SILVA,KVCL, ERDTMANN,B, HENRIQUES,AT AND HENRIQUES,JAP,GENOTOXIC EFFECTS OF STRUCTURALLY RELATED BETA-CARBOLINE ALKALOIDS, MUTAT. RES.379(2):135-149, 1997"
+59-50-7,VITIC,0,-1,"CHLOROCRE",Cc1cc(O)ccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+61734-90-5,EPA3,1,-1,,CCCCN(CC(=O)CC)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+92-88-6,EPA1,0,-1,"DR9712871",Oc1ccc(cc1)c2ccc(O)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7144-65-2,CCRIS,1,-1,,C(Oc1ccccc1c2ccccc2)C3CO3,"ROSMAN,LB, CHAKRABORTY,PK, MESSERLY,EA AND SINSHEIMER,JE, MUTAGENICITYOF AROMATIC GLYCIDYL ETHERS WITH SALMONELLA, MUTAT. RES. 206(1):115-125,1988"
+24280-93-1,GENETOX,1,-1,"MYCOPHENO",COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)\CCC(=O)O,"J PHARMACOL EXP THER 200:1-9,1977"
+873-75-6,EPA1,0,-1,"BRBENZALP",OCc1ccc(Br)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54292-59-0,CCRIS,0,-1,,OCCN(CCO)c1ccc(cc1)N=Nc2cccnc2,"SHAHIN,MM, MUTAGENICITY OF STRUCTURALLY RELATED PHENYLAZO-3-PYRIDINESIN SALMONELLA TYPHIMURIUM, CELL BIOL. TOXICOL. 9(1):33-47, 1993"
+129541-01-1,CCRIS,1,-1,,COC(=O)CNC(=O)C(CSCCCl)NC(=O)CCC(N)C(=O)O,"HUMPHREYS,WG, KIM,DH, CMARIK,JL, SHIMADA,T AND GUENGERICH,FP,COMPARISON OF THE DNA-ALKYLATING PROPERTIES AND MUTAGENIC RESPONSES OF A SERIESOF S-(2-HALOETHYL)-SUBSTITUTED CYSTEINE AND GLUTATHIONE DERIVATIVES,BIOCHEMISTRY 29(45):10342-10350, 1990"
+86-40-8,EPA1,1,-1,"ACRIFLAVI",C[n+]1c2cc(N)ccc2cc3ccc(N)cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98033-24-0,CCRIS,1,-1,,Cc1oc2c(ccc3ccc4ccc(O)cc4c23)n1,"FRIESEN,M, O'NEILL,IK, MALAVEILLE,C, GARREN,L, HAUTEFEUILLE,A ANDBARTSCH,H, SUBSTITUTED HYDROXYPHENANTHRENES IN OPIUM PYROLYSATES IMPLICATED INOESOPHAGEAL CANCER"
+72848-48-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2nc3cc(ccc3nc2c1)[N+](=O)[O-],"WATANABE,T, HANASAKI,Y, HIRAYAMA,T AND FUKUI,S, MUTAGENICITY OF NITRO-AND AMINO-SUBSTITUTED PHENAZINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.225(3):75-82, 1989"
+83504-80-7,EPA1,1,-1,,O=Nc1ccc(Sc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92-24-0,EPA1,1,-1,"NAPHTHACE",c1ccc2cc3cc4ccccc4cc3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115-77-5,EPA1,0,-1,"PENTAEROL",OCC(CO)(CO)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63166-73-4,CCRIS,0,-1,,CC1COC2(CC1OC(=O)\C=C\c3ccccc3)OC4CC(CCC4C25CO5)C(=O)OC6OC(C)C(O)C(OC(=O)C)C6OC7OC(C)C(O)C(OC(=O)C)C7O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y86"
+108-11-2,CCRIS,0,-1,,CC(C)CC(C)O,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+126420-95-9,CCRIS,1,-1,,Cc1cc(C)c(CN2C3C2c4ccccc4c5ccccc35)c(C)c1,"ROLL,M, SHTELZER,S, STARK,AA AND BLUM,J, STRUCTURE-ACTIVITYRELATIONSHIPS IN MUTAGENICITY AND IN NUCLEOPHILIC RING OPENING OFN-(ARYLMETHYL)PHENANTHRENE 9,10-IMINES, MUTAGENESIS 5(1):25-30, 1990"
+188107-71-3,CCRIS,1,-1,,Cc1cc(c(C)c2c3ccccc3n(C)c12)[N+](=O)[O-],"ANDRE,V, BIOSSART,C, SICHEL,F, GAUDUCHON,P, LE TALAER,JY, LANCELOT,JC,MERCIER,C, CHEMTOB,S, RAOULT,E AND TALLEC,A, MUTAGENICITY OF NITRO- ANDAMINO-SUBSTITUTED CARBAZOLES IN SALMONELLA TYPHIMURIUM. III. METHYLATEDDERIVATIVES OF 9H-CARBAZOLE, MUTAT. RES. 389(2-3):247-260, 1997"
+484-08-2,EPA1,1,-1,"KOKUSAGIN",COc1cc2nc3occc3c(OC)c2cc1OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6068-96-8,CCRIS,1,-1,,CCCOO,"BALL,JC, YOUNG,WC, WALLINGTON,TJ AND JAPAR,SM, MUTAGENIC PROPERTIES OFA SERIES OF ALKYL HYDROPEROXIDES, ENVIRON. SCI. TECHNOL. 26(2):397-399,1992"
+24099-25-0,CCRIS,0,-1,,COc1c(OCC2OC2(C)C)ccc3c(OC)c4ccoc4nc13,"PAULINI,H, WAIBEL,R AND SCHIMMER,O, MUTAGENICITY ANDSTRUCTURE-MUTAGENICITY RELATIONSHIPS OF FUROQUINOLINES, NATURALLY OCCURRINGALKALOIDS OF THE RUTACEAE, MUTAT. RES. 227(3):179-86, 1989"
+51938-16-0,GENETOX,1,-1,,CN(CCCCO)N=O,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+112022-09-0,EPA1,1,-1,,CN(C)CCNC(=O)C1=CC=CN2C(=O)c3ccccc3N=C12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38965-71-8,EPA1,1,-1,"ARISTOL1A",OC(=O)c1cc2OCOc2c3c4cccc(O)c4cc(c13)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89-83-8,EPA1,0,-1,"THYMOL",CC(C)c1ccc(C)cc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17479-19-5,CCRIS,0,-1,,CC(C)C1(NC(=O)C2CC3C(Cc4c[nH]c5cccc3c45)N(C)C2)OC6(O)C7CCCN7C(=O)C(Cc8ccccc8)N6C1=O,"DUBINI,F, BIGNAMI,P, ZANOTTI,A AND COPPI,G,MUTAGENICITY STUDIES ONDIHYDRO- ERGOCRISTINE, DRUGS EXP. CLIN. RES. 16(6):255-261, 1990"
+92911-19-8,CCRIS,1,-1,,CNc1ccc(cc1)N=Nc2ccc3ncsc3c2,"ASHBY,J, CALLANDER,RD, LEFEVRE,PA, PATON,D AND FISHWICK,B,MUTAGENICITY TO SALMONELLA OF THE MONOMETHYLAMINO AND N-CYANOETHYL ANALOGS OF 4-DIMETHYLAMINOAZOBENZENE (DAB) AND 6-DIMETHYLAMINOPHENYLAZOBENZTHIAZOLE (6BT),MUTAT. RES. 128(1):11-16, 1984"
+91642-47-6,CCRIS,1,-1,,CCCCCOC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+304-20-1,CCRIS,1,-1,"HYDRALAZI,HYDRALHCL,HYDRALAZS",NNc1nncc2ccccc12,"KITAMURA,J, MORI,H, SUGIE,S AND KAWAI,K, GENETIC TOXICITY OF SEVERALANTIHYPERTENSIVE DRUGS POSSESSING A HYDRAZINE GROUP, RES. COMMUN. CHEM. PATHOL.PHARMACOL. 49(3):415-422, 1985"
+2206-89-5,VITIC,1,-1,,ClCCOC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5910-89-4,EPA1,0,-1,,Cc1nccnc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25148-68-9,VITIC,1,-1,,CNc1ccccc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+141511-29-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(CCc3c4CCCCc4ccc23)c1,"YU,S, HERRENO-SAENZ,D, MILLER,DW, KADLUBAR,FF AND FU,PP, MUTAGENICITYOF NITRO- POLYCYCLIC AROMATIC HYDROCARBONS WITH THE NITRO SUBSTITUENT SITUATEDAT THE LONGEST MOLECULAR AXIS, MUTAT. RES. 283(1):45-52, 1992"
+127924-00-9,CCRIS,1,-1,,OC(CC(=O)OCCBr)(CC(=O)OCCBr)C(=O)OCCBr,"MIN,S, CHAIGNEAU,M, CALLAIS,F AND FESTY,B, MUTAGENIC ACTIVITY OFORGANIC ESTERS LIKELY TO BE FORMED FROM THE 2-BROMOETHANOL GENERATED DURINGFUMIGATION WITH ETHYLENE OXIDE, ANN. PHARM. FR. 47(5):266-275, 1990"
+3778-73-2,EPA1,1,-1,,ClCCN[P@]1(=O)OCCCN1CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15088-70-7,EPA1,0,-1,,CCOC(=O)CNC(=O)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+526-75-0,VITIC,0,-1,,Cc1cccc(O)c1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M354,EPA1,0,-1,,CC[C@H](O)CN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+36519-91-2,CCRIS,1,-1,,Clc1ccc(CC2CO2)cc1,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+105-45-3,EPA1,0,-1,,COC(=O)CC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17886-23-6,CCRIS,1,-1,,CCN1CCN=N1,"SMITH,RH,JR, WLADKOWSKI,BD, TAYLOR,JE, THOMPSON,EJ, PRUSKI,B,KLOSE,JR, ANDREWS,AW AND MICHEJDA,CJ, ACID-CATALYZED DECOMPOSITION OF1-ALKYLTRIAZOLINES: A MECHANISTIC STUDY, J. ORG. CHEM. 58(8):2097-2103,1993"
+16048-37-6,EPA1,1,-1,,O=C1c2ccccc2C(=O)c3c(cccc13)[N+]#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99520-64-6,CCRIS,1,-1,,O1C2C1c3ccc4c5ccccc5c6cc7cccc2c7c3c46,"RICE,JE, COLEMAN,DT, HOSTED,TJ JR, LAVOIE,EJ, MCCAUSTLAND,DJ ANDWILEY,JC JR, IDENTIFICATION OF MUTAGENIC METABOLITES OF INDENO[1,2,3-CD]PYRENEFORMED IN VITRO WITH RAT LIVER ENZYMES, CANCER RES. 45(11, PT. 1):5421-5425,1985"
+94-82-6,EPA1,0,-1,"24-DB",OC(=O)CCCOc1ccc(Cl)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59-02-9,CCRIS,0,-1,,CC(C)CCCC(C)CCCC(C)CCCC1(C)CCc2c(C)c(O)c(C)c(C)c2O1,"PRIVAL,MJ, SIMMON,VF AND MORTELMANS,KE, BACTERIAL MUTAGENICITY TESTINGOF 49 FOOD INGREDIENTS GIVES VERY FEW POSITIVE RESULTS, MUTAT. RES.260(4):321-329, 1991"
+1748-81-8,CCRIS,0,-1,,CC(=O)CCC1C2CC3C(CC12C)OC(=O)C3=C,"STUPPNER,H, STUPPNER,H AND RODRIGUEZ,E, A NOVEL ENOL-PSEUDOGUAIANOLIDEFROM PSILOSTROPHE COOPERI, PHYTOCHEMISTRY 27(8):2681-2684, 1988"
+148-65-2,EPA1,0,-1,"CLPYRILEN,CLPYRILCI",CN(C)CCN(Cc1ccc(Cl)s1)c2ccccn2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+594-71-8,EPA1,1,-1,,CC(C)(Cl)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4457-41-4,EPA1,1,-1,,[O-][N+](=O)c1ccc(COC(=O)c2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+555-66-8,EPA1,1,-1,"SHOGAOL6",CCCCC\C=C\C(=O)CCc1ccc(O)c(OC)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63-74-1,EPA1,0,-1,"ACETYLMBS,SULFANLNA,SULFANILA,SULFANIAL,SULFANIBZ,SULFANMAN",Nc1ccc(cc1)S(=O)(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+504-29-0,VITIC,0,-1,"AMINOPYR2",Nc1ccccn1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24549-06-2,VITIC,1,-1,,CCc1cccc(C)c1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+619-89-6,CCRIS,1,-1,,OC(=O)\C=C\c1ccc(cc1)[N+](=O)[O-],"SHIMIZU,M AND YANO,E, MUTAGENICITY OF MONO-NITROBENZENE DERIVATIVES INTHE AMES TEST AND REC ASSAY, MUTAT. RES. 170(1-2):11-22, 1986"
+6795-23-9,CCRIS,1,-1,"AFLATOXM1",COc1cc2OC3OC=CC3(O)c2c4OC(=O)C5=C(CCC5=O)c14,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+38915-14-9,EPA1,1,-1,,CCN(CCCl)CCCNc1c2ccccc2nc3c(OC)cccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+612-64-6,VITIC,0,-1,,CCN(N=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+39208-00-9,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2ccc(C=O)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75607-61-3,CCRIS,1,-1,,NC(CCC(=O)NC(CSCCCl)NC(=O)CC(=O)O)C(=O)O,"HUMPHREYS,WG, KIM,DH, CMARIK,JL, SHIMADA,T AND GUENGERICH,FP,COMPARISON OF THE DNA-ALKYLATING PROPERTIES AND MUTAGENIC RESPONSES OF A SERIESOF S-(2-HALOETHYL)-SUBSTITUTED CYSTEINE AND GLUTATHIONE DERIVATIVES,BIOCHEMISTRY 29(45):10342-10350, 1990"
+47165-04-8,EPA1,0,-1,"102-198",NC(=N)c1ccc(cc1)c2cc3ccc(cc3[nH]2)C(=N)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97-24-5,VITIC,0,-1,"FENTICLOR",Oc1ccc(Cl)cc1Sc2cc(Cl)ccc2O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78914-75-7,EPA1,1,-1,,CN(C)c1ccc(cc1)N=Nc2ccc(COC(=O)C)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55676-18-1,CCRIS,0,-1,,CC(=O)Nc1ccc2[nH]c3c(C)c4ccncc4c(C)c3c2c1,"LEFRANCOIS,M, LESCOT,E, PSAUME,B, MALVY,C, GANSSER,C, VIRLIZIER,H,BOISSART,C AND GAUDUCHON,P, ON 9-AMINO DERIVATIVES OF ELLIPTICINE AND ACOMPARATIVE STUDY ON DNA APURINIC SITE CLEAVAGE AND MUTAGENICITY, FARMACO47(9):1197-1206, 1992"
+106532-60-9,CCRIS,1,-1,,CC(=O)\N=C\1/SN(C(=O)C)c2ccc(cc12)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+148749-29-5,CCRIS,0,1,,CC(=O)OC1(CCC2C3C(CCC12C)C4(C)C5CC5C(=O)C=C4C6(Cl)CC36)C(=O)C,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+100924-64-9,EPA1,1,-1,,OS(=O)(=O)OCc1cc2ccccc2c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+31297-82-2,EPA3,1,-1,,OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2ccc3C(=O)c4ccccc4C(=O)c3c2O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+139259-91-9,CCRIS,1,-1,,COc1ccc(CON(OC(=O)C)C(=O)c2ccccc2)cc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+33703-08-1,EPA1,0,-1,,CC(C)CCCCCCOC(=O)CCCCC(=O)OCCCCCCC(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+533-30-2,CCRIS,1,-1,,Nc1ccc2ncsc2c1,"SATO,G ASAKURA,S HAKURA,A TSUTSUI-HIYOSHI,Y KOBAYASHI,N ANDTSUKIDATE,K, ASSESSMENT OF POTENTIAL MUTAGENIC ACTIVITIES OF A NOVELBENZOTHIAZOLE MAO-A INHIBITOR E2011 USING SALMONELLA TYPHIMURIUM YG1029, MUTAT.RES. 472(1-2):163-169, 2000"
+311-45-5,EPA1,1,-1,"PARAOXON",CCOP(=O)(OCC)Oc1ccc(cc1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+135294-99-4,CCRIS,0,-1,,OCc1cccc2c3cccc4cccc(c12)c34,"BALL,JC, AND YOUNG,WC, AMES ASSAY MUTAGENICITY AND ELECTRONICSTRUCTURE CALCULATIONS OF BROMOMETHYLFLUORANTHENES, CHLOROMETHYLFLUORANTHENES,AND HYDROXYMETHYLFLUORANTHENES, CHEM.-BIOL. INTERACT. 77(3):291-302,1991"
+108278-72-4,CCRIS,1,-1,,NC(=O)N(CCCC(=O)O)N=O,"JANZOWSKI,C, JACOB,D, HENN,I, ZANKL,H, POOL-ZOBEL,BL, WIESSLER,M ANDEISENBRAND,G,MECHANISM OF ACTION OF THE URINARY BLADDER CARCINOGENN-NITROSOBUTYL-3-CARBOXYPROPYLAMINE, IARC SCI. PUBL. 105(RELEVANCE HUM. CANCERN-NITROSO COMPD., TOB. MYCOTOXINS):332-338, 1991"
+272-16-2,CCRIS,0,-1,,c1ccc2sncc2c1,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+118745-11-2,CCRIS,1,-1,,ON(C=O)c1ccc(\C=C\c2ccccc2)cc1,"WANG,CY, LINSMAIER-BEDNAR,EM, LEE,MS AND KING,CM, MUTAGENICITIES OFN-ACYL-N-ARYLHYDROXYLAMINES FOR SALMONELLA, CHEM-BIOL. INTERACT.67(3-4):215-223, 1988"
+NOCAS_M324,EPA1,0,-1,,CN1CC[C@@H](CN2c3ccccc3Sc4ccccc24)C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+33953-73-0,EPA3,1,-1,,Oc1c2ccccc2c3ccc4cccc5ccc1c3c45,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+51938-15-9,EPA3,1,-1,,CCCCN(CC(=O)C)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+56-40-6,VITIC,0,-1,"GLYCINECA,CUGLYCINA,DIOHALUMI,FERROGLYS,FEGLYCSUL,GLYCINEMG,DR9600995",NCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+593-08-8,VITIC,0,-1,,CCCCCCCCCCCC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+151910-74-6,CCRIS,0,-1,,OC1C=Cc2c(ccc3cc4c5C=CC(O)C(O)c5ccc4cc23)C1O,"PLATT,KL AND SCHOLLMEIER,M, BISDIHYDRODIOLS, RATHER THAN DIHYDRODIOLOXIDES, ARE THE PRINCIPAL MICROSOMAL METABOLITES OF TUMORIGENICTRANS-3,4-DIHYDROXY-3,4-DIHYDRODIBENZ[A,H]ANTHRACENE,CHEM. RES. TOXICOL.7(1):89-97, 1994"
+4273-73-8,CCRIS,0,-1,,COC(=O)\C(=C\C=C\C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C)\C)\C,"AZUINE,MA, GOSWAMI,UC, KAYAL,JJ AND BHIDE,SV, ANTIMUTAGENIC ANDANTICARCINOGENIC EFFECTS OF CAROTENOIDS AND DIETARY PALM OIL, NUTR. CANCER17(3):287-295, 1992"
+108354-48-9,EPA1,1,-1,,Cc1cc2nccnc2c3nc(N)n(C)c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89-25-8,VITIC,0,-1,"NORPHENAZ",CC1=NN(C(=O)C1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M102,EPA1,1,-1,,C[C@@H]1COc2c(N3CCN(C)CC3)c(F)c(C(=O)O)c4C(=O)C=CN1c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51-98-9,CCRIS,0,1,,CC(=O)OC1(CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C)C#C,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+32425-83-5,EPA3,1,-1,,O=C1CCc2ccc3c(ccc4ccccc34)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+131862-17-4,CCRIS,1,-1,,CN(C)CCNC(=O)c1cc2ccccc2c3cccnc13,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+138805-30-8,CCRIS,1,-1,,Cc1ccc(N)cc1N=[N+]([O-])c2cc(N)ccc2C,"SAYAMA,M, MORI,M, NAKADA,Y, KAGAMIMORI,S AND KOZUKA,H, METABOLISM OF2,4-DINITROTOLUENE BY SALMONELLA TYPHIMURIUM STRAINS TA98, TA98NR ANDTA98/1,8-DNP6, AND MUTAGENICITY OF THE METABOLITES OF 2,4-DINITROTOLUENE ANDRELATED COMPOUNDS TO STRAINS TA98 AND TA100, MUTAT. RES. 264(3):147-153,1991"
+110-83-8,CCRIS,0,-1,,C1CCC=CC1,"SYCHEVA,LP ZHOLDAKOVA,ZI POLYAKOVA,EE LUKMANOVA,NE AKHAL'TSEVA,LV ANDZHURKOV,VS,MUTAGENIC ACITIVITY OF CYCLOHEXENE AND PRODUCTS OF ITS CHLORINATION,BULL. EXP. BIOL. MED. 129(6):581-583, 2000"
+105427-00-7,CCRIS,1,-1,,CC1(CO1)C(=O)NCc2ccccc2,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+129286-36-8,CCRIS,1,-1,,Fc1ccc2c3c(ccc4ccccc34)c5cccc1c25,"WEYLAND,EH, HE,ZM, GHODRATI,F, WU,Y, MARSHALL,MV AND LAVOIE,EJ, EFFECTOF FLUORINE SUBSTITUTION ON BENZO[J]FLUORANTHENE GENOTOXICITY, CHEM.- BIOL.INTERACT. 84(1):37-53, 1992"
+2415-85-2,EPA1,0,-1,,CC(=O)CC(=O)Nc1ccc(C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35287-69-5,CCRIS,0,-1,"ERGOCHROM",COC(=O)C12Oc3ccc(c(O)c3C(=C1C(=O)CC(C)C2O)O)c4ccc5OC6(C(O)C(C)CC(=O)C6=C(O)c5c4O)C(=O)OC,"TAKAHASHI,H, OSADA,K, YAZAKI,H AND KIMURA,S, DETECTION OF MUTAGENICACTIVITY OF MYCOTOXINS BY SALMONELLA TYPHIMURIUM/MICROSOME ASSAY AND ULTRA-WEAKCHEMILUMINESCENCE, 45(2):169-173, 1992"
+NOCAS_M569,EPA1,0,-1,,C[C@H]1C[C@H](CC(C)(C)C1)OC(=O)c2ccccc2O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+999-55-3,VITIC,0,-1,,C=CCOC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+393-52-2,VITIC,1,-1,,Fc1ccccc1C(=O)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1025-15-6,VITIC,0,-1,,C=CCN1C(=O)N(CC=C)C(=O)N(CC=C)C1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+127183-64-6,VITIC,1,-1,,Nc1ccc2c(no[n+]2[O-])n1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+150445-99-1,CCRIS,0,-1,,[O-][N+](=O)c1cccc(CO\N=C\c2nc3cc(ccc3n2Cc4ccc(F)cc4)[N+](=O)[O-])c1,"HRELIA,P, MOROTTI,M, VIGAGNI,F, BURNELLI,S, GARUTI,L, SABATINO,P ANDCANTELLI-FORTI,G, SYNTHESIS OF A SERIES OF 5-NITRO-(BENZIMIDAZOLES AND INDOLES)AS NOVEL ANTIMYCOTICS AND EVALUATION AS GENOTOXINS IN THE AMES TEST, MUTAGENESIS8(3):183-188, 1993"
+94223-87-7,CCRIS,0,-1,,Cc1ccc2nc3c(cc2c1)c4cccc5cccc3c45,"RAY,JK AND KAR,GK, ASSESSMENT OF THE MUTAGENIC ACTIVITY OF SOMEACENAPHTHO(1,2-B)QUINOLINES, CANCER LETT. 71(1-3):1-3, 1993"
+NOCAS_M538,EPA1,0,-1,,CCC[C@](C)(COC(=O)N)COC(=O)NC(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+27354-18-3,EPA3,1,-1,,CC(C)Nc1cccc2C(=O)c3ccccc3C(=O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+68-12-2,VITIC,0,-1,"DIMEFORMA",CN(C)C=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+26328-53-0,CCRIS,0,-1,"AMOSCANAT",[O-][N+](=O)c1ccc(Nc2ccc(cc2)N=C=S)cc1,"SHUBBER,EK, JACOBSON-KRAM,D AND WILLIAMS,JR, COMPARISON OF THE AMESASSAY AND THE INDUCTION OF SISTER CHROMATID EXCHANGES: RESULTS WITH TENPHARMACEUTICALS AND FIVE SELECTED AGENTS, CELL BIOL. TOXICOL. 2(3):379-399,1986"
+91254-97-6,CCRIS,1,-1,,Oc1cc2ccc(c3ccc4cccc1c4c23)[N+](=O)[O-],"SANGAIAH,R, RAMACHANDRAN,P, ZHANG,J AND BALL,LM, SYNTHESIS ANDBIOLOGICAL ACTIVITY OF METABOLITES OF ENVIRONMENTAL NITROARENES, POLYCYCLICAROMAT. COMPD. 11(1-4):283-290, 1996"
+133960-21-1,CCRIS,0,-1,,COC(=O)c1oc(NOC(=O)C)c(c2ccccc2)c1c3ccccc3,"SWAMINATHAN,S, HATCHER,JF, YAMAMOTO,K, TANAKA,A, ICHIKAWA,M ANDBRYAN,GT, MUTAGENICITY OF N- AND O-ACETYL DERIVATIVES OF METHYL 3,4-DIPHENYL-5-HYDROXYLAMINO-2-FUROATE AND N-HYDROXY-4-AMINOBIPHENYL IN SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 17(2):84-92, 1991"
+149996-82-7,EPA1,1,-1,,CCN(C=O)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80-13-7,VITIC,1,-1,"HALAZONE,HALAZONNA",OC(=O)c1ccc(cc1)S(=O)(=O)N(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3333-62-8,VITIC,0,-1,,O=C1Oc2cc(ccc2C=C1c3ccccc3)n4nc5ccc6ccccc6c5n4,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+50649-06-4,CCRIS,0,-1,,OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)COc3ccc(Cl)cc3Cl,"RASHID,KA, BABISH,JG AND MUMMA,RO, POTENTIAL OF2,4-DICHLOROPHENOXYACETIC ACID COJUGATES AS PROMUTAGENS IN THESALMONELLA/MICROSOME MUTAGENICITY TEST, J. ENVIRON. SCI. HEALTH. PART BB19(8-9):689-701, 1984"
+98-83-9,VITIC,0,-1,"DR0027316",CC(=C)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1010-93-1,CCRIS,1,-1,"METRONAC1",Cc1ncc([N+](=O)[O-])n1CC(=O)O,"CHACKO,M, NAGABHUSHAN,M, SARKAR,S AND BHIDE,SV, STUDIES ON THEPOSSIBLE MUTAGENIC ACTION OF METRONIDAZOLE, INDIAN J. EXP. BIOL. 25(4):240-243,1987"
+19077-98-6,EPA1,0,-1,"ACSULFAPY",CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2ccccn2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97-88-1,VITIC,0,-1,"DR0008872",CCCCOC(=O)C(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7241-98-7,CCRIS,0,-1,"AFLATOXG",COc1cc2OC3OCCC3c2c4OC(=O)C5=C(CCOC5=O)c14,"TAKAHASHI,H, OSADA,K, YAZAKI,H AND KIMURA,S, DETECTION OF MUTAGENICACTIVITY OF MYCOTOXINS BY SALMONELLA TYPHIMURIUM/MICROSOME ASSAY AND ULTRA-WEAKCHEMILUMINESCENCE, 45(2):169-173, 1992"
+553-97-9,EPA1,0,-1,,CC1=CC(=O)C=CC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M63,EPA1,1,-1,,O[C@@H]1OC(=O)C(=C1C(Cl)Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+130-01-8,CCRIS,0,-1,,C\C=C\1/CC(C)C(C)(O)C(=O)OCC2=CCN3CCC(OC1=O)C23,"YAMANAKA,H NAGAO,M AND SUGIMURA,T, MUTAGENICITY OF PYRROLIZIDINEALKALOIDS IN THE SALMONELLA/MAMMALIAN-MICROSOME TEST, MUTAT. RES. 68(3):211-216,1979"
+507-70-0,CCRIS,0,-1,,CC1(C)C2CCC1(C)C(O)C2,"AZIZAN,A AND BLEVINS,RD, MUTAGENICITY AND ANTIMUTAGENICITY TESTING OFSIX CHEMICALS ASSOCIATED WITH THE PUNGENT PROPERTIES OF SPECIFIC SPICES ASREVEALED BY THE AMES SALMONELLA/MICROSOMAL ASSAY, ARCH. ENVIRON. CONTAM.TOXICOL. 28(2): 248-258, 1995"
+99523-57-6,CCRIS,1,-1,,Cc1ccc2nsc(NC(=O)CCl)c2c1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+166546-18-5,CCRIS,0,-1,,CCN(CCCl)c1ccc(cc1)c2nc3cc(ccc3[nH]2)c4nc5cc(ccc5[nH]4)N6CCN(C)CC6,"FERGUSON,LR AND DENNY,WA, MICROBIAL MUTAGENIC EFFECTS OF THE DNA MINORGROOVE BINDER PIBENZIMOL (HOECHST 33258) AND A SERIES OF MUSTARD ANALOGS, MUTAT.RES. 329(1):19-27, 1995"
+141899-13-0,CCRIS,0,-1,,COc1cc2OC3(C)OC4OC4C3(C)c2c5OC(=O)C6=C(CCC6=O)c15,"IYER,RS, COLES,BF, RANEY,KD, THIER,R, GUENGERICH,FP AND HARRIS,TM, DNAADDUCTION BY THE POTENT CARCINOGEN AFLATOXIN B1: MECHANISTIC STUDIES, J. AM.CHEM. SOC. 116(5):1603-1609, 1994"
+NOCAS_M551,EPA1,0,-1,,CCCC[C@@H](CC)COC(=O)c1ccc(C(=O)OC[C@H](CC)CCCC)c(c1)C(=O)OC[C@H](CC)CCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+69658-16-8,EPA3,1,-1,,OS(=O)(=O)c1ccc(Oc2ccc3c4ccccc4C(=O)c5cccc2c35)cc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+131-12-4,CCRIS,0,-1,"PIMPINELL",COc1c(OC)c2occc2c3OC(=O)C=Cc13,"SCHIMMER,O, KIEFER,J AND PAULINI,H, INHIBITORY EFFECTS OFFUROCOUMARINS IN SALMONELLA TYPHIMURIUM TA98 ON THE MUTAGENICITY OF DICTAMNINEAND RUTACRIDONE, PROMUTAGENS FROM RUTA GRAVEOLENS L, MUTAGENESIS 6(6):501-506,1991"
+51330-27-9,CCRIS,0,-1,,CC1OC(OC2C(O)C(O)C(CO)OC2OC3C(O)C(O)C(OC3OC4CCC5(C)C(CCC6(C)C5CC=C7C8CC(C)(C)CC(O)C8(C)CCC67C)C4(C)CO)C(=O)O)C(O)C(O)C1O,"CZECZOT,H, RAHDEN-STARON,I, OLESZEK,W AND JURZYSTA,M, LACK OFMUTAGENIC ACTIVITY OF SAPONINS IN THE AMES TEST, ACTA BIOCHIM. POL. 40(1):74-76,1993"
+4671-93-6,CCRIS,1,-1,"BENZYSECN",N#C[Se]Cc1ccccc1,"MASLAT,AO AND KHALIL,AM, MUTAGENIC EFFECTS OF TWO SUSPECTEDANTICARCINOGENIC ORGANOSELENIUM COMPOUNDS IN SALMONELLA TYPHIMURIUM, TOXICOL.ENVIRON. CHEM. 33(1-2):23-29, 1991"
+940-14-7,EPA1,1,-1,,[O-][N+](=O)c1ccc(OC=C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+118745-13-4,CCRIS,1,-1,,CCC(=O)N(O)c1ccc2ccccc2c1,"WANG,CY, LINSMAIER-BEDNAR,EM, LEE,MS AND KING,CM, MUTAGENICITIES OFN-ACYL-N-ARYLHYDROXYLAMINES FOR SALMONELLA, CHEM-BIOL. INTERACT.67(3-4):215-223, 1988"
+107-31-3,VITIC,0,-1,,COC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+33779-70-3,EPA3,1,-1,"150C47",C[n+]1c(c2ccc(N)cc2)c3cc(N)ccc3c4ccc(N)cc14,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+60768-66-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2sncc2c1,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+687-47-8,VITIC,0,-1,,CCOC(=O)[C@H](C)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1162-65-8,VITIC,1,-1,,COc1cc2O[C@H]3OC=C[C@H]3c2c4OC(=O)C5=C(CCC5=O)c14,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+557-11-9,VITIC,1,-1,,NC(=O)NCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+64532-97-4,CCRIS,0,-1,,CCCCCCCCCc1ccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)cc1,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T AND MORTELMANS,K, SALMONELLAMUTAGENICITY TESTS: IV. RESULTS FROM THE TESTING OF 300 CHEMICALS, ENVIRON. MOL.MUTAGEN. 11(SUPPL.12):1-158, 1988"
+98-87-3,VITIC,1,-1,,ClC(Cl)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111990-50-2,CCRIS,1,-1,,C(Cc1cccc2ccccc12)C3CO3,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+55556-91-7,EPA3,1,-1,,O=NN1CCC(=O)CC1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+491-35-0,EPA1,1,-1,"LEPIDINE",Cc1ccnc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+138835-35-5,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3nc4ccccc4c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+140-64-7,VITIC,0,-1,"P-1266,P-1457,P-1511,P-1512,P-1513,P-1995,PENTAMIDI,PENTADMES,PENTAMISE",NC(=N)c1ccc(OCCCCCOc2ccc(cc2)C(=N)N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+989-38-8,EPA2,0,-1,,CCNc1cc2OC3=CC(=NCC)C(=CC3=C(c4ccccc4C(=O)OCC)c2cc1C)C,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+23165-19-7,EPA1,0,-1,,C[N+]1(C)CCOCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2650-18-2,CCRIS,1,-1,"BRIBLUFCF",CCN(Cc1cccc(c1)S(=O)(=O)O)c2ccc(cc2)C(=C3C=CC(=[N+](CC)Cc4cccc(c4)S(=O)(=O)O)C=C3)c5ccccc5S(=O)(=O)O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+141-46-8,EPA1,0,-1,"GLYCOLALD",OCC=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+66212-60-0,EPA3,1,-1,,O[C@@H]1[C@H]2O[C@H]2c3cc4ccc5cccc6ccc(c3[C@@H]1O)c4c56,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+98911-23-0,EPA1,1,-1,,CC(=O)N(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c2ccc(Oc3ccc(Cl)cc3)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+41037-13-2,CCRIS,1,-1,,Cc1cc(cc2ccccc12)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+1107-26-2,CCRIS,0,-1,"APOCARB8-",C\C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C)/C)\C=O,"AZUINE,MA, GOSWAMI,UC, KAYAL,JJ AND BHIDE,SV, ANTIMUTAGENIC ANDANTICARCINOGENIC EFFECTS OF CAROTENOIDS AND DIETARY PALM OIL, NUTR. CANCER17(3):287-295, 1992"
+102822-04-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc2C(=O)C(=O)c3cccc4ccc1c2c34,"EL-BAYOUMY,K AND HECHT,SS, MUTAGENICITY OF K-REGION DERIVATIVES OF1-NITROPYRENE, REMARKABLE ACTIVITY OF 1- AND3-NITRO-5H-PHENANTHRO[4,5-BCD]PYRAN-5-ONE, MUTAT. RES. 170(1-2):31-40,1986"
+72869-86-4,CCRIS,0,-1,,CC(CCNC(=O)OCCOC(=O)C(=C)C)CC(C)(C)CNC(=O)OCCOC(=O)C(=C)C,"SCHWEIKL,H, SCHMALZ,G AND RACKEBRANDT,K, THE MUTAGENIC ACTIVITY OFUNPOLYMERIZED RESIN MONOMERS IN SALMONELLA TYPHIMURIUM AND V79 CELLS, MUTAT.RES. 415(1-2):119-130, 1998"
+598-78-7,VITIC,0,-1,"CLPROPIO2",CC(Cl)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2397-76-4,EPA1,0,-1,,CC(=C)C(=O)OCC(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120812-47-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c3CCCCc3c4cccc5ccc1c2c45,"JUNG,H, SHAIKH,AU, HEFLICH,RH AND FU,PP, NITRO GROUP ORIENTATION,REDUCTION POTENTIAL, AND DIRECT-ACTING MUTAGENICITY OF NITRO-POLYCYCLIC AROMATICHYDRO- CARBONS, ENVIRON. MOL. MUTAGEN. 17(3):169-180, 1991"
+188699-17-4,VITIC,1,-1,,COc1nc2cc(cc(CBr)c2nc1OC)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60872-63-1,CCRIS,1,-1,,C\C=C/1\CC(C)C(C)(OC(=O)C)C(=O)OCC2=CCN(C)CCC(OC1=O)C2=O,"YAMANAKA,H NAGAO,M AND SUGIMURA,T, MUTAGENICITY OF PYRROLIZIDINEALKALOIDS IN THE SALMONELLA/MAMMALIAN-MICROSOME TEST, MUTAT. RES. 68(3):211-216,1979"
+1669-70-1,CCRIS,1,-1,,CC1(CO1)c2ccc(Cl)cc2,"ROSMAN,LB, BEYLIN,VG, GADDAMIDI,V, HOOBERMAN,BH AND SINSHEIMER,JE,MUTAGENICITY OF PARA-SUBSTITUTED ALPHA-METHYLSTYRENE OXIDE DERIVATIVES WITHSALMONELLA, MUTAT. RES. 171(2-3):63-70, 1986"
+84-17-3,CCRIS,0,-1,"DIENESTRB",C\C=C(\C(=C\C)\c1ccc(O)cc1)/c2ccc(O)cc2,"INGEROWSKI,GH, SCHEUTWINKEL-REICH,M AND STAN,HJ, MUTAGENICITY STUDIESON VETERINARY ANABOLIC DRUGS WITH THE SALMONELLA/MICROSOME TEST, MUTAT. RES.91(2):93-98, 1981"
+746-53-2,CCRIS,1,-1,,[O-][N+](=O)c1cc2C(=O)c3cc(cc(c3c2c(c1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"KITCHIN,RM, BECHTOLD,WE AND BROOKS,AL, THE STRUCTURE-FUNCTIONRELATIONSHIPS OF NITROFLUORENES AND NITROFLUORENONES IN THE SALMONELLAMUTAGENICITY AND CHO SISTER-CHROMATID EXCHANGE ASSAYS, MUTAT. RES.206(3):367-377, 1988"
+NOCAS_M561,EPA1,0,-1,,CCCC[C@@H](CC)CNC[C@H](CC)CCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M403,EPA1,0,-1,,CCOC(=O)[C@@H]1O[C@]1(C)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61756-39-6,CCRIS,0,-1,,CC(=O)C1=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C,"YOSHIDA,Y, STUDY ON MUTAGENICITY AND ANTIMUTAGENICITY OF BHT AND ITSDERIVATIVES IN A BACTERIAL ASSAY, MUTAT. RES. 242(3):209-217, 1990"
+99333-90-1,CCRIS,1,-1,,Oc1c(cc2ccc3cccc4ccc1c2c34)[N+](=O)[O-],"MOELLER,M, HAGEN,I AND RAMDAHL,T, MUTAGENICITY OF POLYCYCLIC AROMATICCOMPOUNDS (PAC) IDENTIFIED IN SOURCE EMISSIONS AND AMBIENT AIR, MUTAT. RES.157(2-3): 149-156, 1985"
+9002-92-0,EPA1,0,-1,"G-3707",CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18640-74-9,VITIC,1,-1,,CC(C)Cc1nccs1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+109415-89-6,CCRIS,1,-1,,CCOC(=O)C(C)(C#N)c1snc2ccc(cc12)[N+](=O)[O-],"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+5326-87-4,EPA1,0,-1,,BrCC(=O)Nc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+452-06-2,EPA1,0,-1,"AMINOPUR2",Nc1nc2ncnc2c[nH]1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1565-94-2,CCRIS,0,-1,,CC(=C)C(=O)OCC(O)COc1ccc(cc1)C(C)(C)c2ccc(OCC(O)COC(=O)C(=C)C)cc2,"SCHWEIKL,H, SCHMALZ,G AND RACKEBRANDT,K, THE MUTAGENIC ACTIVITY OFUNPOLYMERIZED RESIN MONOMERS IN SALMONELLA TYPHIMURIUM AND V79 CELLS, MUTAT.RES. 415(1-2):119-130, 1998"
+61421-82-7,EPA1,1,-1,,COc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68299-98-9,EPA1,0,-1,,OCC(=O)N(O)c1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1874-22-2,CCRIS,1,-1,,[O-][N+](=O)c1oc(\C=C\C=O)cc1,"EDER,E, DEININGER,C AND MUTH,D, GENOTOXICITY OF P-NITROCINNAMALDEHYDEAND RELATED ALPHA,BETA-UNSATURATED CARBONYL COMPOUNDS IN TWO BACTERIAL ASSAYS,MUTAGENESIS 6(4):261-269, 1991"
+28361-96-8,CCRIS,1,-1,,NC(CSCCCl)C(=O)O,"VAMVAKAS,S, BERTHOLD,K, DEKANT,W AND HENSCHLER,D, BACTERIAL CYSTEINECONJUGATE BETA-LYASE AND THE METABOLISM OF CYSTEINE S-CONJUGATES. STRUCTURALREQUIREMENTS FOR THE CLEAVAGE OF S-CONJUGATES AND THE FORMATION OF REACTIVEINTERMEDIATES, CHEM.-BIOL. INTERACT. 65(1):59-71, 1988"
+98151-92-9,EPA1,1,-1,,Nc1ccc2ccc3c4ccccc4cc5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16053-71-7,GENETOX,1,-1,,Cc1c2C(O)C(O)c3ccccc3c2cc4ccccc14,"CHEM BIOL INTERACT 11:469-472,1975"
+22056-82-2,CCRIS,0,-1,,CCOCC=O,"HOFLACK,JC, LAMBOLEZ,L, ELIAS,Z AND VASSEUR,P, MUTAGENICITY OFETHYLENE GLYCOL ETHERS AND OF THEIR METABOLITES IN SALMONELLA TYPHIMURIUM HIS-,MUTAT. RES. 341(4):281-287, 1994"
+540-49-8,EPA1,1,-1,,Br\C=C\Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2113-57-7,VITIC,0,-1,,Brc1cccc(c1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+36504-66-2,EPA3,1,-1,,O1[C@@H]2C=Cc3cc4ccc5cccc6ccc(c3[C@H]12)c4c56,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M517,EPA1,0,-1,"ISOIDIDMO",O[C@@H]1CO[C@@H]2[C@@H](CO[C@H]12)O[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1734-79-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc(\C=C\C=O)cc1,"EDER,E, DEININGER,C AND MUTH,D, GENOTOXICITY OF P-NITROCINNAMALDEHYDEAND RELATED ALPHA,BETA-UNSATURATED CARBONYL COMPOUNDS IN TWO BACTERIAL ASSAYS,MUTAGENESIS 6(4):261-269, 1991"
+106671-90-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc(cc1)c2nc3sccn3c2N=O,"HRELIA,P, PAOLINI,M, BIAGI,GL AND CANTELLI-FORTI,G, THE DIRECT-ACTINGMUTAGENICITY OF NITROIMIDAZO[2,1-B]THIAZOLES IN SALMONELLA TYPHIMURIUM,TERATOG., CARCINOG., MUTAGEN. 6(6):511-519, 1986"
+10061-01-5,CCRIS,1,-1,,ClC\C=C/Cl,"DE LORENZO,F, DEGL'INNOCENT,IS, RUOCCO,A, SILENGO,L AND CORTESE,R,MUTAGENICITY OF PESTICIDES CONTAINING 1,3-DICHLOROPROPENE, CANCER RES.37:1915-1917, 1977"
+64224-21-1,EPA1,0,-1,"OLTIPRAZ",CC1=C(SSC1=S)c2cnccn2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125372-28-3,CCRIS,1,-1,,Cn1c(N=N#N)nc2ccc3ncccc3c12,"WILD,D, AND DIRR,A, MUTAGENIC NITRENES/NITRENIUM IONS FROMAZIDO-IMIDAZOARENES AND THEIR STRUCTURE-ACTIVITY RELATIONSHIP, MUTAGENESIS4(6):446-52, 1989"
+126-07-8,VITIC,0,-1,"GRISEOFUL",COC1=CC(=O)C[C@@H](C)[C@]12Oc3c(Cl)c(OC)cc(OC)c3C2=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+28995-89-3,CCRIS,1,-1,,[O-][N+](=O)c1cc(c2c(cc(cc2c1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"WHONG,WZ AND EDWARDS,GS, GENOTOXIC ACTIVITY OF NITROAROMATICEXPLOSIVES AND RELATED COMPOUNDS IN SALMONELLA TYPHIMURIUM, MUTAT. RES.136(3):209-215, 1984"
+NOCAS_M394,EPA1,0,-1,,CCC[C@@H](C)C[C@@H](OC(=O)C[C@@H](CC(=O)O)C(=O)O)[C@@H](C[C@H](C)CCCCCC[C@H](O)C[C@H](O)[C@@H](C)N)OC(=O)C[C@@H](CC(=O)O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134998-72-4,CCRIS,0,-1,,CCC(CCC(=O)C)COC(=O)CCCCC(=O)O,"DIRVEN,HAAM, THEUWS,JLG, JONGENEELEN,FJ AND BOS,RP, NON-MUTAGENICITYOF 4 METABOLITES OF DI(2-ETHYLHEXYL)PHTHALATE (DEHP) AND 3 STRUCTURALLY RELATEDDERIVATIVES OF DI(2-ETHYLHEXYL)ADIPATE (DEHA) IN THE SALMONELLA MUTAGENICITYASSAY, MUTAT. RES. 260(1):121-130, 1991"
+5598-53-8,CCRIS,0,-1,"ASPARTMHB,ASPAMGHCL,BETAINASP,LI-ASPART,MGASPARTA,KASPARTAT",NC(CC(=O)O)C(=O)O,"FUJITA,H, SUMI,C AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVESWITH SALMONELLA TYPHIMURIUM TA97 AND TA102. VII,KENKYU NENPO - TOKYO-TORITSUEISEI KENKYUSHO 43:219-227, 1992"
+109-64-8,EPA1,0,-1,,BrCCCBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78-94-4,VITIC,1,-1,"POLETPOLV",CC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+591-12-8,EPA1,0,-1,"ANGELICAA",CC1=CCC(=O)O1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26049-70-7,CCRIS,1,-1,,NNc1nc(cs1)c2ccc(cc2)[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+99-55-8,EPA2,1,-1,,Cc1ccc(cc1N)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+302-84-1,CCRIS,0,-1,,NC(CO)C(=O)O,"WU,X, SKOG,K AND JAEGERSTAD,M, TRIGONELLINE, A NATURALLY OCCURRINGCONSTITUENT OF GREEN COFFEE BEANS BEHIND THE MUTAGENIC ACTIVITY OF ROASTEDCOFFEE?, MUTAT. RES. 391(3):171-177, 1997"
+79-14-1,VITIC,0,-1,"GLYCOLACA,GLYCOLATE,S-245",OCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2429-71-2,EPA1,0,-1,,COc1cc(ccc1N=Nc2cc(c3ccccc3c2O)S(=O)(=O)O)c4ccc(N=Nc5cc(c6ccccc6c5O)S(=O)(=O)O)c(OC)c4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+505-22-6,EPA3,1,-1,,C1COCOC1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+123-32-0,EPA1,0,-1,"DIMEPZN25",Cc1cnc(C)cn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+947-72-8,EPA1,1,-1,,Clc1cc2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M56,EPA1,1,-1,,N1[C@@H]2[C@H]1c3ccccc3c4c2ccc5ccccc45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+104-46-1,EPA2,0,-1,"ANETHOLE",COc1ccc(\C=C\C)cc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+54235-20-0,CCRIS,1,-1,,Oc1cc2c3ccccc3c4cccc(c1[N+](=O)[O-])c24,"SANGAIAH,R, RAMACHANDRAN,P, ZHANG,J AND BALL,LM, SYNTHESIS ANDBIOLOGICAL ACTIVITY OF METABOLITES OF ENVIRONMENTAL NITROARENES, POLYCYCLICAROMAT. COMPD. 11(1-4):283-290, 1996"
+478-45-5,EPA1,0,-1,"DR9600392",OC(=O)c1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+102408-27-5,CCRIS,1,-1,,CN(C)c1nc2c3cccnc3ccc2n1C,"SMITH,C, PAYNE,V, DOOLITTLE,DJ, DEBNATH,AK, LAWLOR,T AND HANSCH,C,MUTAGENIC ACTIVITY OF A SERIES OF SYNTHETIC AND NATURALLY OCCURRING HETEROCYCLICAMINES IN SALMONELLA, MUTAT. RES. 279(1):61-73, 1992"
+50-49-7,CCRIS,0,-1,"BI-2,IMIPRAHCL",CN(C)CCCN1c2ccccc2CCc3ccccc13,"BALBI,A MUSCETTOLA,G STAIANO,N MARTIRE,G AND DE LORENZO,F, PSYCHOTROPIC DRUGS: EVALUATION OF MUTAGENIC EFFECT,  PHARMACOL. RES. COMMUN.12(5):423-431, 1980"
+13436-58-3,CCRIS,1,-1,,Cn1cc2cccc(c2n1)[N+](=O)[O-],"VANCE,WA, OKAMOTO,HS AND WANG,YY, STRUCTURE-ACTIVITY RELATIONSHIPS OFNITRO AND METHYL-NITRO DERIVATIVES OF INDOLINE, INDOLE, INDAZOLE ANDBENZIMIDAZOLE IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 173(3):169-176,1986"
+192-97-2,VITIC,1,-1,"BENZOEPYR",c1ccc2c(c1)c3cccc4ccc5cccc2c5c34,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13171-00-1,EPA1,0,-1,,CC(=O)c1cc(cc2c1CCC2(C)C)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+29590-42-9,EPA1,0,-1,,CC(C)CCCCCOC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89-40-7,VITIC,1,-1,,[O-][N+](=O)c1ccc2C(=O)NC(=O)c2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2531-84-2,VITIC,1,-1,,Cc1ccc2c(ccc3ccccc23)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78468-34-5,CCRIS,1,-1,,Nc1cc(ccc1CO)[N+](=O)[O-],"MORI,M, MIYAHARA,T, MOTO-O,K, FUKUKAWA,M, KOZUKA,H, MIYAGOSHI,M ANDNAGAYAMA,T, MUTAGENICITY OF URINARY METABOLITES OF 2,4-DINITROTOLUENE TOSALMONELLA TYPHIMURIUM, CHEM. PHARM. BULL. 33(10):4556-4563, 1985"
+1649-18-9,EPA1,0,-1,"AZAPERONE",Fc1ccc(cc1)C(=O)CCCN2CCN(CC2)c3ccccn3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+143343-83-3,CCRIS,0,-1,"OPC-18790",COc1ccc(CNCC(O)COc2ccc3nc(O)ccc3c2)cc1OC,"ADAMS,K, JONES,E AND TAKAHASHI,N, IN VITRO MUTAGENICITY STUDIES WITHTOBORINONE (OPC-18790), YAKURI TO CHIRYO 24(11):2339-2346, 1996"
+9002-86-2,VITIC,0,-1,,CCC(Cl)CC(Cl)CC(C)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+64507-38-6,CCRIS,0,-1,,OC(=O)c1cc(Br)cc2cccnc12,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+13010-10-1,CCRIS,1,-1,,CCCCCN(N=O)C(=N)N[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+116374-67-5,CCRIS,1,-1,,CN(C)CCCNc1c2ccccc2nc3c(ccc(c13)[N+](=O)[O-])N(C)C,"FERGUSON,LR, DENNY,WA AND O'ROURKE,SM, MUTAGENIC ACTIVITY OFNITRACRINE DERIVATIVES IN SALMONELLA TYPHIMURIUM: RELATIONSHIP TO DRUGPHYSICOCHEMICAL PARAMETERS, AND TO BACTERIAL UVRB AND RECA GENES AND PLASMIDPKM101, MUTAT. RES. 223(1):13-22, 1989"
+18774-09-9,EPA1,1,-1,,CC1(OO)c2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2213-63-0,VITIC,0,-1,,Clc1nc2ccccc2nc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+64920-33-8,CCRIS,1,-1,,OC1C(O)c2ccc3c(ccc4ccccc34)c2C5OC15,"GLATT,H, PIEE,A, PAULY,K, STEINBRECHER,T, SCHRODE,R, OESCH,F ANDSEIDEL,A, FJORD- AND BAY-REGION DIOL-EPOXIDES INVESTIGATED FOR STABILITY, SOSINDUCTION IN ESCHERICHIA COLI, AND MUTAGENICITY IN SALMONELLA TYPHIMURIUM ANDMAMMALIAN CELLS,CANCER RES. 51(6):1659-1667, 1991"
+5405-53-8,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(Cc3cc(ccc23)[N+](=O)[O-])c1,"HIRAYAMA,T, IGUCHI,K"
+610-28-6,EPA1,1,-1,,OC(=O)c1cc(ccc1[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2400-17-1,CCRIS,0,-1,"CI-624",CNc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+121808-62-6,CCRIS,0,-1,,OC(=O)C1CSCN1C(=O)C2CCC(=O)N2,"ADAMS,K, ALLEN,JA, BROOKER,PC, HENDERSON,L, JONES,E, PROUDLOCK,RJ,MAILLAND, F AND COPPI,G, GENOTOXICITY TESTING OF PIDOTIMOD IN VITRO AND IN VIVO,ARZNEIM.-FORSCH. 44(12A):1454-1459, 1994"
+55691-69-5,EPA1,1,-1,,[O-][N+](=O)c1ccc2c3ccccc3c4ccc(c1c24)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+83053-58-1,CCRIS,0,-1,,CCCOc1cc2C(=O)CCc2c3ccc4ccccc4c13,"BOYD,GW, COOMBS,MM AND IOANNIDES,C, CYP1 INDUCTION, BINDING TO THEHEPATIC AROMATIC HYDROCARBON RECEPTOR AND MUTAGENICITY OF A SERIES OF 11-ALKOXYCYCLOPENTA[A]PHENANTHREN-17-ONES: A STRUCTURE ACTIVITY RELATIONSHIP, TOXICOLOGY95(1-3):27-35, 1995"
+145438-96-6,CCRIS,0,-1,,CNC(=O)c1c(ncn1C)N(C)N=O,"ERDINGER,L, SCHMEZER,P, RAZDAN,R, KUMAR,R, SPIEGELHALDER,B,PREUSSMANN,R AND SIDDIQI,M, CAFFEINE-DERIVED N-NITROSO COMPOUNDS. III:MUTAGENICITY IN S. TYPHIMURIUM AND IN VITRO INDUCTION OF DNA SINGLE-STRANDBREAKS IN RAT HEPATOCYTES BY MONONITROSOCAFFEIDINE AND DINITROSOCAFFEIDINE,MUTAT. RES. 292(1):41-49, 1993"
+33419-42-0,CCRIS,0,-1,,COc1cc(cc(OC)c1O)C2C3C(COC3=O)C(OC4OC5COC(C)OC5C(O)C4O)c6cc7OCOc7cc26,"GUPTA,RS, BROMKE,A, BRYANT,DW, GUPTA,R, SINGH,B AND MCCALLA,DR,ETOPOSIDE (VP16) AND TENIPOSIDE (VM26) NOVEL ANTICANCER DRUGS, STRONGLYMUTAGENIC IN"
+499-12-7,CCRIS,0,-1,"ACONITATT",OC(=O)C\C(=C\C(=O)O)\C(=O)O,"ANDERSEN,PH AND JENSEN,NJ, MUTAGENIC INVESTIGATION OF FLAVORINGS:DIMETHYL SUCCINATE, ETHYL PYRUVATE AND ACONITIC ACID ARE NEGATIVE IN THESALMONELLA/ MAMMALIAN-MICROSOME TEST, FOOD. ADDIT. CONTAM. 1(3):283-288,1984"
+130536-40-2,CCRIS,0,-1,,OC1C=Cc2cccnc2C1O,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+95840-05-4,CCRIS,1,-1,,OC1C=CC2OC2C1O,"GLATT,H, PADYKULA,R, BERCHTOLD,GA, LUDEWIG,G, PLATT,KL, KLEIN,J ANDOESCH,F, MULTIPLE ACTIVATION PATHWAYS OF BENZENE LEADING TO PRODUCTS WITHVARYING GENOTOXIC CHARACTERISTICS, ENVIRON. HEALTH PERSPECT. 82:81-89,1989"
+10373-78-1,CCRIS,0,-1,,CC1(C)C2CCC1(C)C(=O)C2=O,"GOMES-CARNEIRO,MR, FELZENSZWALB,I AND PAUMGARTTEN,FJR, MUTAGENICITYTESTING OF (+/-)-CAMPHOR, 1,8-CINEOLE, CITRAL, CITRONELLAL, (-)-MENTHOL ANDTERPINEOL WITH THE SALMONELLA/MICROSOME ASSAY, MUTAT. RES. 416(1,2):129-136,1998"
+135086-93-0,EPA1,1,-1,,Oc1c2nc3ccccc3c2nnn1\N=C\c4ccc(Cl)cc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+147151-61-9,CCRIS,1,-1,,CC12CCC3C(CCC4CC(CCC34C)OC(=O)\C=C\c5cccc(c5)N(CCCl)CCCl)C1CCC(=O)N2,"VOUTSINAS,G, KAPPAS,A, DEMOPOULOS,NA AND CAMOUTSIS,C, MUTAGENICITY OFFOUR HOMO-AZA-STEROIDAL ESTERS OF M-N,N-BIS(2-CHLOROETHYL)AMINOCINNAMIC ACID INTHE AMES TEST, MUTAT. RES. 319(4):325-329, 1993"
+513-88-2,EPA1,1,-1,,CC(=O)C(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M35,EPA1,1,-1,,C[C@@H](O)CN(C[C@@H](C)O)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80789-74-8,EPA3,1,-1,,OS(=O)(=O)c1ccc2NC(=O)C(=O)c2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+119613-13-7,CCRIS,0,-1,,CCCC(=O)OCc1cccc(c1)[N+](=O)[O-],"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+112022-05-6,EPA1,1,-1,,CN(C)CCNC(=O)c1cccc2cc3ccccc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112309-61-2,CCRIS,1,-1,,CC1=C(Cl)C(=O)OC1O,"LALONDE,RT, COOK,GP, PERAKYLA,H AND BU,L, STRUCTURE-ACTIVITYRELATIONSHIPS OF BACTERIAL MUTAGENS RELATED TO3-CHLORO-4-(DICHLOROMETHYL)-5-HYDROXY-2(5H)- FURANONE: AN EMPHASIS ON THE EFFECTOF STEPWISE REMOVAL OF CHLORINE FROM THE DICHLOROMETHYL GROUP, CHEM. RES.TOXICOL. 4(5):540-545, 1991"
+244-63-3,EPA2,1,-1,"NORHARMAN",c1ccc2c(c1)[nH]c3cnccc23,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+NOCAS_M270,EPA1,1,-1,,N[C@H](CS)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+619-23-8,VITIC,1,-1,,[O-][N+](=O)c1cccc(CCl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M157,EPA1,1,-1,,CCN(CC)CCC[C@@H](C)Nc1cc(OC)cc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80-54-6,VITIC,0,-1,,CC(CC=O)c1ccc(cc1)C(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120388-69-4,EPA1,1,-1,,O=Nc1ccc2ccc3c4ccccc4cc5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+58-14-0,VITIC,0,-1,"PYRIMETHA,PYRIMESUD,PYRITHTAR",CCc1nc(N)nc(N)c1c2ccc(Cl)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5443-49-2,EPA1,1,-1,"ALPHABROC",Br\C(=C/c1ccccc1)\C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+627-93-0,VITIC,0,-1,,COC(=O)CCCCC(=O)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+61996-71-2,CCRIS,0,-1,,OS(=O)(=O)Oc1ccc2ccc3c4ccccc4cc5ccc1c2c35,"IRWIN,SE, KWEI,GY, BLACKBURN,GR, THURMAN,R AND KAUFFMAN,FC,MUTAGENICITY OF BENZO[A]PYRENYL-1-SULFATE IN THE AMES TEST,ENVIRON. MOL.MUTAGEN. 19(3):253- 258, 1992"
+2465-27-2,VITIC,1,-1,"BENZOPHEN",CN(C)c1ccc(cc1)C(=N)c2ccc(cc2)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4097-53-4,CCRIS,1,-1,,Oc1c(cc(cc1[N+](=O)[O-])c2ccccc2)[N+](=O)[O-],"SUZUKI,J, SATO,T AND SUZUKI,S, HYDROXYNITROBIPHENYLS PRODUCED BYPHOTOCHEMICAL REACTION OF BIPHENYL IN AQUEOUS NITRATE SOLUTION AND THEIRMUTAGENICITIES, CHEM. PHARM. BULL. 33(6):2507-2515, 1985"
+65945-06-4,EPA1,1,-1,,Oc1ccc2c(ccc3c4ccccc4ccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+279242-17-0,CCRIS,1,-1,,CC(C)(C)c1ccc(cc1)c2ccc(cc2)N=O,"HAACHK,T ERDINGER,L AND BOCHE,G, MUTAGENICITY IN SALMONELLATYPHIMURIUM TA98 AND TA100 OF NITROSO AND RESPECTIVE HYDROXYLAMINE COMPOUNDS,MUTAT. RES. 491(1-2):183-193, 2001"
+77094-11-2,EPA1,1,-1,,Cc1cc2ncccc2c3nc(N)n(C)c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3764-01-0,EPA1,0,-1,,Clc1cc(Cl)nc(Cl)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1064-48-8,EPA1,1,-1,"DR0002925",Nc1c(N=Nc2ccc(cc2)[N+](=O)[O-])c(cc3cc(c(N=Nc4ccccc4)c(O)c13)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+610-67-3,CCRIS,1,-1,,CCOc1ccccc1[N+](=O)[O-],"SHIMIZU,M AND YANO,E, MUTAGENICITY OF MONO-NITROBENZENE DERIVATIVES INTHE AMES TEST AND REC ASSAY, MUTAT. RES. 170(1-2):11-22, 1986"
+71382-44-0,CCRIS,1,-1,,N1C2C1c3cc4ccccc4cc3c5ccccc25,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+NOCAS_M159,EPA1,1,-1,,C=C[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1212-29-9,VITIC,0,-1,,S=C(NC1CCCCC1)NC2CCCCC2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5633-20-5,CCRIS,0,-1,"OXYBUTYNI,OXYBUTHCL",CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)c2ccccc2,"IWATA,T, KUNIBA,S, YAMAGUCHI,K, ARIGA,F AND HIRAMATSU,Y, MUTAGENICITYTESTS ON OXYBUTYNIN HYDROCHLORIDE, YAKURI TO CHIRYO 13(11):6637-6643,1985"
+106532-61-0,CCRIS,1,-1,,CCC(=O)\N=C\1/SN(C(=O)CC)c2ccc(cc12)[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+98-37-3,VITIC,0,-1,,Nc1cc(ccc1O)S(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2082-79-3,VITIC,0,-1,,CCCCCCCCCCCCCCCCCCOC(=O)CCc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+35001-52-6,CCRIS,0,-1,,CCOc1ccc(cc1NC(=O)C(=O)Nc2ccccc2CC)C(C)(C)C,"HACHIYA,N AND TAKIZAWA,Y, MUTAGENICITY OF PLASTIC ADDITIVES,HEN'IGENSEI SHIKEN 3(3):147-154, 1994"
+75-17-2,EPA1,0,-1,,ON=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+773-76-2,EPA1,0,-1,"CHLOROXIN",Oc1c(Cl)cc(Cl)c2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95186-19-9,CCRIS,0,-1,"SC-36741",Nc1nc(c(CCO)c2ncnn12)c3ccccc3,"OSHIRO,Y, PIPER,CE, GARRIOTT,ML, BALWIERZ,PS, SOELTER,SG ANDROHRBACHER,E, GENETIC TOXICOLOGY STUDIES WITH A TUMOR PROMOTER, J. APPL.TOXICOL. 13(2): 91-101, 1993"
+37853-59-1,VITIC,0,-1,,Brc1cc(Br)c(OCCOc2c(Br)cc(Br)cc2Br)c(Br)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+142534-71-2,CCRIS,0,-1,,CC1(C(Cl)Cl)C2C(Cl)C(Cl)C1(C(Cl)Cl)C(Cl)C2Cl,"STEINBERG,M, KINOSHITA,FK AND BALLANTYNE,M,MUTAGENICITY STUDIES WITHTOXAPHENE CONGENERS, ORGANOHALOGEN COMPD. 35(ANALYSIS, CHLORINATED BORNANES,CHIRAL CONTAMINANTS, POLYMER ADDITIVES AND MONOMERS):243-246, 1998"
+67410-22-4,EPA3,1,-1,,Nc1ccc2ccc3ccccc3c2n1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+31555-54-1,CCRIS,1,-1,,ClC(=C1OC(=O)C(=C1Cl)Cl)Cl,"SMEDS,A, FRANZEN,R AND KRONBERG,L, OCCURRENCE OF SOME CHLORINATED ENOLLACTONES AND CYCLOPENTENE-1,3-DIONES IN CHLORINE-TREATED WATERS, ENVIRON. SCI.TECHNOL. 29(9):1839-1844, 1995"
+6730-83-2,CCRIS,0,-1,,CC12CCCC(C)(C1CCC34CC(CCC23)C(=C)C4)C(=O)O,"PEZZUTO,JM, NANAYAKKARA,NPD, COMPADRE,CM, SWANSON,SM, KINGHORN,AD,GUENTHNER,TM, SPARNINS,VL AND LAM,LKT, CHARACTERIZATION OF BACTERIALMUTAGENICITY MEDIATED BY 13-HYDROXY-ENT-KAURENOIC ACID (STEVIOL) AND SEVERALSTRUCTURALLY-RELATED DERIVATIVES AND EVALUATION OF POTENTIAL TO INDUCEGLUTATHIONE S-TRANSFERASE IN MICE, MUTAT. RES. 169(3):93-103, 1986"
+141691-42-1,EPA1,1,-1,,Cn1c(N)nc2ccc(cc12)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1689-84-5,EPA1,0,-1,"BROMINAL",Oc1c(Br)cc(cc1Br)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+921-14-2,EPA1,1,-1,,CC(C)N(N)C(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119914-60-2,CCRIS,0,-1,"OPC-17116",CC1CN(CCN1)c2cc3N(C=C(C(=O)O)C(=O)c3c(C)c2F)C4CC4,"TAKAHASHI,N, SHIBAHARA,T, KANEKO,E, ITOH,T, SHIRAGIKU,T, AWOGI,T ANDSHIBUYA, T, GENOTOXICITY STUDIES OF GREPAFLOXACIN, YAKURI TO CHIRYO22(11):4567-4577, 1994"
+674-82-8,CCRIS,0,-1,,C=C1CC(=O)O1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+172374-58-2,CCRIS,1,-1,,CC(=O)Nc1ccc(Oc2ccc(cc2)N(O)C(=O)C)cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, GENOTOXICITY OF POTENTIAL METABOLITESOF NITROSCANATE- AN ANTISCHISTOSOMAL DRUG, MUTAT. RES. 335(3):235-243,1995"
+NOCAS_M452,EPA1,0,-1,,CCCC[C@@H](CC)COCCCN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M299,EPA1,1,-1,,Cn1c(ncc1[N+](=O)[O-])[C@H]2NC(CO)(CO)CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+145439-03-8,EPA1,1,-1,,CNc1ncn(C)c1C(=O)N(C)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1066-40-6,CCRIS,0,-1,,C[Si](C)(C)O,"ISQUITH,A, MATHESON,D AND SLESINSKI,R, GENOTOXICITY STUDIES ONSELECTED ORGANOSILICON COMPOUNDS. IN VITRO ASSAYS, FOOD CHEM. TOXICOL.26(3):255-261, 1988"
+329-71-5,CCRIS,1,-1,"DR0001214",Oc1cc(ccc1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+119-90-4,VITIC,1,-1,"DIANISIDI",COc1cc(ccc1N)c2ccc(N)c(OC)c2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5862-77-1,EPA1,1,-1,,CCOc1ccc(N)cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+159092-68-9,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c3ccccc3cc(c12)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+106428-28-8,CCRIS,1,-1,,CC12CCCC(C)(C1CCC34CC(O)(CCC23)C(=C)C4=O)C(=O)O,"COMPADRE,CM, HUSSAIN,RA, NANAYAKKARA,NPD, PEZZUTO,JM AND KINGHORN,AD,MASS SPECTRAL ANALYSIS OF SOME DERIVATIVES AND IN VITRO METABOLITES OF STEVIOL,THE AGLYCONE OF THE NATURAL SWEETENERS, STEVIOSIDE, REBAUDIOSIDE A, ANDRUBUSOSIDE, BIOMED. ENVIRON. MASS SPECTROM. 15(4):211-222, 1988"
+157730-36-4,EPA1,0,-1,,Cn1c(N)nc2nc3ccncc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+581-50-0,EPA1,1,-1,,c1ccc(nc1)c2cccnc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88133-11-3,EPA1,0,-1,"BEMITRADI",CCOCCc1c(nc(N)n2ncnc12)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98736-51-7,CCRIS,0,-1,,COC(=O)c1ccc(CN(C)N=O)cc1,"SINGER,GM, ANDREWS,AW AND GUO,SM, QUANTITATIVE STRUCTURE-ACTIVITYRELATIONSHIP OF THE MUTAGENICITY OF SUBSTITUTED N-NITROSO-N-BENZYLMETHYLAMINES:POSSIBLE IMPLICATIONS FOR CARCINOGENICITY, J. MED. CHEM. 29(1):40-44,1986"
+107759-11-5,CCRIS,1,-1,,CCOC(=O)N(N=O)C(CCC=O)c1cccnc1,"HECHT,SS AND LIN,D, COMPARATIVE MUTAGENICITY OF4-(CARBETHOXYNITROSAMINO)-4- (3-PYRIDYL)BUTANAL AND4-(CARBETHOXYNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANONE, MODEL COMPOUNDS FORALPHA-HYDROXYLATION OF N'-NITROSONORNICOTINE, CARCINOGENESIS 7(4):611-614,1986"
+486-56-6,CCRIS,0,-1,,CN1C(CCC1=O)c2cccnc2,"DOOLITTLE,DJ, WINEGAR,R, LEE,CK, CALDWELL,WS, HAYES,AW ANDDEBETHIZY,JD, THE GENOTOXIC POTENTIAL OF NICOTINE AND ITS MAJOR METABOLITES,MUTAT. RES. 344(3,4):95-102, 1995"
+14170-43-5,CCRIS,0,-1,,Nc1cc(c2cccc(c2c1)S(=O)(=O)O)S(=O)(=O)O,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+150-90-3,EPA1,0,-1,"AMINOTSUC,DR9501565,BERNAMINE,SUCCINCAL,FESUCCINA,LISUCCINA,SUCCINANA,SUCCINABI,SUCCINATE",OC(=O)CCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+634-91-3,EPA1,0,-1,,Nc1cc(Cl)c(Cl)c(Cl)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+129927-37-3,CCRIS,0,-1,"DR9702110",CCNCC#CC(C)(C)OC(=O)C(O)(C1CCCCC1)c2ccccc2,"TAMURA,H, YAMASHITA,Y, KITAYAMA,E, IWAKURA,K, WATANABE,M AND SUMI,N,MUTAGENICITY STUDIES OF RCC-36, THE ACTIVE METABOLITE OF(+/-)-4-DIETHYLAMINO-1,1-DIMETHYLBUT-2-YN-1-YL2-CYCLOHEXYL-2-HYDROXY-2-PHENYLACETATE MONOHYDROCHLORIDE MONOHYDRATE (NS-21), ANOVEL DRUG FOR URINARY FREQUENCY AND INCONTINENCE, J. TOXICOL. SCI.22(SUPPL.1):263-274, 1997"
+106-58-1,EPA1,0,-1,,CN1CCN(C)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95933-74-7,CCRIS,1,-1,,N\C(=N/O)\c1cc(O)c(O)c(O)c1,"MIADOKOVA,E, MACAKOVA,K, PODSTAVKOVA,S AND VLECK,D, GENOTOXICPROPERTIES OF THE NEWLY SYNTHESIZED ANTINEOPLASTIC AGENTS AMIDOX, DIDOX ANDTRIMIDOX, PHARMAZIE 52(7):540-544, 1997"
+124-40-3,VITIC,0,-1,"DIMEAMINE",CNC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+87-83-2,VITIC,0,-1,,Cc1c(Br)c(Br)c(Br)c(Br)c1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M44,EPA1,1,-1,,O[C@@H]1c2ccccc2c3ccc(cc13)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98114-61-5,CCRIS,1,-1,,OCCCN=N,"UKAWA-ISHIKAWA,S, SAWADA,A, KASUYA,A AND MOCHIZUKI,M, MUTAGENICITY OFISOMERIC ALKANEDIAZOTATES, PRECURSORS FOR ULTIMATE ALKYLATING SPECIES OFCARCINOGENIC N-NITROSO COMPOUNDS, MUTAT. RES. 412(1):99-107, 1998"
+75-07-0,VITIC,0,-1,"ACETALDEH",CC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+335-76-2,EPA1,0,-1,"PERFLDETE",OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+93673-34-8,CCRIS,1,-1,,O1C2C1c3cc4cc5ccccc5cc4c6cccc2c36,"BARTCZAK,AW, SANGAIAH,R, BALL,LM, WARREN,SH AND GOLD,A, SYNTHESIS ANDBACTERIAL MUTAGENICITY OF THE CYCLOPENTA OXIDES OF THE FOUR CYCLOPENTA-FUSEDISOMERS OF BENZANTHRACENE, MUTAGENESIS 2(2):101-105, 1987"
+107-19-7,VITIC,1,-1,,OCC#C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+117929-13-2,CCRIS,1,-1,,[O-][N+](=O)c1cc2CCc3cc(cc4CCc(c1)c2c34)[N+](=O)[O-],"HIRAYAMA,T, WATANABE,T, AKITA,M, SHIMOMURA,S, FUJIOKA,Y, OZASA,S ANDFUKUI,S, RELATIONSHIPS BETWEEN STRUCTURE OF NITRATED ARENES AND THEIRMUTAGENICITY IN SALMONELLA TYPHIMURIUM, 2- AND 2,7-NITRO SUBSTITUTED FLUORENE,PHENANTHRENE AND PYRENE, MUTAT. RES. 209(1-2):67-74, 1988"
+62018-89-7,EPA3,1,-1,,OCCCCN(CCO)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+60878-02-6,CCRIS,1,-1,,[O-][N+](=O)c1oc(\C=N\c2snc3ccccc23)cc1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+173216-45-0,CCRIS,1,-1,,OCC(CN=N#N)Cc1ccccc1,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+118326-90-2,CCRIS,0,-1,,Brc1ccc2C3CCCCC3C=Cc2c1,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+52547-00-9,EPA1,1,-1,,Cc1cc(N)sn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+330-55-2,GENETOX,1,-1,"LINURON",CON(C)C(=O)Nc1ccc(Cl)c(Cl)c1,"CANCER RES 36:4525-4529,1976"
+87009-12-9,CCRIS,1,-1,,OC(CN=N#N)CN1C=CC(=O)NC1=O,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+86-30-6,VITIC,0,-1,"NITROSPHA",O=NN(c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+33813-20-6,EPA1,0,-1,,S=C1SSC2=NCCN12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M347,EPA1,0,-1,,COC(=O)[C@H]([C@H]1CCCCN1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18458-01-0,CCRIS,1,-1,,Cc1ccc(CC2CO2)cc1,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+105-60-2,VITIC,0,-1,"CAPROLACT",O=C1CCCCCN1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+76180-96-6,EPA1,1,-1,,Cn1c(N)nc2c3cccnc3ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M16,EPA1,1,-1,,C[C@@H](O)CN(C)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91254-96-5,CCRIS,1,-1,,Oc1cc2cccc3ccc4c(ccc1c4c23)[N+](=O)[O-],"SANGAIAH,R, RAMACHANDRAN,P, ZHANG,J AND BALL,LM, SYNTHESIS ANDBIOLOGICAL ACTIVITY OF METABOLITES OF ENVIRONMENTAL NITROARENES, POLYCYCLICAROMAT. COMPD. 11(1-4):283-290, 1996"
+115085-17-1,CCRIS,1,-1,,O1C=CC=Cc2c1c3cc4ccccc4cc3c5ccccc25,"KUMAR,S, KOLE,PL AND SIKKA,HC, MUTAGENICITY OF DIBENZ[A,C]ANTHRACENEAND ITS DERIVATIVES IN SALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 242(4):337-343,1990"
+82789-18-2,CCRIS,0,-1,,OC(=O)C1Cc2c([nH]c3ccccc23)C(N1)c4ccccc4,"PAPAVERGOU,E, IOANNIDES,C AND CLIFFORD,MN, THE EVALUATION IN THE AMESTEST OF THE MUTAGENICITY OF TETRAHYDRO-BETA-CARBOLINE-3-CARBOXYLIC ACIDS FROMSMOKED FOODS, FOOD ADDIT. CONTAM. 9(2):183-187, 1992"
+91575-29-0,EPA1,1,-1,,CC(=O)Nc1ccc(Cc2ccc(NC(=O)C)c(Cl)c2)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84987-77-9,EPA1,1,-1,,ClCCOC\C(=C/Cl)\Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1204-60-0,EPA1,0,-1,,O=Cc1cccc(c1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+104535-31-1,CCRIS,0,-1,,CC(O)Cc1cc(N)cc(c1N)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+23564-05-8,EPA1,1,-1,"THIOPHAME",COC(=O)NC(=S)Nc1ccccc1NC(=S)NC(=O)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-59-8,CCRIS,0,-1,"MEMALONAT",COC(=O)CC(=O)OC,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION   CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING   CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF   THE INDUSTRIAL SAFETY AND HEALTH LAW, (SUPPL. 2),2000"
+95-85-2,EPA1,1,-1,,Nc1cc(Cl)ccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+29927-08-0,VITIC,1,-1,,Cc1cc2nc(N)sc2cc1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+65002-17-7,CCRIS,0,-1,"THIOBUTAR",CC(C)(S)C(=O)NC(CS)C(=O)O,"MORIKAWA,K, YAMAUCHI,H AND ISO,T, MUTAGENICITY TESTS ON N-(2-MERCAPTO-2-METHYLPROPIONYL)-L-CYSTEINE (SA96), IYAKUHIN KENKYU 16(4):784-792,1985"
+194-69-4,EPA1,1,-1,,c1ccc2c(c1)ccc3c2ccc4ccc5ccccc5c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+158729-28-3,CCRIS,0,-1,,Clc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1Cl,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+92180-79-5,EPA1,1,-1,,Cc1nc2ccc3c(nc(N)n3C)c2nc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88-74-4,VITIC,0,-1,,Nc1ccccc1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+109-97-7,EPA1,0,-1,,c1cc[nH]c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2314-97-8,CCRIS,1,-1,,FC(F)(F)I,"DODD,DE, LEDBETTER,AD AND MITCHELL,AD, GENOTOXICITY TESTING OF THEHALON REPLACEMENT CANDIDATES TRIFLUOROIODOMETHANE (CF3I) AND1,1,1,2,3,3,3-HEPTAFLUOROPROPANE (HFC-227EA) USING THE SALMONELLA TYPHIMURIUMAND L5178Y MOUSE LYMPHOMA MUTATION ASSAYS AND THE MOUSE MICRONUCLEUS TEST,INHALATION TOXICOL. 9(2):111-131, 1997"
+161697-03-6,EPA1,1,-1,,Cc1nc2ccc(N)c(C)c2nc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2940-63-8,EPA1,0,-1,,COC1=CC(=O)C(=O)C(=C1)C(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59229-75-3,CCRIS,1,-1,,Cc1c(N)cc(cc1N)[N+](=O)[O-],"GEORGE,SE HUGGINS-CLARK,G AND BROOKS,LR, USE OF A SALMONELLAMICROSUSPENSION BIOASSAY TO DETECT THE MUTAGENICITY OF MUNITIONS COMPOUNDS ATLOW CONCENTRATIONS, MUTAT. RES. 490(1):45-56, 2001"
+68107-25-5,EPA3,1,-1,,C[C@H]1C[C@H]2OC(=O)[C@H](C)[C@H]2C[C@@]3(C)[C@H](O)C[C@H](O)C[C@H]13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+78415-72-2,EPA1,0,-1,"MILRINONE",Cc1nc(O)c(cc1c2ccncc2)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75321-20-9,EPA1,1,-1,,[O-][N+](=O)c1cc(c2ccc3cccc4ccc1c2c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+65734-38-5,EPA1,1,-1,,CC(=O)NNc1ccc(CO)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2234-13-1,VITIC,0,-1,,Clc1c(Cl)c(Cl)c2c(Cl)c(Cl)c(Cl)c(Cl)c2c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105708-67-6,CCRIS,1,-1,,CC(=O)OC1Cc2cc3cccc4ccc5ccc1c2c5c34,"ROGAN,EG, CAVALIERI,EL, WALKER,BA, BALASUBRAMANIAN,R, WISLOCKI,PG,ROTH,RW AND SAUGIER,RK, MUTAGENICITY OF BENZYLIC ACETATES, SULFATES AND BROMIDESOF POLYCYCLIC AROMATIC HYDROCARBONS, CHEM.-BIOL. INTERACT. 58(3):253-275,1986"
+6637-88-3,EPA1,1,-1,,Cc1cc(c(N)c(N=Nc2ccc(cc2C)c3ccc(N=Nc4ccc(O)c(c4)C(=O)O)c(C)c3)c1N)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-16-3,CCRIS,1,-1,,NNc1ccc(cc1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+NOCAS_M397,EPA1,0,-1,,CC[C@@H](C)[C@H](C)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19866-61-6,CCRIS,0,-1,,[O-][n+]1cc2cccnc2cn1,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+63390-12-5,EPA1,1,-1,,Nc1ccc(cc1Cl)c2cc(Cl)c(N)c(Cl)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142044-38-0,CCRIS,0,-1,,[O-][n+]1cccc2C3OC3C=Cc12,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+156-59-2,VITIC,0,-1,,Cl\C=C/Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+621-42-1,VITIC,0,-1,"ACAMPHEN3",CC(=O)Nc1cccc(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24305-27-9,CCRIS,0,-1,,NC(=O)C1CCCN1C(=O)C(Cc2c[nH]cn2)NC(=O)C3CCC(=O)N3,"ALLEN,JS AND PANFILI,J, AMES SALMONELLA/MAMMALIAN-MICROSOME TESTING OFPEPTIDES AND PEPTIDE SYNTHESIS REAGENTS, MUTAT. RES. 170(1-2):23-29,1986"
+60877-92-1,CCRIS,1,-1,,Oc1ccc(\C=N\c2snc3ccccc23)cc1,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+31125-05-0,CCRIS,1,-1,,CC(=O)c1ccc(cc1)N=O,"GUPTA,RL, SINGH,M AND JUNEJA,TR, MUTAGENICITY OF CERTAIN PARASUBSTITUTED NITROSOBENZENES - A STRUCTURE ACTIVITY RELATIONSHIP, INDIAN J. EXP.BIOL. 25(7):445-449, 1987"
+NOCAS_M280,EPA1,1,-1,,CC(C)NC[C@@H]1CCc2cc(CO)c(cc2N1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+80-15-9,VITIC,1,-1,"CUMENHPER",CC(C)(OO)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+82-33-7,EPA1,1,-1,,Nc1ccc(N)c2C(=O)c3c(cccc3[N+](=O)[O-])C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+139-13-9,VITIC,0,-1,"BINATRIGL,FENITRTAC,DR9506050,NITRILOTR",OC(=O)CN(CC(=O)O)CC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+303-98-0,CCRIS,0,-1,"UBIDECARE",COC1=C(OC)C(=O)C(=C(C)C1=O)C\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CCC=C(C)C,"IKEDA,K SUZUKI,Y AND YOSHIMURA,I, MUTAGENICITY OF COENZYME Q10, J.NUTR. SCI. VITAMINOL. 51(1):45-47, 2004."
+9003-53-6,EPA3,0,-1,,C[C@H](CCc1ccccc1)c2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+119631-01-5,EPA1,1,-1,,Cc1ccc2nc3cc(C)c(N)cc3nc2c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67-68-5,VITIC,0,-1,"DIMESULFO",CS(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+613-93-4,VITIC,0,-1,,CNC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3570-75-0,CCRIS,1,-1,"NIFURTHIA",[O-][N+](=O)c1oc(cc1)c2csc(NNC=O)n2,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+110-71-4,VITIC,1,-1,,COCCOC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78448-09-6,EPA1,1,-1,,Oc1cccc2c1ccc3[nH]c4ccc5ccccc5c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+812-00-0,VITIC,0,-1,,COP(=O)(O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+123-86-4,VITIC,0,-1,"BUACETATE",CCCCOC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2227-17-0,CCRIS,1,-1,,ClC1=C(Cl)C(Cl)(C(=C1Cl)Cl)C2(Cl)C(=C(Cl)C(=C2Cl)Cl)Cl,"MORIYA,M OHTA,T WATANABE,K MIYAZAWA,T KATO,K AND SHIRASU,Y, FURTHERMUTAGENICITY STUDIES ON PESTICIDES IN BACTERIAL REVERSION ASSAY SYSTEMS, MUTAT.RES. 116(3-4):185-216,1982"
+88598-57-6,EPA1,1,-1,,[O-][N+](=O)c1ccc2ccc3c4CCCCc4cc5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+530-78-9,EPA1,0,-1,"FLUFENAAL,FLUFENAMA",OC(=O)c1ccccc1Nc2cccc(c2)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+824-94-2,EPA1,0,-1,,COc1ccc(CCl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+632-21-3,EPA1,1,-1,,ClC(Cl)C(=O)C(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109897-80-5,CCRIS,0,-1,,OC1C(O)c2cc3ccc(cc3cc2CC1=O)[N+](=O)[O-],"FU,PP, HEFLICH,RH, VON TUNGELN,LS, YANG,DTC, FIFER,EK AND BELAND,FA,EFFECT OF THE NITRO GROUP CONFORMATION ON THE RAT LIVER MICROSOMAL METABOLISMAND BACTERIAL MUTAGENICITY OF 2- AND 9-NITROANTHRACENE, CARCINOGENESIS7(11):1819-1827, 1986"
+NOCAS_M112,EPA1,1,-1,,CC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+146177-62-0,EPA1,1,-1,,Cc1nc2c(C)c(C)c3c(nc(N)n3C)c2nc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16783-47-4,VITIC,1,-1,,C=CN=Nc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M328,EPA1,0,-1,,CN1C[C@@H](c2ccccc2)c3cccc(N)c3C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55804-66-5,EPA1,0,-1,,CCOC(=O)C1=Cc2cc3CCCN4CCCc(c2OC1=O)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+20426-12-4,CCRIS,0,-1,"DR9800115",Oc1ccc(\C=C\C(=O)c2ccccc2)cc1,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+35144-55-9,CCRIS,0,-1,,OC(=O)CC(NC(=O)COc1ccc(Cl)cc1Cl)C(=O)O,"RASHID,KA, BABISH,JG AND MUMMA,RO, POTENTIAL OF2,4-DICHLOROPHENOXYACETIC ACID COJUGATES AS PROMUTAGENS IN THESALMONELLA/MICROSOME MUTAGENICITY TEST, J. ENVIRON. SCI. HEALTH. PART BB19(8-9):689-701, 1984"
+533-73-3,EPA1,1,-1,,Oc1ccc(O)c(O)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+123-39-7,VITIC,0,-1,"MEFORMAMI",CNC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+163275-60-3,CCRIS,1,-1,,Fc1cccc2c1ccc3cccnc23,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+52278-77-0,CCRIS,0,-1,,NC1=NC(=O)N(C=C1O)C2CC(O)C(CO)O2,"ARASHIDANI,K, IWAMOTO-TANAKA,N, MURAOKA,M AND KASAI,H, GENOTOXICITY OFRIBO- AND DEOXYRIBONUCLEOSIDES OF 8-HYDROXYGUANINE, 5-HYDROXYCYTOSINE, AND2-HYDROXYADENINE: INDUCTION OF SCE IN HUMAN LYMPHOCYTES AND MUTAGENICITY INSALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 403(1-2):223-227, 1998"
+102791-34-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3cccc4C(=O)Oc1c2c34,"EL-BAYOUMY,K AND HECHT,SS, MUTAGENICITY OF K-REGION DERIVATIVES OF1-NITROPYRENE, REMARKABLE ACTIVITY OF 1- AND3-NITRO-5H-PHENANTHRO[4,5-BCD]PYRAN-5-ONE, MUTAT. RES. 170(1-2):31-40,1986"
+142713-67-5,CCRIS,0,-1,,CC(NCc1ccccc1)C(=O)NCc2ccccc2,"DOLZANI,L, TAMARO,M, LAGATOLLA,C, MONTI-BRAGADIN,C, CAVICCHIONI,G,MARCHETTI,P AND D'ANGELI,F, STRUCTURE-ACTIVITY RELATIONSHIP IN THE MUTAGENICEFFECT OF CHIRAL OR RACEMIC 2-BROMOPROPANAMIDES ON SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 19(4):311-315, 1992"
+83-26-1,VITIC,0,-1,"PINDONE",CC(C)(C)C(=O)C1C(=O)c2ccccc2C1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99-51-4,VITIC,1,-1,,Cc1ccc(cc1C)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4803-27-4,GENETOX,1,-1,"ANTRAMYCI",Cc1ccc2C(=O)N3C=C(CC3C(O)Nc2c1O)\C=C\C(=O)N,"PROC NATL ACAD SCI USA 70:782-786,1973"
+NOCAS_M451,EPA1,0,-1,,COC(=C1[C@H](C(=C(C)N=C1C)C(=O)OCC(=O)C)c2ccccc2[N+](=O)[O-])O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110004-65-4,CCRIS,1,-1,,CS(=O)(=O)Nc1ccc(Nc2c3ccc(cc3nc4cc(ccc24)N=N#N)N=N#N)cc1,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+606-31-5,EPA1,1,-1,,[O-][N+](=O)c1cccc(c1C=O)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88488-97-5,EPA1,1,-1,,Oc1ccc2c(c1)c3ccccc3c4cc5ccccc5cc24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60032-80-6,EPA1,1,-1,,C1CCc2c(C1)cc3c4ccccc4cc5c6ccccc6c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117549-85-6,CCRIS,0,-1,,N\C(=N/OC1OC(C(O)C(O)C1O)C(=O)O)\c2ccccc2,"CLEMENT,B CHRISTIANSEN,K AND GIRRESER,U, PHASE 2 METABOLITES OFN-HYDROXYLATED AMIDINES (AMIDOXIMES): SYNTHESIS, IN VITRO FORMATION BY PIGHEPATOCYTES, AND MUTAGENICITY TESTING, CHEM. RES. TOXICOL. 14(3):319-326,2000"
+66357-59-3,EPA1,0,-1,"RANTBICIT",CN\C(=C\[N+](=O)[O-])\NCCSCc1oc(CN(C)C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+118745-15-6,EPA1,1,-1,,O=Nc1c2ccccc2c3ccc4cccc5ccc1c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50-79-3,VITIC,0,-1,,OC(=O)c1cc(Cl)ccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+83435-67-0,EPA1,0,-1,"DELAPRIL,CV-3317",CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N(CC(=O)O)C2Cc3ccccc3C2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13177-31-6,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c3cccc4cccc(c12)c34,"VANCE,WA AND LEVIN,DE, STRUCTURAL FEATURES OF NITROAROMATICS THATDETERMINE MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM, ENVIRON. MUTAGEN.6(6):797-811, 1984"
+39720-27-9,EPA1,1,-1,,CC(=O)Oc1ccc(CCl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+315-30-0,VITIC,0,-1,"ALLOPURIN",Oc1[nH]cnc2nncc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95-55-6,VITIC,1,-1,"AMINOPHEO",Nc1ccccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+26541-51-5,EPA2,1,-1,,O=NN1CCSCC1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+1838-94-4,CCRIS,0,-1,,CC1(CO1)C=C,"GERVASI,PG, CITTI,L, DEL MONTE,M, LONGO,V AND BENETTI,D, MUTAGENICITYAND CHEMICAL REACTIVITY OF EPOXIDIC INTERMEDIATES OF THE ISOPRENE METABOLISM ANDOTHER STRUCTURALLY RELATED COMPOUNDS, MUTAT. RES. 156(1-2):77-82,1985"
+33448-26-9,EPA1,1,-1,,CNC1Cc2cccc3cccc(C1)c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75586-69-5,EPA1,1,-1,,C[n+]1c2ccccc2cc3cc(N)ccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84498-34-0,EPA1,0,-1,,Oc1cc2ccccc2c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91897-48-2,EPA1,1,-1,,CN1CC(=C[C@@H]2[C@H]1Cc3cn(CC=C)c4cccc2c34)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4261-14-7,EPA1,1,-1,"BZADENINE",Nc1ncnc2c1ncn2Cc3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25834-80-4,VITIC,1,-1,,Nc1ccc(Cc2ccc(N)c(Cc3ccc(N)cc3)c2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+542-56-3,VITIC,1,-1,"IBUNITRIT",CC(C)CON=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106871-13-0,EPA1,1,-1,,Cc1ccc(cc1N(CCCl)CCCl)C(O)(P(=O)(O)O)P(=O)(O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7492-66-2,EPA3,0,-1,,CCOC(OCC)\C=C(\C)/CCC=C(C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+94-58-6,EPA2,0,-1,,CCCc1ccc2OCOc2c1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+93957-55-2,EPA1,0,-1,,CC(C)n1c(\C=C\[C@H](O)C[C@@H](O)CC(=O)O)c(c2ccc(F)cc2)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53340-16-2,EPA1,1,-1,"DR9800521",CC[N+](=C1C=CC2=Nc3c(OC2=C1)cc(N)c4ccccc34)CC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2243-61-0,VITIC,1,-1,,Nc1ccc(N)c2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+20589-85-9,CCRIS,1,-1,,Cl\C=C(/Cl)\C(Cl)Cl,"NESTMANN,ER, LEE,EGH, MATULA,TI, DOUGLAS,GR AND MUELLER,JC,MUTAGENICITY OF CONSTITUENTS IDENTIFIED IN PULP AND PAPER MILL EFFLUENTS USINGTHE SALMONELLA/MAMMALIAN-MICROSOME ASSAY, MUTAT. RES. 79:203-212,1980"
+637-07-0,EPA1,0,-1,"CLOFIBRAT",CCOC(=O)C(C)(C)Oc1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54749-90-5,EPA2,1,-1,,OCC(O)C(O)C(O)C(NC(=O)N(CCCl)N=O)C=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+20324-66-7,CCRIS,1,-1,,Cc1cc(O)c2C(=O)c3c(O)cc(O)c(O)c3C(=O)c2c1,"MOROOKA,N, NAKANO,S, ITOI,N AND UENO,Y, THE CHEMICAL STRUCTURE AND THEMUTAGENICITY OF EMODIN METABOLITES, AGRIC. BIOL. CHEM. 54(5):1247-1252,1990"
+108-46-3,VITIC,0,-1,"RESORCINO",Oc1cccc(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+17526-24-8,EPA1,1,-1,,CC(=O)OCc1c2ccccc2cc3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54827-17-7,VITIC,0,-1,,Cc1cc(cc(C)c1N)c2cc(C)c(N)c(C)c2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+85-33-6,EPA1,1,-1,"LACTAROVI",CC(=C)c1ccc(C)c2ccc(C=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+144425-09-2,CCRIS,1,-1,,COc1ccc2cc(c3C=CC(=O)Oc3c2c1)[N+](=O)[O-],"SCHIMMER,O AND DREWELLO,U, 9-METHOXYTARIACURIPYRONE, A NATURALLYOCCURRING NITRO-AROMATIC COMPOUND WITH STRONG MUTAGENICITY IN SALMONELLATYPHIMURIUM, MUTAGENESIS 9(6):547-551, 1994"
+109237-00-5,CCRIS,0,-1,,CC(=O)C1=CCC2C3=CCC4=CC(O)C(O)CC4(C)C3CC(O)C12C,"DUH,CY, KINGHORN,AD AND PEZZUTO,JM, CELL-CYCLE SPECIFIC CYTOTOXICITYMEDIATED BY STIZOPHYLLIN(2ALPHA,3BETA,12BETA-TRIHYDROXYPREGNA-4,7,16-TRIEN-20-ONE), A NOVELELECTROPHILIC PREGNANE ISOLATED FROM STIZOPHYLLUM RIPARIUM, CHEM.-BIOL.INTERACT. 80(1):43-56, 1991"
+50-30-6,VITIC,0,-1,,OC(=O)c1c(Cl)cccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+118995-84-9,CCRIS,0,-1,,CC(C)(C)NC(=O)SCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O,"STAHL,W, DENKEL,E AND EISENBRAND,G, INFLUENCE OF GLUTATHIONE ON THEMUTAGENICITY OF 2-CHLOROETHYLNITROSOUREAS. MUTAGENIC POTENTIAL OF GLUTATHIONEDERIVATIVES FORMED FROM 2-CHLOROETHYLNITROSOUREAS AND GLUTATHIONE, MUTAT. RES.206(4): 459-465, 1988"
+556-08-1,VITIC,0,-1,"ACEDOBEN,DEANOACDB",CC(=O)Nc1ccc(cc1)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78-11-5,EPA2,0,-1,"PENTAERTN",[O-][N+](=O)OCC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+699-18-3,CCRIS,0,-1,,[O-][N+](=O)\C=C\c1occc1,"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+2880-58-2,EPA1,0,-1,,COC1=CC(=O)C=CC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115459-65-9,EPA1,1,-1,,[O-][N+](=O)c1ccc(cc1)C(=O)OC[C@H]2CO2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55936-77-1,EPA3,1,-1,,CN(OC(=O)C)c1ccc(cc1)N=Nc2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+17627-75-7,CCRIS,0,-1,,COc1ccc(\C=C\C)c(OC)c1,"RAMOS-OCAMPO,VE AND HSIA,MTS, MUTAGENICITY AND DNA-DAMAGING ACTIVITYOF CALAMUS OIL, ASARONE ISOMERS, AND DIMETHOXYPROPENYLBENZENE ANALOGUES,PHILLIP. ENTOMOL. 7(3):275-291, 1988"
+199536-65-7,CCRIS,1,-1,,ClC1=C(CBr)COC1=O,"LALONDE,RT, BU,L, HENWOOD,A, FIUMANO,J AND ZHANG,L, BROMINE-,CHLORINE-, AND MIXED HALOGEN-SUBSTITUTED 4-METHYL-2(5H)-FURANONES: SYNTHESIS ANDMUTAGENIC EFFECTS OF HALOGEN AND HYDROXYL GROUP REPLACEMENTS,CHEM. RES. TOXICOL.10(12):1427-1436, 1997"
+116530-07-5,CCRIS,1,-1,,Cc1cccc2ccc(cc12)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+NOCAS_M172,EPA1,1,-1,,O[C@@H]1CCO[P@](=O)(N1)N(CCCl)CCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+931-97-5,VITIC,0,-1,,OC1(CCCCC1)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+69839-83-4,EPA1,1,-1,"DIDOX,VF-147",ONC(=O)c1ccc(O)c(O)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5845-67-0,CCRIS,0,-1,"CYCLEUGLY",CC(C)CC1NC(=O)CNC1=O,"ALLEN,JS AND PANFILI,J, AMES SALMONELLA/MAMMALIAN-MICROSOME TESTING OFPEPTIDES AND PEPTIDE SYNTHESIS REAGENTS, MUTAT. RES. 170(1-2):23-29,1986"
+103-30-0,VITIC,0,-1,,C(=C\c1ccccc1)/c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+51857-25-1,CCRIS,1,-1,,Cc1c(cc(cc1[N+](=O)[O-])N=[N+]([O-])c2cc(c(C)c(c2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"GEORGE,SE HUGGINS-CLARK,G AND BROOKS,LR, USE OF A SALMONELLAMICROSUSPENSION BIOASSAY TO DETECT THE MUTAGENICITY OF MUNITIONS COMPOUNDS ATLOW CONCENTRATIONS, MUTAT. RES. 490(1):45-56, 2001"
+136112-70-4,CCRIS,1,-1,,Nc1nc(nc2c1ncn2c3ccc(cc3)[N+](=O)[O-])c4ccc(cc4)[N+](=O)[O-],"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+608-71-9,VITIC,0,-1,,Oc1c(Br)c(Br)c(Br)c(Br)c1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+57018-52-7,EPA3,1,-1,,C[C@@H](O)COC(C)(C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+50-76-0,EPA1,0,-1,,CC(C)[C@@H]1NC(=O)[C@@H](NC(=O)C2=C(N)C(=O)C(=C3Oc4c(C)ccc(C(=O)N[C@H]5[C@@H](C)OC(=O)[C@@H](C(C)C)N(C)C(=O)CN(C)C(=O)[C@@H]6CCCN6C(=O)[C@@H](NC5=O)C(C)C)c4N=C23)C)[C@H](C)OC(=O)[C@H](C(C)C)N(C)C(=O)CN(C)C(=O)[C@@H]7CCCN7C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+20917-49-1,EPA2,1,-1,,O=NN1CCCCCCC1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+80-09-1,EPA1,0,-1,,Oc1ccc(cc1)S(=O)(=O)c2ccc(O)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3237-50-1,VITIC,0,-1,,OC1(O)C(=O)NC(=O)NC1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+53716-49-7,CCRIS,0,-1,"CARPROFEN",CC(C(=O)O)c1ccc2c(c1)[nH]c3ccc(Cl)cc23,"KADOTANI,S, ARISAWA,M AND MARUYAMA,HB, MUTAGENICITY EXAMINATION OFSEVERAL NON- STEROIDAL ANTI-INFLAMMATORY DRUGS IN BACTERIAL SYSTEMS, MUTAT. RES.138(2-3): 133-136, 1984"
+NOCAS_M557,EPA1,0,-1,,CC[C@@H](CO)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+116505-53-4,CCRIS,1,-1,,OC(=O)CCCc1ccc(NCCCl)cc1,"FERGUSON,LR, PALMER,BD AND DENNY,WA, MICROBIAL MUTAGENICITY OFCHLORAMBUCIL, ITS HALF-MUSTARD AND MITOMYCIN C. A MODIFIED SCREENING STRATEGYFOR GENETIC TOXICOLOGY OF BIS-ALKYLATING ANTI-TUMOUR DRUGS, ANTI-CANCER DRUGDES. 3(1): 67-76, 1988"
+106-43-4,VITIC,0,-1,,Cc1ccc(Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+15826-37-6,EPA1,0,-1,"CROMOLYNN,CROMOLYN",OC(COc1cccc2OC(=CC(=O)c12)C(=O)O)COc3cccc4OC(=CC(=O)c34)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+191861-19-5,CCRIS,1,-1,,Fc1cc2cccnc2c3ncccc13,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+235760-37-9,VITIC,1,-1,,Cc1cc(C)c2nsnc2c1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105361-85-1,CCRIS,0,-1,,ONc1cccc(c1)c2ccccc2,"IOANNIDES,C, LEWIS,DFV, TRINICK,J, NEVILLE,S, SERTKAYA,NN, KAJBAF,MAND GORROD,JW, A RATIONALE FOR THE NON-MUTAGENICITY OF 2- AND 3-AMINOBIPHENYLS,CARCINOGENESIS 10(8):1403-1407, 1989"
+81-16-3,VITIC,1,-1,,Nc1ccc2ccccc2c1S(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+15307-79-6,EPA1,0,-1,"DICLOFENC,DICLOFDEA,DICLOFDIE,DICLDIOLA,DICLHOETP,DICLOFENK,DICLOFENA",OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133-32-4,EPA1,0,-1,"INDOLEBUT",OC(=O)CCCc1c[nH]c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106589-49-5,EPA1,1,-1,,C1Cc2ccc3nc4ccc5ccccc5c4cc3c2C=C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91254-93-2,CCRIS,1,-1,,Oc1cc2c(ccc3ccc4cccc1c4c23)[N+](=O)[O-],"SANGAIAH,R, RAMACHANDRAN,P, ZHANG,J AND BALL,LM, SYNTHESIS ANDBIOLOGICAL ACTIVITY OF METABOLITES OF ENVIRONMENTAL NITROARENES, POLYCYCLICAROMAT. COMPD. 11(1-4):283-290, 1996"
+88-06-2,VITIC,0,-1,,Oc1c(Cl)cc(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+534-22-5,VITIC,0,-1,,Cc1occc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+124-02-7,VITIC,0,-1,,C=CCNCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+534-52-1,CCRIS,0,-1,"DNOC",Cc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-],"HRELIA,P, VIGAGNI,F, MAFFEI,F, MOROTTI,M, COLACCI,A, PEROCCO,P,GRILLI,S AND CANTELLI-FORTI,G, GENETIC SAFETY EVALUATION OF PESTICIDES INDIFFERENT SHORT-TERM TESTS, MUTAT. RES. 321(4):219-228, 1994"
+10396-68-6,CCRIS,0,-1,,OC1COC(Nc2ccc(cc2)C(=O)O)C(O)C1O,"MERSCH-SUNDERMANN,V AND KRAEMER,H, THE INFLUENCE OF CULTURE CONDITIONSON THE SUSCEPTIBILITY OF SALMONELLA TYPHIMURIUM IN THE SALMONELLA MUTAGENICITYTEST, ZENTRALBL. HYG. UMWELTMED. 193(5):471-480, 1993"
+129833-03-0,CCRIS,0,-1,,CC(=O)C1(C)OC12C(=O)C=Cc3ccccc23,"ADAM,W, HAUER,H, MOSANDL,T, SAHA-MOELLER,CR, WAGNER,W AND WILD,D,FUROCOUMARIN-, NAPHTHOFURAN-, AND FUROQUINOLINE-ANNULATED 1,2-DIOXETANES:SYNTHESIS, THERMOLYSIS, AND MUTAGENICITY, LIEBIGS ANN. CHEM. (12):1227-1236,1990"
+16354-52-2,EPA1,0,-1,,CCc1c2ccccc2c(CC)c3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1072-83-9,EPA1,1,-1,"ACPYRROL2",CC(=O)c1ccc[nH]1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17626-02-7,CCRIS,1,-1,,COc1cc(N)c(OC)cc1N,"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+262-20-4,VITIC,0,-1,,O1c2ccccc2Sc3ccccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+257948-44-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(c1)c3nc4ccccc4c5c6ccccc6nc2c35,"UPTON,M AND UPTON,C, NOVEL NITRATED DERIVATIVES OF5,8-DIAZABENZO[C]-PHENANTHRENE AND 9,14-DIAZADIBENZ[A,E]ACEPHENANTHRYLENE:NEWCLASSES OF POTENT MUTAGENIC COMPOUNDS, MUTAGENESIS 14(6):587-593,1999"
+7213-59-4,EPA3,1,-1,,COc1cc2C(=O)c3cc(C)cc(O)c3C(=O)c2c(O)c1O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1121-55-7,CCRIS,0,-1,,C=Cc1cccnc1,"BRUNNEMANN,KD, RIVENSON,A, CHENG,SC, SAA,V AND HOFFMANN,D, A STUDY OFTOBACCO CARCINOGENESIS XLVII. BIOASSAYS OF VINYLPYRIDINES FOR GENOTOXICITY ANDFOR TUMORIGENICITY IN A/J MICE, CANCER LETT. 65(2):107-113, 1992"
+113-98-4,EPA3,0,-1,,CC1(C)S[C@@H]2[C@@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1606-67-3,EPA1,1,-1,,Nc1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5323-95-5,EPA1,0,-1,,CCCCCC[C@H](O)C\C=C/CCCCCCCC(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67616-44-8,CCRIS,1,-1,,OCCSN=O,"CARTER,MH AND JOSEPHY,PD, MUTAGENICITY OF THIONITRITES IN THE AMESTEST. THE BIOLOGICAL ACTIVITY OF THIYL FREE RADICALS,BIOCHEM. PHARMACOL.35(21):3847-3851, 1986"
+3844-63-1,EPA3,1,-1,,O=NN1CCNC1=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+41340-25-4,CCRIS,0,-1,"ETODOLAC",CCc1cccc2c3CCOC(CC)(CC(=O)O)c3[nH]c12,"IWAKURA,K, TAMURA,H, KITAYAMA,E, HAMASU,Y, NAGASAWA,H, SUMI,N ANDNOMURA,A, MUTAGENICITY STUDIES OF ETODOLAC. (1). REVERSE MUTATION TEST ONBACTERIA, OYO YAKURI 40(6):723-726, 1990"
+590-21-6,CCRIS,1,-1,,C\C=C\Cl,"SIMMON,VF, KAUHANEN,K AND TARDIFF,RG, MUTAGENIC ACTIVITY OF CHEMICALSIDENTIFIED IN DRINKING WATER, DEV. TOXICOL. ENVIRON. SCI. 2:249-258,1977"
+573-58-0,EPA1,1,-1,"CONGORED",Nc1c(cc(c2ccccc12)S(=O)(=O)O)N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M253,EPA1,1,-1,,[O-][N+](=O)c1ccc(OC[C@H]2CO2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+239-35-0,EPA1,1,-1,,c1ccc2c(c1)ccc3c4ccccc4sc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6358-23-2,VITIC,1,-1,,Oc1ccccc1Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+61695-74-7,EPA3,1,-1,,C1O[C@@H]1c2ccc3ccc4cccc5ccc2c3c45,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+79-46-9,EPA2,1,-1,"NITROPR-2",CC(C)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+1319-69-3,CCRIS,0,-1,"GLYCEROCA,GLYCEROFE,GLYCEROMG,GLYCEROMN,GLYCERPHO,GLYCEROPH",OCC(O)COP(=O)(O)O,"PRIVAL,MJ, SIMMON,VF AND MORTELMANS,KE, BACTERIAL MUTAGENICITY TESTINGOF 49 FOOD INGREDIENTS GIVES VERY FEW POSITIVE RESULTS, MUTAT. RES.260(4):321-329, 1991"
+1401-55-4,CCRIS,0,-1,,Oc1cc(cc(O)c1O)C(=O)OCC2OC(OC(=O)c3cc(O)c(OC(=O)c4cc(O)c(O)c(O)c4)c(O)c3)C(OC(=O)c5cc(O)c(O)c(O)c5)C(OC(=O)c6cc(O)c(O)c(O)c6)C2OC(=O)c7cc(O)c(O)c(O)c7,"WATANABE,K, SASAKI,T AND KAWAKAMI,K, COMPARISONS OF CHEMICALLY-INDUCEDMUTATION AMONG FOUR BACTERIAL STRAINS, SALMONELLA TYPHIMURIUM TA102 AND TA2638,AND ESCHERICHIA COLI WP2/PKM101 AND WP2 UVRA/PKM101: COLLABORATIVE STUDY III ANDEVALUATION OF THE USEFULNESS OF THESE STRAINS, MUTAT. RES. 416(3):169-181,1998"
+55-18-5,VITIC,1,-1,"NITROSODI",CCN(CC)N=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100-19-6,VITIC,1,-1,"DR9510451",CC(=O)c1ccc(cc1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+69866-21-3,CCRIS,0,-1,"CC-1065",COc1c(O)c2N(CCc2c3cc([nH]c13)C(=O)N4CCc5c4c(O)c(OC)c6[nH]c(cc56)C(=O)N7CC8CC89C7=CC(=O)c%10[nH]cc(C)c9%10)C(=O)N,"HARBACH,PR, TRZOS,RJ, MAZUREK,JH, ZIMMER,DM, PETZOLD,GL AND BHUYAN,BK,GENOTOXICITY OF THE ANTITUMOR ANTIBIOTIC CC-1065, MUTAGENESIS 1(6):407-410,1986"
+128753-82-2,CCRIS,1,-1,,COC12OOC1(C)Oc3ccccc23,"ADAM,W, ALBRECHT,O, FEINEIS,E, REUTHER,I, SAHA-MOELLER,CR,SEUFERT-BAUMBACH,P AND WILD,D, BENZOFURAN DIOXETANES, A NEW CLASS OF MUTAGENICAGENTS: SYNTHESIS BY PHOTOOXYGENATION OF BENZOFURAN DERIVATIVES,LIEBIGS ANN.CHEM. (1):33-40, 1991"
+2208-41-5,EPA1,0,-1,"OHMELATO6",COc1cc2c(CCNC(=O)C)c[nH]c2cc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39482-21-8,CCRIS,1,-1,,C[Si](C)(C)CN(N=O)C(=O)N,"HAKURA,A, KOHDA,K AND KAWAZOE,Y, STUDIES ON CHEMICAL CARCINOGENS ANDMUTAGENS. XXXIX. MUTAGENIC N-TRIMETHYLSILYLMETHYL-N-NITROSOUREA AS A BIOLOGICALALKYLATING AGENT EQUIVALENT TO N-METHYL-N-NITROSOUREA (MNU), MUTAT. RES.157(1):87-93, 1985"
+51483-40-0,EPA1,1,-1,,ClC(CBr)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+620-89-3,CCRIS,1,-1,,Cc1ccc(Nc2ccc(cc2)[N+](=O)[O-])cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, MUTAGENICITY OF THE ANTISCHISTOSOMALAGENT AMOSCANATE AND ITS HYDROLYTIC AND RELATED PARA SUBSTITUTED4-NITRODIPHENYLAMINE PRODUCTS, MED. SCI. RES. 20(10):365-368, 1992"
+NOCAS_M555,EPA1,0,-1,,CC(C)OC(=O)C[C@@](O)(CC(=O)O)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134-03-2,EPA1,0,-1,"ASCORBATE,ASCORBBIS,ASCORBACA,FE2ASCORB,MAGNESACS,ASCORBAMN,ASCORBATK,ASCORBANA",OC[C@H](O)[C@H]1OC(=C(O)C1=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M27,EPA1,1,-1,,O[C@H]1C=C2c3ccc4ccccc4c3c5cccc([C@@H]1O)c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55738-54-0,EPA2,1,-1,,CN(C)CNc1oc(\C=C\c2oc(cc2)[N+](=O)[O-])nn1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+57-57-8,VITIC,1,-1,"PROPIOLAC",O=C1CCO1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+65-45-2,VITIC,0,-1,"SALICYLAM",NC(=O)c1ccccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+15104-03-7,EPA3,1,-1,,CC1CCN(CC1)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+18715-54-3,CCRIS,1,-1,,C[Si](C)(CCCOCC1CO1)c2ccc(cc2)[Si](C)(C)CCCOCC3CO3,"SCHWEIKL,H SCHMALZ,G AND WEINMANN,W MUTAGENIC ACTIVITY OF STRUCTURALLYRELATED OXIRANES AND SILORANES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.521(1-2):19-27, 2002"
+NOCAS_M205,EPA1,1,-1,,CC(C)(C)OC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89-75-8,EPA1,1,-1,,ClC(=O)c1ccc(Cl)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105-67-9,EPA3,1,-1,"DR0003885",Cc1ccc(O)c(C)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+6098-44-8,EPA1,1,-1,,CC(=O)ON(C(=O)C)c1ccc2c(Cc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2432-99-7,VITIC,0,-1,,NCCCCCCCCCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+689-98-5,CCRIS,1,-1,"DR9602185",NCCCl,"STAHL,W, DENKEL,E AND EISENBRAND,G, INFLUENCE OF GLUTATHIONE ON THEMUTAGENICITY OF 2-CHLOROETHYLNITROSOUREAS. MUTAGENIC POTENTIAL OF GLUTATHIONEDERIVATIVES FORMED FROM 2-CHLOROETHYLNITROSOUREAS AND GLUTATHIONE, MUTAT. RES.206(4): 459-465, 1988"
+1127-45-3,CCRIS,0,-1,,Oc1cccc2ccc[n+]([O-])c12,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+26227-73-6,EPA3,1,-1,,CCCCc1ccc(cc1)\N=C/c2ccc(OC)cc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+83-67-0,VITIC,0,-1,"THEOBSANA,THEOBROMI,THEOBSACA",CN1C(=O)NC(=O)c2c1ncn2C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+19213-09-3,CCRIS,0,-1,"DEETBUCET",CC(O)CC(=O)Nc1ccc(O)cc1,"NOHMI,T, ISHIDATE,M,JR, HIRATSUKA,A AND WATABE,T, MECHANISM OFMETABOLIC ACTIVATION"
+62-23-7,CCRIS,1,-1,"JM-290,NITROBEZP",OC(=O)c1ccc(cc1)[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+5711-16-0,CCRIS,0,-1,,CC1CC23CCC4C(C)(CCCC4(C)C(=O)O)C2CCC1(O)C3,"PEZZUTO,JM, COMPADRE,CM, SWANSON,SM, NANAYAKKARA,NPD AND KINGHORN,AD,METABOLICALLY ACTIVATED STEVIOL, THE AGLYCONE OF STEVIOSIDE, IS MUTAGENIC, PROC.NATL. ACAD. SCI. U. S. A. 82(8):2478-2482, 1985"
+765-87-7,EPA1,1,-1,"CYCLOHE12",O=C1CCCCC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6728-26-3,CCRIS,1,-1,"DR9604934",CCC\C=C\C=O,"EDER,E, DEININGER,C, NEUDECKER,T AND DEININGER,D, MUTAGENICITY OFBETA-ALKYL SUBSTITUTED ACROLEIN CONGENERS IN THE SALMONELLA TYPHIMURIUM STRAINTA100 AND GENOTOXICTY TESTING IN THE SOS CHROMOTEST, ENVIRON. MOL. MUTAGEN.19(4):338-345, 1992"
+158729-25-0,CCRIS,0,-1,,[O-][N+](=O)c1cccc(NS(=O)(=O)c2cccc3cccnc23)c1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+565-64-0,CCRIS,0,-1,,OC(=O)C(Cl)CCl,"WATANABE,K, SAKAMOTO,K AND SASAKI,T, COMPARISONS ON CHEMICALLY-INDUCEDMUTAGENICITY AMONG FOUR BACTERIAL STRAINS, SALMONELLA TYPHIMURIUM TA102 ANDTA2638, AND ESCHERICHIA COLI WP2/PKM101 AND WP2 UVRA/PKM101: COLLABORATIVE STUDY1, MUTAT. RES. 361(2-3):143-155, 1996"
+107-02-8,EPA1,1,-1,"ACROLEIN",C=CC=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+146795-43-9,CCRIS,1,-1,,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2Br,"HRELIA,P, VIGAGNI,F, MOROTTI,M, FORTI,GC, BARBIERI,CL, SPINELLI,D ANDLAMARTINA,L, MECHANISM OF GENOTOXICITY AND ELECTRON DENSITY DISTRIBUTION BY NMROF 5-NITRO-3-THIOPHENECARBOXAMIDES, A NOVEL GROUP OF DIRECT-ACTING MUTAGENS INSALMONELLA TYPHIMURIUM, CHEM.-BIOL. INTERACT. 86(3):229-254, 1993"
+137-66-6,CCRIS,0,-1,"ISOASCPAL",CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(=C(O)C1=O)O,"PRIVAL,MJ, SIMMON,VF AND MORTELMANS,KE, BACTERIAL MUTAGENICITY TESTINGOF 49 FOOD INGREDIENTS GIVES VERY FEW POSITIVE RESULTS, MUTAT. RES.260(4):321-329, 1991"
+107793-72-6,CCRIS,0,-1,"IOXILAN",CC(=O)N(CC(O)CO)c1c(I)c(C(=O)NCCO)c(I)c(C(=O)NCC(O)CO)c1I,"MISHIMA,M, HORIUCHI,K, FUKUDA,T, HASEGAWA,T AND INOUE,M, A REVERSEMUTATION TEST OF IOXILAN IN BACTERIA, YAKURI TO CHIRYO 21(SUPPL. 6):S1571-S1574,1993"
+68641-49-6,EPA1,1,-1,,ClP(=O)(N1CCOC1=O)N2CCOC2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+62674-12-8,EPA1,1,-1,,ClC1=C(Cl)C(=O)OC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71721-78-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2Oc3cc(Cl)c(Cl)cc3Oc2c1,"DONNELLY,KC, JONES,DH AND SAFE,S, THE BACTERIAL MUTAGENICITY OFNITROPOLYCHLORINATED DIBENZO-P-DIOXINS, MUTAT. RES. 169(1-2):17-22,1986"
+98640-41-6,CCRIS,0,-1,,NC(CSC(F)(F)C(F)(F)C(F)F)C(=O)O,"GREEN,T AND ODUM,J, STRUCTURE/ACTIVITY STUDIES OF THE NEPHROTOXIC ANDMUTAGENIC ACTION OF CYSTEINE CONJUGATES OF CHLORO AND FLUOROALKENES, CHEM. BIOL.INTERACT. 54(1):15-31, 1985"
+7700-17-6,EPA3,0,-1,,COP(=O)(OC)O\C(=C/C(=O)O[C@@H](C)c1ccccc1)\C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+611-13-2,EPA1,0,-1,,COC(=O)c1occc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+623-05-2,EPA1,0,-1,"DR9600341",OCc1ccc(O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M542,EPA1,0,-1,,CCCC[C@@H](CC)COP(=O)(Oc1ccccc1)Oc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1148-79-4,EPA1,1,-1,,c1ccc(nc1)c2cccc(n2)c3ccccn3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+93535-04-7,EPA1,1,-1,,Nc1ccc(\C=C\c2cccc(Cl)c2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-57-7,EPA1,0,-1,,CS(=O)(=O)c1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-26-8,VITIC,0,-1,"PYRIDOSTG,PYRIDOSTI",CN(C)C(=O)Oc1ccc[n+](C)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+500-38-9,CCRIS,0,-1,"NORDIHGUA",CC(Cc1ccc(O)c(O)c1)C(C)Cc2ccc(O)c(O)c2,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y85"
+195-27-7,CCRIS,0,-1,,c1ccc2c(c1)ncc3cnc4ccccc4c23,"UPTON,M AND UPTON,C, NOVEL NITRATED DERIVATIVES OF5,8-DIAZABENZO[C]-PHENANTHRENE AND 9,14-DIAZADIBENZ[A,E]ACEPHENANTHRYLENE:NEWCLASSES OF POTENT MUTAGENIC COMPOUNDS, MUTAGENESIS 14(6):587-593,1999"
+107-13-1,VITIC,1,-1,"ACRYLONIT",C=CC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+22769-68-2,CCRIS,0,-1,"DR9604502",COC(=O)Nc1nc2cc(O)ccc2[nH]1,"SARRIF,AM, ARCE,GT, KRAHN,DF, O'NEIL,RM AND REYNOLDS,VL, EVALUATION OFCARBENDAZIM FOR GENE MUTATIONS IN THE SALMONELLA/AMES PLATE-INCORPORATION ASSAY:THE ROLE OF AMINOPHENAZINE IMPURITIES, MUTAT. RES. 321(1-2):43-56,1994"
+3414-62-8,EPA1,1,-1,,OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(NO)ncnc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2481-94-9,EPA1,0,-1,,CCN(CC)c1ccc(cc1)N=Nc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+104-28-9,EPA3,0,-1,,CCOCCOC(=O)\C=C/c1ccc(OC)cc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+934-32-7,EPA3,0,-1,"DR0005832",Nc1nc2ccccc2[nH]1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+73-22-3,EPA3,0,-1,,N[C@H](Cc1c[nH]c2ccccc12)C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+6367-36-8,CCRIS,1,-1,,CC(C)(C)OC(=O)CN=N#N,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+3442-62-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc2nc3ccccc3nc2c1,"WATANABE,T, HANASAKI,Y, HIRAYAMA,T AND FUKUI,S, MUTAGENICITY OF NITRO-AND AMINO-SUBSTITUTED PHENAZINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.225(3):75-82, 1989"
+3694-52-8,CCRIS,1,-1,,Nc1cccc(c1N)[N+](=O)[O-],"CHUNG,KT, MURDOCK,CA, ZHOU,Y, STEVENS,SE, LI,YS, WEI,CI, FERNANDO,SYAND CHOU,MW, EFFECTS OF THE NITRO GROUP ON THE MUTAGENICITY AND TOXICITY OF SOMEBENZAMINES, ENVIRON. MOL. MUTAGEN. 27(1):67-74, 1996"
+99240-66-1,CCRIS,1,-1,,CCN(C(=O)C)c1ccc2c(Cc3ccccc23)c1,"CREBELLI,R AND IORIO,MA, CHEMISTRY AND IN VITRO MUTAGENICITY OF2-AMINOFLUORENE DERIVATIVES, CHEM.-BIOL. INTERACT. 54(1):71-83, 1985"
+NOCAS_M303,EPA1,1,-1,,C[C@H](I)[C@@H]1OC[C@@H](CO)O1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133591-33-0,EPA1,1,-1,,Cc1cc(c(C)c2c3ccccc3[nH]c12)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105579-74-6,CCRIS,1,-1,,Oc1ccc2C3C4OC4C(=O)c5c(O)ccc(C6C7OC7C(=O)c1c26)c35,"STACK,ME AND PRIVAL,MJ, MUTAGENICITY OF THE ALTERNARIA METABOLITESALTERTOXINS I, II AND III, APPL. ENVIRON. MICROBIOL. 52(4):718-722,1986"
+142-09-6,VITIC,0,-1,,CCCCCCOC(=O)C(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+61439-60-9,VITIC,1,-1,,CS(=O)(=O)OCCc1ccc(OCc2ccccc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5956-39-8,CCRIS,0,-1,"EPIPOLYGO",CC1(C)CCCC2(C)C1CC=C(C=O)C2C=O,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+106-40-1,VITIC,0,-1,,Nc1ccc(Br)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1718-34-9,EPA3,1,-1,"ALIZARIYR",OC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+160543-16-8,CCRIS,0,-1,,Cc1ccc2nc3c4ccccc4C(O)C(O)c3c(C)c2c1,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+2642-98-0,EPA1,1,-1,"CHRYSENAM",Nc1cc2c3ccccc3ccc2c4ccccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131229-64-6,CCRIS,1,-1,,CCCCON(OC(=O)C)C(=O)c1ccc(cc1)[N+](=O)[O-],"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+75005-80-0,CCRIS,0,-1,,NC(CSc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl)C(=O)O,"VAMVAKAS,S, BERTHOLD,K, DEKANT,W AND HENSCHLER,D, BACTERIAL CYSTEINECONJUGATE BETA-LYASE AND THE METABOLISM OF CYSTEINE S-CONJUGATES. STRUCTURALREQUIREMENTS FOR THE CLEAVAGE OF S-CONJUGATES AND THE FORMATION OF REACTIVEINTERMEDIATES, CHEM.-BIOL. INTERACT. 65(1):59-71, 1988"
+109-06-8,EPA1,0,-1,"PICOLINAL,DR9604326",Cc1ccccn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+158729-27-2,CCRIS,0,-1,,Clc1ccc(NS(=O)(=O)c2cccc3cccnc23)c(Cl)c1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+31566-31-1,VITIC,0,-1,"MONOSTEAR",CCCCCCCCCCCCCCCCCC(=O)OCC(O)CO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105650-23-5,EPA1,1,-1,,Cn1c(N)nc2ncc(cc12)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7230-71-9,EPA1,1,-1,,Cc1ccc2cc3ccc4ccccc4c3nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1119-48-8,CCRIS,0,-1,,CNCCCC(=O)O,"WELLS,DA, THOMAS,HF AND DIGENIS,GA, MUTAGENICITY AND CYTOTOXICITY OFN-METHYL-2-PYRROLIDINONE AND 4-(METHYLAMINO)BUTANOIC ACID IN THESALMONELLA/MICROSOME ASSAY, J. APPL. TOXICOL. 8(2):135-139, 1988"
+14371-10-9,EPA3,1,-1,,O=C\C=C/c1ccccc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+56-23-5,VITIC,0,-1,"TETRA",ClC(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+104-54-1,CCRIS,0,-1,"CINNAMALC",OC\C=C\c1ccccc1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+96-48-0,VITIC,0,-1,"BUTYROLAC",O=C1CCCO1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+66291-31-4,EPA1,0,-1,,Cc1ccc2ccc3ccccc3c2c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+42200-33-9,CCRIS,0,-1,,CC(C)(C)NCC(O)COc1cccc2CC(O)C(O)Cc12,"HUSSAIN,SS, AL-DAKAN,AA, ABOUL-ENEIN,HY AND HANNAN,MA, DNA STRANDBREAKS AND MUTATIONS CAUSED BY PENBUTOLOL, A BETA BLOCKER, MUTAT. RES.204(4):675-682, 1988"
+133762-84-2,CCRIS,1,-1,,COC1=NC(=O)N(CC(O)CN=N#N)C=C1C,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+598-57-2,CCRIS,0,-1,,CN[N+](=O)[O-],"FREI,E, POOL,BL, PLESCH,W AND WIESSLER,M, BIOCHEMICAL AND BIOLOGICALPROPERTIES OF PROSPECTIVE N-NITRODIALKYLAMINE METABOLITES AND THEIR DERIVATIVES,IARC SCI. PUBL. 57(N-NITROSO COMPD: OCCURRENCE, BIOL. EFF. RELEVANCE HUM.CANCER):491-497, 1984"
+2520-60-7,VITIC,0,-1,,CC(=CCC1CCCC1=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+225366-91-6,CCRIS,1,-1,,Fc1ccc2ncccc2c1F,"KATO,T, SAEKI,K, KAWAZOE,Y AND HAKURA,A, EFFECTS OF OLIGOFLUORINESUBSTITUTION ON THE MUTAGENICITY OF QUINOLINE: A STUDY WITH TWELVEFLUOROQUINOLINE DERIVATIVES, MUTAT. RES. 439(2):149-157, 1999"
+6201-87-2,VITIC,0,-1,,Nc1cc(C(=O)O)c(O)c(c1)S(=O)(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+80-05-7,VITIC,0,-1,"BISPHENOA",CC(C)(c1ccc(O)cc1)c2ccc(O)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+71711-58-5,EPA1,1,-1,,Cc1c(C)c2c(N)c3ccccc3nc2c4ccccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53527-28-9,CCRIS,0,-1,,CC(=O)OC1CC2C3(C)CCCC(C)(C)C3CCC2(C)C4CC=C(C=O)C(C=O)C14C,"STERNER,O, CARTER,RE AND NILSSON,LM, STRUCTURE-ACTIVITY RELATIONSHIPSFOR UNSATURATED DIALDEHYDES 1. THE MUTAGENIC ACTIVITY OF 18 COMPOUNDS IN THESALMONELLA/MICROSOME ASSAY, MUTAT. RES. 188(3):169-174, 1987"
+4332-51-8,EPA1,1,-1,,ClCCSCc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68395-77-7,EPA1,1,-1,,Cc1cc(C)cc(NO)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155014-05-4,CCRIS,1,-1,,Nc1cccc2ncc(F)cc12,"SAEKI,K, KAMIYA,M, SENGOKU,Y, TAKAHASHI,K AND KAWAZOE,Y, MUTAGENICITYOF FLUORINE-SUBSTITUTED AMINOQUINOLINES, HEN'IGENSEI SHIKEN 2(4):234-238,1993"
+125486-24-0,EPA1,1,-1,,CCN(CCCl)c1ccc(CCCNc2c3ccccc3nc4ccccc24)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-91-8,VITIC,0,-1,"MORPHOLIN",C1COCCN1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+6756-41-8,EPA1,0,-1,,Cc1ccc(cc1)N=Nc2c(O)ccc3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+113202-71-4,CCRIS,1,-1,,O=Nc1cc2c3ccccc3ccc2c4ccccc14,"EL-BAYOUMY,K, DELCLOS,KB, HEFLICH,RH, WALKER,R, SHIUE,GH AND HECHT,SS,MUTAGENICITY, METABOLISM AND DNA ADDUCT FORMATION OF 6-NITROCHRYSENE INSALMONELLA TYPHIMURIUM, MUTAGENESIS 4(3):235-240, 1989"
+551-06-4,VITIC,1,-1,"NAPHISOTH",S=C=Nc1cccc2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+109032-48-6,CCRIS,1,-1,,CNC(=O)Oc1cc2ccccc2c3ccccc13,"NARBONNE,JF, CASSAND,P, ALZIEU,P, GROLIER,P, MRLINA,G AND CALMON,JP,STRUCTURE-ACTIVITY RELATIONSHIPS OF THE N-METHYLCARBAMATE SERIES IN SALMONELLATYPHIMURIUM, MUTAT. RES. 191(1):21-27, 1987"
+517-28-2,EPA1,0,-1,,Oc1cc2C[C@@]3(O)COc4c(O)c(O)ccc4[C@@H]3c2cc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+215-58-7,EPA1,1,-1,,c1ccc2cc3c4ccccc4c5ccccc5c3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155164-62-8,CCRIS,0,-1,,ClC1=C(Cl)C(=O)N(N=C1)S(=O)(=O)c2ccc(Cl)cc2Cl,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+6673-35-4,CCRIS,0,-1,"PRACTOLOL,PRACTOHCL",CC(C)NCC(O)COc1ccc(NC(=O)C)cc1,"OKINE,LKN, IOANNIDES,C AND PARKE,DV, STUDIES ON THE POSSIBLEMUTAGENICITY OF BETA-ADRENERGIC BLOCKER DRUGS, TOXICOL. LETT. 16(3-4):167-174,1983"
+1985-51-9,EPA1,0,-1,,CC(=C)C(=O)OCC(C)(C)COC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125761-28-6,CCRIS,1,-1,,CC(=O)OC1C(O)C(OC(=O)\C=C\c2ccc(O)cc2)C(CO)OC1OC34CC(C)(C)C(=O)C3C(C)(O)C5(CC5)C(=C4)C,"NAGAO,T, SAITO,K, HIRAYAMA,E, UCHIKOSHI,K, KOYAMA,K, NATORI,S,MORISAKI,N, IWASAKI,S AND MATSUSHIMA,T, MUTAGENICITY OF PTAQUILOSIDE, THECARCINOGEN IN BRACKEN, AND ITS RELATED ILLUDANE-TYPE SESQUITERPENES. I.MUTAGENICITY IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 215(2):173-8,1989"
+90-65-3,GENETOX,1,-1,,CO\C(=C/C(=O)O)\C(=O)C(=C)C,"MUTAT RES 31:347-364,1975"
+110336-19-1,CCRIS,0,-1,,O=C1CCc2ccc3ccc4ccccc4c3c12,"MARROCCHI,A, MINUTI,L, MOROZZI,G, PAMPANELLA,L AND TATICCHI,A,SYNTHESIS AND MUTAGENICITY OF SOME CYCLO[C]PHENANTHRENES ANDINDENO[C]PHENANTHRENES, CARCINOGENESIS 17(9):2009-2012, 1996"
+142-96-1,VITIC,0,-1,,CCCCOCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+63885-23-4,CCRIS,1,-1,,CCNC(=N)N(N=O)[N+](=O)[O-],"YAMADA,M, MATSUI,K, SOFUNI,T AND NOHMI,T, NEW TESTER STRAINS OFSALMONELLA TYPHIMURIUM LACKING O6-METHYLTRANSFERASES AND HIGHLY SENSITIVE TOMUTAGENIC ALKYLATING AGENTS, MUTAT. RES. 381(1):15-24, 1997"
+161697-02-5,EPA1,1,-1,,CNc1ccc2ncc(nc2c1C)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78-51-3,VITIC,0,-1,,CCCCOCCOP(=O)(OCCOCCCC)OCCOCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+58-08-2,VITIC,0,-1,"CAFFEINE,CAFFEINHI,CAFNABENZ,DR9504023,CAFFEINSA,CAFFEINCI,CAFNAPHNA",CN1C(=O)N(C)c2ncn(C)c2C1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3175-89-1,CCRIS,1,-1,,CN1CCc2cc3OCOc3c4c5ccccc5C(O)C1c24,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+115-11-7,VITIC,0,-1,,CC(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+129833-00-7,CCRIS,1,-1,,CC1=CC(=O)Oc2c3OC4(C)OOC4(C)c3ccc12,"ADAM,W, HAUER,H, MOSANDL,T, SAHA-MOELLER,CR, WAGNER,W AND WILD,D,FUROCOUMARIN-, NAPHTHOFURAN-, AND FUROQUINOLINE-ANNULATED 1,2-DIOXETANES:SYNTHESIS, THERMOLYSIS, AND MUTAGENICITY, LIEBIGS ANN. CHEM. (12):1227-1236,1990"
+104-88-1,VITIC,0,-1,,Clc1ccc(C=O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+35300-54-0,EPA1,1,-1,,CCCC(=O)OCc1ccc(cc1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142713-66-4,CCRIS,0,-1,,CC(Br)C(=O)NC(C)(C)C,"DOLZANI,L, TAMARO,M, LAGATOLLA,C, MONTI-BRAGADIN,C, CAVICCHIONI,G,MARCHETTI,P AND D'ANGELI,F, STRUCTURE-ACTIVITY RELATIONSHIP IN THE MUTAGENICEFFECT OF CHIRAL OR RACEMIC 2-BROMOPROPANAMIDES ON SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 19(4):311-315, 1992"
+80-78-4,CCRIS,0,1,,CC1CCC2C(C)C3C(CC4C5CC=C6CC(O)CCC6(C)C5CCC34C)N2C1,"FRIEDMAN,M AND HENIKA,PR, ABSENCE OF GENOTOXICITY OF POTATO ALKALOIDSALPHA- CHACONINE, ALPHA-SOLANINE, AND SOLANIDINE IN THE AMES SALMONELLA ANDADULT AND FETAL ERYTHROCYTE MICRONUCLEUS ASSAYS, FOOD CHEM. TOXICOL.30(8):689-694, 1992"
+188970-84-5,CCRIS,1,-1,,Oc1cccc2c1ccc3[nH]c4cc(c5ccccc5c4c23)[N+](=O)[O-],"XUE,W, LADOW,K AND WARSHAWSKY,D, SYNTHESIS, CHARACTERIZATION, ANDMUTAGENICITY OF NITRATED 7H-DIBENZO[C,G]CARBAZOLE AND ITS PHENOLIC DERIVATIVES,CHEM. RES. TOXICOL. 10(4):432-438, 1997"
+74339-98-3,CCRIS,1,-1,,OC1C=Cc2c(cc3c4ccccc4cc5c6ccccc6c2c35)C1O,"MALAVEILLE,C, HAUTEFEUILLE,A, PERIN-ROUSSEL,O, SAGUEM,S,CROISY-DELCEY,M, ZAJDELA,F AND BARTSCH,H, POSSIBLE INVOLVEMENT OF A VICINAL,NON-BAY-REGION DIHYDRODIOL EPOXIDE IN THE ACTIVATION OF DIBENZO[A,E]FLUORANTHENEINTO BACTERIAL MUTAGENS, CARCINOGENESIS 5(10):1263-1266, 1984"
+56892-30-9,EPA3,1,-1,,Oc1cc2ccc3cc4ccccc4c5ccc(c1)c2c35,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+99520-67-9,CCRIS,0,-1,,Oc1c2c3ccccc3c4ccc5ccc6cccc1c6c5c24,"RICE,JE, COLEMAN,DT, HOSTED,TJ JR, LAVOIE,EJ, MCCAUSTLAND,DJ ANDWILEY,JC JR, IDENTIFICATION OF MUTAGENIC METABOLITES OF INDENO[1,2,3-CD]PYRENEFORMED IN VITRO WITH RAT LIVER ENZYMES, CANCER RES. 45(11, PT. 1):5421-5425,1985"
+110963-29-6,CCRIS,1,-1,,NNC(=O)c1[nH]c2ccccc2c1N,"LOPEZ-DE-CERAIN,A, GARCIA,E AND GULLON,A, INFLUENCE OF THE TRIAZINERING ON THE MUTAGENICITY OF TRIAZINOINDOLES AND SOME CONGENERS, MUTAGENESIS7(1):37-39, 1992"
+138154-39-9,CCRIS,1,-1,"DR9602740",CCN(CC)CCNc1ccc2ncn3c4ccc(O)cc4C(=O)c1c23,"BERGER,B, MARQUARDT,H AND WESTENDORF,J, PHARMACOLOGICAL ANDTOXICOLOGICAL ASPECTS OF NEW IMIDAZOACRIDINONE ANTITUMOR AGENTS, CANCER RES.56(9):2094-2104, 1996"
+17928-28-8,VITIC,0,-1,,C[Si](C)(C)O[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+56548-64-2,CCRIS,1,-1,,CCN(CC)c1cc(NC(=O)C)c(cc1OC)N=Nc2c(Br)cc(cc2[N+](=O)[O-])[N+](=O)[O-],"UMBUZEIRO,GDA FREEMAN,H WARREN,SH KUMMROW,F AND CLAXTON,LD,MUTAGENICITY EVALUATION OF THE COMMERICAL PRODUCT CI DISPERSE BLUE 291 USINGDIFFFERENT PROTOCOLS OF THE SALMONELLA ASSAY, FOOD CHEM. TOXICOL. 43(1):49-56,2004"
+2270-40-8,CCRIS,0,-1,,CC(=O)OCC12CCC(=CC1OC3C(O)C(OC(=O)C)C2(C)C34CO4)C,"LAFONT,J, ROMAND,A AND LAFONT,P, EFFECTS OF MYCOTOXINS ON BACTERIALGENETICS, MICROBIOL., ALIMENTS, NUTR. 1(3):251-258, 1983"
+33237-74-0,EPA1,0,-1,"APRINDINE,APRINDHCL",CCN(CC)CCCN(C1Cc2ccccc2C1)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56-72-4,VITIC,0,-1,"COUMAFOS",CCOP(=S)(OCC)Oc1ccc2C(=C(Cl)C(=O)Oc2c1)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95-94-3,VITIC,0,-1,,Clc1cc(Cl)c(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4539-51-9,EPA1,1,-1,,Nc1ccc2c(c1)[nH]c3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7177-48-2,EPA3,0,-1,,CC1(C)S[C@@H]2[C@@H](NC(=O)[C@@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+141511-31-1,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(ccc3cc4c(ccc5ccccc45)cc23)c1,"YU,S, HERRENO-SAENZ,D, MILLER,DW, KADLUBAR,FF AND FU,PP, MUTAGENICITYOF NITRO- POLYCYCLIC AROMATIC HYDROCARBONS WITH THE NITRO SUBSTITUENT SITUATEDAT THE LONGEST MOLECULAR AXIS, MUTAT. RES. 283(1):45-52, 1992"
+7437-61-8,CCRIS,0,-1,,CC(=C)C1CO1,"GERVASI,PG, CITTI,L, DEL MONTE,M, LONGO,V AND BENETTI,D, MUTAGENICITYAND CHEMICAL REACTIVITY OF EPOXIDIC INTERMEDIATES OF THE ISOPRENE METABOLISM ANDOTHER STRUCTURALLY RELATED COMPOUNDS, MUTAT. RES. 156(1-2):77-82,1985"
+74011-58-8,EPA1,1,-1,"ENOXACIN",CCN1C=C(C(=O)O)C(=O)c2cc(F)c(nc12)N3CCNCC3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+479-79-8,CCRIS,0,-1,,O=C1c2ccccc2c3ccc4ccccc4c13,"MOELLER,M, HAGEN,I AND RAMDAHL,T, MUTAGENICITY OF POLYCYCLIC AROMATICCOMPOUNDS (PAC) IDENTIFIED IN SOURCE EMISSIONS AND AMBIENT AIR, MUTAT. RES.157(2-3): 149-156, 1985"
+470-82-6,EPA1,0,-1,,C[C@@]12CC[C@@H](CC1)C(C)(C)O2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97-77-8,VITIC,0,-1,"DISULFIRA",CCN(CC)C(=S)SSC(=S)N(CC)CC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1622-62-4,CCRIS,1,-1,"FLUNITRAZ",CN1C(=O)CN=C(c2ccccc2F)c3cc(ccc13)[N+](=O)[O-],"STAIANO,N, BELISARIO,MA, DELLA MORTE,R, FARINA,C, REMONDELLI,P ANDMUSCETTOLA,G, MUTAGENIC EFFECTS OF FLUNITRAZEPAM, BOLL. SOC. ITAL. BIOL. SPER.60(12): 2247-2253, 1984"
+162050-09-1,CCRIS,1,-1,,[O-][N+](=O)c1oc(C(=O)CBr)c(Cl)c1Cl,"HATCHER,JF, YAMAMOTO,K, ICHIKAWA,M, BRYAN,GT AND SWAMINATHAN,S,METABOLIC REDUCTION OF NOVEL 3,4-DICHLORO-5-NITROFURANS IN SALMONELLATYPHIMURIUM, ENVIRON. MOL. MUTAGEN. 25(1):58-66, 1995"
+641-38-3,EPA1,0,-1,,Cc1cc(O)cc2OC(=O)c3c(O)cc(O)cc3c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+938-55-6,CCRIS,1,-1,,CN(C)c1[nH]cnc2ncnc12,"KATOH,M ARAKI,A OGURA,T AND VALDIVIA,RPA,  6-DIMETHYLAMINOPURINE(6-DMAP), WHICH IS USED TO PRODUCE  MOST CLONED ANIMALS, IS MUTAGENIC INSALMONELLA TYPHIMURIUM  TA1535, MUTAT. RES. 560(2):199-201, 2004"
+422-56-0,EPA1,0,-1,,FC(F)(F)C(F)(F)C(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1156-19-0,EPA2,0,-1,"TOLAZAMID",Cc1ccc(cc1)S(=O)(=O)NC(=O)NN2CCCCCC2,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+16582-03-9,EPA1,1,-1,,Nc1cccc2nc3c(N)cccc3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+42471-28-3,EPA1,1,-1,"ACNU,NIMUSTINE",Cc1ncc(CNC(=O)N(CCCl)N=O)c(N)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+22755-15-3,EPA1,1,-1,,CC(=O)Nc1ccc2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M330,EPA1,0,-1,,C1C=C[C@@H]2[C@@H]3C[C@@H](C=C3)[C@H]12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-49-2,VITIC,1,-1,,COCCOCCOCCOC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+54522-52-0,CCRIS,0,1,,COC1(CCC(C)COC2OC(CO)C(O)C(O)C2O)OC3CC4C5CC=C6CC(CCC6(C)C5CCC4(C)C3C1C)OC7OC(CO)C(OC8OC(C)C(O)C(O)C8O)C(O)C7OC9OC(C)C(O)C(O)C9O,"KIM,SW, SON,KH AND CHUNG,KC, MUTAGENIC EFFECT OF STEROIDAL SAPONINSFROM SMILAX CHINA RHIZOMES, YAKHAK HOECHI 33(5):285-289, 1989"
+88169-60-2,CCRIS,1,-1,,COC(=O)C(N)CSCCCl,"HUMPHREYS,WG, KIM,DH, CMARIK,JL, SHIMADA,T AND GUENGERICH,FP,COMPARISON OF THE DNA-ALKYLATING PROPERTIES AND MUTAGENIC RESPONSES OF A SERIESOF S-(2-HALOETHYL)-SUBSTITUTED CYSTEINE AND GLUTATHIONE DERIVATIVES,BIOCHEMISTRY 29(45):10342-10350, 1990"
+103-33-3,VITIC,1,-1,"AZOBENZEN",c1ccc(cc1)N=Nc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+95-51-2,VITIC,0,-1,,Nc1ccccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+115-96-8,VITIC,0,-1,,ClCCOP(=O)(OCCCl)OCCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+77-06-5,EPA1,0,-1,,C[C@]12[C@@H](O)C=C[C@@]3(OC1=O)[C@H]4CC[C@]5(O)C[C@]4(CC5=C)[C@H]([C@H]23)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4914-30-1,CCRIS,0,-1,,CCC1=C(CC2NCCc3cc(OC)c(OC)cc23)CC4N(CCc5cc(OC)c(OC)cc45)C1,"SHUBBER,EK, JACOBSON-KRAM,D AND WILLIAMS,JR, COMPARISON OF THE AMESASSAY AND THE INDUCTION OF SISTER CHROMATID EXCHANGES: RESULTS WITH TENPHARMACEUTICALS AND FIVE SELECTED AGENTS, CELL BIOL. TOXICOL. 2(3):379-399,1986"
+51230-49-0,EPA1,1,-1,,Clc1ccc2oc3ccccc3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94-75-7,VITIC,0,-1,"24-D",OC(=O)COc1ccc(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+389-08-2,EPA2,0,-1,"NALIDIXNA,NALIDIXAT",CCN1C=C(C(=O)O)C(=O)c2ccc(C)nc12,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+2493-84-7,VITIC,0,-1,,CCCCCCCCOc1ccc(cc1)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+75-09-2,VITIC,1,-1,"DICLOMETH",ClCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+159714-84-8,CCRIS,1,-1,,Cc1cccc2C3NC3c4cc5ccccc5cc4c12,"GLATT,H, ABU-SHQARA,E, MARTINE,U, BAIDOSSI,W, HARVEY,RG AND BLUM,J,K-REGION OXIDES AND IMINES DERIVED FROM ALKYLATED BENZ[A]ANTHRACENE CONGENERS:SYNTHESIS, STABILITY IN AQUEOUS MEDIA AND MUTAGENICITY, MUTAGENESIS 9(2):83-92,1994"
+97672-08-7,EPA1,1,-1,,O=Nn1cc(CC#N)c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-10-1,VITIC,0,-1,"MEIBUKETO",CC(C)CC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+122-88-3,EPA1,0,-1,"CH-100,CLOFAMINO,METFOCLPH,CLPHOACEP",OC(=O)COc1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1728-96-7,CCRIS,1,-1,,COc1ccc(cc1)c2nc(c3ccc(OC)cc3)c([nH]2)c4ccc(OC)cc4,"MERCANGOZ,A AND TUYLU,BA, DETECTION OF MUTAGENIC EFFECTS OF 2,4,5,TRI(SUBSTITUTE)PHENYL IMIDAZOLE AND ITS DERIVATIVES IN AMES/SALMONELLA/TESTSYSTEM,TURK. J. BIOL. 24(1):57-64, 2000"
+100-20-9,EPA1,1,-1,"TEREPHTCL",ClC(=O)c1ccc(cc1)C(=O)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7493-72-3,VITIC,0,-1,,CCCCCCCCC(=O)OCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106532-73-4,CCRIS,1,-1,,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3cccc(Cl)c3)\c2c1)C(=O)c4cccc(Cl)c4,"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+548-93-6,EPA1,0,-1,"HOANTHRA3",Nc1c(O)cccc1C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+149922-82-7,CCRIS,1,-1,,ClC1c2cccc3ccc4c5ccccc5cc1c4c23,"GLATT,H, HENSCHLER,R, FRANK,H, SEIDEL,A, YANG,C, ABU-SHQARA,E ANDHARVEY,RG, SULFOTRANSFERASE-MEDIATED MUTAGENICITY OF 1-HYDROXYMETHYLPYRENE AND4H- CYCLOPENTA[DEF]CHRYSEN-4-OL AND ITS ENHANCEMENT BY CHLORIDE ANIONS,CARCINOGENESIS 14(4):599-602, 1993"
+104145-44-0,EPA1,1,-1,,COC(=O)c1cc2c3ccccc3[nH]c2c(n1)c4ccc5C(=O)C=CC(=O)c5n4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+85-02-9,VITIC,1,-1,,c1ccc2c(c1)ccc3ncccc23,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+38915-28-5,EPA1,1,-1,,CCN(CCCl)CCCNc1c2ccc(Cl)cc2nc3ccc(OC)nc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M582,EPA1,0,-1,,C[C@@H](O)C[N+](C)(C)NC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13674-87-8,VITIC,1,-1,,ClCC(CCl)OP(=O)(OC(CCl)CCl)OC(CCl)CCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+85-81-4,EPA3,1,-1,,COc1cc(c2ncccc2c1)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+129251-09-8,CCRIS,0,-1,,CCC(CCOCN1C=CN(C)C1\C=N\O)[N+](=O)[O-],"SEBASTIAN,SE AND KORTE,DW, MUTAGENIC POTENTIAL OF2-HYDROXYIMINOMETHYL-3-METHYL-1-[2-(3-NITROPENTYLOXYMETHYL)]IMIDAZOLIUM CHLORIDE(WR#255,128) IN THE AMES SALMONELLA/MAMMALIAN MICROSOME MUTAGENICITY TEST,LETTERMAN ARMY INSTITUTE OF RESEARCH, LAIR-IR-363:TOXICOLOGYSER-208, MAY1989"
+958-93-0,VITIC,0,-1,"THENYLDIA,THDIAMHCL",CN(C)CCN(Cc1ccsc1)c2ccccn2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+617-35-6,EPA1,0,-1,,CCOC(=O)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106-39-8,EPA3,0,-1,,Clc1ccc(Br)cc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+78-93-3,VITIC,0,-1,"BUTANONE",CCC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+63710-10-1,CCRIS,1,-1,,CCC1(O)CC(OC2CC(C(OC3CC(O)C(OC4CC(O)C(O)C(C)O4)C(C)O3)C(C)O2)N(C)C)c5c(O)c6C(=O)c7c(O)ccc(O)c7C(=O)c6cc5C1C(=O)OC,"THOMAS,HF, MUTAGENIC AND CYTOTOXIC POTENCIES OF A SERIES OFANTHRACYCLINE DERIVATIVES AS MEASURED BY HIS+ REVERSION, 8-AZAGUANINE RESISTANCEAND DIRECT PLATING CYTOTOXICITY TESTS IN SALMONELLA TYPHIMURIUM, TERATOG.,CARCINOG., MUTAGEN. 6(3):219-235, 1986"
+119-84-6,VITIC,0,-1,"DIHCOUMAR",O=C1CCc2ccccc2O1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+764-42-1,EPA3,0,-1,,N#C\C=C/C#N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+32157-71-4,CCRIS,0,-1,,Brc1ccc(cc1)C(=O)C2OC2c3ccccc3,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+NOCAS_M265,EPA1,1,-1,,OC[C@H](O)CI,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M342,EPA1,0,-1,,CCCCC[C@@H](CC)OC(=O)c1cccc(c1)C(=O)O[C@H](CC)CCCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M304,EPA1,1,-1,,COC(=O)[C@@]1(O[C@@]1(C)[C@H](O)C(C)C)C(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+158729-21-6,CCRIS,0,-1,,Cc1cccc(NS(=O)(=O)c2cccc3cccnc23)c1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+262-12-4,EPA2,0,-1,,O1c2ccccc2Oc3ccccc13,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+99-35-4,CCRIS,1,-1,,[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+832-69-9,VITIC,1,-1,,Cc1cccc2c1ccc3ccccc23,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3761-53-3,EPA1,1,-1,,Cc1ccc(N=Nc2c(O)c(cc3cc(ccc23)S(=O)(=O)O)S(=O)(=O)O)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38716-10-8,CCRIS,1,-1,,OCC1OC(CC1O)N2C=C(COO)C(=O)NC2=O,"PATEL,U, BHIMANI,R AND FRENKEL,K, MECHANISM OF MUTAGENICITY BY5-HYDROPEROXYMETHYL-2'-DEOXYURIDINE, AN INTERMEDIATE PRODUCT OF IONIZINGRADIATION, IN BACTERIA. HPMDU BACTERIAL MUTAGENICITY AND OXIDATION OF DNA BASES,MUTAT. RES. 283(2):145-156, 1992"
+160543-00-0,CCRIS,1,-1,,Cc1ccc2nc3c(ccc4ccccc34)c(CO)c2c1,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+118-92-3,VITIC,0,-1,"ANTHRANIL",Nc1ccccc1C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+63521-85-7,CCRIS,1,-1,,COc1cccc2C(=O)c3c(O)c4CC(O)(CC(OC5CC(N)CC(C)O5)c4c(O)c3C(=O)c12)C(=O)CO,"COLE,JA AND THOMAS,HF, IMPACT OF A POINT MUTATION IN THE MUC REGION OFPLASMID PKM101 ON ANTHRACYCLINE-INDUCED MUTAGENESIS IN SALMONELLA TYPHIMURIUM,ENVIRON. MUTAGEN. 7(1):129-133, 1985"
+603-87-2,CCRIS,0,-1,,Nc1cccc(c1O)[N+](=O)[O-],"SHAHIN,MM, MUTAGENICITY EVALUATION OF NITROANILINES ANDNITROAMINOPHENOLS IN SALMONELLA TYPHIMURIUM, INT. J. COSMET. SCI. 7(6):277-289,1985"
+3153-55-7,CCRIS,1,-1,,COc1c(O)cc2CCN(C)C3Cc4ccccc4c1c23,"NOZAKA,T, WATANABE,F, TADAKI,S, ISHINO,M, MORIMOTO,I, KUNITOMO,J,ISHII,H, AND NATORI,S, MUTAGENICITY OF ISOQUINOLINE ALKALOIDS, ESPECIALLY OF THEAPORPHINE TYPE, MUTAT. RES. 240(4):267-79, 1990"
+1686-14-2,CCRIS,0,-1,"PINENEOXA",CC1(C)C2CC3OC3(C)C1C2,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+188107-70-2,CCRIS,1,-1,,Cn1c2ccccc2c3ccc(cc13)[N+](=O)[O-],"ANDRE,V, BIOSSART,C, SICHEL,F, GAUDUCHON,P, LE TALAER,JY, LANCELOT,JC,MERCIER,C, CHEMTOB,S, RAOULT,E AND TALLEC,A, MUTAGENICITY OF NITRO- ANDAMINO-SUBSTITUTED CARBAZOLES IN SALMONELLA TYPHIMURIUM. III. METHYLATEDDERIVATIVES OF 9H-CARBAZOLE, MUTAT. RES. 389(2-3):247-260, 1997"
+22433-76-7,EPA1,1,-1,,CC(=O)Nc1ccc2ncccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+117-12-4,EPA1,1,-1,"ANTHRARUF",Oc1cccc2C(=O)c3c(O)cccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2154-68-9,CCRIS,0,-1,,CC1(C)CC(C(=O)O)C(C)(C)N1O,"SOSNOVSKY,G, A CRITICAL EVALUATION OF THE PRESENT STATUS OF TOXICITYOF AMINOXYL RADICALS, J. PHARM. SCI. 81(6):496-499, 1992"
+150147-09-4,CCRIS,0,-1,,OCCN(CCO)c1ccc(cc1)N=Nc2ccc(nc2)N(CCO)CCO,"SHAHIN,MM, MUTAGENICITY OF STRUCTURALLY RELATED PHENYLAZO-3-PYRIDINESIN SALMONELLA TYPHIMURIUM, CELL BIOL. TOXICOL. 9(1):33-47, 1993"
+621-77-2,VITIC,0,-1,,CCCCCN(CCCCC)CCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+135105-90-7,CCRIS,1,-1,,COc1cc(OC)c2C3C(OC4OC34)Oc2c1,"TURMO,E, SANCHEZ-BAEZA,F, BUJONS,J, CAMPS,F, CASELLAS,M, SOLANAS,AMAND MESSEGUER,A, SYNTHESIS AND MUTAGENICITY OF THE AFLATOXIN B1 MODEL 3A,8A-DIHYDRO-4,6-DIMETHOXYFURO[2,3-B]BENZOFURAN AND ITS 2,3-EPOXY DERIVATIVE, J.AGRIC. FOOD CHEM. 39(10):1723-1728, 1991"
+23590-59-2,CCRIS,1,-1,,Clc1nncc2cccnc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+27554-26-3,VITIC,0,-1,,CC(C)CCCCCOC(=O)c1ccccc1C(=O)OCCCCCC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+108-38-3,VITIC,0,-1,,Cc1cccc(C)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+525-66-6,CCRIS,0,-1,"PROPRANOL,PROPRAHCL,PROPRAPBA,PROPRANOC,PROPRALAU",CC(C)NC[C@@H](O)COc1cccc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+160543-10-2,CCRIS,0,-1,,OCc1ccc2c(CO)c3ccc4ccccc4c3nc2c1,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+89-63-4,CCRIS,1,-1,,Nc1ccc(Cl)cc1[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+97461-42-2,CCRIS,1,-1,,CCCCCNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+623-24-5,EPA1,0,-1,,BrCc1ccc(CBr)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+53552-01-5,CCRIS,1,-1,,Clc1ccc(Oc2ccc(NC=O)cc2)c(Cl)c1,"MIYAUCHI,M, ENDOH,Y AND UEMATSU,T, MUTAGENIC ACTIVITY OF THE AMIDODERIVATIVES AND THEIR HYDROXAMIC ACIDS OF NITROBIPHENYL ETHERS, BULL. ENVIRON.CONTAM. TOXICOL. 55(3):446-452, 1995"
+50-02-2,CCRIS,0,1,,C[C@@H]1CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,"SINGH,H, SINGH,JR, DHILLON,VS, BALI,D AND PAUL,H, IN VITRO AND IN VIVOGENOTOXICITY EVALUATION OF HORMONAL DRUGS II. DEXAMETHASONE, MUTAT. RES. 308(1):89-97, 1994"
+2062-78-4,CCRIS,0,-1,"PIMOZIDE",Oc1nc2ccccc2n1C3CCN(CCCC(c4ccc(F)cc4)c5ccc(F)cc5)CC3,"BALBI,A MUSCETTOLA,G STAIANO,N MARTIRE,G AND DE LORENZO,F, PSYCHOTROPIC DRUGS: EVALUATION OF MUTAGENIC EFFECT,  PHARMACOL. RES. COMMUN.12(5):423-431, 1980"
+162022-93-7,CCRIS,0,-1,,Clc1nncc2ccncc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+108-98-5,CCRIS,0,-1,"THIOPHENL",Sc1ccccc1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+626-60-8,EPA1,0,-1,,Clc1cccnc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103-17-3,EPA1,0,-1,"CHLORBENS",Clc1ccc(CSc2ccc(Cl)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57-71-6,EPA3,0,-1,,CC(=O)\C(=N/O)\C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+74-95-3,EPA1,1,-1,,BrCBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+104-78-9,EPA1,0,-1,,CCN(CC)CCCN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128350-04-9,CCRIS,0,-1,,CC(\C=C(/C#N)\c1ccc(F)cc1)C(C(C#N)c2ccc(F)cc2)c3ccccc3,"AL-ARAB,MM, GHANEM,BS AND MASLAT,AO, SYNTHESIS, SPECTROSCOPY, ANDMUTAGENICITY OF NOVEL HEPTENEDINITRILES, TOXICOL. ENVIRON. CHEM. 27(4):267-275,1990"
+2438-88-2,EPA2,0,-1,,COc1c(Cl)c(Cl)c(c(Cl)c1Cl)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+114656-96-1,EPA1,1,-1,,Cc1[nH]c2C(=O)C=C(N3CC3)C(=O)c2c4nc5ccccc5c14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+97166-13-7,CCRIS,1,-1,,CC(Cl)C(Br)CBr,"OMICHINSKI,JG, SOEDERLUND,EJ, BAUSANO,JA, DYBING,E AND NELSON,SD,SYNTHESIS AND MUTAGENICITY OF SELECTIVELY METHYLATED ANALOGS OFTRIS(2,3-DIBROMOPROPYL) PHOSPHATE AND 1,2-DIBROMO-3-CHLOROPROPANE, MUTAGENESIS2(4):287-292, 1987"
+82-71-3,CCRIS,0,-1,,Oc1c(cc(c(O)c1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+645-05-6,VITIC,0,-1,"ALTRETAMI",CN(C)c1nc(nc(n1)N(C)C)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+110-82-7,VITIC,0,-1,,C1CCCCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+92134-94-6,CCRIS,0,-1,,OCC(O)C(O)C(O)C1SCCN1N=O,"UMANO,K, SHIBAMOTO,T, FERNANDO,SY AND WEI,CI, MUTAGENICITY OF2-HYDROXYALKYL-N- NITROSOTHIAZOLIDINES, FOOD CHEM. TOXICOL. 22(4):253-259,1984"
+NOCAS_M327,EPA1,0,-1,,CN(C)CCO[C@@](C)(c1ccccc1)c2ccccn2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67976-98-1,CCRIS,1,-1,,O1C2C1c3nc4ccc5ccccc5c4cc3c6ccccc26,"BONIN,AM, ROSARIO,CA, DUKE,CC, BAKER,RSU, RYAN,AJ AND HOLDER,GM, THEMUTAGENICITY OF DIBENZ[A,J]ACRIDINE, SOME METABOLITES AND OTHER DERIVATIVES INBACTERIA AND MAMMALIAN CELLS, CARCINOGENESIS 10(6):1079-1084, 1989"
+7203-89-6,EPA1,1,-1,,CN(C)N=Nc1ccc(C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M384,EPA1,0,-1,,CC(=CCC[C@](C)(OC(=O)c1ccccc1N)C=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1767-28-8,EPA1,1,-1,,Oc1ccc2ccc3c(ccc4ccc1c2c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98736-49-3,EPA1,1,-1,,CN(Cc1cccc(c1)C#N)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+288-47-1,EPA1,1,-1,"THIAZOLE",c1cscn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95741-57-4,EPA1,1,-1,,Cc1cc2c3cc4ccccc4cc3c5cccc(c1)c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7379-35-3,EPA1,0,-1,,Clc1ccncc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M369,EPA1,0,-1,,C[C@@H](O)COC[C@@H](C)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99240-67-2,CCRIS,0,-1,,CC(=O)Nc1ccc2c(Cc3ccccc23)c1OC(=O)c4ccccc4,"CREBELLI,R AND IORIO,MA, CHEMISTRY AND IN VITRO MUTAGENICITY OF2-AMINOFLUORENE DERIVATIVES, CHEM.-BIOL. INTERACT. 54(1):71-83, 1985"
+894-52-0,EPA3,1,-1,,Cc1c(C)c2c(ccc3ccccc23)c4CCC(=O)c14,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M457,EPA1,0,-1,,C[C@@H](N)CN,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+58-54-8,VITIC,0,-1,"ETACRYNNA,ETACRYNAT",CCC(=C)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+87425-69-2,CCRIS,0,-1,,OC1C=Cc2cc3c(ccc4ccccc34)c(Br)c2C1O,"FU,PP, VON TUNGELN,LS, UNRUH,LE, NI,Y AND CHOU,MW, COMPARATIVEREGIOSELECTIVE AND STEREOSELECTIVE METABOLISM OF 7-CHLOROBENZ[A]ANTHRACENE AND7-BROMOBENZ[A]-ANTHRACENE BY MOUSE AND RAT LIVER MICROSOMES, CARCINOGENESIS12(3):371-378, 1991"
+54-31-9,VITIC,0,-1,"FUROSEMID,FUROSEMNA",NS(=O)(=O)c1cc(C(=O)O)c(NCc2occc2)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+115165-01-0,CCRIS,0,-1,,Oc1cccc2c3ccccc3c4cc5ccccc5cc4c12,"KUMAR,S, KOLE,PL AND SIKKA,HC, MUTAGENICITY OF DIBENZ[A,C]ANTHRACENEAND ITS DERIVATIVES IN SALMONELLA TYPHIMURIUM TA100, MUTAT. RES. 242(4):337-343,1990"
+69227-45-8,CCRIS,1,-1,,CC(O)C(NC(=O)C(C)C(O)C(C)NC(=O)C(NC(=O)c1nc(nc(N)c1C)C(CNCC(N)C(=O)N)C(=O)N)C(OC2OC(CO)C(O)C(O)C2OC3OC(CO)C(O)C(OC(=O)N)C3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCN(C)CCCNC(=N)CC7CCC(Cl)CC7,"UMEZAWA,K, HARESAKU,M, MURAMATSU,M AND MATSUSHIMA,T, MUTAGENICITY OFANTHRACYCLINE GLYCOSIDES AND BLEOMYCINS IN A SALMONELLA ASSAY SYSTEM, BIOMED.PHARMACOTHER. 41(5):214-218, 1987"
+2353-45-9,EPA2,0,-1,"FASTGRFCF",CCN(Cc1cccc(c1)S(=O)(=O)O)c2ccc(cc2)C(=C3C=CC(=[N+](CC)Cc4cccc(c4)S(=O)(=O)O)C=C3)c5ccc(O)cc5S(=O)(=O)O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+394-69-4,EPA1,1,-1,,Fc1cccc2ncccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-79-4,VITIC,0,-1,,Cc1ccc(Cl)cc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+33089-36-0,EPA1,0,-1,,C1COCCOCCOCCOCCOCCOCCO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38363-41-6,CCRIS,1,-1,"ISOPENBUT",CC(C)(C)NCC(O)COc1ccccc1C2CCCC2,"HUSSAIN,SS, ABOUL-ENEIN,HY, AL-DAKAN,A AND HANNAN,MA, MUTAGENICITY OFENANTIOMERS OF PENBUTOLOL, DRUG CHEM. TOXICOL. 12(1):77-83, 1989"
+420-12-2,EPA1,1,-1,,C1CS1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+497-23-4,EPA1,0,-1,"CROTONLAC",O=C1OCC=C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111858-66-3,CCRIS,1,-1,,OC1COC(C(O)C1O)N(CCc2c[nH]c3ccccc23)N=O,"MERSCH-SUNDERMANN,V AND KRAEMER,H, THE INFLUENCE OF CULTURE CONDITIONSON THE SUSCEPTIBILITY OF SALMONELLA TYPHIMURIUM IN THE SALMONELLA MUTAGENICITYTEST, ZENTRALBL. HYG. UMWELTMED. 193(5):471-480, 1993"
+100850-37-1,CCRIS,0,-1,,CN(CC(=O)NN)c1ccc2ccccc2c1,"RAMAMURTHY,B, PAI,SB AND RAMAKRISHNAN,T, EVALUATION OF MUTAGENICITY OFTHE ANTITUBERCULAR NAPHTHYLGLYCINE HYDRAZIDES IN SALMONELLA TYPHIMURIUM, J.BIOSCI. 9(1-2):47-52, 1985"
+148193-32-2,CCRIS,1,-1,,COc1nsc2cc(ccc12)[N+](=O)[O-],"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+115767-74-3,CCRIS,0,-1,"TAT-59",CC\C(=C(\c1ccc(OCCN(C)C)cc1)/c2ccc(OP(=O)(O)O)cc2)\c3ccc(cc3)C(C)C,"OHUCHIDA,A, TANIGUCHI,A, MAEDA,Y, KASHIHARA,A, OHMAE,S AND MIZUMOTO,T,MUTAGENICITY TESTS OF MIPROXIFENE PHOSPHATE (TAT-59), YAKURI TO CHIRYO25(SUPPL.2):S447-S456, 1997"
+15961-88-3,CCRIS,0,-1,,[O-][N+](=Nc1ccc2c(Cc3ccccc23)c1)c4ccc5c(Cc6ccccc56)c4,"CREBELLI,R AND IORIO,MA, CHEMISTRY AND IN VITRO MUTAGENICITY OF2-AMINOFLUORENE DERIVATIVES, CHEM.-BIOL. INTERACT. 54(1):71-83, 1985"
+600-14-6,EPA1,0,-1,,CCC(=O)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-59-8,VITIC,0,-1,,CCCCC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+67274-48-0,CCRIS,0,-1,,CC(=O)N(O)c1ccc(Br)cc1,"WEI,CI, COHEN,MD, SWARTZ,DD, FERNANDO,SY AND CORBETT,MD, MUTAGENICITYOF SOME MONOAROMATIC HYDROXAMIC ACIDS, TOXICOL. LETT. 24(1):111-116,1985"
+3096-63-7,EPA1,1,-1,,Cc1cccc(C)c1NO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4418-26-2,EPA1,0,-1,,CC(=O)C1=C(O)C=C(C)OC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M140,EPA1,1,-1,,O1[C@@H]2[C@H]1c3ccccc3c4c2ccc5ccccc45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M458,EPA1,0,-1,,CC(C)C[C@@H](C)Nc1ccc(Nc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24961-39-5,EPA1,1,-1,,BrCc1c2ccccc2cc3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+482-66-6,CCRIS,0,-1,,C1Cc2ccc3c(ccc4ccccc34)c2C1,"PAPAPARASKEVA-PETRIDES,C, IOANNIDES,C, BOYD,GW, YOUNG,RJ, HARVEY,RGAND COOMBS, MM, THE MUTAGENICITY OF CHEMICALLY SYNTHESIZED METABOLITES OF16,17-DIHYDRO-15H-CYCLOPENTA[A]PHENANTHRENE AND ITS CARCINOGENIC 11-METHYLHOMOLOG, MUTAGENESIS 8(4):307-310, 1993"
+2815-45-4,CCRIS,0,-1,,CC(C)(C)C1CCC2(CC1)CO2,"SINSHEIMER,JE, CHAKRABORTY,PK, MESSERLY,EA AND GADDAMIDI,V,MUTAGENICITY OF OXASPIRO COMPOUNDS WITH SALMONELLA, MUTAT. RES. 224(2):171-5,1989"
+105752-67-8,CCRIS,1,-1,,Cc1cccc2cc(ccc12)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+13060-14-5,CCRIS,0,-1,,COc1cc(cc(OC)c1OC)C2OCC3C2COC3c4cc(OC)c(OC)c(OC)c4,"MARQUES,RCP BATISTUZZO DE MEDEIROS,SR DIAS,CDS BARBOSA-FILHO,JM ANDAGNEZ-LIMA,LF, EVALUATION OF THE MUTAGENIC POTENTIAL OF YANGAMBIN AND OF THEHYDROALCOHOLIC EXTRACT OF OCOTEA DUCKEI BY THE AMES TEST, MUTAT. RES. 536(1-2):117-120, 2003"
+40321-99-1,CCRIS,0,-1,,CCC(CCC(C)O)COC(=O)c1ccccc1C(=O)O,"DIRVEN,HAAM, THEUWS,JLG, JONGENEELEN,FJ AND BOS,RP, NON-MUTAGENICITYOF 4 METABOLITES OF DI(2-ETHYLHEXYL)PHTHALATE (DEHP) AND 3 STRUCTURALLY RELATEDDERIVATIVES OF DI(2-ETHYLHEXYL)ADIPATE (DEHA) IN THE SALMONELLA MUTAGENICITYASSAY, MUTAT. RES. 260(1):121-130, 1991"
+96563-06-3,CCRIS,1,-1,,CC1c2ccccc2c3cc(C)c(C)cc13,"LAVOIE,EJ, COLEMAN,DT, GEDDIE,NG AND RICE,JE, STUDIES ON THEMUTAGENICITY AND TUMOR-INITIATING ACTIVITY OF METHYLATED FLUORENES, CHEM.-BIOL.INTERACT. 52(3):301-309, 1985"
+781-43-1,EPA1,1,-1,,Cc1c2ccccc2c(C)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54-16-0,EPA1,0,-1,"HIAA5",OC(=O)Cc1c[nH]c2ccc(O)cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6317-18-6,VITIC,0,-1,,N#CSCSC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+62450-06-0,EPA1,1,-1,,Cc1nc(N)c(C)c2[nH]c3ccccc3c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+36848-41-6,CCRIS,0,-1,,[O-][N+](=O)c1cccc2nc3c(cccc3nc12)[N+](=O)[O-],"WATANABE,T, HANASAKI,Y, HIRAYAMA,T AND FUKUI,S, MUTAGENICITY OF NITRO-AND AMINO-SUBSTITUTED PHENAZINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.225(3):75-82, 1989"
+NOCAS_M59,EPA1,1,-1,,Nc1ncnc2c1ncn2C[C@H](O)CN=[N+]=[N-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7570-37-8,CCRIS,1,-1,,COc1ccc(\C=C\c2ccc(N)cc2)cc1,"YOU,Z, BREZZELL,MD, DAS,SK, HOOBERMAN,BH AND SINSHEIMER,JE,SUBSTITUENT EFFECTS ON THE IN VITRO AND IN VIVO GENOTOXICITY OF 4-AMINOBIPHENYLAND 4-AMINOSTILBENE DERIVATIVES, MUTAT. RES. 320(1-2):45-58, 1994"
+60262-85-3,CCRIS,0,-1,,OC1C(Oc2c3ccccc3c4ccc5cccc6ccc2c4c56)OC(C(O)C1O)C(=O)O,"IRWIN,SE, KWEI,GY, BLACKBURN,GR, THURMAN,R AND KAUFFMAN,FC,MUTAGENICITY OF BENZO[A]PYRENYL-1-SULFATE IN THE AMES TEST,ENVIRON. MOL.MUTAGEN. 19(3):253- 258, 1992"
+188970-88-9,CCRIS,1,-1,,Oc1ccc2ccc3[nH]c4cc(c5ccccc5c4c3c2c1)[N+](=O)[O-],"XUE,W, LADOW,K AND WARSHAWSKY,D, SYNTHESIS, CHARACTERIZATION, ANDMUTAGENICITY OF NITRATED 7H-DIBENZO[C,G]CARBAZOLE AND ITS PHENOLIC DERIVATIVES,CHEM. RES. TOXICOL. 10(4):432-438, 1997"
+120-52-5,CCRIS,1,-1,,O=C(ON=C1C=CC(=NOC(=O)c2ccccc2)C=C1)c3ccccc3,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+475-75-2,EPA1,1,-1,"LIRIODENI",O=C1c2ccccc2c3c4OCOc4cc5ccnc1c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106-96-7,VITIC,1,-1,,BrCC#C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+108-89-4,EPA1,0,-1,,Cc1ccncc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+590-88-5,CCRIS,0,-1,,CC(N)CCN,"TAKAHASHI,A AND ONO,H, MUTAGENICITY ASSESSMENT IN 44 EPOXY RESINHARDENERS IN SALMONELLA TYPHIMURIUM TESTER STRAINS, CHEM. EXPRESS 8(9):785-788,1993"
+99-66-1,VITIC,0,-1,"DR9508797,VALPROABI,VALPROATC,VALPROAMG,VALSEMINA",CCCC(CCC)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99217-04-6,EPA1,1,-1,,CC(=O)Oc1cc(c2ccc3cccc4ccc1c2c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+8022-00-2,EPA1,0,-1,"DEMETONME",CCSCCOP(=S)(OC)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24698-43-9,CCRIS,1,-1,,CC(C)COS(=O)(=O)c1ccccc1,"GLOWIENKE,S, FRIAUFF,W, ALLMENDINGER,T, MARTUS,HJ, SUTER,W ANDMUELLER,L, STRUCTURE-ACTIVITY CONSIDERATIONS AND IN VITRO APPROACHES TO ASSESSTHE GENOTOXICTY OF 19 METHANE-, BENZENE- AND TOLUENESULFONIC ACID ESTERS, MUTAT.RES. 581(1-2):23-34, 2005"
+173216-44-9,CCRIS,1,-1,,N#N=NCCC(c1ccccc1)c2ccccc2,"MATSUMURA,Y, SHIOZAWA,T, MATSUSHITA,H AND TERAO,Y, MUTAGENICITY OFALKYL AZIDES, BIOL. PHARM. BULL. 18(12):1805-1807, 1995"
+581-89-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccccc2c1,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+115550-35-1,EPA1,1,-1,"MARBOFLOX",CN1CCN(CC1)c2c(F)cc3C(=O)C(=CN4N(C)COc2c34)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105-55-5,VITIC,0,-1,,CCNC(=S)NCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M382,EPA1,0,-1,,CCCC[C@@H](CC)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+23788-22-9,CCRIS,0,-1,,Oc1ccc(OP2(NP(NP(N2)(Oc3ccc(O)cc3)Oc4ccc(O)cc4)(Oc5ccc(O)cc5)Oc6ccc(O)cc6)Oc7ccc(O)cc7)cc1,"ALLCOCK,HR, PUCHER,SR, FITZPATRICK,RJ AND RASHID,K, ANTIBACTERIALACTIVITY AND MUTAGENICITY STUDIES OF WATER-SOLUBLE PHOSPHAZENE HIGH POLYMERS,BIOMATERIALS 13(12):857-862, 1992"
+104789-46-0,EPA1,1,-1,"CLOTURIN",ClCCNC(=O)Sc1[nH]cnc2ncnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1120-36-1,EPA1,0,-1,,CCCCCCCCCCCCC=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51325-91-8,EPA1,1,-1,,CN(C)c1ccc(\C=C\C2=CC(=C(C#N)C#N)C=C(C)O2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+135086-99-6,CCRIS,0,-1,,Nc1c([nH]c2ccccc12)C(=O)N\N=C\c3ccccc3,"LOPEZ-DE-CERAIN,A, GARCIA,E AND GULLON,A, INFLUENCE OF THE TRIAZINERING ON THE MUTAGENICITY OF TRIAZINOINDOLES AND SOME CONGENERS, MUTAGENESIS7(1):37-39, 1992"
+61845-52-1,CCRIS,0,-1,,CCOC1=CC(N(O)c2ccccc12)(c3ccccc3)c4ccccc4,"DAMIANI,E GRECI,L AND HRELIA,P, CYTO- AND GENOTOXIC EFFECTS OF NOVELAROMATIC NITROXIDE RADICALS IN VITRO, FREE RADICAL BIOL. MED. 28(3):330-336,2000"
+24400-01-9,CCRIS,1,-1,,CN(C)CCCNc1c2ccccc2nc3c(C)ccc(c13)[N+](=O)[O-],"FERGUSON,LR, DENNY,WA AND O'ROURKE,SM, MUTAGENIC ACTIVITY OFNITRACRINE DERIVATIVES IN SALMONELLA TYPHIMURIUM: RELATIONSHIP TO DRUGPHYSICOCHEMICAL PARAMETERS, AND TO BACTERIAL UVRB AND RECA GENES AND PLASMIDPKM101, MUTAT. RES. 223(1):13-22, 1989"
+31438-22-9,EPA1,1,-1,,[O-][N+](=O)c1cccc2c3ccccc3[nH]c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+124617-83-0,CCRIS,1,-1,,CCON(OC(=O)C)C(=O)c1ccccc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+578-06-3,EPA1,1,-1,,Nc1cccc2nc3ccccc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71432-00-3,EPA1,1,-1,,O=C1Oc2cccc3ccc4c5ccccc5cc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+87-10-5,VITIC,0,-1,"TRIBROMSA",Oc1c(Br)cc(Br)cc1C(=O)Nc2ccc(Br)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100-52-7,VITIC,0,-1,"BENZALDEH",O=Cc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2437-56-1,EPA1,0,-1,,CCCCCCCCCCCC=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+102-60-3,CCRIS,0,-1,"EDETOL",CC(O)CN(CCN(CC(C)O)CC(C)O)CC(C)O,"HACHIYA,N AND TAKIZAWA,Y, MUTAGENICITY OF PLASTIC ADDITIVES,HEN'IGENSEI SHIKEN 3(3):147-154, 1994"
+68302-57-8,EPA1,0,-1,"AMOXANOX",CC(C)c1ccc2Oc3nc(N)c(cc3C(=O)c2c1)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+140-11-4,VITIC,0,-1,,CC(=O)OCc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120404-26-4,EPA1,1,-1,,OCCNc1ccc(cc1)N=Nc2ccc(NCCO)cc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3009-50-5,CCRIS,1,-1,,COc1ccc(cc1)N=Nc2ccc(cc2)N(C)C,"BARNI,E BAROLO,C QUAGLIOTTO,P VALLDEPARAS,J AND VISCARDI,G, NOVELAZOBENZENE DERIVATIVES CONTAINING A GLUCOPYRANOSIDE MOIETY. PART I: SYNTHESIS,CHARCTERISATION AND MUTAGENIC PROPERTIES, DYES PIGM. 46(1):29-36,2000"
+131-11-3,VITIC,0,-1,"DIMEPHTHA",COC(=O)c1ccccc1C(=O)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+626-15-3,EPA1,0,-1,,BrCc1cccc(CBr)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1666-13-3,CCRIS,1,-1,,[Se]([Se]c1ccccc1)c2ccccc2,"ROSA,RM SULZBACHER,K PICADA,JN ROESLER,R SAFFI,J BRENDEL,M ANDHENRIQUES,JAP GENOTOXICITY OF DIPHENYL DISELENIDE IN BACTERIA AND YEAST, MUTAT.RES. 563(2): 107-115, 2004"
+87-65-0,VITIC,0,-1,,Oc1c(Cl)cccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2319-96-2,EPA1,1,-1,,Cc1cc2cc3ccccc3cc2c4ccccc14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92569-05-6,CCRIS,1,-1,"BA-40922",[O-][N+](=O)c1cnc(s1)N2CCN(C(=O)C(Cl)Cl)C2=O,"HOF,H, MUTAGENIC ACTIVITIES OF NITROTHIAZOLE DERIVATIVES, ZENTRALBL.BAKTERIOL., MIKROBIOL. HYG., ABT. 1, ORIG. B 181(1-2):64-70, 1985"
+73018-98-1,CCRIS,1,-1,,OCC(O)CN=N#N,"JURICEK,M, GRUZ,P, VELEMINSKY,J, STANEK,J, KEFURT,K, MORAVCOVA,J ANDJARY,J, MUTAGENIC ACTIVITY OF 6-AZIDO DEOXYHEXOSES AND AZIDO ALCOHOLS INSALMONELLA TYPHIMURIUM AND ITS INHIBITION BY A STRUCTURE-SIMILAR CARBON SOURCEIN THE MEDIUM, MUTAT. RES. 251(1):13-20, 1991"
+19406-51-0,CCRIS,1,-1,,Cc1c(cc(N)cc1[N+](=O)[O-])[N+](=O)[O-],"GEORGE,SE HUGGINS-CLARK,G AND BROOKS,LR, USE OF A SALMONELLAMICROSUSPENSION BIOASSAY TO DETECT THE MUTAGENICITY OF MUNITIONS COMPOUNDS ATLOW CONCENTRATIONS, MUTAT. RES. 490(1):45-56, 2001"
+20496-16-6,CCRIS,0,-1,,CCc1ccc2c3ccccc3c4cccc1c24,"OTERO-LOBATO,MJ JENNESKENS,LW SEINEN,W,  CYCLOPENTA[CD]FLUORANTHENEAND ITS PRECURSORS IN COMBUSTION  EXHAUSTS: A SURVEY OF THEIR BACTERIALMUTAGENIC ACTIVITY,  ENVIRON. MOL. MUTAGEN. 44(4):304-312, 2004"
+144730-01-8,CCRIS,1,-1,,FC(F)(F)c1cc2C(=O)CCc2c3ccc4ccccc4c13,"BOYD,GW, ZEPIK,HH, KING,LM, IOANNIDES,C AND COOMBS,M, THE IN VITROMETABOLIC ACTIVATION"
+NOCAS_M543,EPA1,0,-1,,O=C1NC(=O)[C@H]2CC=CC[C@@H]12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54-11-5,VITIC,0,-1,,CN1CCC[C@@H]1c2cccnc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+529-49-7,EPA1,1,-1,,Oc1ccc2Oc3cc(O)cc(O)c3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1918-13-4,EPA1,1,-1,,NC(=S)c1c(Cl)cccc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67019-30-1,CCRIS,0,-1,,CN(C(=O)C)c1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+60877-86-3,CCRIS,0,-1,,C(=N\c1snc2ccccc12)/c3ccccc3,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+148193-29-7,CCRIS,1,-1,,C(Oc1cccc2cnsc12)C3CO3,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+140-95-4,VITIC,1,-1,"OXYMETAMI",OCNC(=O)NCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111955-19-2,CCRIS,1,-1,,Cc1ccc(cc1)N(N=O)C2OCC(O)C(O)C2O,"MERSCH-SUNDERMANN,V AND KRAEMER,H, THE INFLUENCE OF CULTURE CONDITIONSON THE SUSCEPTIBILITY OF SALMONELLA TYPHIMURIUM IN THE SALMONELLA MUTAGENICITYTEST, ZENTRALBL. HYG. UMWELTMED. 193(5):471-480, 1993"
+479-45-8,CCRIS,1,-1,,CN(c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+109-89-7,VITIC,0,-1,"DIETAMINE",CCNCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M62,EPA1,1,-1,,O=C[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51837-64-0,CCRIS,0,-1,,COc1cc(NC(=O)C)ccc1NC(=O)C,"KOOVI,DG, MAMANE,R, CALLAIS,F, FESTY,B AND LICH,NP, STUDY ON THEGENOTOXICITY OF 2-AMINO-5-NITROANISOLE (ANA) AND ITS METABOLITES, ANN. FALSIF.EXPERT. CHIM. TOXICOL. 80(854):25-39, 1987"
+NOCAS_M194,EPA1,1,-1,,CC(C)(c1ccc(OC[C@H]2CO2)cc1)c3ccc(OC[C@H]4CO4)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107673-64-3,EPA1,1,-1,,[O-][N+](=O)c1ccc2c(c1)c3cc4ccccc4c5cccc2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M321,EPA1,0,-1,,CN(C)[C@@H]1[C@@H]2[C@H](O)[C@H]3C(=C(O)[C@@]2(O)C(=C(C(=O)N)C1=O)O)C(=O)c4c(O)cccc4[C@]3(C)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6341-85-1,CCRIS,1,-1,,CC1(CO1)C2CO2,"GERVASI,PG, CITTI,L, DEL MONTE,M, LONGO,V AND BENETTI,D, MUTAGENICITYAND CHEMICAL REACTIVITY OF EPOXIDIC INTERMEDIATES OF THE ISOPRENE METABOLISM ANDOTHER STRUCTURALLY RELATED COMPOUNDS, MUTAT. RES. 156(1-2):77-82,1985"
+104-82-5,EPA1,0,-1,,Cc1ccc(CCl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90625-53-9,CCRIS,0,-1,,COC1=CC(=O)C=C/C/1=N\c2c3ccccc3nc4ccccc24,"IWAMOTO,Y, FERGUSON,LR, PEARSON,A AND BAGULEY,B, PHOTOENHANCEMENT OFTHE MUTAGENICITY OF 9-ANILINOACRIDINE DERIVATIVES RELATED TO THE ANTITUMOR AGENTAMSACRINE, MUTAT. RES. 268(1):35-41, 1992"
+60102-37-6,CCRIS,1,-1,,CC1CC2(OC2C)C(=O)OC3CCN(C)CC=C(COC(=O)C1(C)O)C3=O,"YAMANAKA,H NAGAO,M AND SUGIMURA,T, MUTAGENICITY OF PYRROLIZIDINEALKALOIDS IN THE SALMONELLA/MAMMALIAN-MICROSOME TEST, MUTAT. RES. 68(3):211-216,1979"
+80-43-3,VITIC,0,-1,,CC(C)(OOC(C)(C)c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M20,EPA1,1,-1,,OC[C@H](Br)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16292-86-7,CCRIS,1,-1,,Nc1ccc(c(O)c1)[N+](=O)[O-],"SHAHIN,MM, MUTAGENICITY EVALUATION OF NITROANILINES ANDNITROAMINOPHENOLS IN SALMONELLA TYPHIMURIUM, INT. J. COSMET. SCI. 7(6):277-289,1985"
+103395-25-1,EPA1,1,-1,,ClCc1ccc2cccc3c4ccccc4c1c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3626-28-6,EPA1,1,-1,,Nc1c(N=Nc2ccc(cc2)c3ccc(cc3)N=Nc4ccc(O)cc4)c(cc5cc(c(N=Nc6ccccc6)c(O)c15)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2876-23-5,EPA1,1,-1,,Nc1ccc2nc3ccccc3nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119-53-9,EPA3,0,-1,,O[C@H](C(=O)c1ccccc1)c2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+818-61-1,EPA1,0,-1,"HOETACRYL",OCCOC(=O)C=C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-13-4,EPA1,0,-1,"ACETONYLA",CC(=O)CCC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91137-27-8,CCRIS,1,-1,,Cc1cccc2c(cccc12)[N+](=O)[O-],"GUPTA,P, HARGER,WP AND AREY,J, THE CONTRIBUTION OF NITRO- ANDMETHYLNITRONAPHTHALENES TO THE VAPOR-PHASE MUTAGENICITY OF AMBIENT AIR SAMPLES,ATMOS. ENVIRON. 30(18):3157-3166, 1996"
+16830-15-2,CCRIS,0,-1,,C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O,"KWON,J LEE,M CHA,K KIM,JC AND HAN,J, GENOTOXICITY STUDY OF  AS6, ATRITERPENOID DERIVATIVES, J. APPL. PHARMACOL.  11(3):190-195, 2003"
+5336-53-8,EPA3,0,-1,,O=NN(Cc1ccccc1)Cc2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+39156-41-7,EPA2,1,-1,,COc1ccc(NOS(=O)(=O)O)cc1N,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+102-77-2,VITIC,0,-1,,C1CN(CCO1)Sc2nc3ccccc3s2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M388,EPA1,0,-1,,CC[C@@]1(CC(=O)O)OCCc2c1n(C)c3ccccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+52-67-5,CCRIS,1,-1,,CC(C)(S)C(N)C(=O)O,"GLATT,H AND OESCH,F, MUTAGENICITY OF CYSTEINE AND PENICILLAMINE ANDITS ENANTIOMERIC SELECTIVITY, BIOCHEM. PHARMACOL. 34(20):3725-3728,1985"
+NOCAS_M413,EPA1,0,-1,,CC(C)NC[C@@H](O)COc1cccc2C[C@@H](COc12)O[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-94-1,VITIC,0,-1,"CYCLHEXON",O=C1CCCCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+154-93-8,EPA1,1,-1,"CARMUSTIN",ClCCNC(=O)N(CCCl)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+153260-27-6,CCRIS,0,-1,,C1Cc2scnc2c3cccnc13,"JAEN,JC, KROPKO,ML, THEISS,JC, WOLD,S, CAPRATHE,BW AND WISE,LD,ASSESSMENT OF MUTAGENIC POTENTIAL IN A SERIES OF COMPOUNDS STRUCTURALLY RELATEDTO 2-AMINO-3-METHYLIMIDAZO[4,5-F]QUINOLINE (IQ), EUR. J. MED. CHEM. 28(7-8):547-553, 1993"
+56719-41-6,CCRIS,0,-1,,COC(=O)\C(=C(/OP(=O)(OC)OC)\c1ccc(Cl)cc1Cl)\Br,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+3671-78-1,EPA1,1,-1,,O=C(Nc1ccc2c(Cc3ccccc23)c1)c4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+38661-82-4,CCRIS,0,-1,,CC(Cl)c1ccccc1,"BALL,JC AND YOUNG,WC, MUTAGENICITY STUDIES OFALPHA,ALPHA'-DIHALOMETHYLBENZENES, ALPHA-METHYLBENZYL HALIDES, AND1-CHLOROMETHYLPYRENE IN THE AMES ASSAY, MUTAT. RES. 191(2):79-84,1987"
+112022-13-6,EPA1,1,-1,,CN(C)CCNC(=O)c1cccc2Oc3ccccc3Nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91-21-4,VITIC,0,-1,"TEHIQUINO",C1Cc2ccccc2CN1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+720-39-8,CCRIS,0,-1,,CCCCc1cc(C)cc(CCCC)c1O,"KARAMOVA,NS, IL'INSKAYA,ON, IVANCHENKO,OB, ERMOLAEV,AI,GIL'MUTDINOV,GZ, GERSHANOV,FB AND KHAMITOV,BR, STUDY OF GENOTOXIC EFFECTS OFTONAROL, RUSS. J. GENET. 33(9):1120-1122, 1997"
+20480-67-5,CCRIS,0,-1,,C1CCC2C(C1)CCc3ccccc23,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+28540-82-1,CCRIS,0,-1,,CC(C)CC1NC(=O)C(C)N(C)C(=O)CNC(=O)\C(=C/c2ccccc2)\N(C)C1=O,"SCHRADER,TJ CHERRY,W SOPER,K LANGLOIS,I AND VIJAY,HM, EXAMINATION OFALTERNARIA ALTERNATA MUTAGENICITY AND EFFECTS OF NITROSYLATION USING THE AMESSALMONELLA TEST, TERATOG., CARCINOG., MUTAGEN. 21(4):261-274, 2001"
+109621-20-7,CCRIS,1,-1,,COC(=O)C(CSCC(C)Br)NC(=O)C,"ZOETEMELK,CEM, MOHN,GR, VAN DER GEN,A AND BREIMER,DD, 1,2-DIBROMOCOMPOUNDS. THEIR MUTAGENICITY IN SALMONELLA STRAINS DIFFERING IN GLUTATHIONECONTENT AND THEIR ALKYLATING POTENTIAL, BIOCHEM. PHARMACOL. 36(11):1829-1835,1987"
+54292-61-4,CCRIS,0,-1,,Cc1cc(ccc1N=Nc2cccnc2)N(CCO)CCO,"SHAHIN,MM, MUTAGENICITY OF STRUCTURALLY RELATED PHENYLAZO-3-PYRIDINESIN SALMONELLA TYPHIMURIUM, CELL BIOL. TOXICOL. 9(1):33-47, 1993"
+89459-43-8,EPA1,1,-1,,CN(C)CCNC(=O)c1cccc2c(N)c3ccccc3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+43192-03-6,EPA1,0,-1,,Cc1ccc(NO)cc1[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7786-61-0,EPA1,0,-1,,COc1cc(C=C)ccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M385,EPA1,0,-1,,CCc1cccc2cc(oc12)[C@H](O)CNC(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+122021-01-6,CCRIS,0,-1,,CCCCC(CC)COC(=O)c1ccc(cc1)N(C)N=O,"DUNKEL,VC, SAN,RHC, HARBELL,JW, SEIFRIED,HE AND CAMERON,TP, EVALUATIONOF THE MUTAGENICITY OF AN N-NITROSO CONTAMINANT OF THE SUNSCREEN PADIMATE O:N-NITROSO- N-METHYL-P-AMINOBENZOIC ACID, 2-ETHYLHEXYL ESTER (NPABAO), ENVIRON.MOL. MUTAGEN. 20(3):188-198, 1992"
+813-78-5,VITIC,0,-1,,COP(=O)(O)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+577-59-3,VITIC,0,-1,,CC(=O)c1ccccc1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+92-36-4,VITIC,1,-1,,Cc1ccc2nc(sc2c1)c3ccc(N)cc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+13506-76-8,VITIC,1,-1,,Cc1cccc(c1C(O)O)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+439-14-5,VITIC,0,-1,"DIAZEPAM,DIAZEPCHH,DIAZEPAMK",CN1C(=O)CN=C(c2ccccc2)c3cc(Cl)ccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7364-25-2,EPA1,0,-1,,Oc1[nH]nc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+109-01-3,EPA1,0,-1,,CN1CCNCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4424-06-0,VITIC,1,-1,,O=C1c2ccc3c4nc5ccccc5n4C(=O)c6ccc(c7nc8ccccc8n17)c2c36,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+218-02-0,EPA1,1,-1,,c1ccc2c(c1)ccc3c4ccncc4ccc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131-73-7,EPA1,1,-1,"DIPICRYLA",[O-][N+](=O)c1cc(c(Nc2c(cc(cc2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])c(c1)[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1321-94-4,VITIC,0,-1,,Cc1ccc2ccccc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5329-87-3,CCRIS,1,-1,,[O-][N+](=O)c1ccc2c(CCc3ccccc23)c1,"HIRAYAMA,T, WATANABE,T, AKITA,M, SHIMOMURA,S, FUJIOKA,Y, OZASA,S ANDFUKUI,S, RELATIONSHIPS BETWEEN STRUCTURE OF NITRATED ARENES AND THEIRMUTAGENICITY IN SALMONELLA TYPHIMURIUM, 2- AND 2,7-NITRO SUBSTITUTED FLUORENE,PHENANTHRENE AND PYRENE, MUTAT. RES. 209(1-2):67-74, 1988"
+63224-44-2,GENETOX,1,-1,,CCCCCCCCCCCCCC(=O)ON(C(=O)C)c1ccc2c(Cc3ccccc23)c1,"MUTAT RES 168:69-240,1986"
+85-68-7,VITIC,0,-1,,CCCCOC(=O)c1ccccc1C(=O)OCc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98114-62-6,CCRIS,1,-1,,OCN=N,"UKAWA-ISHIKAWA,S, SAWADA,A, KASUYA,A AND MOCHIZUKI,M, MUTAGENICITY OFISOMERIC ALKANEDIAZOTATES, PRECURSORS FOR ULTIMATE ALKYLATING SPECIES OFCARCINOGENIC N-NITROSO COMPOUNDS, MUTAT. RES. 412(1):99-107, 1998"
+75-50-3,VITIC,0,-1,"TRIMEAMIN",CN(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+108-91-8,VITIC,0,-1,"CYCHEXAMI,JM-118,JM-149,JM-221,JM-231,JM-251,JM-256,JM-262,JM-272,JM-291,JM-334,DR9504566,DR9604517,NSC170899,JM-216",NC1CCCCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+72-56-0,VITIC,1,-1,,CCc1ccc(cc1)C(C(Cl)Cl)c2ccc(CC)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+128505-52-2,CCRIS,0,-1,,CCN(CC)C(=S)SSCC(NC(=O)C)C(=O)O,"LEE,BH, LEE,S, KIM,YS, BERTRAM,B AND WIESSLER,M, MIXED DISULFIDES FROMDISULFIRAM INHIBIT THE BENZO[A]PYRENE INDUCED MUTAGENESIS, MUTAT. RES.371(3-4):215-220, 1996"
+738-70-5,VITIC,0,-1,"TRIMETHOP,TRIMELACT,TRIMESDIA,TRIMESDID,TRIMESDOX,TRIMESFUR,TRIMESLEN,TRIMESMER,TRIMESMAZ,TRIMESMPY,TRIMESMET,TRIMESMOX,TRIMESULF,TRIMESTRO",COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+131-92-0,VITIC,0,-1,,O=C(Nc1cccc2C(=O)c3c(ccc4c5cc(NC(=O)c6ccccc6)c7C(=O)c8ccccc8C(=O)c7c5[nH]c34)C(=O)c12)c9ccccc9,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1888-89-7,CCRIS,1,-1,,C(CC1CO1)C2CO2,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+61734-86-9,EPA3,1,-1,,CCCCCN(CCCCO)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+104-04-1,CCRIS,0,-1,,CC(=O)Nc1ccc(cc1)[N+](=O)[O-],"CORBETT,MD, WEI,CI AND CORBETT,BR, NITROREDUCTASE-DEPENDENTMUTAGENICITY OF P-NITROPHENYLHYDROXYLAMINE AND ITS N-ACETYL AND N-FORMYLHYDROXAMIC ACIDS, CARCINOGENESIS 6(5):727-732, 1985"
+17135-78-3,EPA1,1,-1,,Clc1ccc2cc3ccccc3cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+34430-26-7,CCRIS,0,-1,,CCCC[CH-][N+](=O)[O-],"CONAWAY,CC, HUSSAIN,NS, WAY,BM AND FIALA,ES, EVALUATION OF SECONDARYNITROALKANES, THEIR NITRONATES, PRIMARY NITROALKANES, NITROCARBINOLS, AND OTHERALIPHATIC NITRO COMPOUNDS IN THE AMES SALMONELLA ASSAY, MUTAT. RES.261(3):197-207, 1991"
+68006-83-7,EPA1,1,-1,,Cc1cc2c3ccccc3[nH]c2nc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+63-56-9,VITIC,0,-1,"THONZYLAM,THONZYHCL",COc1ccc(CN(CCN(C)C)c2ncccn2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5875-25-2,CCRIS,1,-1,,CC(Br)C(=O)N,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+1732-23-6,EPA1,1,-1,,Nc1cc2ccc3cccc4ccc(c1)c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50-01-1,CCRIS,0,-1,"GUANIDINE,GUANIDHCL",NC(=N)N,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+88598-59-8,CCRIS,1,-1,,OC1C=Cc2c(cc3ccc4ccc(c5ccc2c3c45)[N+](=O)[O-])C1O,"CHOU,MW, HEFLICH,RH AND FU,PP, METABOLISM OF 1-NITROBENZO[A]PYRENE BYRAT LIVER MICROSOMES TO POTENT MUTAGENIC METABOLITES,CARCINOGENESIS7(11):1837-1844, 1986"
+144-48-9,EPA1,0,-1,"IODACETAM",NC(=O)CI,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6629-29-4,EPA1,1,-1,,Cc1c(N)cc(N)cc1[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89811-25-6,CCRIS,1,-1,,CC(C)CNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+98931-06-7,CCRIS,1,-1,,CCCn1cc2CC3C(CC(C)CN3C#N)c4cccc1c24,"GLATT,H, PERTZ,H, KASPER,R AND EICH,E, CLAVINE ALKALOIDS ANDDERIVATIVES AS MUTAGENS DETECTED IN THE AMES TEST, ANTI-CANCER DRUGS3(6):609-614, 1992"
+620-26-8,CCRIS,0,-1,,Cc1cccc(c1)N=O,"GUPTA,RL, KAUR,IP, GUPTA,AK, PATHAK,DP AND JUNEJA,TR, EFFECT OFNORHARMAN ON THE MUTAGENICITY OF TOLUIDINE METABOLITES, TOXICOL. LETT.48(1):75-81, 1989"
+31431-39-7,EPA1,1,-1,"MEBENDAZO,NSC184849",COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96910-70-2,EPA1,1,-1,,CC1(C)C[C@H]2C=C(CO)[C@]3(C[C@@]3(C)[C@@H]2C1)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54607-64-6,CCRIS,0,-1,,OC(=O)c1occ(c2ccccc2)c1c3ccccc3,"ICHIKAWA,M, YAMAMOTO,K, TANAKA,A, SWAMINATHAN,S, HATCHER,JF, ERTURK,EAND BRYAN,GT, MUTAGENICITY OF 3,4-DIPHENYL-5-NITROFURAN ANALOGS IN SALMONELLATYPHIMURIUM, CARCINOGENESIS 7(8):1339-1344, 1986"
+67019-28-7,CCRIS,1,-1,,O=C(Nc1snc2ccccc12)c3ccccc3,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+620-88-2,CCRIS,1,-1,,[O-][N+](=O)c1ccc(Oc2ccccc2)cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, GENOTOXICITY OF POTENTIAL METABOLITESOF NITROSCANATE- AN ANTISCHISTOSOMAL DRUG, MUTAT. RES. 335(3):235-243,1995"
+93-72-1,CCRIS,0,-1,"FENOPROP",CC(Oc1cc(Cl)c(Cl)cc1Cl)C(=O)O,"MERSCH-SUNDERMANN,V, DICKGIESSER,N, HABLIZEL,U AND GRUBER,B,EXAMINATION OF MUTAGENICITY OF ORGANIC MICROCONTAMINATIONS ON THE ENVIRONMENT.PART 1. THE MUTAGENICITY OF SELECTED HERBICIDES AND INSECTICIDES WITH THESALMONELLA-MICROSOME TEST (AMES TEST) IN CONSIDERATION OF THE PATHOGENICITY OFCONTAMINATED GROUND- AND DRINKING-WATER, ZENTRALBL. BAKTERIOL., MIKROBIOL. HYG.,SER. B 186(3):247-260, 1988"
+41840-28-2,EPA1,0,-1,,Cc1cc(C)nc(SC(=O)OC(C)(C)C)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+163275-64-7,CCRIS,1,-1,,Fc1ccc(F)c2c1ccc3cccnc23,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+105-36-2,VITIC,1,-1,,CCOC(=O)CBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106-44-5,VITIC,0,-1,"CRESOL-P",Cc1ccc(O)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+606-35-9,EPA1,1,-1,,COc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2498-77-3,EPA1,1,-1,,Cc1cccc2ccc3cc4ccccc4cc3c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+136112-73-7,CCRIS,1,-1,,Nc1ncnc2c1ncn2c3ccc(cc3[N+](=O)[O-])[N+](=O)[O-],"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+66842-42-0,EPA3,1,-1,,Cc1c2ccccc2c([C@@H]3CO3)c4ccccc14,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+99-98-9,VITIC,1,-1,,CN(C)c1ccc(N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+25125-72-8,CCRIS,1,-1,,N1[C@@H]([C@H]1c2ccccc2)c3ccccc3,"GLATT,HR, ROBERTSON,LW, ARAND,M, RAUCH,P, SCHRAMM,H, SETIABUDI,F,POECHLAUER,P, MUELLER,EP AND OESCH,F, CIS- AND TRANS-1,2-DIPHENYLAZIRIDINES.INDUCTION OF XENOBIOTIC-METABOLIZING ENZYMES IN RAT LIVER AND MUTAGENICITY INSALMONELLA TYPHIMURIUM, ARCH. TOXICOL. 59(4):242-248, 1986"
+25799-70-6,EPA1,1,-1,,COc1ccc(c2c(NCCCN(C)C)c3ccccc3nc12)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96014-36-7,EPA1,1,-1,,Nc1ccc2[nH]c3ccccc3c2c1[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51938-14-8,EPA3,1,-1,,CCCCN(CCO)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+107-22-2,VITIC,1,-1,"GLYOXAL",O=CC=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+74877-25-1,CCRIS,0,-1,,O=C1C=Cc2c(ccc3cc4ccccc4cc23)C1=O,"FLOWERS-GEARY,L, BLECZINSKI,W, HARVEY,RG AND PENNING,TM, CYTOTOXICITYAND MUTAGENICITY OF POLYCYCLIC AROMATIC HYDROCARBON O-QUINONES PRODUCED BYDIHYDRODIOL DEHYDROGENASE, CHEM.- BIOL. INTERACT. 99(1-3):55-72, 1995"
+144-62-7,VITIC,0,-1,"CERIUMOXA,GDOXALATE,GLISULFAZ,FEOXALATE",OC(=O)C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M450,EPA1,0,-1,,CC[C@@H](C)Nc1ccc(N[C@H](C)CC)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+892-17-1,EPA1,1,-1,,Cc1cc2C(=O)CCc2c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111-30-8,EPA1,1,-1,"GLUTARAL",O=CCCCC=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+64314-52-9,EPA1,1,-1,,C[C@@H]1O[C@H](C[C@H](N)[C@H]1O)O[C@H]2C[C@@](O)(Cc3c(O)c4C(=O)c5ccccc5C(=O)c4c(O)c23)C(=O)CO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7681-76-7,EPA3,1,-1,"RONIDAZOL",Cn1c(COC(=O)N)ncc1[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+85431-61-4,CCRIS,1,-1,,CC1C(O)CCC2=CC(=O)C3(OC3C12C)C4(CO)CO4,"BHATTACHARYA,G, DHAR,TK, BHATTACHARYYA,FK AND SIDDIQUI,KAI, MUTAGENICACTION OF A PHASEOLINONE, A MYCOTOXIN ISOLATED FROM MACROPHOMINA PHASEOLINA,AUST. J. BIOL. SCI. 40(4):349-353, 1987"
+55-86-7,VITIC,1,-1,"CLMETHINE,CHLORMHCL",CN(CCCl)CCCl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+130-15-4,EPA1,1,-1,"DR9605273",O=C1C=CC(=O)c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86-87-3,EPA2,0,-1,"REGENASOL,REGENASNA",OC(=O)Cc1cccc2ccccc12,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+67392-87-4,CCRIS,0,1,,CC12CCC(=O)C=C1C3CC3C4C2CCC5(C)C4C6CC6C57CCC(=O)O7,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+92116-67-1,CCRIS,0,-1,,CNc1ccc2ncc(C)nc2c1N,"GRIVAS,S AND JAEGERSTAD,M, MUTAGENICITY OF SOME SYNTHETIC QUINOLINESAND QUINOXALINES RELATED TO IQ, MEIQ OR MEIQX IN AMES TEST, MUTAT. RES. 137(1):29-32, 1984"
+137-26-8,VITIC,1,-1,"THIRAM",CN(C)C(=S)SSC(=S)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100-51-6,VITIC,0,-1,"BENZYLALC",OCc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+184582-58-9,CCRIS,1,-1,,Oc1c2ccccc2nc3ccc4OCCOc4c13,"TANAKA,M, CSURI,K, MUCSI,I, MOLNAR,J, GALY,JP AND BARBE,J,MUTAGENICITY OF SYNTHETIC ACRIDINONES AND THIOACRIDINES IN DIRECT AMESSALMONELLA MUTAGENICITY ASSAY, HETEROCYCL. COMMUN. 2(5):463-467, 1996"
+81-13-0,CCRIS,0,-1,"PANTHENOL",CC(C)(CO)C(O)C(=O)NCCCO,"PRIVAL,MJ, SIMMON,VF AND MORTELMANS,KE, BACTERIAL MUTAGENICITY TESTINGOF 49 FOOD INGREDIENTS GIVES VERY FEW POSITIVE RESULTS, MUTAT. RES.260(4):321-329, 1991"
+630-17-1,EPA1,0,-1,,CC(C)(C)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56986-35-7,EPA3,1,-1,,CCCCN(N=O)[C@@H](CCC)OC(=O)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+142078-76-0,CCRIS,0,-1,,OC1C(O)c2cccnc2C3OC13,"WILLEMS,MI, DUBOIS,G, BOYD,DR, DAVIES,RJH, HAMILTON,L, MCCULLOUGH,JJAND VAN BLADEREN,PJ, COMPARISON OF THE MUTAGENICITY OF QUINOLINE AND ALLMONOHYDROXYQUINOLINES WITH A SERIES OF ARENE OXIDE, TRANS-DIHYDRODIOL, DIOLEPOXIDE, N-OXIDE AND ARENE HYDRATE DERIVATIVES OF QUINOLINE IN THE AMES/SALMONELLA MICROSOME TEST, MUTAT. RES. 278(4):227-236, 1992"
+68884-32-2,CCRIS,1,-1,,C(C1CO1)c2cccc3ccccc23,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+5417-50-5,EPA1,0,-1,,CC(=O)Nc1cnc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155164-64-0,CCRIS,0,-1,,CCC(=O)N1N=CC(=C(Cl)C1=O)Cl,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+5784-45-2,EPA1,0,-1,,Clc1nncc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+89-62-3,VITIC,1,-1,,Cc1ccc(N)c(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+93-05-0,VITIC,1,-1,"CD-1",CCN(CC)c1ccc(N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+96-37-7,VITIC,0,-1,,CC1CCCC1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+28164-57-0,EPA1,0,-1,"DIOSPYRIN",Cc1cc(O)c2C(=O)C=C(C(=O)c2c1)c3c(C)cc4C(=O)C=CC(=O)c4c3O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98151-91-8,EPA1,1,-1,,O[C@H]1C=Cc2cc3ccc4c(ccc5ccc(c2[C@@H]1O)c3c45)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+205-82-3,EPA1,1,-1,,c1ccc2c3c(ccc2c1)c4cccc5cccc3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+127072-59-7,CCRIS,0,-1,,CC\C=C\C=C\C=C\C=C\C=C\SCC(O)CO,"VOOGD,CE, VERTEGAAL,LBJ, VAN DER STEEG,M, VAN DER GEN,A, MOHN,GR,STUCTURE, CHEMICAL REACTIVITY, AND IN VITRO MUTAGENIC ACTIVITY IN A SERIES OFFECAPENTAENE ANALOGS, MUTAT. RES. 243(3):195-9, 1990"
+5496-41-3,CCRIS,1,-1,,COc1ccc(cc1OC)c2nc(c3ccccc3)c([nH]2)c4ccccc4,"MERCANGOZ,A AND TUYLU,BA, DETECTION OF MUTAGENIC EFFECTS OF 2,4,5,TRI(SUBSTITUTE)PHENYL IMIDAZOLE AND ITS DERIVATIVES IN AMES/SALMONELLA/TESTSYSTEM,TURK. J. BIOL. 24(1):57-64, 2000"
+92134-95-7,CCRIS,0,-1,,CC(O)C(O)C(O)C(O)C1SCCN1N=O,"UMANO,K, SHIBAMOTO,T, FERNANDO,SY AND WEI,CI, MUTAGENICITY OF2-HYDROXYALKYL-N- NITROSOTHIAZOLIDINES, FOOD CHEM. TOXICOL. 22(4):253-259,1984"
+1929-73-3,EPA1,0,-1,,CCCCOCCOC(=O)COc1ccc(Cl)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10453-89-1,CCRIS,0,-1,,CC(=CC1C(C(=O)O)C1(C)C)C,"SIMMON,VF, RICCIO,ES, ROBINSON,DE AND MITCHELL,AD, IN VITROMICROBIOLOGICAL MUTAGENICITY AND UNSCHEDULED DNA SYNTHESIS STUDIES OF FIFTEENPESTICIDES, EPA/600/1-85/006, NTIS PB85-193761, 1985"
+935-95-5,VITIC,0,-1,,Oc1c(Cl)c(Cl)cc(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+30560-19-1,CCRIS,0,-1,,COP(=O)(NC(=O)C)SC,"HOUR,TC, CHEN,L AND LIN,JK, COMPARATIVE INVESTIGATION ON THEMUTAGENICITIES OF ORGANOPHOSPHATE, PHTHALIMIDE, PYRETHROID AND CARBAMATEINSECTICIDES BY THE AMES AND LACTAM TESTS, MUTAGENESIS 13(2):157-166,1998"
+230-46-6,CCRIS,1,-1,"DR9803632",c1cnc2c(c1)ccc3ncccc23,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+1928-38-7,EPA1,0,-1,,COC(=O)COc1ccc(Cl)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+480-22-8,EPA1,0,-1,,Oc1cccc2cc3cccc(O)c3c(O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4394-00-7,EPA1,0,-1,"DR9506388,NIFLUMAAL,NIFLUMATE,PYRIDONIF",OC(=O)c1cccnc1Nc2cccc(c2)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5632-47-3,EPA2,1,-1,"NITROSOPN",O=NN1CCNCC1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+135294-98-3,CCRIS,1,-1,,BrCc1ccc2c3ccccc3c4cccc1c24,"BALL,JC, AND YOUNG,WC, AMES ASSAY MUTAGENICITY AND ELECTRONICSTRUCTURE CALCULATIONS OF BROMOMETHYLFLUORANTHENES, CHLOROMETHYLFLUORANTHENES,AND HYDROXYMETHYLFLUORANTHENES, CHEM.-BIOL. INTERACT. 77(3):291-302,1991"
+75-34-3,VITIC,0,-1,,CC(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+75888-03-8,EPA1,1,-1,"FURAPYRIM",[O-][N+](=O)c1oc(\C=N\N2CCCNC2=O)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1504-74-1,EPA3,1,-1,,COc1ccccc1\C=C/C=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+703-83-3,CCRIS,0,-1,,CCNc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+70092-13-6,CCRIS,0,-1,,Cc1c2ccccc2c(C)c3c4C=CC(=O)C(=O)c4ccc13,"FLOWERS-GEARY,L, BLECZINSKI,W, HARVEY,RG AND PENNING,TM, CYTOTOXICITYAND MUTAGENICITY OF POLYCYCLIC AROMATIC HYDROCARBON O-QUINONES PRODUCED BYDIHYDRODIOL DEHYDROGENASE, CHEM.- BIOL. INTERACT. 99(1-3):55-72, 1995"
+3930-20-9,CCRIS,0,-1,"SOTALOL,SOTALOHCL",CC(C)NCC(O)c1ccc(NS(=O)(=O)C)cc1,"OKINE,LKN, IOANNIDES,C AND PARKE,DV, STUDIES ON THE POSSIBLEMUTAGENICITY OF BETA-ADRENERGIC BLOCKER DRUGS, TOXICOL. LETT. 16(3-4):167-174,1983"
+75996-85-9,CCRIS,0,-1,,CCOC(=O)Cc1c(C(=O)O)c2ccccc2n1C,"LOPEZ DE CERAIN,A, GARCIA,E, GULLON,A, IGNACIO,RJ AND MONGE,A,MUTAGENIC EVALUATION OF SOME TRIAZINO INDOLES USING THE SALMONELLA/MAMMALIANMICROSOME ASSAY, MUTAGENESIS 5(4):307-311, 1990"
+61691-82-5,EPA3,1,-1,,COc1ccc(cc1)[C@H](OC(=O)C)C=C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+10088-95-6,CCRIS,0,-1,,C\C=C\C1=CC2=C(C(=O)O1)C(=O)C(O)C(C)O2,"SCHRADER,TJ CHERRY,W SOPER,K LANGLOIS,I AND VIJAY,HM, EXAMINATION OFALTERNARIA ALTERNATA MUTAGENICITY AND EFFECTS OF NITROSYLATION USING THE AMESSALMONELLA TEST, TERATOG., CARCINOG., MUTAGEN. 21(4):261-274, 2001"
+431-03-8,EPA1,1,-1,,CC(=O)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92433-40-4,EPA1,1,-1,,CC(=O)Nc1cc2Cc3ccccc3c2cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-16-7,VITIC,0,-1,"DEANOLMAL,MALEATE",OC(=O)\C=C/C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+33704-61-9,CCRIS,0,-1,,CC1C(C)(C)C2=C(C(=O)CCC2)C1(C)C,"MERSCH-SUNDERMANNO,V, KEVEKORDESO,S AND JENTERO,C, LACK OFMUTAGENICITY OF POLYCYCLIC MUSK FRAGRANCES IN SALMONELLA TYPHIMURIUM, TOXICOL.IN VITRO 12(4):389-393, 1998"
+109-70-6,EPA1,1,-1,,ClCCCBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60-80-0,EPA1,0,-1,"DICHLORAL,PHENAZONE,PHENAZOAS,PHENAZOBZ,PHENAZMAN,PHENZMEGL,PHECAFCIT,SALIPHENA",CN1N(C(=O)C=C1C)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68688-84-6,GENETOX,1,-1,,CC1(O)C=Cc2cc3c(ccc4ccccc34)c5CCC1(O)c25,"TOXICOL APPL PHARMACOL 45:629-633,1978"
+108-68-9,VITIC,0,-1,"DR0030105",Cc1cc(C)cc(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+91626-52-7,CCRIS,1,-1,,CS(=O)(=O)N1N=CC(=C(Cl)C1=O)Cl,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+95-33-0,VITIC,0,-1,,C1CCC(CC1)NSc2nc3ccccc3s2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+73198-02-4,CCRIS,0,-1,,OCC1NC(Cc2c1[nH]c3ccccc23)C(=O)O,"PAPAVERGOU,E, IOANNIDES,C AND CLIFFORD,MN, THE EVALUATION IN THE AMESTEST OF THE MUTAGENICITY OF TETRAHYDRO-BETA-CARBOLINE-3-CARBOXYLIC ACIDS FROMSMOKED FOODS, FOOD ADDIT. CONTAM. 9(2):183-187, 1992"
+60971-98-4,CCRIS,0,-1,,COC(=O)C1=C(C)C(C)(O)OC1=O,"KIM,IS, AND BJELDANES,LF, SYNTHESES AND MUTAGENICITY OF FUSARIN C RINGANALOGS, J. AGRIC. FOOD CHEM. 40(9):1625-1630, 1992"
+16239-84-2,EPA3,1,-1,,Nc1nc(\C=C/c2oc(cc2)[N+](=O)[O-])cs1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+89459-25-6,EPA1,1,-1,"NSC601316",CN(C)CCNC(=O)c1cccc2cc3ccccc3nc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-70-3,VITIC,0,-1,,Clc1cc(Cl)cc(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24934-91-6,EPA1,0,-1,,CCOP(=S)(OCC)SCCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+580-18-7,EPA1,0,-1,,Oc1cnc2ccccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71-41-0,VITIC,0,-1,"PENTANOL",CCCCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+160543-14-6,CCRIS,1,-1,,Cc1c2ccc3C(O)C(O)C=Cc3c2nc4ccc(CO)cc14,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+1953-54-4,EPA1,0,-1,"DR9712873",Oc1ccc2[nH]ccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15012-61-0,CCRIS,0,-1,,CCC1=C(OC)C(=O)c2c(O)c(OC)c(OC)c(O)c2C1=O,"LEBEDEV,AV LEVITSKAYA,EL TIKHONOVA,EV AND IVANOVA,MV, ANTIOXIDANTPROPERTIES, AUTOOXIDATION, AND MUTAGENIC ACTIVITY OF ECHINOCHROME A COMPAREDWITH ITS ETHERIFIED DERIVATIVE, BIOCHEMISTRY (MOSCOW, RUSS. FED.) 66(8):885-893,2001"
+144-80-9,VITIC,0,-1,"AGSULFACE,SULFACETA,SULFACENA",CC(=O)NS(=O)(=O)c1ccc(N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24085-03-8,CCRIS,1,-1,,CC(C)(C)N(CC(O)c1ccc(O)c(CO)c1)Cc2ccccc2,"LITTLE,CA, TWEATS,DJ AND PINNEY,RJ, RELEVANCE OF PLASMIDPKM101-MEDIATED MUTAGENICITY IN BACTERIA TO GENOTOXICITY IN MAMMALIAN CELLS,MUTAGENESIS 4(5): 371-376, 1989"
+1769-41-1,CCRIS,0,-1,,O\N=C\C(=O)Nc1ccccc1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y86"
+6653-71-0,CCRIS,1,-1,,CC(Br)C(=O)NCc1ccccc1,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+198-55-0,EPA1,1,-1,,c1cc2cccc3c4cccc5cccc(c(c1)c23)c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+578-95-0,EPA1,0,-1,,Oc1c2ccccc2nc3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+138805-33-1,CCRIS,0,-1,,CC(=O)Nc1ccc(C)c(c1)N=Nc2cc(NC(=O)C)ccc2C,"SAYAMA,M, MORI,M, NAKADA,Y, KAGAMIMORI,S AND KOZUKA,H, METABOLISM OF2,4-DINITROTOLUENE BY SALMONELLA TYPHIMURIUM STRAINS TA98, TA98NR ANDTA98/1,8-DNP6, AND MUTAGENICITY OF THE METABOLITES OF 2,4-DINITROTOLUENE ANDRELATED COMPOUNDS TO STRAINS TA98 AND TA100, MUTAT. RES. 264(3):147-153,1991"
+24684-56-8,EPA3,1,-1,,Cc1cc2C(=O)[C@@H](O)Cc2c3ccc4ccccc4c13,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+119-34-6,EPA2,1,-1,,Nc1ccc(O)c(c1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+75-05-8,VITIC,0,-1,"ACETONTRL",CC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2304-85-0,EPA1,1,-1,,O=C1C=Cc2ccc3C=CC(=O)c4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+84-88-8,EPA1,1,-1,"CUPROXANE,HYDROXYSP",Oc1ccc(c2cccnc12)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110417-88-4,CCRIS,0,-1,,CCC(C)C(C(CC(=O)N1CCCC1C(OC)C(C)C(=O)NC(Cc2ccccc2)c3nccs3)OC)N(C)C(=O)C(NC(=O)C(C(C)C)N(C)C)C(C)C,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y96"
+112368-27-1,CCRIS,0,-1,,Clc1ccc(N2C(=O)CCC2=O)c(Cl)c1Cl,"RASHID,KA, ARJMAND,M, SANDERMANN,H AND MUMMA,RO, MUTAGENICITY OFCHLOROANILINE/LIGNIN METABOLITES IN THE SALMONELLA/MICROSOME ASSAY, J. ENVIRON.SCI. HEALTH, PART B B22(6):721-729, 1987"
+29975-16-4,CCRIS,0,-1,"ESTAZOLAM",Clc1ccc2c(c1)C(=NCc3nncn23)c4ccccc4,"WAKISAKA,Y AND NISHIMOTO,Y, MUTAGENICITY STUDY ON A NEW SLEEP INDUCER,A 1H-1,2,4-TRIAZOLYLBENZOPHENONE DERIVATIVE (450191-S), AND ITS METABOLITE INBACTERIA, IYAKUHIN KENKYU 18(1):12-20, 1987"
+96614-59-4,CCRIS,1,-1,,NC(CCC(=O)NC(CS\C(=C\Cl)\Cl)C(=O)NCC(=O)O)C(=O)O,"VAMVAKAS,S, ELFARRA,AA, DEKANT,W, HENSCHLER,D AND ANDERS,MW,MUTAGENICITY OF AMINO ACID AND GLUTATHIONE S-CONJUGATES IN THE AMES TEST, MUTAT.RES. 206(1): 83-90, 1988"
+25168-26-7,EPA3,0,-1,,CC(C)CCCCCOC(=O)Cc1ccc(Cl)cc1Cl,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+4436-24-2,CCRIS,1,-1,,C(C1CO1)c2ccccc2,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+NOCAS_M123,EPA1,1,-1,,N[C@@H](CS\C(=C\Cl)\Cl)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131-17-9,VITIC,0,-1,,C=CCOC(=O)c1ccccc1C(=O)OCC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+709-98-8,EPA1,0,-1,"PROPANIL",CCC(=O)Nc1ccc(Cl)c(Cl)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3351-30-2,EPA1,1,-1,,Cc1cccc2ccc3c4ccccc4ccc3c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7350-43-8,EPA3,1,-1,,CC(=O)Nc1nc(\C=C/c2oc(cc2)[N+](=O)[O-])cs1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+86-86-2,EPA2,1,-1,,NC(=O)Cc1cccc2ccccc12,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+21314-05-6,CCRIS,1,-1,,Nc1ncnc2c1ncn2c3ccc(cc3)[N+](=O)[O-],"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+146177-57-3,EPA1,1,-1,,Cc1cc2c(nc(N)n2C)c3nccnc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15545-48-9,CCRIS,0,-1,"CHLORTOLU",CN(C)C(=O)Nc1ccc(C)c(Cl)c1,"RAMLJAK,S HACKENBERGER,BK SMITAL,T AND BRITVIC,S, EVALUATION OF THEGENOTOXIC AND CYTOCHROME P450 MONOOXYGENASE-INHIBITORY POTENTIAL OF DICURAN ONPROCARYOTIC AND"
+NOCAS_M219,EPA1,1,-1,,O[C@H]1C=Cc2cc3c(cc2[C@@H]1O)c4cccc5cccc3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16709-86-7,CCRIS,0,-1,,C[Si](C)(CCl)C=C,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y90"
+60448-19-3,EPA3,1,-1,,O1[C@@H]2[C@H]1c3cccc4ccc5cc6ccccc6c2c5c34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+620-25-7,EPA1,1,-1,,Cc1cccc(NO)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+122-34-9,EPA1,0,-1,"SIMAZINE",CCNc1nc(Cl)nc(NCC)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+121958-18-7,CCRIS,0,-1,,C1CC2CCc3ccccc3C24OC4C1,"CROTTI,P, DI BUSSOLO,V, BENETTI,D, LONGO,V AND GERVASI,PG,MUTAGENICITY OF HEXAHYDROPHENANTHRENES AND THEIR OXIRANE DERIVATIVES, J.ENVIRON. PATHOL., TOXICOL. ONCOL. 13(4):221-226, 1994"
+1943-79-9,EPA1,0,-1,,CNC(=O)Oc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+77-09-8,VITIC,0,-1,"PHENOLPHT",Oc1ccc(cc1)C2(OC(=O)c3ccccc23)c4ccc(O)cc4,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1198-61-4,EPA1,0,-1,,Fc1c(F)c(Cl)c(F)c(Cl)c1F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1520-21-4,EPA1,1,-1,,Nc1ccc(C=C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50-55-5,EPA1,0,-1,,CO[C@H]1[C@@H](C[C@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)c6cc(OC)c(OC)c(OC)c6,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+920-66-1,VITIC,0,-1,"HEXFISOPR",OC(C(F)(F)F)C(F)(F)F,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+136112-72-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc(Nc2ncnc3c2ncn3c4ccc(cc4)[N+](=O)[O-])cc1,"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+3032-55-1,CCRIS,0,-1,,CC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-],"SANO,SK AND KORTE,DW, MUTAGENIC POTENTIAL OF TRIMETHYLOLETHANETRINITRATE IN THE AMES SALMONELLA/MAMMALIAN MICROSOME MUTAGENICITY TEST, GOV.REP. ANNOUNCE. INDEX (U.S) 89(6):ABSTR. NO. 914,197, 1989"
+27969-93-3,CCRIS,0,-1,,Cc1cccc(C)c1N=Nc2c(O)ccc3ccccc23,"HAYAKAWA,Y, MIYAGOSHI,M AND NAGAYAMA,T, HYGIENIC STUDIES OF COAL TARDYES USED IN DRUGS AND COSMETICS. II. STRUCTURAL ISOMERS OF RED NO. 505, EISEIKAGAKU 30(4):211-215, 1984"
+28921-94-0,CCRIS,0,-1,,C\C=C\C1OC(=O)C=CC1O,"KRIVOBOK,S, THOMASSON,F, SEIGLE-MURANDI,F, STEIMAN,R ANDBOTTEX-GAUTHIER,C, 6-ALLYL-5,6-DIHYDRO-5-HYDROXYPYRAN-2-ONE, A LACTONE PRODUCEDBY A NEW DRECHSLERA SPECIES: SPECIFIED 1H AND 13C NMR ASSIGNMENTS, MUTAGENIC ANDIMMUNOMODULATING TESTINGS, PHARMAZIE 49(8):605-607, 1994"
+610-30-0,EPA1,1,-1,,OC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+505-23-7,EPA1,1,-1,,C1CSCSC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1552-42-7,VITIC,0,-1,,CN(C)c1ccc(cc1)C2(OC(=O)c3cc(ccc23)N(C)C)c4ccc(cc4)N(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+530-52-9,CCRIS,0,-1,,Oc1c2ccoc2nc3ccccc13,"KLIER,B AND SCHIMMER,O, MICROSOMAL METABOLISM OF DICTAMNINE:IDENTIFICATION OF METABOLITES AND EVALUATION OF THEIR MUTAGENICITY IN SALMONELLATYPHIMURIUM: MUTAGENESIS 14(2):181-185, 1999"
+107027-12-3,EPA1,1,-1,"NSC608506",CN(C)CCNC(=O)c1cccc2ccc(nc12)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+158321-20-1,CCRIS,1,-1,,Nc1ccc2c3ccccc3[nH]c2c1[N+](=O)[O-],"ANDRE,V, BOISSART,C, SICHEL,F, GAUDUCHON,P, LE TALAEER,JY,LANCELOT,JC, ROBBA,M, MERCIER,C, CHEMTOB,S, RAOULT,E AND TALLEC,A, MUTAGENICITYOF NITRO- AND AMINO-SUBSTITUTED CARBAZOLES IN SALMONELLA TYPHIMURIUM. II.ORTHO-AMINONITRO DERIVATIVES OF 9H-CARBAZOLE, MUTAT. RES. 345(1,2):11-25,1995"
+622-20-8,VITIC,0,-1,,C(CSc1ccccc1)Sc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+723-46-6,VITIC,0,-1,"SULFAMXNA,SULMETOXA",Cc1onc(NS(=O)(=O)c2ccc(N)cc2)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+50880-65-4,CCRIS,1,-1,,Oc1c(N=Nc2ccc(cc2)S(=O)(=O)O)c3ccc(cc3cc1S(=O)(=O)O)S(=O)(=O)O,"GLATT,H, PIEE,A, PAULY,K, STEINBRECHER,T, SCHRODE,R, OESCH,F ANDSEIDEL,A, FJORD- AND BAY-REGION DIOL-EPOXIDES INVESTIGATED FOR STABILITY, SOSINDUCTION IN ESCHERICHIA COLI, AND MUTAGENICITY IN SALMONELLA TYPHIMURIUM ANDMAMMALIAN CELLS,CANCER RES. 51(6):1659-1667, 1991"
+5401-94-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2[nH]ncc2c1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y92"
+28920-43-6,EPA1,1,-1,,ClC(=O)OCC1c2ccccc2c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+81851-68-5,CCRIS,1,-1,,Cc1cc2ccccc2c3ccc4C(O)C(O)C5OC5c4c13,"AMIN,S, HUIE,K, HECHT,SS AND HARVEY,RG, SYNTHESIS OF6-METHYLCHRYSENE-1,2-DIOL-3,4-EPOXIDES AND COMPARISON OF THEIR MUTAGENICITY TO5-METHYLCHRYSENE-1,2-DIOL-3,4-EPOXIDES, CARCINOGENESIS 7(12):2067-2070,1986"
+76014-81-8,CCRIS,1,-1,,CN(CCCC(O)c1cccnc1)N=O,"BROWN,B AVALOS,J LEE,C AND DOOLITTLE,D, THE EFFECT OF TOBACCO SMOKE,NICOTINE, AND COTININE ON THE MUTAGENICITY OF4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANOL (NNAL), MUTAT. RES.494(1-2):21-29, 2001"
+32588-76-4,VITIC,0,-1,,Brc1c(Br)c(Br)c2C(=O)N(CCN3C(=O)c4c(Br)c(Br)c(Br)c(Br)c4C3=O)C(=O)c2c1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+60129-60-4,CCRIS,1,-1,,CC12CCCC(C)(C1CCC34CC(=C)C(CCC23)(C4)OC5OC(CO)C(O)C(O)C5O)C(=O)O,"PEZZUTO,JM, NANAYAKKARA,NPD, COMPADRE,CM, SWANSON,SM, KINGHORN,AD,GUENTHNER,TM, SPARNINS,VL AND LAM,LKT, CHARACTERIZATION OF BACTERIALMUTAGENICITY MEDIATED BY 13-HYDROXY-ENT-KAURENOIC ACID (STEVIOL) AND SEVERALSTRUCTURALLY-RELATED DERIVATIVES AND EVALUATION OF POTENTIAL TO INDUCEGLUTATHIONE S-TRANSFERASE IN MICE, MUTAT. RES. 169(3):93-103, 1986"
+55556-94-0,EPA3,1,-1,,C[C@H]1CN(CCN1N=O)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+110-86-1,VITIC,0,-1,"PK-104P,DR9802432,SKF-40539",c1ccncc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107-04-0,VITIC,1,-1,,ClCCBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+191-07-1,EPA1,1,-1,,c1cc2ccc3ccc4ccc5ccc6ccc1c7c6c5c4c3c27,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99-33-2,CCRIS,1,-1,,[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Cl,"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+610-66-2,VITIC,1,-1,,[O-][N+](=O)c1ccccc1CC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+34866-46-1,CCRIS,0,-1,"CARBUTERO,CARBUTHCL",CC(C)(C)NCC(O)c1ccc(O)c(NC(=O)N)c1,"HUSSAIN,SS, AL-DAKAN,AA, ABOUL-ENEIN,HY AND HANNAN,MA, DNA STRANDBREAKS AND MUTATIONS CAUSED BY PENBUTOLOL, A BETA BLOCKER, MUTAT. RES.204(4):675-682, 1988"
+106-22-9,CCRIS,0,-1,"CITRONEOL",CC(CCO)CCC=C(C)C,"KONO,M, YOSHIDA,Y, ITAYA,Y, SHIMOBO,K, YOSHIKAWA,K, TERASHITA,T ANDSHISHIYAMA,J, ANTIMICROBIAL ACTIVITY AND MUTAGENICITY OF ALLYL ISOTHIOCYANATESAND SEVERAL ESSENTIAL OILS FROM SPICES, KINKI DAIGAKU NOGAKUBU KIYO 28:11-19,1995"
+478-08-0,EPA1,1,-1,"LUCIDIN",OCc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+141-78-6,VITIC,0,-1,"ETACETATE",CCOC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5461-85-8,CCRIS,1,-1,,CC(C)CN(N=O)C(=N)N[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+87-51-4,EPA1,0,-1,"INDOLEACE",OC(=O)Cc1c[nH]c2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+695-99-8,EPA1,0,-1,,ClC1=CC(=O)C=CC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+100-14-1,VITIC,1,-1,,[O-][N+](=O)c1ccc(CCl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+107-12-0,VITIC,0,-1,"PROPIONIT",CCC#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+153260-26-5,CCRIS,0,-1,,CC(=O)Nc1nc2C3=CCCN(CC=C)C3CCc2s1,"JAEN,JC, KROPKO,ML, THEISS,JC, WOLD,S, CAPRATHE,BW AND WISE,LD,ASSESSMENT OF MUTAGENIC POTENTIAL IN A SERIES OF COMPOUNDS STRUCTURALLY RELATEDTO 2-AMINO-3-METHYLIMIDAZO[4,5-F]QUINOLINE (IQ), EUR. J. MED. CHEM. 28(7-8):547-553, 1993"
+52748-31-9,CCRIS,0,-1,,O1C=CC2OC2C=C1,"STARK,AA AND RASTETTER,WH, STRUCTURE-ACTIVITY RELATIONSHIPS IN THEMUTAGENICITY AND CYTOTOXICITY OF PUTATIVE METABOLITES AND RELATED ANALOGS OFBENZENE DERIVED FROM THE VALENCE TAUTOMERS BENZENE OXIDE AND OXEPIN, ENVIRON.MOL. MUTAGEN. 28(3):284-293, 1996"
+147293-13-8,EPA1,1,-1,,Cn1c(N)nc2c3ncccc3ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24815-24-5,EPA1,0,-1,,CO[C@H]1[C@@H](C[C@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)\C=C\c6cc(OC)c(OC)c(OC)c6,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56211-40-6,EPA1,0,-1,"C-3534",CC(C)NC(=O)NS(=O)(=O)c1cnccc1Nc2cccc(C)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4741-24-6,CCRIS,0,-1,,O1OC2c3ccccc3C1c4ccccc24,"MOELLER,M, HAGEN,I AND RAMDAHL,T, MUTAGENICITY OF POLYCYCLIC AROMATICCOMPOUNDS (PAC) IDENTIFIED IN SOURCE EMISSIONS AND AMBIENT AIR, MUTAT. RES.157(2-3): 149-156, 1985"
+94500-46-6,EPA1,1,-1,,ClCc1cc2cc3ccccc3c4ccc5cccc1c5c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-69-0,EPA3,1,-1,,CCC\C=N/O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+15403-45-9,EPA1,1,-1,,COC(=O)c1cc(ccc1N)c2ccc(N)c(c2)C(=O)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1646-75-9,EPA3,0,-1,,CSC(C)(C)\C=N/O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+16400-63-8,EPA1,1,-1,,ClCC(=C)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+216-48-8,EPA1,1,-1,,C1=Cc2cc3c4ccccc4ccc3c5cccc1c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M367,EPA1,0,-1,,BrC[C@@H](Br)[C@@H]1CC[C@@H](Br)[C@@H](Br)C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+95-16-9,VITIC,0,-1,"CGI-16343",c1ccc2scnc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+117-82-8,VITIC,1,-1,,COCCOC(=O)c1ccccc1C(=O)OCCOC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+26196-04-3,CCRIS,1,-1,,COC1OC1(C)C,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+85048-96-0,CCRIS,0,-1,,OCC1OC(O)C(O)C(Op2(OC3C(O)C(O)OC(CO)C3O)np(OC4C(O)C(O)OC(CO)C4O)(OC5C(O)C(O)OC(CO)C5O)np(OC6C(O)C(O)OC(CO)C6O)(OC7C(O)C(O)OC(CO)C7O)n2)C1O,"ALLCOCK,HR, PUCHER,SR, FITZPATRICK,RJ AND RASHID,K, ANTIBACTERIALACTIVITY AND MUTAGENICITY STUDIES OF WATER-SOLUBLE PHOSPHAZENE HIGH POLYMERS,BIOMATERIALS 13(12):857-862, 1992"
+98640-42-7,CCRIS,0,-1,,CC(=O)NC(CS\C(=C(/F)\C(F)(F)F)\F)C(=O)O,"GREEN,T AND ODUM,J, STRUCTURE/ACTIVITY STUDIES OF THE NEPHROTOXIC ANDMUTAGENIC ACTION OF CYSTEINE CONJUGATES OF CHLORO AND FLUOROALKENES, CHEM. BIOL.INTERACT. 54(1):15-31, 1985"
+29814-12-8,CCRIS,1,-1,,CC(C)OC1OC(=O)C(=C1Cl)Cl,"LALONDE,RT AND XIE,S, GLUTATHIONE AND N-ACETYLCYSTEINE INACTIVATIONSOF MUTAGENIC 2(5H)-FURANONES FROM THE CHLORINATION OF HUMICS IN WATER, CHEM.RES. TOXICOL. 6(4):445-451, 1993"
+1874-24-4,CCRIS,1,-1,,COC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+88652-48-6,CCRIS,0,-1,,CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCC(C)O,"HACHIYA,N AND TAKIZAWA,Y, MUTAGENICITY OF PLASTIC ADDITIVES,HEN'IGENSEI SHIKEN 3(3):147-154, 1994"
+21232-47-3,EPA3,0,-1,,[O-][N+](=Nc1ccc(Cl)c(Cl)c1)c2ccc(Cl)c(Cl)c2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+NOCAS_M395,EPA1,0,-1,,O[C@@H]1CO[C@@](O)(CN(CC(=O)O)N=O)[C@H](O)[C@@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+127-69-5,VITIC,0,-1,"SULFAFURA,SULFAFDOL,SULFAFUNA",Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3958-57-4,CCRIS,0,-1,,[O-][N+](=O)c1cccc(CBr)c1,"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+20861-99-8,EPA3,1,-1,,C1O[C@@H]1c2ccc3ccccc3c2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+40297-54-9,CCRIS,1,-1,,OCC1OC(C(O)C1O)n2cnc3c(NCc4ccc(cc4)[N+](=O)[O-])ncnc23,"MATSUDA,A, AKASHI,M, OHARA,Y, WATAYA,Y, HAYATSU,H AND UEDA,T,MUTAGENICITY OF (P-NITROPHENYL)ADENINES IN SALMONELLA TYPHIMURIUM, MUTAT. RES.263(2):93-100, 1991"
+78865-83-5,EPA1,1,-1,,CCCCCCCCCCSCn1cc[n+](C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142741-10-4,CCRIS,1,-1,,Cc1nc(cc2c3cc(cc(c3[nH]c12)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],"SALVI,NA, CHOUGHULEY,ASU, SHETTY,TK AND BHATTACHARYA,RK,NITROPYRIDOINDOLES. FORMATION, CHARACTERIZATION AND MUTAGENICITY, TOXICOL.ENVIRON. CHEM. 34(2-4): 123-131, 1992"
+131-14-6,EPA1,1,-1,,Nc1ccc2C(=O)c3cc(N)ccc3C(=O)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108043-88-5,EPA1,1,-1,,Cn1c(N)nc2c3ccc(O)nc3ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5598-13-0,EPA1,0,-1,"CHLORPYME",COP(=S)(OC)Oc1nc(Cl)c(Cl)cc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+507-19-7,CCRIS,1,-1,,CC(C)(C)Br,"SIMMON,VF, KAUHANEN,K AND TARDIFF,RG, MUTAGENIC ACTIVITY OF CHEMICALSIDENTIFIED IN DRINKING WATER, DEV. TOXICOL. ENVIRON. SCI. 2:249-258,1977"
+124340-47-2,CCRIS,1,-1,,CN(C)CCNC(=O)c1cccc2[nH]c(nc12)c3ccccc3,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+129833-02-9,CCRIS,0,-1,,CC(=O)C1(C)OC12C=Cc3ccccc3C2=O,"ADAM,W, HAUER,H, MOSANDL,T, SAHA-MOELLER,CR, WAGNER,W AND WILD,D,FUROCOUMARIN-, NAPHTHOFURAN-, AND FUROQUINOLINE-ANNULATED 1,2-DIOXETANES:SYNTHESIS, THERMOLYSIS, AND MUTAGENICITY, LIEBIGS ANN. CHEM. (12):1227-1236,1990"
+959-33-1,CCRIS,0,-1,,COc1ccc(\C=C\C(=O)c2ccccc2)cc1,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+100772-18-7,CCRIS,0,1,,CC(CCC(=O)O)C1CCC2C3CCc4cc(O)ccc4C3CCC12C,"NAMBA,T, TAKASHI,H AND HAYAKAWA,S, SYNTHESIS AND MUTAGENICITY OF ARING-A-AROMATIZED BILE ACID, 3-HYDROXY-19-NOR-1,3,5(10)-CHOLATRIEN-24-OIC ACID,J. LIPID RES. 29(6):809-814, 1988"
+109-55-7,VITIC,0,-1,,CN(C)CCCN,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+31688-71-8,EPA1,1,-1,,CC(=O)OCc1c2ccccc2c(C)c3ccccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60262-82-0,CCRIS,0,-1,,OC1C(Oc2ccc3ccc4cc5ccccc5c6ccc2c3c46)OC(C(O)C1O)C(=O)O,"IRWIN,SE, KWEI,GY, BLACKBURN,GR, THURMAN,R AND KAUFFMAN,FC,MUTAGENICITY OF BENZO[A]PYRENYL-1-SULFATE IN THE AMES TEST,ENVIRON. MOL.MUTAGEN. 19(3):253- 258, 1992"
+41044-12-6,EPA1,0,-1,,CCN(CC)c1ccc2C=C(C(=O)Oc2c1)c3nc4ccccc4n3C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+20153-98-4,EPA1,0,-1,"DILAZEP,DILAZDHCL",COc1cc(cc(OC)c1OC)C(=O)OCCCN2CCCN(CCCOC(=O)c3cc(OC)c(OC)c(OC)c3)CC2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24424-99-5,EPA1,0,-1,,CC(C)(C)OC(=O)OC(=O)OC(C)(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24554-26-5,EPA2,1,-1,,[O-][N+](=O)c1oc(cc1)c2csc(NC=O)n2,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+23452-05-3,EPA1,0,-1,,COc1cc(O)c2C(=O)Oc3cc(O)cc(C)c3c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125-46-2,CCRIS,0,-1,"USNATE,USNATENA",CC(=O)C1C(=O)C=C2Oc3c(C(=O)C)c(O)c(C)c(O)c3C2(C)C1=O,"SHIBAMOTO,T AND WEI,CI, MUTAGENICITY OF LICHEN CONSTITUENTS, ENVIRON.MUTAGEN. 6(5):757-762, 1984"
+25635-22-7,CCRIS,0,-1,,CCOC(=O)c1cccc2cccnc12,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+120-22-9,CCRIS,1,-1,,CCN(CC)c1ccc(cc1)N=O,"GOODALL,CM, MOORE,CM AND STEPHENS,OB, MUTAGENICITY OFPARA-NITROSO-DIMETHYL- AND DIETHYL-ANILINES, XENOBIOTICA 16(6):587-593,1986"
+52101-40-3,EPA1,1,-1,,OC(=O)c1oc(c(c2ccccc2)c1c3ccccc3)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+528-29-0,EPA1,1,-1,,[O-][N+](=O)c1ccccc1[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4337-65-9,EPA3,0,-1,,CCCC[C@@H](CC)COC(=O)CCCCC(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+9003-39-8,VITIC,0,-1,"NA-5,KOLLIVA64,POLYVIDON,POVIDONEI,SOVIAL",C=CN1CCCC1=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+118-71-8,EPA3,1,-1,"IRONMALTO,MALTOL",CC1=C(O)C(=O)C=CO1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+580-22-3,EPA1,1,-1,,Nc1ccc2ccccc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94-59-7,VITIC,0,-1,"SAFROLE",C=CCc1ccc2OCOc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+123-91-1,VITIC,0,-1,"DR9800443",C1COCCO1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+110933-34-1,CCRIS,1,-1,,Cc1c2ccccc2c(COS(=O)(=O)O)c3ccc4ccccc4c13,"SURH,YJ, LIEM,A, MILLER,EC AND MILLER,JA,7-SULFOOXYMETHYL-12-METHYLBENZ[A] ANTHRACENE IS AN ELECTROPHILIC MUTAGEN, BUTDOES NOT APPEAR TO PLAY A ROLE IN CARCINOGENESIS BY7,12-DIMETHYLBENZ[A]ANTHRACENE OR 7-HYDROXYMETHYL-12- METHYLBENZ[A]ANTHRACENE,CARCINOGENESIS 12(2):339-347, 1991"
+120-36-5,CCRIS,0,-1,,CC(Oc1ccc(Cl)cc1Cl)C(=O)O,"MERSCH-SUNDERMANN,V, DICKGIESSER,N, HABLIZEL,U AND GRUBER,B,EXAMINATION OF MUTAGENICITY OF ORGANIC MICROCONTAMINATIONS ON THE ENVIRONMENT.PART 1. THE MUTAGENICITY OF SELECTED HERBICIDES AND INSECTICIDES WITH THESALMONELLA-MICROSOME TEST (AMES TEST) IN CONSIDERATION OF THE PATHOGENICITY OFCONTAMINATED GROUND- AND DRINKING-WATER, ZENTRALBL. BAKTERIOL., MIKROBIOL. HYG.,SER. B 186(3):247-260, 1988"
+76215-00-4,CCRIS,1,-1,,CC(=O)OCN(CCCl)N=O,"ISHIKAWA,S SAITOH,N AND MOCHIZUKI,M, SYNTHESIS AND PROPERTIES OF NOVELBIFUNCTIONAL NITROSAMINES WITH OMEGA-CHLOROALKYL GROUPS, CHEM. PHARM. BULL.48(10):1500-1503, 2000"
+35483-50-2,GENETOX,0,-1,,COC(=O)CC1Cc2cc3cc(OC)c(c(O)c3c(O)c2C(=O)O1)c4c(O)c5c(O)c6C(=O)OC(CC(=O)OC)Cc6cc5cc4OC,"MUTAT RES 168:69-240,1986"
+33942-93-7,EPA1,1,-1,,Cc1ccc2nc3c(ccc4ccccc34)cc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+612-83-9,VITIC,1,-1,,Nc1ccc(cc1Cl)c2ccc(N)c(Cl)c2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+79243-67-7,CCRIS,0,1,,CCCC1(O)CCC2C3CCC4CC(=O)CC(C)C4(C)C3CCC12C,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+80-40-0,EPA1,1,-1,,CCOS(=O)(=O)c1ccc(C)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108-24-7,VITIC,0,-1,"ACETICANH",CC(=O)OC(=O)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7132-67-4,EPA1,1,-1,,Nc1c2ccccc2nc3ccc(O)cc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15176-29-1,CCRIS,0,-1,,CCC1=CN(C2CC(O)C(CO)O2)C(=O)NC1=O,"MARQUADT,H, WESTENDORF,J, SCHAEFER,A, BOLDT,J, DE CLERCQ,E ANDMARQUARDT,H, MUTAGENIC AND ANTIMUTAGENIC EFFECTS OF 5-SUBSTITUTED2'-DEOXYURIDINES DEPENDING ON THE NATURE OF THE 5-SUBSTITUENT, ARZNEIM.-FORSCH.38(12):1820-1824, 1988"
+2453-44-3,CCRIS,0,-1,,O=C(\C=C\c1ccccc1)c2ccc(cc2)c3ccccc3,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+24684-49-9,EPA3,1,-1,,COc1cc2c3CCC(=O)c3cc(C)c2c4ccccc14,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+533-31-3,EPA1,0,-1,"SESAMOL",Oc1ccc2OCOc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91-22-5,VITIC,1,-1,"AVS-1018,MK-0591,DR9802434",c1ccc2ncccc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+21919-05-1,EPA1,1,-1,"CB-1954",NC(=O)c1cc(N2CC2)c(cc1[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M209,EPA1,1,-1,,CC(=C)C(=O)OC[C@H](Br)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M425,EPA1,0,-1,,CC\C=C\[C@@H](CC)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+49852-84-8,EPA1,0,-1,,ClCc1c2ccccc2c3ccc4cccc5ccc1c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+101-83-7,VITIC,0,-1,"DICYCLOHA",C1CCC(CC1)NC2CCCCC2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99026-65-0,EPA1,1,-1,,CC(=O)Nc1cc(O)c2ccc3cccc4ccc1c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+619-67-0,CCRIS,0,-1,,NNc1ccc(cc1)C(=O)O,"WALTON,K, COOMBS,MM, WALKER,R AND IOANNIDES,C, BIOACTIVATION OFMUSHROOM HYDRAZINES TO MUTAGENIC PRODUCTS BY MAMMALIAN AND FUNGAL ENZYMES,MUTAT. RES. 381(1):131-139, 1997"
+81593-13-7,CCRIS,1,-1,,CCOP(=O)(OCC)N1C2C1c3ccccc3c4ccccc24,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+2363-23-7,CCRIS,1,-1,,CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],"KERKLAAN,PRM, BOUTER,S, TE KOPPELE,JM, VERMEULEN,NPE, VAN BLADEREN,PJAND MOHN,GR,MUTAGENICITY OF HALOGENATED AND OTHER SUBSTITUTED DINITROBENZENES INSALMONELLA TYPHIMURIUM TA100 AND DERIVATIVES DEFICIENT IN GLUTATHIONE(TA100/GSH-) AND NITROREDUCTASE (TA100NR), MUTAT. RES. 176(2):171-180,1987"
+29122-68-7,CCRIS,0,-1,"ATENOLOL",CC(C)NCC(O)COc1ccc(CC(=O)N)cc1,"OKINE,LKN, IOANNIDES,C AND PARKE,DV, STUDIES ON THE POSSIBLEMUTAGENICITY OF BETA-ADRENERGIC BLOCKER DRUGS, TOXICOL. LETT. 16(3-4):167-174,1983"
+620-22-4,VITIC,0,-1,,Cc1cccc(c1)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+506-21-8,CCRIS,0,-1,"LINOLELAI",CCCCC\C=C\C\C=C\CCCCCCCC(=O)O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y85"
+96-34-4,EPA1,0,-1,,COC(=O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+535-80-8,VITIC,0,-1,"CLBZOATEM",OC(=O)c1cccc(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106-46-7,VITIC,0,-1,"DICLBENZP",Clc1ccc(Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+146724-31-4,CCRIS,0,-1,,OCc1cc2ccc3cccnc3c2[nH]1,"FERLIN,MG, CHIARELOTTO,G, BACCICHETTI,F, CARLASSARE,F, TONIOLO,L ANDBORDIN,F, 2-SUBSTITUTED 1H-PYRROLO[3,2-H]QUINOLINE DERIVATIVES: SYNTHESIS ANDASPECTS OF THEIR BIOLOGICAL ACTIVITY, FARMACO 47(12):1513-1528, 1992"
+23255-93-8,EPA3,1,-1,,CCN(CC)CCNc1ccc(COS(=O)(=O)C)c2Sc3ccccc3C(=O)c12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+153654-35-4,CCRIS,0,-1,,Oc1ccc2c3ccccc3[nH]c2c1[N+](=O)[O-],"HOLLOWAY,TC AND BALL,LM, SYNTHESIS AND MUTAGENICITY OF A SERIES OFNITRATED CARBAZOLES AND HYDROXYCARBAZOLES, MUTAGENESIS 8(4):321-327,1993"
+874-42-0,VITIC,0,-1,,Clc1ccc(C=O)c(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+74339-99-4,EPA1,1,-1,,Oc1ccc2c(c1)c3cc4ccccc4c5cc6ccccc6c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+609-65-4,EPA1,1,-1,,ClC(=O)c1ccccc1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+312304-87-3,CCRIS,1,-1,,CC(=O)OCN(CCCCl)N=O,"ISHIKAWA,S SAITOH,N AND MOCHIZUKI,M, SYNTHESIS AND PROPERTIES OF NOVELBIFUNCTIONAL NITROSAMINES WITH OMEGA-CHLOROALKYL GROUPS, CHEM. PHARM. BULL.48(10):1500-1503, 2000"
+NOCAS_M38,EPA1,1,-1,,COc1cc(O)c2C(=O)c3c(OC)cc4O[C@@H]5OC=C[C@H]5c4c3Oc2c1OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+77784-21-5,EPA1,1,-1,,COc1ccc2c(cc3N(C)C(=O)C(=O)c4cc5OCOc5c2c34)c1OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56803-37-3,VITIC,0,-1,,CC(C)(C)c1ccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M236,EPA1,1,-1,,C[C@@H](Br)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4569-77-1,EPA1,1,-1,,Nc1cc2nc3ccccc3nc2cc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+6111-78-0,EPA1,1,-1,,Cc1cccc2cc3ccc4ccccc4c3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+34549-30-9,VITIC,1,-1,,OCC(CO)(CCBr)CCBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+76-03-9,VITIC,0,-1,"TRICLOROA",OC(=O)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+130965-73-0,CCRIS,1,-1,,OS(=O)(=O)OCc1ccc2ccc3cccc4ccc1c2c34,"SURH,YJ, BLOMQUIST,JC,"
+7473-93-0,CCRIS,0,-1,,[O-][N+](=O)c1ccccc1\C=C\C(=O)c2ccccc2,"MULLEN,CA, RASHID,KA AND MUMMA,RO, MUTAGENIC POTENCY OF SOMECONJUGATED NITROAROMATIC COMPOUNDS AND ITS RELATIONSHIP TO STRUCTURE, MUTAT.RES. 188(4): 267-274, 1987"
+2429-73-4,EPA1,1,-1,,Nc1ccc2cc(c(N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5c(O)c6c(N)cc(cc6cc5S(=O)(=O)O)S(=O)(=O)O)c(O)c2c1)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M563,EPA1,0,-1,,CCCCCCCCCC[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+129176-04-1,CCRIS,1,-1,,ClC1OC1CBr,"PEARSON,PG, OMICHINSKI,JG, MYERS,TG, SOEDERLUND,EJ, DYBING,E ANDNELSON,SD, METABOLIC"
+28804-88-8,VITIC,0,-1,,Cc1ccc2ccccc2c1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+119-93-7,VITIC,1,-1,"TOLIDINE",Cc1cc(ccc1N)c2ccc(N)c(C)c2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+50-06-6,EPA1,1,-1,"BARBEXACL,PHENOBACA,PHENOBAMG,PHENOBARB,PHENOBAAM,PHENOBDIE,PHENOETDA,PHENOBARN,PHENOBASP,PHENOTEAM,PHENOBNMG",CCC1(C(=O)NC(=O)NC1=O)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5397-37-5,CCRIS,1,-1,,[O-][N+](=O)c1ccc2Cc3ccccc3c2c1,"WATANABE,T, KAJI,H, TAKASHIMA,M, KASAI,T, LEWTAS,J AND HIRAYAMA,T,METABOLIC ACTIVATION"
+4809-35-2,CCRIS,0,-1,,CC(C)(c1ccc(OCC(O)CCl)cc1)c2ccc(OCC(O)CCl)cc2,"SUEIRO,RA ARAUJO,M SUAREZ,S AND GARRIDO,MJ,MUTAGENIC POTENTIAL OFBISPHENOL A DIGLYCIDYL ETHER (BADGE) AND ITS HYDROLYSIS-DERIVED PRODUCTS IN THEAMES SALMONELLA ASSAY, MUTAGENESIS 16(4):303-307, 2001"
+786-66-3,EPA3,1,-1,,O=C1CCc2c1ccc3c2ccc4ccccc34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+484-47-9,EPA1,1,-1,,c1ccc(cc1)c2nc(c3ccccc3)c([nH]2)c4ccccc4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111380-09-7,CCRIS,1,-1,,Cn1cnc(N=O)c1c2ccccc2,"EHLHARDT,WJ, BEAULIEU,BB AND GOLDMAN,P, MAMMALIAN CELL TOXICITY ANDBACTERIAL MUTAGENICITY OF NITROSOIMIDAZOLES, BIOCHEM. PHARMACOL.37(13):2603-2606, 1988"
+95307-47-4,CCRIS,0,-1,,CC12CCCC(C)(C1CCC34CC(O)(CCC23)C(=C)C4O)C(=O)O,"COMPADRE,CM, HUSSAIN,RA, NANAYAKKARA,NPD, PEZZUTO,JM AND KINGHORN,AD,MASS SPECTRAL ANALYSIS OF SOME DERIVATIVES AND IN VITRO METABOLITES OF STEVIOL,THE AGLYCONE OF THE NATURAL SWEETENERS, STEVIOSIDE, REBAUDIOSIDE A, ANDRUBUSOSIDE, BIOMED. ENVIRON. MASS SPECTROM. 15(4):211-222, 1988"
+18031-40-8,CCRIS,0,-1,"PERILLALD",CC(=C)C1CCC(=CC1)C=O,"FUJITA,H, AOKI,N AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVESWITH SALMONELLA TYPHIMURIUM TA97 AND TA102. IX, TOKYO-TORITSU EISEI KENKYUSHOKENKYU NENPO 45:191-199, 1994"
+87-86-5,VITIC,0,-1,"PENTACHLO",Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+139953-96-1,CCRIS,1,-1,,CC\C=C\C=C\C=C\C=C\C=C\OCCCO,"VERTEGAAL,LBJ, VOOGD,CE, MOHN,GR AND VAN DER GEN,A, FURTHER STUDIES ONTHE MUTAGENIC ACTIVITY OF FECAPENTAENE-12 ANALOGS AND CONCLUSIONS ABOUT THEIRMOLECULAR MODE OF ACTION, MUTAT. RES. 281(2):93-98, 1992"
+774-15-2,CCRIS,0,-1,,CC(C)Nc1snc2ccccc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+51410-45-8,CCRIS,1,-1,,COc1ccc(CC2CO2)cc1,"ROSMAN,LB, GADDAMIDI,V AND SINSHEIMER,JE, MUTAGENICITY OF ARYLPROPYLENE AND BUTYLENE OXIDES WITH SALMONELLA, MUTAT. RES. 189(3):189-204,1987"
+23590-73-0,CCRIS,1,-1,,NNc1nncc2cccnc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+91-68-9,VITIC,1,-1,,CCN(CC)c1cccc(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+924-42-5,VITIC,0,-1,,OCNC(=O)C=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+125239-64-7,EPA1,1,-1,,COc1cc2nc3cc(N)c(OC)cc3nc2cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98046-74-3,CCRIS,1,-1,,Cc1cccn2c1nc3c(C)c(cnc23)[N+](=O)[O-],"N'GOY,K, SAINT-RUF,G AND DE MEESTER,C, MUTAGENICITY OF SOMEDERIVATIVES OF DIPYRIDO[1,2-A:3',2'-D]IMIDAZOLES IN SALMONELLA TYPHIMURIUM WITHMETABOLIC ACTIVATION"
+4291-30-9,CCRIS,0,-1,,Oc1c(cccc1[N+](=O)[O-])c2ccccc2,"SUZUKI,J, SATO,T AND SUZUKI,S, HYDROXYNITROBIPHENYLS PRODUCED BYPHOTOCHEMICAL REACTION OF BIPHENYL IN AQUEOUS NITRATE SOLUTION AND THEIRMUTAGENICITIES, CHEM. PHARM. BULL. 33(6):2507-2515, 1985"
+619-73-8,CCRIS,0,-1,,OCc1ccc(cc1)[N+](=O)[O-],"JUNEJA,TR, BALA,A, KUMAR,P AND GUPTA,RL, MUTAGENICITY OF NITROBENZYLDERIVATIVES: POTENTIAL BIOREDUCTIVE ANTICANCER AGENTS, MUTAT. RES.348(3):137-145, 1995"
+68906-23-0,CCRIS,1,-1,,Clc1cc(Cl)c(Oc2ccc(NC=O)cc2)c(Cl)c1,"MIYAUCHI,M, ENDOH,Y AND UEMATSU,T, MUTAGENIC ACTIVITY OF THE AMIDODERIVATIVES AND THEIR HYDROXAMIC ACIDS OF NITROBIPHENYL ETHERS, BULL. ENVIRON.CONTAM. TOXICOL. 55(3):446-452, 1995"
+113124-69-9,EPA1,1,-1,,COC1=CC(=O)c2c([nH]cc3c4CCCCc4nc23)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90147-18-5,CCRIS,1,-1,,CCCOC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+1070-13-9,EPA1,1,-1,,CCCC(=C)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-31-0,VITIC,0,-1,"IPROPLATI,ISOPROAMI,JM-147,JM-6",CC(C)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+82486-82-6,EPA1,1,-1,,CCCCN(CCO[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4698-96-8,CCRIS,1,-1,,C(Oc1ccc(cc1)c2ccccc2)C3CO3,"ROSMAN,LB, CHAKRABORTY,PK, MESSERLY,EA AND SINSHEIMER,JE, MUTAGENICITYOF AROMATIC GLYCIDYL ETHERS WITH SALMONELLA, MUTAT. RES. 206(1):115-125,1988"
+1477-42-5,EPA3,0,-1,,Cc1cccc2sc(N)nc12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+14625-58-2,CCRIS,0,-1,,Cc1cccc(c1)c2oc3ccccc3n2,"UCUCU,U, ISIKDAG,I, GUENDOGDU,N AND MERCANGOZ,A, SYNTHESIS OF SOME2-ARYL-BENZOXAZOLE DERIVATIVES AND INVESTIGATION OF THEIR MUTAGENICITY, J. FAC.PHARM. GAZI UNIV. 12(2):165-172, 1995"
+99601-31-7,EPA1,1,-1,,CCn1c(N)nc2c3nc(C)cnc3ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M108,EPA1,1,-1,,O=C1N(C[C@H]2CO2)C(=O)N(C[C@H]3CO3)C(=O)N1C[C@H]4CO4,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86853-91-0,EPA1,1,-1,,O=C1c2cccc3ccc4c5ccccc5cc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7059-24-7,CCRIS,0,-1,,COC(C1Cc2cc3cc(OC4CC(OC5CC(O)C(OC)C(C)O5)C(OC(=O)C)C(C)O4)c(C)c(O)c3c(O)c2C(=O)C1OC6CC(OC7CC(OC8CC(C)(O)C(OC(=O)C)C(C)O8)C(O)C(C)O7)C(O)C(C)O6)C(=O)C(O)C(C)O,"SAKAMOTO,Y, FUJIKAWA,K, NAGAYABU,O, YAMAMOTO,KS AND SAMEJIMA,K, TRIPLESHORT-TERM TESTS WITH BACTERIA AND DROSOPHILA FOR ASSESSMENT OF MUTAGENICITY OFANTINEOPLASTICS, TAKEDA KENKYUSHOHO 44(1/2):96-116, 1985"
+99601-33-9,CCRIS,1,-1,,CCn1c(N)nc2c3cccnc3ccc12,"JAEGERSTAD,M AND GRIVAS,S, THE SYNTHESIS AND MUTAGENICITY OF THE3-ETHYL ANALOGUES OF THE POTENT MUTAGENS IQ, MEIQ, MEIQX AND ITS 3,7-DIMETHYLISOMER, MUTAT. RES. 144(3):131-136, 1985"
+13838-16-9,EPA2,0,-1,"ENFLURANE",FC(F)OC(F)(F)C(F)Cl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+29086-39-3,CCRIS,0,-1,,Cl\C=C(/Cl)\c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,"TARKPEA,M, HAGEN,I, CARLBERG,GE, KOLSAKER,P AND STORFLOR,H,MUTAGENICITY, ACUTE TOXICITY, AND BIOACCUMULATION POTENTIAL OF SIX CHLORINATEDSTYRENES, BULL. ENVIRON. CONTAM. TOXICOL. 35(4):525-530, 1985"
+90509-02-7,CCRIS,0,-1,"LUXABENDA",COC(=O)Nc1nc2cc(OS(=O)(=O)c3ccc(F)cc3)ccc2[nH]1,"ORTIZ,AI, POLLASTRINI,MT, BAREA,M AND ORDONEZ,D, BACTERIAL MUTAGENICEVALUATION OF LUXABENDAZOLE, A NEW BROAD SPECTRUM ANTHELMINTIC, WITH THESALMONELLA TYPHIMURIUM HIS- AND THE ESCHERICHIA COLI TRYP- REVERSION TESTS,MUTAGENESIS 11(1):27-31, 1996"
+110783-84-1,CCRIS,0,-1,,COc1cc(N)cc(OC)c1N,"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+148174-24-7,CCRIS,0,-1,,ClCCCC(=O)\N=C\1/SN(C(=O)CCCCl)c2ccccc12,"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+594-20-7,CCRIS,0,-1,,CC(C)(Cl)Cl,"TORNERO-VELEZ,R ROSS,MK GRANVILLE,C LASKEY,J JONES,JP DEMARINI,DM ANDEVANS,MV, METABOLISM AND MUTAGENICITY OF SOURCE WATER CONTAMINANTS1,3-DICHLOROPROPANE AND 2,2-DICHLOROPROPANE, DRUG METABOL. DISPOS. 32(1):123-131, 2004"
+NOCAS_M15,EPA1,1,-1,,CCOC(=O)[C@@H](C)C[C@](C)(C[C@H](C[C@@](C)(C[C@@H](C[C@](C)(CC)C(=O)O)C(=O)OCC)C(=O)O)C(=O)OCC)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13014-24-9,VITIC,1,-1,,Clc1ccc(cc1Cl)C(Cl)(Cl)Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+540-80-7,EPA1,1,-1,,CC(C)(C)ON=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+104-91-6,EPA1,1,-1,,Oc1ccc(cc1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+62450-07-1,EPA3,1,-1,,CC1=NC(=C[C@H]2[C@@H]1Nc3ccccc23)N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+2318-18-5,CCRIS,1,-1,,C\C=C\1/CC(C)C(C)(O)C(=O)OCC2=CC[N+]3(C)CCC(OC1=O)C23O,"YAMANAKA,H NAGAO,M AND SUGIMURA,T, MUTAGENICITY OF PYRROLIZIDINEALKALOIDS IN THE SALMONELLA/MAMMALIAN-MICROSOME TEST, MUTAT. RES. 68(3):211-216,1979"
+84-79-7,EPA1,0,-1,"LAPACHOL",CC(=CCC1=C(O)C(=O)c2ccccc2C1=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+481-73-2,CCRIS,1,-1,,OCc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1,"MOROOKA,N, NAKANO,S, ITOI,N AND UENO,Y, THE CHEMICAL STRUCTURE AND THEMUTAGENICITY OF EMODIN METABOLITES, AGRIC. BIOL. CHEM. 54(5):1247-1252,1990"
+26306-61-6,EPA1,1,-1,,Nc1ccc(Oc2c(Cl)cc(Cl)cc2Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+132898-07-8,EPA1,1,-1,,Cc1cc2nc(C)c(C)nc2c3nc(N)n(C)c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99240-68-3,CCRIS,0,-1,,CC(=O)Nc1cc2Cc3ccccc3c2cc1OC(=O)c4ccccc4,"CREBELLI,R AND IORIO,MA, CHEMISTRY AND IN VITRO MUTAGENICITY OF2-AMINOFLUORENE DERIVATIVES, CHEM.-BIOL. INTERACT. 54(1):71-83, 1985"
+26078-25-1,EPA1,0,-1,,CCNc1cc2OC(=O)C=C(C)c2cc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88381-44-6,CCRIS,0,-1,,OC(=O)C1CSCN1N=O,"UMANO,K, SHIBAMOTO,T, FERNANDO,SY AND WEI,CI, MUTAGENICITY OF2-HYDROXYALKYL-N- NITROSOTHIAZOLIDINES, FOOD CHEM. TOXICOL. 22(4):253-259,1984"
+1122-58-3,EPA1,0,-1,"DIMEAMIP4",CN(C)c1ccncc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61421-83-8,EPA1,1,-1,,Oc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50330-59-1,CCRIS,0,-1,"450247",CN(C)C(=O)c1nc2CN=C(c3ccccc3Cl)c4cc(Cl)ccc4n2n1,"WAKISAKA,Y AND NISHIMOTO,Y, MUTAGENICITY STUDY ON A NEW SLEEP INDUCER,A 1H-1,2,4-TRIAZOLYLBENZOPHENONE DERIVATIVE (450191-S), AND ITS METABOLITE INBACTERIA, IYAKUHIN KENKYU 18(1):12-20, 1987"
+68-11-1,VITIC,0,-1,"THIOGSBNA,AUROGLYCA,THIOGBINA,THIOGCTCA,THIOGCTSR,THIOGLYCO",OC(=O)CS,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+538-23-8,VITIC,1,-1,"SEFSOL668",CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5466-84-2,VITIC,1,-1,,[O-][N+](=O)c1ccc2C(=O)OC(=O)c2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M2,EPA1,1,-1,,NC(=O)C[C@H]1CO1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19408-84-5,EPA1,1,-1,"DIHCAPSAI",COc1cc(CNC(=O)CCCCCCC(C)C)ccc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M496,EPA1,0,-1,,O[C@H](C#N)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50502-17-5,CCRIS,0,-1,,CC(=O)Nc1ccc2ccccc2n1,"JORDAN,VC, LABABIDI,MK AND LANGAN-FAHEY,S, SUPPRESSION OF MOUSEMAMMARY TUMORIGENESIS BY LONG-TERM TAMOXIFEN THERAPY, J. NATL. CANCER INST.83:492-496, 1991"
+80-71-7,EPA1,0,-1,,CC1=C(O)C(=O)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-30-5,EPA1,0,-1,,CCCCCCCCCCCCCCCCCC(=O)NCCNC(=O)CCCCCCCCCCCCCCCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56-05-3,EPA1,0,-1,"PY-11",Nc1nc(Cl)cc(Cl)n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+41533-75-9,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c(Cl)nsc12,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+173450-37-8,CCRIS,0,-1,,CCN(CC)C(=O)c1cc(Cc2ccc(N)c(c2)C(=O)N(CC)CC)ccc1N,"TAKAGI,Y, ENDOH,O, GOTO,S, KOHZAKI,K AND MATSUSHITA,H, MUTAGENICITY OFDIAMINODIPHENYLMETHANE AND RELATED COMPOUNDS, KANKYO KAGAKU 5(4):841-845,1995"
+24752-66-7,CCRIS,0,-1,,CC(Cl)C(=O)NCc1ccccc1,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+67-99-2,CCRIS,0,-1,"GLIOTOXIN",CN1C(=O)C23CC4=CC=CC(O)C4N2C(=O)C1(CO)SS3,"NIEMINEN,SM MAKI-PAAKKANEN,J HIRVONEN,MR ROPONEN,M AND VON WRIGHT,A,GENOTOXICITY OF GLIOTOXIN, A SECONDARY METABOLITE OF ASPERGILLUS FUMIGATUS, IN ABATTERY OF"
+632-99-5,EPA3,1,-1,,Cc1cc(ccc1N)C(=C2C=CC(N)C=C2)c3ccc(N)cc3,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+7330-46-3,CCRIS,0,-1,,Nc1ccc(Cc2ccc(N)c(c2)C(=O)O)cc1C(=O)O,"TAKAGI,Y, ENDOH,O, GOTO,S, KOHZAKI,K AND MATSUSHITA,H, MUTAGENICITY OFDIAMINODIPHENYLMETHANE AND RELATED COMPOUNDS, KANKYO KAGAKU 5(4):841-845,1995"
+34627-78-6,EPA3,1,-1,,CC(=O)O[C@H](C=C)c1ccc2OCOc2c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+100527-20-6,CCRIS,1,-1,,[O-][N+](=O)c1ccc2ccc3ccc(cc3c2c1)[N+](=O)[O-],"SERA,N, FUKUHARA,K, MIYATA,N AND TOKIWA,H, MUTAGENICITY OFNITROPHENANTHRENE DERIVATIVES FOR SALMONELLA TYPHIMURIUM: EFFECTS OFNITROREDUCTASE AND ACETYLTRANSFERASE, MUTAT. RES. 349(1):137-144,1996"
+119169-78-7,CCRIS,0,1,,CC(C)(C)NC(=O)C1CCC2C3CC=C4C=C(CCC4(C)C3CCC12C)C(=O)O,"WANG,XL, ZHEN,WJ, WU,HY, FENG,J AND TU,ZH, MUTAGENICITY TESTS ONEPRISTERIDE IN VITRO AND IN VIVO, ZHONGGUO YAOLI XUEBAO 19(6):569-572,1998"
+100325-51-7,EPA1,0,-1,"CP-67015",CCN1C=C(C(=O)O)C(=O)c2cc(F)c(c(F)c12)c3ccncc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+94500-43-3,CCRIS,0,-1,,OCc1cc2c3ccccc3cc4ccc5cccc1c5c24,"BALL,JC, FOXALL-VANAKEN,S, LEON,AA, DAUB,GH AND JAGT,DLV, 11-AND 12-CHLOROMETHYLBENZO[A]PYRENE ARE POTENT DIRECT-ACTING MUTAGENS IN THE AMES ASSAY,MUTAT. RES. 142(4):141-144, 1985"
+583-78-8,VITIC,0,-1,,Oc1cc(Cl)ccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+16311-38-9,EPA1,1,-1,,[O-][N+](=O)c1ccc(cc1)c2nc3sccn3c2[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+16561-29-8,EPA3,0,-1,,CCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](C)[C@]2(O)[C@@H](C=C(CO)C[C@]3(O)[C@H]2C=C(C)C3=O)[C@H]4C(C)(C)[C@@]14OC(=O)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+136379-59-4,CCRIS,0,-1,,CCCCC(C)C(OC(=O)CC(CC(=O)O)C(=O)O)C(CC(C)CC(O)CCCCCCC(O)C(C)N)OC(=O)CC(CC(=O)O)C(=O)O,"GELDERBLOM,WC AND SNYMAN,SD, MUTAGENICITY OF POTENTIALLY CARCINOGENICMYCOTOXINS PRODUCED BY FUSARIUM MONILIFORME, MYCOTOXIN RES. 7(2):46-52,1991"
+19057-60-4,CCRIS,0,1,,CC1CCC2(OC1)OC3CC4C5CC=C6CC(CCC6(C)C5CCC4(C)C3C2C)OC7OC(CO)C(OC8OC(C)C(O)C(O)C8O)C(O)C7OC9OC(C)C(O)C(O)C9O,"KIM,SW, SON,KH AND CHUNG,KC, MUTAGENIC EFFECT OF STEROIDAL SAPONINSFROM SMILAX CHINA RHIZOMES, YAKHAK HOECHI 33(5):285-289, 1989"
+286-75-9,CCRIS,0,-1,,C1CC2OC2CCC3OC13,"VON DER HUDE,W, SEELBACH,A, BASLER,A, EPOXIDES: COMPARISON OF THEINDUCTION OF SOS REPAIR IN ESCHERICHIA COLI PQ37 AND THE BACTERIAL MUTAGENICITYIN THE AMES TEST, MUTAT. RES. 231(2):205-18, 1990"
+38707-70-9,CCRIS,1,-1,,O=Cc1cccc2cccnc12,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+1817-73-8,VITIC,1,-1,,Nc1c(Br)cc(cc1[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3387-36-8,CCRIS,0,-1,,OC1C(O)C(OC1COP(=O)(O)O)N2C=CC(=O)NC2=O,"FUJITA,H, SUMI,C AND SASAKI,M, MUTAGENICITY TEST OF FOOD ADDITIVESWITH SALMONELLA TYPHIMURIUM TA97 AND TA102. VII,KENKYU NENPO - TOKYO-TORITSUEISEI KENKYUSHO 43:219-227, 1992"
+4568-36-9,CCRIS,0,-1,"BITHIONSU",Oc1c(Cl)cc(Cl)cc1S(=O)(=O)c2cc(Cl)cc(Cl)c2O,"MOUROT,D AND MOUROT,A, MUTAGENICITY OF BITHIONOL SULFOXIDE AND ITSMETABOLITES IN THE SALMONELLA/MAMMALIAN MICROSOME TEST, MUTAT. RES.188(1):53-55, 1987"
+133762-80-8,CCRIS,1,-1,,CC1=CN(CC(O)CN=N#N)C(=O)NC1=O,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+95-64-7,VITIC,1,-1,,Cc1ccc(N)cc1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+71-58-9,CCRIS,0,1,,CC1CC2C(CCC3(C)C2CCC3(OC(=O)C)C(=O)C)C4(C)CCC(=O)C=C14,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T AND MORTELMANS,K, SALMONELLAMUTAGENICITY TESTS. V. RESULTS FROM THE TESTING OF 311 CHEMICALS, ENVIRON. MOL.MUTAGEN. 19(SUPPL.21):2-141, 1992"
+492-27-3,EPA1,0,-1,"KYNURENAT,DR9802354",OC(=O)c1cc(O)c2ccccc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+138245-73-5,CCRIS,1,-1,,OC(CN=N#N)C(O)C(O)C(O)C(=O)O,"JURICEK,M, GRUZ,P, VELEMINSKY,J, STANEK,J, KEFURT,K, MORAVCOVA,J ANDJARY,J, MUTAGENIC ACTIVITY OF 6-AZIDO DEOXYHEXOSES AND AZIDO ALCOHOLS INSALMONELLA TYPHIMURIUM AND ITS INHIBITION BY A STRUCTURE-SIMILAR CARBON SOURCEIN THE MEDIUM, MUTAT. RES. 251(1):13-20, 1991"
+117135-59-8,CCRIS,1,-1,,CCCCN=NC(C)(C)OO,"MOCHIZUKI,M, MICHIHIRO,K, SHIOMI,K, ITOH,K, TANGE,Y AND HIZATATE,S,AUTOOXIDATION OF ALKYLHYDRAZONES AND MUTAGENICITY OF THE RESULTINGHYDROPEROXIDES, BIOL. PHARM. BULL. 16(1):96-98, 1993"
+304-81-4,CCRIS,1,-1,,[O-][n+]1c2ccccc2nc3ccccc13,"MORIYA,M OHTA,T WATANABE,K MIYAZAWA,T KATO,K AND SHIRASU,Y, FURTHERMUTAGENICITY STUDIES ON PESTICIDES IN BACTERIAL REVERSION ASSAY SYSTEMS, MUTAT.RES. 116(3-4):185-216,1982"
+110419-21-1,CCRIS,1,-1,,[O-][N+](=O)c1cc(c2cccc3c4ccccc4c1c23)[N+](=O)[O-],"SHANE,BS, SQUADRITO,GL, CHURCH,DF AND PRYOR,WA, COMPARATIVEMUTAGENICITY OF NITROFLUORANTHENES IN SALMONELLA TYPHIMURIUM TA98, TA98NR, ANDTA98/1,8DNP6,ENVIRON. MOL. MUTAGEN. 17(2):130-138, 1991"
+NOCAS_M262,EPA1,1,-1,,CN1c2ccccc2C(=O)c3c(O)cc4O[C@H](Cc4c13)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3930-19-6,EPA1,1,-1,"RUFOCROMO",COC1=C(N)C(=O)c2nc(ccc2C1=O)c3nc(C(=O)O)c(C)c(c3N)c4ccc(OC)c(OC)c4O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17233-93-1,CCRIS,0,-1,,CC(C)[C@@](O)([C@@H](C)O)C(=O)O,"YAMANAKA,H NAGAO,M AND SUGIMURA,T, MUTAGENICITY OF PYRROLIZIDINEALKALOIDS IN THE SALMONELLA/MAMMALIAN-MICROSOME TEST, MUTAT. RES. 68(3):211-216,1979"
+NOCAS_M322,EPA1,0,-1,,OC(=O)C1=NN(C(=O)[C@H]1N=Nc2ccc(cc2)S(=O)(=O)O)c3ccc(cc3)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142438-61-7,CCRIS,0,-1,,NC(=O)C12OC1C(O)(NC2=O)c3ccccc3,"KIM,IS, AND BJELDANES,LF, SYNTHESES AND MUTAGENICITY OF FUSARIN C RINGANALOGS, J. AGRIC. FOOD CHEM. 40(9):1625-1630, 1992"
+2814-77-9,EPA3,1,-1,,Oc1ccc2ccccc2c1N=Nc3ccc(cc3Cl)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+91598-92-4,CCRIS,1,-1,,CC(=O)Nc1ccc2ccc3ccc(O)c4ccc1c2c34,"SANGAIAH,R, RAMACHANDRAN,P, ZHANG,J AND BALL,LM, SYNTHESIS ANDBIOLOGICAL ACTIVITY OF METABOLITES OF ENVIRONMENTAL NITROARENES, POLYCYCLICAROMAT. COMPD. 11(1-4):283-290, 1996"
+92-94-4,EPA1,0,-1,,c1ccc(cc1)c2ccc(cc2)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M348,EPA1,0,-1,,CCCC[C@@H](CC)COS(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+110-00-9,EPA2,0,-1,,o1cccc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+71382-50-8,CCRIS,1,-1,,N1C2C1c3cc4ccccc4c5ccc6cccc2c6c35,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+123392-56-3,CCRIS,0,-1,,NC(CCC(=O)NC(CSC(=O)NCCO)C(=O)NCC(=O)O)C(=O)O,"STAHL,W, DENKEL,E AND EISENBRAND,G, INFLUENCE OF GLUTATHIONE ON THEMUTAGENICITY OF 2-CHLOROETHYLNITROSOUREAS. MUTAGENIC POTENTIAL OF GLUTATHIONEDERIVATIVES FORMED FROM 2-CHLOROETHYLNITROSOUREAS AND GLUTATHIONE, MUTAT. RES.206(4): 459-465, 1988"
+68743-68-0,EPA1,1,-1,,CCOC(=O)N(CCCC(=O)c1cccnc1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7213-98-1,CCRIS,0,-1,,CC(=O)Nc1cc2Cc3ccccc3c2cc1OC(=O)C,"CREBELLI,R AND IORIO,MA, CHEMISTRY AND IN VITRO MUTAGENICITY OF2-AMINOFLUORENE DERIVATIVES, CHEM.-BIOL. INTERACT. 54(1):71-83, 1985"
+89930-59-6,CCRIS,1,-1,,CCCn1cc2CC3C(C=C(C)CN3C)c4cccc1c24,"GLATT,H, EICH,E, PERTZ,H, BECKER,C AND OESCH,F, MUTAGENICITYEXPERIMENTS ON AGROCLAVINES, NEW NATURAL ANTINEOPLASTIC COMPOUNDS, CANCER RES.47(7):1811-1814, 1987"
+2980-32-7,EPA1,1,-1,,Oc1cc(O)c2C(=O)c3c(O)ccc(O)c3Oc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+631-64-1,VITIC,1,-1,,OC(=O)C(Br)Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+38412-38-3,CCRIS,0,-1,,Cc1ccc(cc1S(=O)(=O)O)N=Nc2c(O)c(cc3ccccc23)C(=O)O,"MIYAGOSHI,M, HAYAKAWA,Y, NAGATA,M AND NAGAYAMA,T, ANALYSIS OF THESUBSIDIARY DYES OF LITHOL RUBINE B AND THEIR MUTAGENICITIES, EISEI KAGAKU36(2):133-138, 1990"
+38915-49-0,EPA3,1,-1,,NCCN(CCCl)c1c2ccccc2nc3c1ccc4ccccc34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+62641-66-1,EPA3,1,-1,,O=NN1CCCNC1=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+102-08-9,VITIC,0,-1,,S=C(Nc1ccccc1)Nc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1421-63-2,VITIC,1,-1,,CCCC(=O)c1cc(O)c(O)cc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+112022-08-9,EPA1,1,-1,,CN(C)CCNC(=O)c1cccc2C(=O)c3ccccc3Oc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+604-35-3,CCRIS,0,1,,CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C,"ISLAM,S AND AHMAD,M, MUTAGENIC ACTIVITY OF AZIRIDINYL STEROIDS ANDTHEIR MECHANISM OF ACTION IN BIOLOGICAL SYSTEMS, MUTAGENESIS 6(4):271-278,1991"
+79-81-2,EPA1,0,-1,"RETINOLPA",CCCCCCCCCCCCCCCC(=O)OC\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111238-10-9,CCRIS,1,-1,,Cc1c2ccccc2cc3ccc4C(=O)C(=O)C=Cc4c13,"FLOWERS-GEARY,L, BLECZINSKI,W, HARVEY,RG AND PENNING,TM, CYTOTOXICITYAND MUTAGENICITY OF POLYCYCLIC AROMATIC HYDROCARBON O-QUINONES PRODUCED BYDIHYDRODIOL DEHYDROGENASE, CHEM.- BIOL. INTERACT. 99(1-3):55-72, 1995"
+121111-61-3,CCRIS,1,-1,,COc1ccc(cc1OC)c2nc(c3ccc(C)cc3)c([nH]2)c4ccc(C)cc4,"MERCANGOZ,A AND TUYLU,BA, DETECTION OF MUTAGENIC EFFECTS OF 2,4,5,TRI(SUBSTITUTE)PHENYL IMIDAZOLE AND ITS DERIVATIVES IN AMES/SALMONELLA/TESTSYSTEM,TURK. J. BIOL. 24(1):57-64, 2000"
+66931-57-5,CCRIS,1,-1,,C(OCc1cccc2ccccc12)C3CO3,"ROSMAN,LB, CHAKRABORTY,PK, MESSERLY,EA AND SINSHEIMER,JE, MUTAGENICITYOF AROMATIC GLYCIDYL ETHERS WITH SALMONELLA, MUTAT. RES. 206(1):115-125,1988"
+504-88-1,EPA2,1,-1,"NITRPRAT3",OC(=O)CC[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+63041-90-7,CCRIS,1,-1,,[O-][N+](=O)c1c2ccccc2c3ccc4cccc5ccc1c3c45,"ANDERSON,JG, MCCALLA,DR, BRYANT,DW, MCCARRY,BE AND BROMKE,AM,METABOLIC ACTIVATION"
+90421-84-4,CCRIS,0,-1,,O=C1N(CC2CO2)Sc3ccccc13,"ZANI,F, MAGGIALI,CA, MINGIARDI,MR AND MAZZA,P, BIOLOGICAL STUDIES ON1,2-BENZISOTHIAZOLE DERIVATIVES. IV. RELATIONSHIPS BETWEEN CHEMICAL STRUCTUREAND GENOTOXICITY, FARMACO 46(5):639-646, 1991"
+6957-71-7,EPA1,1,-1,,O=CNc1ccc2c(Cc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133502-50-8,EPA1,0,-1,,CN(C)c1ccc(cc1)C(=C2C=CC(=N)C=C2)c3ccc(cc3)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25917-89-9,CCRIS,1,-1,,Cc1cc(N)c(cc1N)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+1198-27-2,EPA1,0,-1,,Nc1c(O)ccc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+35142-05-3,EPA1,1,-1,"ARISTOLAT",COc1cccc2c1ccc3c(cc4OCOc4c23)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+87919-37-7,CCRIS,0,-1,,CN(CCO)C(=O)Nc1ccc(Cl)c(Cl)c1,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+99601-32-8,CCRIS,1,-1,,CCn1c(N)nc2c3cccnc3cc(C)c12,"JAEGERSTAD,M AND GRIVAS,S, THE SYNTHESIS AND MUTAGENICITY OF THE3-ETHYL ANALOGUES OF THE POTENT MUTAGENS IQ, MEIQ, MEIQX AND ITS 3,7-DIMETHYLISOMER, MUTAT. RES. 144(3):131-136, 1985"
+75605-59-3,EPA1,1,-1,,C[n+]1c2ccccc2cc3c(N)cccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+147151-67-5,EPA1,1,-1,,C[C@]12CC[C@H]3[C@@H](CC=C4C[C@H](CC[C@]34C)OC(=O)\C=C\c5cccc(c5)N(CCCl)CCCl)[C@@H]1CCC(=O)N2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+131862-18-5,CCRIS,1,-1,,CN(C)CCNC(=O)c1ccc2ccc3cccnc3c2n1,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+85-48-3,EPA1,0,-1,,OS(=O)(=O)c1cccc2cccnc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24903-46-6,EPA1,1,-1,,c1ccc2c(c1)ccc3cc4ccc5ccncc5c4cc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+70-54-2,CCRIS,1,-1,"CULYSINAT,FOSFOMLYS,LYSINECU,LYSINE-ZN,VAL-781",NCCCCC(N)C(=O)O,"WU,X, SKOG,K AND JAEGERSTAD,M, TRIGONELLINE, A NATURALLY OCCURRINGCONSTITUENT OF GREEN COFFEE BEANS BEHIND THE MUTAGENIC ACTIVITY OF ROASTEDCOFFEE?, MUTAT. RES. 391(3):171-177, 1997"
+10549-22-1,CCRIS,1,-1,,[O-][N+](=O)c1cc2CCc3cccc4CCc(c1)c2c34,"HIRAYAMA,T, WATANABE,T, AKITA,M, SHIMOMURA,S, FUJIOKA,Y, OZASA,S ANDFUKUI,S, RELATIONSHIPS BETWEEN STRUCTURE OF NITRATED ARENES AND THEIRMUTAGENICITY IN SALMONELLA TYPHIMURIUM, 2- AND 2,7-NITRO SUBSTITUTED FLUORENE,PHENANTHRENE AND PYRENE, MUTAT. RES. 209(1-2):67-74, 1988"
+18873-03-5,CCRIS,0,-1,,COc1ccc(cc1)C(=O)C2OC2c3ccccc3,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+507-55-1,CCRIS,0,-1,,FC(Cl)C(F)(F)C(F)(F)Cl,"BROCK,WJ, SHIN-YA,S, RUSCH,GM, HARDY,CJ AND TROCHIMOWICZ,HJ,INHALATION TOXICITY AND GENOTOXICITY OF HYDROCHLOROFLUOROCARBON (HCFC)-225CA ANDHCFC-225CB, J. APPL. TOXICOL. 19(2):101-112, 1999"
+52819-96-2,CCRIS,1,-1,,COc1cc2OC3OC=CC3c2c4OC(=O)C5=C(C(O)CC5=O)c14,"YOURTEE,DM AND KIRK-YOURTEE,CL, THE MUTAGENICITY OF AFLATOXIN Q1 TOSALMONELLA TYPHIMURIUM TA 100 WITH OR WITHOUT RAT OR HUMAN LIVER MICROSOMALPREPARATIONS, RES. COMMUN. CHEM. PATHOL. PHARMACOL. 54(1):101-113,1986"
+56299-00-4,CCRIS,1,-1,,CC1C(OC(=O)C)C2OC2C3=CC(=O)C4(CC13C)OC4(C)C=O,"LAFONT,J, ROMAND,A AND LAFONT,P, EFFECTS OF MYCOTOXINS ON BACTERIALGENETICS, MICROBIOL., ALIMENTS, NUTR. 1(3):251-258, 1983"
+121111-59-9,CCRIS,1,-1,,Cc1ccc(cc1)c2nc([nH]c2c3ccc(C)cc3)c4ccc(C)cc4C,"MERCANGOZ,A AND TUYLU,BA, DETECTION OF MUTAGENIC EFFECTS OF 2,4,5,TRI(SUBSTITUTE)PHENYL IMIDAZOLE AND ITS DERIVATIVES IN AMES/SALMONELLA/TESTSYSTEM,TURK. J. BIOL. 24(1):57-64, 2000"
+86674-49-9,CCRIS,1,-1,,Oc1cc(c2ccc3cccc4ccc1c2c34)[N+](=O)[O-],"CONSOLO,MC, ANDERS,M AND HOWARD,PC, MUTAGENICITY OF THE PHENOLICMICROSOMAL METABOLITES OF 3-NITROFLUORANTHENE AND 1-NITROPYRENE IN STRAINS OFSALMONELLA TYPHIMURIUM, MUTAT. RES. 210(2):263-269, 1989"
+7068-83-9,EPA3,1,-1,,CCCCN(C)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+39093-14-6,CCRIS,0,-1,"DIOSPDIME",COc1cc(C)cc2C(=O)C(=CC(=O)c12)c3c(C)cc4C(=O)C=CC(=O)c4c3OC,"HAZRA,B, PAL,S, SHETTY,TK AND BHATTACHARYA,RK, AN INVESTIGATION ON THEMUTAGENIC ACTIVITY OF DIOSPYRIN AND ITS SEMISYNTHETIC DERIVATIVES, MED. SCI.RES. 23(7):449-450, 1995"
+98-01-1,EPA1,1,-1,"FURFURAL",O=Cc1occc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4245-77-6,CCRIS,1,-1,,CCN(N=O)C(=N)N[N+](=O)[O-],"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+90301-92-1,CCRIS,0,-1,,Cl\C=C\c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,"TARKPEA,M, HAGEN,I, CARLBERG,GE, KOLSAKER,P AND STORFLOR,H,MUTAGENICITY, ACUTE TOXICITY, AND BIOACCUMULATION POTENTIAL OF SIX CHLORINATEDSTYRENES, BULL. ENVIRON. CONTAM. TOXICOL. 35(4):525-530, 1985"
+609-19-8,VITIC,0,-1,,Oc1cc(Cl)c(Cl)c(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+23184-66-9,CCRIS,1,-1,,CCCCOCN(C(=O)CCl)c1c(CC)cccc1CC,"MORIYA,M OHTA,T WATANABE,K MIYAZAWA,T KATO,K AND SHIRASU,Y, FURTHERMUTAGENICITY STUDIES ON PESTICIDES IN BACTERIAL REVERSION ASSAY SYSTEMS, MUTAT.RES. 116(3-4):185-216,1982"
+2244-21-5,EPA1,0,-1,,ON1CN(Cl)CN(Cl)C1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M509,EPA1,0,-1,,CCCC[C@@H](CC)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+55557-02-3,EPA1,1,-1,,COC(=O)C1=CCCN(C1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+36097-31-1,CCRIS,0,-1,,CN(CCO)C(=O)Nc1ccccc1,"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+640-15-3,EPA1,0,-1,,CCSCCSP(=S)(OC)OC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+71989-02-1,CCRIS,1,-1,,Cc1c2ccccc2cc3c4C=CC(=O)C(=O)c4ccc13,"FLOWERS-GEARY,L, BLECZINSKI,W, HARVEY,RG AND PENNING,TM, CYTOTOXICITYAND MUTAGENICITY OF POLYCYCLIC AROMATIC HYDROCARBON O-QUINONES PRODUCED BYDIHYDRODIOL DEHYDROGENASE, CHEM.- BIOL. INTERACT. 99(1-3):55-72, 1995"
+13523-86-9,CCRIS,0,-1,"PINDOLOL",CC(C)NCC(O)COc1cccc2[nH]ccc12,"OKINE,LKN, IOANNIDES,C AND PARKE,DV, STUDIES ON THE POSSIBLEMUTAGENICITY OF BETA-ADRENERGIC BLOCKER DRUGS, TOXICOL. LETT. 16(3-4):167-174,1983"
+60657-25-2,CCRIS,1,-1,,OC1C=Cc2c(cc3ccc4cccc5ccc2c3c45)C1O,"CHIU,PL AND YANG,SK, METABOLISM OF 7,8-DIHYDROBENZO[A]PYRENE BY RATLIVER MICROSOMAL ENZYMES AND MUTAGENICITY OF METABOLITES, CANCER RES. 46(10):5084-5094, 1986"
+10540-29-1,CCRIS,0,-1,,CC\C(=C(\c1ccccc1)/c2ccc(OCCN(C)C)cc2)\c3ccccc3,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y96"
+548-39-0,EPA1,1,-1,,O=C1C=Cc2cccc3cccc1c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18774-85-1,EPA2,1,-1,,CCCCCCN(N=O)C(=O)N,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+97-63-2,VITIC,0,-1,,CCOC(=O)C(=C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+26780-96-1,VITIC,0,-1,,CC1C(C)(C)Nc2ccccc2C1(C)C3C(C)(C)Nc4ccccc4C3(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2687-40-3,CCRIS,1,-1,,CC(=O)Nc1ccc(Oc2ccc(cc2)[N+](=O)[O-])cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, GENOTOXICITY OF POTENTIAL METABOLITESOF NITROSCANATE- AN ANTISCHISTOSOMAL DRUG, MUTAT. RES. 335(3):235-243,1995"
+57-47-6,CCRIS,0,-1,,CNC(=O)Oc1ccc2N(C)C3N(C)CCC3(C)c2c1,"ORNER,GA, SEBASTIAN,SE AND KORTE,DW, MUTAGENIC POTENTIAL OFPHYSOSTIGMINE FREE BASE IN THE AMES SALMONELLA/MAMMALIAN MICROSOME MUTAGENICITYTEST, LETTERMAN ARMY INSTITUTE OF RESEARCH, LAIR-IR-389:TOXICOLOGYSER-243, JULY1989"
+619-72-7,CCRIS,0,-1,,[O-][N+](=O)c1ccc(cc1)C#N,"SHIMIZU,M AND YANO,E, MUTAGENICITY OF MONO-NITROBENZENE DERIVATIVES INTHE AMES TEST AND REC ASSAY, MUTAT. RES. 170(1-2):11-22, 1986"
+768-52-5,EPA1,0,-1,,CC(C)Nc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+113698-23-0,EPA1,1,-1,,Cc1nc2C(=O)C(=CC(=O)c2c3[nH]c4ccccc4c13)N5CC5,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2466-76-4,EPA1,0,-1,"ACIMIDAZ1",CC(=O)n1ccnc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M573,EPA1,0,-1,,CC1(C)C[C@H](C[C@](C)(CN=C=O)C1)N=C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+147293-15-0,EPA1,1,-1,,Cn1c(N)nc2c3ccncc3ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5392-40-5,EPA3,0,-1,"CITRAL",CC(=CCC\C(=C/C=O)\C)C,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+114899-77-3,EPA1,1,-1,,COc1cc2c(CCN[C@]23CSC4[C@H]5[C@@H]6N(C)[C@@H](Cc7cc(C)c(OC)c(O)c67)[C@H](O)N5[C@@H](COC3=O)c8c9OCOc9c(C)c(OC(=O)C)c48)cc1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+962-32-3,CCRIS,1,-1,,O1C2C1c3cc4ccccc4cc3c5ccccc25,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+199536-79-3,CCRIS,1,-1,,BrC(Br)C1=C(Br)C(=O)OC1,"LALONDE,RT, BU,L, HENWOOD,A, FIUMANO,J AND ZHANG,L, BROMINE-,CHLORINE-, AND MIXED HALOGEN-SUBSTITUTED 4-METHYL-2(5H)-FURANONES: SYNTHESIS ANDMUTAGENIC EFFECTS OF HALOGEN AND HYDROXYL GROUP REPLACEMENTS,CHEM. RES. TOXICOL.10(12):1427-1436, 1997"
+89925-00-8,CCRIS,1,-1,,CC1(CO1)C(=O)N,"HASHIMOTO,K AND TANII,H, MUTAGENICITY OF ACRYLAMIDE AND ITS ANALOGUESIN SALMONELLA TYPHIMURIUM, MUTAT. RES. 158(3):129-133, 1985"
+122-39-4,VITIC,0,-1,"DIPHENYLA",N(c1ccccc1)c2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+105708-80-3,EPA1,1,-1,,OCc1c2ccccc2cc3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67151-57-9,EPA1,0,-1,,Cc1ccc(cc1N=[N+]([O-])c2cc(ccc2C)[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M132,EPA1,1,-1,,C[C@@H]1CNC(=O)N1c2ncc(s2)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M571,EPA1,0,-1,,CCCC[C@@H](CC)COP(=O)(OC[C@H](CC)CCCC)OC[C@H](CC)CCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+105-11-3,VITIC,1,-1,,ONc1ccc(cc1)N=O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+51489-62-4,CCRIS,1,-1,,Clc1ccc(Oc2ccc(NC=O)cc2)cc1,"MIYAUCHI,M, ENDOH,Y AND UEMATSU,T, MUTAGENIC ACTIVITY OF THE AMIDODERIVATIVES AND THEIR HYDROXAMIC ACIDS OF NITROBIPHENYL ETHERS, BULL. ENVIRON.CONTAM. TOXICOL. 55(3):446-452, 1995"
+125974-08-5,CCRIS,1,-1,,OC1OC(=O)C(=C1CCl)Cl,"LALONDE,RT, BU,L, HENWOOD,A, FIUMANO,J AND ZHANG,L, BROMINE-,CHLORINE-, AND MIXED HALOGEN-SUBSTITUTED 4-METHYL-2(5H)-FURANONES: SYNTHESIS ANDMUTAGENIC EFFECTS OF HALOGEN AND HYDROXYL GROUP REPLACEMENTS,CHEM. RES. TOXICOL.10(12):1427-1436, 1997"
+82-62-2,VITIC,0,-1,,Oc1c(Cl)cc(Cl)c(Cl)c1[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+550-60-7,CCRIS,1,-1,,Oc1ccc2ccccc2c1[N+](=O)[O-],"SUZUKI,J, WATANABE,T AND SUZUKI,S, FORMATION OF MUTAGENS BYPHOTOCHEMICAL REACTION OF 2-NAPHTHOL IN AQUEOUS NITRITE SOLUTION, CHEM. PHARM.BULL. 36(6): 2204-2211, 1988"
+56-38-2,EPA2,0,-1,"PARATHION",CCOP(=S)(OCC)Oc1ccc(cc1)[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+79642-27-6,CCRIS,1,-1,,Nc1[nH]ccc2nc3ccccc3c12,"LIN,JK, WU,SS AND CHEN,JT, MUTAGENICITIES OF NITROSATED CARBOLINEDERIVATIVES, PROC. NATL. SCI. COUNC., REPUB. CHINA, PART B: LIFE SCI.10(4):280-286, 1986"
+64091-91-4,EPA1,1,-1,,CN(CCCC(=O)c1cccnc1)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+609-15-4,CCRIS,0,-1,"A-21960",CCOC(=O)C(Cl)C(=O)C,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y95"
+129812-26-6,CCRIS,1,-1,,CC1=CC(=O)Oc2ccc3OC4(C)OOC4(C)c3c12,"ADAM,W, HAUER,H, MOSANDL,T, SAHA-MOELLER,CR, WAGNER,W AND WILD,D,FUROCOUMARIN-, NAPHTHOFURAN-, AND FUROQUINOLINE-ANNULATED 1,2-DIOXETANES:SYNTHESIS, THERMOLYSIS, AND MUTAGENICITY, LIEBIGS ANN. CHEM. (12):1227-1236,1990"
+538-75-0,VITIC,0,-1,"DCCD",C1CCC(CC1)N=C=NC2CCCCC2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+473-55-2,VITIC,0,-1,,CC1CCC2CC1C2(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+132934-48-6,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c1ncc3cnc4ccccc4c23,"UPTON,M AND UPTON,C, NOVEL NITRATED DERIVATIVES OF5,8-DIAZABENZO[C]-PHENANTHRENE AND 9,14-DIAZADIBENZ[A,E]ACEPHENANTHRYLENE:NEWCLASSES OF POTENT MUTAGENIC COMPOUNDS, MUTAGENESIS 14(6):587-593,1999"
+91-53-2,VITIC,0,-1,"ETHOXYQUI",CCOc1ccc2NC(C)(C)C=C(C)c2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+42373-04-6,EPA1,1,-1,,C[n+]1ccsc1N=Nc2c(c3ccccc3)n(C)c4ccccc24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50-33-9,VITIC,0,-1,"AMINOPPHE,CLOFEZONE,PHENYLBUT,PHBUTDIET,PHENYBUGE,PHENYLBUP,PHENYLBQU,PHEBUTHIA",CCCCC1C(=O)N(N(C1=O)c2ccccc2)c3ccccc3,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+34237-98-4,EPA1,1,-1,,Nc1ccc(cc1Br)c2ccc(N)c(Br)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15687-27-1,CCRIS,0,-1,"IBUPROFEN,IBUPROFAL,DR9603131,IBUPRGUAI,IBUPROLYS,IBUPROMEG,IBUPROFNA,IBUPROFZN",CC(C)Cc1ccc(cc1)C(C)C(=O)O,"OLDHAM,JW, PRESTON,RF AND PAULSON,JD, MUTAGENICITY TESTING OF SELECTEDANALGESICS IN AMES SALMONELLA STRAINS, J. APPL. TOXICOL. 6(4):237-243,1986"
+16354-55-5,EPA1,0,-1,,CCc1c2ccccc2c(C)c3ccc4ccccc4c13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1836-75-5,EPA2,1,-1,"NITROFEN",[O-][N+](=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+51-43-4,CCRIS,0,-1,"RACEPINEP,RACEPIHCL",CNCC(O)c1ccc(O)c(O)c1,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T, MORTELMANS,K AND SPECK,W,SALMONELLA MUTAGENICITY TESTS: III. RESULTS FROM THE TESTING OF 255 CHEMICALS,ENVIRON. MOL. MUTAGEN. 9(SUPPL.9):1-110, 1987"
+109-08-0,EPA1,0,-1,,Cc1cnccn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+61695-73-6,EPA3,1,-1,,C1O[C@@H]1c2c3ccccc3cc4ccccc24,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+230-27-3,EPA1,1,-1,,c1ccc2c(c1)ccc3cccnc23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+135-88-6,VITIC,0,-1,"NEOZONED",N(c1ccccc1)c2ccc3ccccc3c2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+58329-89-8,CCRIS,0,-1,,Cc1ccc(cc1)N=Nc2ccc(cc2)N(CCO)CCO,"SHAHIN,MM, EVALUATION OF THE MUTAGENICITY OF AZO DYES IN SALMONELLATYPHIMURIUM: A STUDY OF STRUCTURE-ACTIVITY RELATIONSHIPS, MUTAGENESIS 4(2):115-125, 1989"
+106807-80-1,EPA1,1,-1,,CNC(=O)N(O)C(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+50-27-1,CCRIS,0,1,,CC12CCC3C(CCc4cc(O)ccc34)C1CC(O)C2O,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y96"
+994-05-8,VITIC,0,-1,,CCC(C)(C)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1576-87-0,EPA1,1,-1,,CC\C=C\C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+589-18-4,VITIC,0,-1,,Cc1ccc(CO)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+131229-62-4,CCRIS,1,-1,,CCCCON(OC(=O)C)C(=O)c1ccc(Cl)cc1,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+155603-50-2,CCRIS,0,-1,,CCCCC(CC)COC(=O)c1ccc(cc1)C(=O)O,"BARBER,ED, GENETIC TOXICOLOGY TESTING OFDI(2-ETHYLHEXYL)TEREPHTHALATE, ENVIRON. MOL. MUTAGEN. 23(3):228-233,1994"
+NOCAS_M305,EPA1,1,-1,,CO[C@@H]1C[C@](C)(O)Cc2cc3C(=O)c4c5O[C@@H]6O[C@@](C)([C@H](O)[C@H]([C@H]6O)N(C)C)c5cc(O)c4C(=O)c3c(O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+121-32-4,VITIC,0,-1,"ETHYLVANI",CCOc1cc(C=O)ccc1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+62902-12-9,CCRIS,0,-1,,CNc1ccc(cc1)C(=C2C=CC(=NC)C=C2)c3ccc(cc3)N(C)C,"AIDOO,A, GAO,N, NEFT,RE, SCHOL,HM, HASS,BS, MINOR,TY AND HEFLICH,RH,EVALUATION OF THE GENOTOXICITY OF GENTIAN VIOLET IN BACTERIAL AND MAMMALIAN CELLSYSTEMS, TERATOG., CARCINOG., MUTAGEN. 10(6):449-462, 1990"
+103554-58-1,CCRIS,1,-1,,CN(C)CCNC(=O)c1cccc2c(O)c3ccccc3nc12,"DENNY,WA, TURNER,PM, ATWELL,GJ, REWCASTLE,GW AND FERGUSON,LR,STRUCTURE- ACTIVITY RELATIONSHIPS FOR THE MUTAGENIC ACTIVITY OF TRICYCLICINTERCALATING AGENTS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 232(2):233-241,1990"
+42579-28-2,EPA2,1,-1,,O=NN1CC(=O)NC1=O,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+95152-79-7,CCRIS,1,-1,,Cc1cn2c(c(nc2s1)c3ccc(cc3)[N+](=O)[O-])[N+](=O)[O-],"HRELIA,P, PAOLINI,M, BIAGI,GL AND CANTELLI-FORTI,G, THE DIRECT-ACTINGMUTAGENICITY OF NITROIMIDAZO[2,1-B]THIAZOLES IN SALMONELLA TYPHIMURIUM,TERATOG., CARCINOG., MUTAGEN. 6(6):511-519, 1986"
+124-04-9,VITIC,0,-1,"ADIPATEBI,ADIPATELI,ADIPATPOT,ADIPATE,PIPERAZAD",OC(=O)CCCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+57-06-7,EPA1,1,-1,"ALLYLISOT",C=CCN=C=S,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+518-28-5,CCRIS,0,-1,,COc1cc(cc(OC)c1OC)C2C3C(COC3=O)C(O)c4cc5OCOc5cc24,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y86"
+106-65-0,VITIC,0,-1,"MESUCCINA",COC(=O)CCC(=O)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+959-23-9,CCRIS,0,-1,,COc1ccc(cc1)C(=O)\C=C\c2ccccc2,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+28911-01-5,EPA1,0,-1,"TRIAZOLAM",Cc1nnc2CN=C(c3ccccc3Cl)c4cc(Cl)ccc4n12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+149127-56-0,CCRIS,1,-1,,CN=NC(C)(C)OO,"MOCHIZUKI,M, MICHIHIRO,K, SHIOMI,K, ITOH,K, TANGE,Y AND HIZATATE,S,AUTOOXIDATION OF ALKYLHYDRAZONES AND MUTAGENICITY OF THE RESULTINGHYDROPEROXIDES, BIOL. PHARM. BULL. 16(1):96-98, 1993"
+93-68-5,EPA1,0,-1,,CC(=O)CC(=O)Nc1ccccc1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155506-70-0,CCRIS,0,-1,,CCOC(=O)C1=C(C)N=C(C)C(=C(O)OCC2COC3(CCCC3)O2)C1c4cccc(Cl)c4,"MUCKOVA,M AND LAZOVA,J, EVALUATION OF VULM 993 MUTAGENICITY IN VITRO,FARM. OBZ. 66(6-7):177-181, 1997"
+158470-95-2,CCRIS,1,-1,,CC1C2C(=Nc3ccc(C)cc23)N(C)c4ccc(C)cc14,"RAHDEN-STARON,I, PECZYNSKA-CZOCH,W AND KACZMAREK,L, MUTAGENICITY OFCARBOLINE METHYL DERIVATIVES IN SALMONELLA, ACTA MICROBIOL. POL. 43(2):247-250,1994"
+139953-98-3,CCRIS,1,-1,,CC\C=C\C=C\C=C\C=C\C=C\OCC(O)c1ccccc1,"VERTEGAAL,LBJ, VOOGD,CE, MOHN,GR AND VAN DER GEN,A, FURTHER STUDIES ONTHE MUTAGENIC ACTIVITY OF FECAPENTAENE-12 ANALOGS AND CONCLUSIONS ABOUT THEIRMOLECULAR MODE OF ACTION, MUTAT. RES. 281(2):93-98, 1992"
+77-90-7,EPA1,0,-1,"TRIBUACCI",CCCCOC(=O)CC(CC(=O)OCCCC)(OC(=O)C)C(=O)OCCCC,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+389104-62-5,CCRIS,0,-1,,CC(C)c1cc(cc(C(C)C)c1N)c2ccccc2,"GLENDE,C SCHMITT,H ERDINGER,L ENGELHARDT,G AND BOCHE,G, TRANSFORMATIONOF MUTAGENIC AROMATIC AMINES INTO NON-MUTAGENIC SPECIES BY ALKYL SUBSTITUENTS.PART I. ALKYLATION ORTHO TO THE AMINO FUNCTION. MUTAT. RES. 498(1-2):19-37,2001"
+142022-84-2,EPA1,1,-1,,O=S1(=O)c2cccc3ccc4c5ccccc5cc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+220168-47-8,CCRIS,1,-1,,O=Cc1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,"BONIN,AM BANKS,TM CAMPBELL,JJ GLOVER,SA HAMMOND,GP PRAKASH,AS ANDROWBOTTOM,CA, MUTAGENICITY OF ELECTROPHILIC N-ACYLOXY-N-ALKOXYAMIDES, MUTAT.RES. 494(1-2):115-134, 2001"
+108893-58-9,CCRIS,1,-1,,CC1(C)CC2=C(C=O)C3(CC3(C)C(O)C2(O)C1)C=O,"ANKE,H, STERNER,O AND STEGLICH,W, STRUCTURE-ACTIVITY RELATIONSHIPS FORUNSATURATED DIALDEHYDES. 3. MUTAGENIC, ANTIMICROBIAL, CYTOTOXIC, AND PHYTOTOXICACTIVITIES OF MERULIDIAL DERIVATIVES, J. ANTIBIOT. 42(5):738-744,1989"
+585-79-5,EPA1,1,-1,,[O-][N+](=O)c1cccc(Br)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155144-64-2,CCRIS,1,-1,"RO-473359",Cc1cc(cc(C)n1)c2cc3N(C4CC4)C5=CC(=O)N(O)C(=O)N5c3cc2F,"ALBERTINI,S, CHETELAT,AA, MILLER,B, MUSTER,W, PUJADAS,E, STROBEL,R ANDGOCKE,E,GENOTOXICITY OF 17 GYRASE- AND FOUR MAMMALIAN TOPOISOMERASE II-POISONSIN PROKARYOTIC"
+166546-23-2,CCRIS,0,-1,,CN1CCN(CC1)c2ccc3[nH]c(CCCCCCc4ccc5[nH]c(nc5c4)c6ccc(cc6)N(CCCl)CCCl)nc3c2,"FERGUSON,LR AND DENNY,WA, MICROBIAL MUTAGENIC EFFECTS OF THE DNA MINORGROOVE BINDER PIBENZIMOL (HOECHST 33258) AND A SERIES OF MUSTARD ANALOGS, MUTAT.RES. 329(1):19-27, 1995"
+157730-37-5,EPA1,0,-1,,Cn1c(N)nc2nc3cccnc3cc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+25990-37-8,CCRIS,0,-1,,COC(=O)C[C@H]1[C@@]2(C)[C@H](OC3C[C@H](C(=C23)C)c4cocc4)[C@@H]5OC(=O)[C@]6(C)C=CC(=O)[C@@]1(C)C56,"UWAIFO,AO, THE MUTAGENICITIES OF SEVEN COUMARIN DERIVATIVES AND AFURAN DERIVATIVE (NIMBOLIDE) ISOLATED FROM THREE MEDICINAL PLANTS, J. TOXICOL.ENVIRON. HEALTH 13(4-6):521-530, 1984"
+52315-07-8,CCRIS,0,-1,"CYPERMETH",CC1(C)C(C=C(Cl)Cl)C1C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2,"SIMMON,VF, RICCIO,ES, ROBINSON,DE AND MITCHELL,AD, IN VITROMICROBIOLOGICAL MUTAGENICITY AND UNSCHEDULED DNA SYNTHESIS STUDIES OF FIFTEENPESTICIDES, EPA/600/1-85/006, NTIS PB85-193761, 1985"
+94339-55-6,CCRIS,1,-1,,OC1CC=Cc2c1cc3ccc4cccc5ccc2c3c45,"CHIU,PL AND YANG,SK, METABOLISM OF 7,8-DIHYDROBENZO[A]PYRENE BY RATLIVER MICROSOMAL ENZYMES AND MUTAGENICITY OF METABOLITES, CANCER RES. 46(10):5084-5094, 1986"
+51410-44-7,EPA2,0,-1,,COc1ccc(cc1)C(O)C=C,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+73391-96-5,CCRIS,0,-1,,CN(Cc1ccccc1)C(=O)CBr,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+580-16-5,EPA1,0,-1,"DR0003887",Oc1ccc2ncccc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+75-15-0,VITIC,0,-1,"CS2",S=C=S,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2031-67-6,CCRIS,0,-1,,CCO[Si](C)(OCC)OCC,"ISQUITH,A, MATHESON,D AND SLESINSKI,R, GENOTOXICITY STUDIES ONSELECTED ORGANOSILICON COMPOUNDS. IN VITRO ASSAYS, FOOD CHEM. TOXICOL.26(3):255-261, 1988"
+78281-06-8,EPA1,1,-1,,ON(C=O)c1ccc(cc1)c2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+480-85-3,CCRIS,0,-1,"RETRONECI",OCC1=CCN2CC[C@@H](O)[C@@H]12,"YAMANAKA,H NAGAO,M AND SUGIMURA,T, MUTAGENICITY OF PYRROLIZIDINEALKALOIDS IN THE SALMONELLA/MAMMALIAN-MICROSOME TEST, MUTAT. RES. 68(3):211-216,1979"
+143603-72-9,CCRIS,1,-1,,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3ccc(cc3)[N+](=O)[O-],"LOPEZ DE CERAIN,A, GARCIA,E, BEORLEGUI,JJ, GULLON,A, ARRARAS,JA ANDMONGE,A, MUTAGENIC EVALUATION OF 3-(4'-BENZYLIDENEAMINO)INDOLE-2-ETHYLCARBOXYLATE IN HIS- SALMONELLA TYPHIMURIUM STRAINS, REV. TOXICOL. 10(3):151-154,1993"
+111955-24-9,CCRIS,0,-1,,CC(=O)OC1COC(Nc2ccc(cc2)C(=O)O)C(OC(=O)C)C1OC(=O)C,"MERSCH-SUNDERMANN,V AND KRAEMER,H, THE INFLUENCE OF CULTURE CONDITIONSON THE SUSCEPTIBILITY OF SALMONELLA TYPHIMURIUM IN THE SALMONELLA MUTAGENICITYTEST, ZENTRALBL. HYG. UMWELTMED. 193(5):471-480, 1993"
+759-73-9,VITIC,1,-1,"ETHYLNITR",CCN(N=O)C(=O)N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+188970-77-6,CCRIS,1,-1,,[O-][N+](=O)c1cc2[nH]c3cc(c4ccccc4c3c2c5ccccc15)[N+](=O)[O-],"XUE,W, LADOW,K AND WARSHAWSKY,D, SYNTHESIS, CHARACTERIZATION, ANDMUTAGENICITY OF NITRATED 7H-DIBENZO[C,G]CARBAZOLE AND ITS PHENOLIC DERIVATIVES,CHEM. RES. TOXICOL. 10(4):432-438, 1997"
+13911-90-5,CCRIS,1,-1,,Cc1cccc2nc3c(ccc4ccccc34)cc12,"TANAKA,M, CSURI,K, MOLNAR,J AND MOTOHASHI,N, DIVERSE MUTAGENICITY OFMETHYLBENZ[C]ACRIDINES IN THE DIRECT AMES' SALMONELLA MUTAGENICITY ASSAY,ANTICANCER RES. 16(5A):2837-2842, 1996"
+55400-87-8,CCRIS,1,-1,,O1C2C1c3cc4c(cc3c5ccccc25)C6OC6c7ccccc47,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+464-10-8,EPA1,1,-1,,[O-][N+](=O)C(Br)(Br)Br,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68498-25-9,CCRIS,0,-1,,OCC1OC(CC1O)n2cnc3c2ncn4ccnc34,"NEGISHI,K, OOHARA,K, URUSHIDANI,H, OHARA,Y AND HAYATSU,H, EVALUATIONOF THE MUTAGENICITY OF 1,N6-ETHENOADENINE- AND 3,N4-ETHENOCYTOSINE-NUCLEOSIDESIN SALMONELLA TYPHIMURIUM, IN: SINGER,B AND BARTSCH,H (EDS.), IARC SCIENTIFICPUBLICATIONS NO. 70, THE ROLE OF CYCLIC NUCLEIC ACID ADDUCTS IN CARCINOGENESISAND MUTAGENESIS, INTERNATIONAL AGENCY FOR RESEARCH ON CANCER, LYON, FRANCE,1986, PP. 293-297"
+109-16-0,EPA1,0,-1,,CC(=C)C(=O)OCCOCCOCCOC(=O)C(=C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+82617-23-0,CCRIS,1,-1,,NC(=O)OC1CO1,"PARK,KK, SURH,YJ, STEWART,BC AND MILLER,JA,SYNTHESIS AND PROPERTIES OFVINYL CARBAMATE EPOXIDE, A POSSIBLE ULTIMATE ELECTROPHILIC AND CARCINOGENICMETABOLITE OF VINYL CARBAMATE AND ETHYL CARBAMATE, BIOCHEM. BIOPHYS. RES.COMMUN. 169(3):1094-1098, 1990"
+158729-23-8,CCRIS,0,-1,,Clc1cccc(NS(=O)(=O)c2cccc3cccnc23)c1,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+551-92-8,CCRIS,1,-1,"DIMETRIDA,DIMETRIME",Cc1ncc([N+](=O)[O-])n1C,"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+17026-81-2,VITIC,1,-1,,CCOc1ccc(NC(=O)C)cc1N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+103-83-3,EPA1,0,-1,"DR0029640",CN(C)Cc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+518-75-2,EPA1,0,-1,,C[C@H]1OC=C2C(=C(C(=O)O)C(=O)C(=C2[C@@H]1C)C)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M441,EPA1,0,-1,,CCCCCCCCCC\C=C\[C@H]1CC(=O)OC1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+27032-78-6,EPA1,1,-1,,O=C1NCNC(=O)N1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+60-57-1,EPA1,0,-1,,ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@H]4C[C@H]([C@H]5O[C@@H]45)[C@@H]3[C@]1(Cl)C2(Cl)Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+161697-00-3,EPA1,1,-1,,CNc1ccc2nc(C)c(C)nc2c1C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111205-70-0,CCRIS,0,-1,,COC(=O)c1oc(NO)c(c2ccccc2)c1c3ccccc3,"SWAMINATHAN,S, HATCHER,JF, YAMAMOTO,K, TANAKA,A, ICHIKAWA,M ANDBRYAN,GT, MUTAGENICITY OF N- AND O-ACETYL DERIVATIVES OF METHYL 3,4-DIPHENYL-5-HYDROXYLAMINO-2-FUROATE AND N-HYDROXY-4-AMINOBIPHENYL IN SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 17(2):84-92, 1991"
+143924-52-1,CCRIS,1,-1,,OC1c2cccc3ccc4c5ccccc5cc1c4c23,"GLATT,H, HENSCHLER,R, FRANK,H, SEIDEL,A, YANG,C, ABU-SHQARA,E ANDHARVEY,RG, SULFOTRANSFERASE-MEDIATED MUTAGENICITY OF 1-HYDROXYMETHYLPYRENE AND4H- CYCLOPENTA[DEF]CHRYSEN-4-OL AND ITS ENHANCEMENT BY CHLORIDE ANIONS,CARCINOGENESIS 14(4):599-602, 1993"
+122587-23-9,CCRIS,0,-1,,COC(=O)c1oc(N)c(Cl)c1Cl,"HATCHER,JF, YAMAMOTO,K, ICHIKAWA,M, BRYAN,GT AND SWAMINATHAN,S,METABOLIC REDUCTION OF NOVEL 3,4-DICHLORO-5-NITROFURANS IN SALMONELLATYPHIMURIUM, ENVIRON. MOL. MUTAGEN. 25(1):58-66, 1995"
+67902-33-4,CCRIS,0,-1,,C1CC2=CC3OC3C=C(C1)O2,"STARK,AA AND RASTETTER,WH, STRUCTURE-ACTIVITY RELATIONSHIPS IN THEMUTAGENICITY AND CYTOTOXICITY OF PUTATIVE METABOLITES AND RELATED ANALOGS OFBENZENE DERIVED FROM THE VALENCE TAUTOMERS BENZENE OXIDE AND OXEPIN, ENVIRON.MOL. MUTAGEN. 28(3):284-293, 1996"
+97869-39-1,CCRIS,0,-1,,CC[N+](=NC)[O-],"LIJINSKY,W, ANDREWS,AW, ELESPURU,RK AND FARRELLY,JG, LACK OF GENETICAND IN VITRO METABOLIC ACTIVITY OF POTENTLY CARCINOGENIC AZOXYALKANES, MUTAT.RES. 157(1):23-27, 1985"
+97534-21-9,EPA1,0,-1,,O=C(Nc1ccccc1)C2C(=O)NC(=S)NC2=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+99346-51-7,CCRIS,0,-1,,CCCNc1c(C(=O)O)c(Cl)ccc1[N+](=O)[O-],"SZARAPINSKA-KWASZEWSKA,J, MIKUCKI,J, BAKUNIAK,E, DUDKIEWICZ,BA,NAWROT,E AND SOBIS,M, STUDIES OF PESTICIDES MUTAGENICITY, GENET. POL.25(4):327-332, 1984"
+217-59-4,EPA1,1,-1,,c1ccc2c3ccccc3c4ccccc4c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+74014-51-0,CCRIS,0,-1,,CCCC(=O)OC1C(C)OC(CC1(C)OC(=O)CC)OC2C(C)OC(OC3C(CC=O)CC(C)C(O)\C=C/C=C\CC(C)OC(=O)CC(O)C3OC)C(O)C2N(C)C,"SONO,A, OYAIDE,K, KOBAYASHI,Y AND YAMAMOTO,H, MUTAGENICITY TESTS ONTMS-19-Q,CHEMOTHERAPHY (TOKYO) 32(SUPPL. 6):222-227, 1984"
+98451-51-5,CCRIS,0,-1,,Nc1cccc(c1CO)[N+](=O)[O-],"SAYAMA,M, MORI,M, SHIROKAWA,T, INOUE,M, MIYAHARA,T AND KOZUKA,H,MUTAGENICITY OF 2,6-DINITROTOLUENE AND ITS METABOLITES, AND THEIR RELATEDCOMPOUNDS IN SALMONELLA TYPHIMURIUM, MUTAT. RES. 226(3):181-184, 1989"
+66-56-8,CCRIS,1,-1,,Oc1cccc(c1[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+111-44-4,EPA2,1,-1,,ClCCOCCCl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+64201-68-9,CCRIS,1,-1,,[O-][N+](=O)c1ccc(cc1)c2csc(NC=O)n2,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+2381-40-0,EPA1,1,-1,,Cc1ccc2c(C)c3ccc4ccccc4c3nc2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+24246-00-2,CCRIS,1,-1,,[O-][N+](=O)c1cccc2csnc12,"ZANI,F, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIES ON2,1-BENZISOTHIAZOLE DERIVATIVES II. EVALUATION OF ANTIMICROBIAL AND GENOTOXICPROPERTIES OF BZ-NITRO-, 3-ETHYLACETATE-, 3-AMINO- AND 3-SUBSTITUTED AMINO2,1-BENZISOTHIAZOLES, FARMACO 49(11):713-719, 1994"
+616-69-3,CCRIS,0,-1,,Cc1cc(cc(c1C)[N+](=O)[O-])[N+](=O)[O-],"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+78-89-7,CCRIS,1,-1,,CC(Cl)CO,"ROSENKRANZ,HS, WLODKOWSKI,TJ AND BODINE,SR,CHLOROPROPANOL, A MUTAGENICRESIDUE RESULTING FROM PROPYLENE OXIDE STERILIZATION, MUTAT. RES. 30(2):303-304,1975"
+111467-88-0,CCRIS,1,-1,,CC\C=C\C=C\C=C\C=C\C=C\OC,"PETERS,JH, RICCIO,ES, STEWART,KR AND REIST,EJ, MUTAGENIC ACTIVITIES OFFECAPENTAENE DERIVATIVES"
+91540-29-3,CCRIS,1,-1,,CCCCCN1C2C1c3ccccc3c4ccccc24,"GLATT,H, SHTELZER,S, SHERADSKY,T, BLUM,J AND OESCH,F, MUTAGENICITY OFN-SUBSTITUTED PHENANTHRENE 9,10-IMINES IN SALMONELLA TYPHIMURIUM AND CHINESEHAMSTER V-79 CELLS,ENVIRON. MUTAGEN. 8(6):829-837, 1986"
+61734-89-2,EPA3,1,-1,,CCCCN(CCC(=O)C)N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+40568-90-9,EPA1,1,-1,,Cc1ccc2ccc3cc4ccccc4c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+114656-95-0,EPA1,1,-1,,COC1=CC(=O)c2[nH]c(C)c3c4ccccc4nc3c2C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+102859-52-9,CCRIS,1,-1,,[O-][N+](=O)C1=Cc2ccc3ccc4cccc5cc1c2c3c45,"GOLDRING,JM, BALL,LM, SANGAIAH,R AND GOLD,A, MUTAGENIC ACTIVITY OFNITRO-SUBSTITUTED CYCLOPENTA-FUSED POLYCYCLIC AROMATIC HYDROCARBONS TOWARDSSALMONELLA TYPHIMURIUM, MUTAT. RES. 187(2):67-77, 1987"
+158729-32-9,CCRIS,0,-1,,ONS(=O)(=O)c1cccc2cccnc12,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+55256-55-8,EPA1,1,-1,,COc1c2[C@@H]3C=CO[C@H]3Oc2cc4Oc5c(CCC(C)(C)O)ccc(O)c5C(=O)c14,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1758-68-5,EPA1,1,-1,,Nc1ccc2C(=O)c3ccccc3C(=O)c2c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7247-89-4,EPA3,1,-1,,C[C@@H]1CCCCN1N=O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+50-65-7,EPA1,1,-1,"NICLOSAMI,NICLOSAMO,NICLOSAPI",Oc1ccc(Cl)cc1C(=O)Nc2ccc(cc2Cl)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+39007-51-7,CCRIS,0,-1,,OCC1OC(C(O)C1O)n2cnc3c2ncn4ccnc34,"NEGISHI,K, OOHARA,K, URUSHIDANI,H, OHARA,Y AND HAYATSU,H, EVALUATIONOF THE MUTAGENICITY OF 1,N6-ETHENOADENINE- AND 3,N4-ETHENOCYTOSINE-NUCLEOSIDESIN SALMONELLA TYPHIMURIUM, IN: SINGER,B AND BARTSCH,H (EDS.), IARC SCIENTIFICPUBLICATIONS NO. 70, THE ROLE OF CYCLIC NUCLEIC ACID ADDUCTS IN CARCINOGENESISAND MUTAGENESIS, INTERNATIONAL AGENCY FOR RESEARCH ON CANCER, LYON, FRANCE,1986, PP. 293-297"
+95860-07-4,EPA1,0,-1,,Cc1ccc(cc1NO)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+29385-43-1,CCRIS,0,-1,,Cc1cccc2[nH]nnc12,"ZEIGER,E, ANDERSON,B, HAWORTH,S, LAWLOR,T AND MORTELMANS,K, SALMONELLAMUTAGENICITY TESTS: IV. RESULTS FROM THE TESTING OF 300 CHEMICALS, ENVIRON. MOL.MUTAGEN. 11(SUPPL.12):1-158, 1988"
+85060-01-1,CCRIS,0,-1,,CC(O)C(C)[N+](=O)[O-],"CONAWAY,CC, HUSSAIN,NS, WAY,BM AND FIALA,ES, EVALUATION OF SECONDARYNITROALKANES, THEIR NITRONATES, PRIMARY NITROALKANES, NITROCARBINOLS, AND OTHERALIPHATIC NITRO COMPOUNDS IN THE AMES SALMONELLA ASSAY, MUTAT. RES.261(3):197-207, 1991"
+108-22-5,EPA1,0,-1,,CC(=C)OC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103878-84-8,CCRIS,0,-1,"RO-196327",NCCNC(=O)c1ccc(Cl)cn1,"GOCKE,E, STROBEL,R, SHINDOH,H AND HORII,I, MUTAGENICITY STUDIES OFLAZABEMIDE, YAKURI TO CHIRYO 22(SUPPL. 11):S2825-S2847, 1994"
+64-75-5,EPA1,0,-1,,CN(C)[C@H]1[C@H]2C[C@H]3C(=C(O)[C@]2(O)C(=C(C(=O)N)C1=O)O)C(=O)c4c(O)cccc4[C@@]3(C)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+211-91-6,EPA1,1,-1,,C1=Cc2c3c1cccc3cc4ccc5ccccc5c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+28322-02-3,VITIC,1,-1,,CC(=O)Nc1cccc2Cc3ccccc3c12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+36059-21-9,VITIC,0,-1,,Cc1c(C)c(Br)c(Br)c(Br)c1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+109143-18-2,CCRIS,1,-1,,COc1ccc(N(CCCl)CCCl)c2oc(cc12)[N+](=O)[O-],"CASTELAIN,P, HENDRICKX,B, TROMELIN,A, DEMERSEMAN,P AND MOENS,W,MUTAGENIC ACTIVITY OF DICHLOROETHYLAMINO DERIVATIVES OF NITRONAPHTHOFURAN ANDSOME NITROBENZOFURANS IN THE SALMONELLA/MICROSOME ASSAY, MUTAT. RES.280(1):9-15, 1992"
+172374-57-1,CCRIS,1,-1,,CC(=O)Nc1ccc(Oc2ccc(NO)cc2)cc1,"GUPTA,RL, KAUR,IP AND JUNEJA,TR, GENOTOXICITY OF POTENTIAL METABOLITESOF NITROSCANATE- AN ANTISCHISTOSOMAL DRUG, MUTAT. RES. 335(3):235-243,1995"
+19200-30-7,CCRIS,0,-1,,CCN(CC)C(=S)SC1OC(CO)C(O)C(O)C1O,"LEE,BH, RYU,EK, LEE,S, KIM,KR, SHIM,SK, PARK,J AND RYU,JC,MUTAGENICITY STUDY OF DISULFIRAM DERIVATIVES IN SHORT TERM TESTS,KOREAN J.TOXICOL. 10(2):351-358, 1994"
+31335-69-0,EPA1,0,-1,,ON(C=O)c1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1191-41-9,EPA3,1,-1,"ETLINOLEN",CCOC(=O)CCCCCCC\C=C/C\C=C/C\C=C/CC,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+22316-47-8,EPA1,0,-1,"CLOBAZAM",CN1C(=O)CC(=O)N(c2ccccc2)c3cc(Cl)ccc13,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+57781-14-3,EPA1,0,1,,CC(=O)OCC(=O)[C@]1(CC[C@H]2[C@@H]3C[C@@H](F)C4=CC(=O)C(=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)Br)OC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+868-77-9,EPA1,0,-1,"HOETMETHA,DR9510529",CC(=C)C(=O)OCCO,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+86247-86-1,CCRIS,0,-1,"DENITRONI",CC(C)NCC(O)COc1cccc2CC(O)COc12,"HATTORI,Y, NAGOYA,T, KOSHI,T AND ODA,T, MUTAGENICITY TESTS OFNIPRADILOL (K-351), OYO YAKURI 30(2):293-298, 1985"
+7481-89-2,EPA3,1,-1,,NC1=NC(=O)N(C=C1)[C@@H]2CC[C@H](CO)O2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+22868-29-7,CCRIS,0,-1,,Clc1cccc(c1)c2oc3ccccc3n2,"UCUCU,U, ISIKDAG,I, GUENDOGDU,N AND MERCANGOZ,A, SYNTHESIS OF SOME2-ARYL-BENZOXAZOLE DERIVATIVES AND INVESTIGATION OF THEIR MUTAGENICITY, J. FAC.PHARM. GAZI UNIV. 12(2):165-172, 1995"
+591-27-5,VITIC,1,-1,"AMINOPHEM",Nc1cccc(O)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+515-46-8,CCRIS,1,-1,,CCOS(=O)(=O)c1ccccc1,"GLOWIENKE,S, FRIAUFF,W, ALLMENDINGER,T, MARTUS,HJ, SUTER,W ANDMUELLER,L, STRUCTURE-ACTIVITY CONSIDERATIONS AND IN VITRO APPROACHES TO ASSESSTHE GENOTOXICTY OF 19 METHANE-, BENZENE- AND TOLUENESULFONIC ACID ESTERS, MUTAT.RES. 581(1-2):23-34, 2005"
+6471-49-4,EPA2,1,-1,,COc1ccc(cc1N=Nc2c(O)c(cc3ccccc23)C(=O)Nc4cccc(c4)[N+](=O)[O-])[N+](=O)[O-],"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+163275-59-0,CCRIS,1,-1,,Fc1cc2cccnc2c3ccccc13,"SAEKI,KI, KAWAI,H, KAWAZOE,Y AND HAKURA,A, DUAL STIMULATORY ANDINHIBITORY EFFECTS OF FLUORINE-SUBSTITUTION ON MUTAGENICITY: AND EXTENSION OFTHE ENAMINE EPOXIDE THEORY FOR ACTIVATION OF THE QUINOLINE NUCLEUS, BIOL. PHARM.BULL. 20(6):646-650, 1997"
+NOCAS_M5,EPA1,1,-1,,N\N=C\1/N=NC=C2C=CC=C[C@H]12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+88-88-0,VITIC,1,-1,,[O-][N+](=O)c1cc(c(Cl)c(c1)[N+](=O)[O-])[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78-78-4,VITIC,0,-1,,CCC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+120143-20-6,CCRIS,1,-1,,NC(CCN=[N+]=[N-])C(=O)O,"MANGOLD,JB, MISCHKE,MR AND LAVELLE,JM, AZIDOALANINE MUTAGENICITY INSALMONELLA: EFFECT OF HOMOLOGATION AND ALPHA-METHYL SUBSTITUTION, MUTAT. RES.216(1):27-33, 1989"
+53956-04-0,CCRIS,0,-1,,CC1(C)C(CCC2(C)C1CCC3(C)C2C(=O)C=C4C5CC(C)(CCC5(C)CCC34C)C(=O)O)OC6OC(C(O)C(O)C6OC7OC(C(O)C(O)C7O)C(=O)O)C(=O)O,"PRIVAL,MJ, SIMMON,VF AND MORTELMANS,KE, BACTERIAL MUTAGENICITY TESTINGOF 49 FOOD INGREDIENTS GIVES VERY FEW POSITIVE RESULTS, MUTAT. RES.260(4):321-329, 1991"
+162022-88-0,CCRIS,1,-1,,NNc1nncc2cnccc12,"MORITA,T, NAITOU,H AND OISHI,E, MUTAGENICITY OF CONDENSED PYRIDAZINESWITH DIFFERENT SUBSTITUENTS, BIOL. PHARM. BULL. 18(2):363-367, 1995"
+99-65-0,VITIC,1,-1,,[O-][N+](=O)c1cccc(c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+82-45-1,VITIC,1,-1,,Nc1cccc2C(=O)c3ccccc3C(=O)c12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106532-76-7,CCRIS,1,-1,,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccccc3[N+](=O)[O-])\c2c1)C(=O)c4ccccc4[N+](=O)[O-],"ZANI,F, MASSIMO,G, COGHI,E, BELLOTTI,A AND MAZZA,P, BIOLOGICAL STUDIESON 2,1-BENZISOTHIAZOLE DERIVATIVES. I. EVALUATION OF ANTIBACTERIAL, ANTIFUNGALAND GENOTOXIC ACTIVITIES OF 1-ACYL-3-ACYLIMINO-2,1-BENZISOTHIAZOLINES, FARMACO45(11):1219-1228, 1990"
+21466-07-9,EPA1,0,-1,"BROMOPHEN",Oc1c(Br)cc(Br)cc1c2cc(Br)cc(Br)c2OP(=O)(O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51787-42-9,EPA1,1,-1,,Cc1cc(C)c2nc3c(ccc4ccccc34)c(C)c2c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+NOCAS_M512,EPA1,0,-1,,CCCC[C@@H](CC)COC(=O)C(=C(c1ccccc1)c2ccccc2)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59405-70-8,CCRIS,1,-1,,COc1ccc(cn1)N=Nc2ccc(cc2)N(C)C,"SHAHIN,MM, MUTAGENICITY OF STRUCTURALLY RELATED PHENYLAZO-3-PYRIDINESIN SALMONELLA TYPHIMURIUM, CELL BIOL. TOXICOL. 9(1):33-47, 1993"
+23702-49-0,EPA1,0,-1,,O=C1Oc2cccc3ccc4cccc1c4c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2150-55-2,EPA3,0,-1,,NC1=N[C@@H](CS1)C(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+709-49-9,CCRIS,1,-1,,[O-][N+](=O)c1ccc(I)c(c1)[N+](=O)[O-],"GUPTA,RL, SAINI,BHK AND JUNEJA,TR, NITROREDUCTASE INDEPENDENTMUTAGENICITY OF 1-HALOGENATED-2,4-DINITROBENZENES, MUTAT. RES. 381(1):41-47,1997"
+115689-52-6,CCRIS,1,-1,,Nc1nc2c(CCc3ncccc23)s1,"KROPKO,ML, JAEN,JC, THEISS,JC, WOLD,S, CAPRATHE,BW AND WISE,LD,CHEMICAL PURITY AND MUTAGENICITY: CASE STUDY OF A DRUG IN DEVELOPMENT, MUTAT.RES. 281(4):233-238, 1992"
+2835-97-4,EPA1,0,-1,,Cc1cccc(O)c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+92758-43-5,EPA1,1,-1,,Nc1ccc2ccc3cc4ccccc4c5ccc1c2c35,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+142741-09-1,CCRIS,1,-1,,[O-][N+](=O)c1cc(c2[nH]c3cnc(cc3c2c1)[N+](=O)[O-])[N+](=O)[O-],"SALVI,NA, CHOUGHULEY,ASU, SHETTY,TK AND BHATTACHARYA,RK,NITROPYRIDOINDOLES. FORMATION, CHARACTERIZATION AND MUTAGENICITY, TOXICOL.ENVIRON. CHEM. 34(2-4): 123-131, 1992"
+112-27-6,VITIC,1,-1,"TRIETHGLY",OCCOCCOCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1806-54-8,VITIC,0,-1,,CCCCCCCCOP(=O)(OCCCCCCCC)OCCCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+119-06-2,VITIC,0,-1,,CCCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+142-78-9,VITIC,0,-1,,CCCCCCCCCCCC(=O)NCCO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+514-10-3,CCRIS,0,-1,,CC(C)C1=CC2=CCC3C(C)(CCCC3(C)C(=O)O)C2CC1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+63104-32-5,EPA1,1,-1,,Cc1cccc2cc3ccc4cccc5ccc(c12)c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+621-90-9,EPA1,1,-1,,CNc1ccc(cc1)N=Nc2ccccc2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155379-83-2,CCRIS,1,-1,,Cc1cc(N)c(C)c(c1N)[N+](=O)[O-],"SHAHIN,MM, STRUCTURE-ACTIVITY RELATIONSHIPS WITHIN VARIOUS SERIES OFP-PHENYLENEDIAMINE DERIVATIVES, MUTAT. RES. 307(1):83-93, 1994"
+150-68-5,VITIC,0,-1,"MONURON",CN(C)C(=O)Nc1ccc(Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M329,EPA1,0,-1,"ISOSORBDI",[O-][N+](=O)O[C@H]1CO[C@@H]2[C@@H](CO[C@H]12)O[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+87679-37-6,CCRIS,0,-1,,CCOC(=O)C(CCc1ccccc1)NC(C)C(=O)N2C3CCCCC3CC2C(=O)O,"ARUGA,F, NAGASAWA,Y, TANAKA,R AND ISHIHARA,R, REVERSE MUTATION TEST OFTRANDOLAPRIL (RU44570) WITH BACTERIA, J. TOXICOL. SCI. 18(SUPPL. 1):177-181,1993"
+72-54-8,VITIC,0,-1,"DDD",ClC(Cl)C(c1ccc(Cl)cc1)c2ccc(Cl)cc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M431,EPA1,0,-1,,C(C(C1CCCCC1)C2CCCCC2)[C@H]3CCCCN3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+15743-13-2,EPA1,0,-1,,ClC1=C(Cl)C(=O)C(Cl)(Cl)C1=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103124-60-3,CCRIS,0,-1,,CCOC(=O)C(=NNc1ccc(cc1Cl)c2ccc(NN=C(C(=O)OCC)C(=O)OCC)c(Cl)c2)C(=O)OCC,"DE FRANCE,BF, CARTER,MH AND JOSEPHY,PD, COMPARATIVE METABOLISM ANDMUTAGENICITY OF AZO AND HYDRAZONE DYES IN THE AMES TEST, FOOD CHEM. TOXICOL.24(2):165-169, 1986"
+838-95-9,CCRIS,1,-1,,CN(C)c1ccc(\C=C\c2ccccc2)cc1,"SHORT-TERM TEST PROGRAM SPONSORED BY THE DIVISION OF CANCER BIOLOGY,NATIONAL CANCER INSTITUTE, MS. ELLEN ZAIKA, ASSISTANT PROJECT   OFFICER , p.Y84"
+118430-74-3,VITIC,1,-1,,Cn1nc(cc1N)C2CC2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7085-19-0,EPA1,0,-1,,C[C@@H](Oc1ccc(Cl)cc1C)C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+54897-62-0,CCRIS,1,-1,,CCN(CCCCO)N=O,"RINKUS,SJ AND LEGATOR,MS, CHEMICAL CHARACTERIZATION OF 465 KNOWN ORSUSPECTED CARCINOGENS AND THEIR CORRELATION WITH MUTAGENIC ACTIVITY IN THESALMONELLA TYPHIMURIUM SYSTEM, CANCER RES. 39:3289-3318, 1979 & SUGIMURA,T,SATO,S, NAGAO,M, YAHAGI,T, MATSUSHIMA,T, SEINO,Y, TAKEUCHI,M AND KAWAC HI,T,OVERLAPPING OF CARCINOGENS AND MUTAGENS, IN: MAGEE,PN, TAKAYAMA,S, SUGIMURA,TAND MATSUSHIMA,T (EDS.), FUNDAMENTALS IN CANCER PREVENTION, UNIVERSITY PARKPRESS, BALTIMORE, MARYLAND, 1976, PP. 191-215"
+968-81-0,VITIC,0,-1,"ACETOHEXA",CC(=O)c1ccc(cc1)S(=O)(=O)NC(=O)NC2CCCCC2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+NOCAS_M203,EPA1,1,-1,,[O-][N+](=O)c1ccc2[C@H]3O[C@H]3c4cccc5c6ccccc6c1c2c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7085-85-0,VITIC,0,-1,"POLYETCYA",CCOC(=O)C(=C)C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+33389-36-5,CCRIS,1,-1,,OCCNc1nc(nc2ccccc12)c3ccc(s3)[N+](=O)[O-],"MCCANN,J, CHOI,E, YAMASAKI,E AND AMES,BN, DETECTION OF CARCINOGENS ASMUTAGENS IN THE SALMONELLA/MICROSOME TEST: ASSAY OF 300 CHEMICALS, PROC. NATL.ACAD. SCI. USA 72(12):5135-5139, 1975"
+60259-80-5,CCRIS,1,-1,,Cc1ccc(NN=NCc2ccc(cc2)[N+](=O)[O-])cc1,"AZUMA,S, KISHINO,S, KATAYAMA,S, AKAHORI,Y AND MATSUSHITA,H,MUTAGENICITY OF 12 HPLC LABELING REAGENTS FOR ANALYZING CARBOXYL COMPOUNDS,KANKYO KAGAKU 7(2):249-255, 1997"
+693-13-0,VITIC,0,-1,,CC(C)N=C=NC(C)C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7570-36-7,EPA1,1,-1,,Nc1ccc(\C=C\c2ccc(Cl)cc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90-30-2,VITIC,0,-1,,N(c1ccccc1)c2cccc3ccccc23,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+24316-91-4,EPA3,1,-1,,NC(=O)c1[nH]cnc1[N+]#N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+2461-42-9,CCRIS,1,-1,,C(Oc1cccc2ccccc12)C3CO3,"ROSMAN,LB, CHAKRABORTY,PK, MESSERLY,EA AND SINSHEIMER,JE, MUTAGENICITYOF AROMATIC GLYCIDYL ETHERS WITH SALMONELLA, MUTAT. RES. 206(1):115-125,1988"
+99007-32-6,CCRIS,0,-1,,Cc1ccc(cc1S(=O)(=O)O)N=Nc2c(O)ccc3ccccc23,"MIYAGOSHI,M, HAYAKAWA,Y, NAGATA,M AND NAGAYAMA,T, ANALYSIS OF THESUBSIDIARY DYES OF LITHOL RUBINE B AND THEIR MUTAGENICITIES, EISEI KAGAKU36(2):133-138, 1990"
+102234-07-1,EPA1,1,-1,,O=C1NC2(CCCCC2)C(=O)N1CCN3CC3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+119239-63-3,CCRIS,0,-1,,OC1C2OC2c3c(ccc4ncccc34)C1O,"KUMAR,S, SIKKA,HC, DUBEY,SK, CZECH,A, GEDDIE,N, WANG,CX AND LAVOIE,EJ,MUTAGENICITY AND TUMORIGENICITY OF DIHYDRODIOLS, DIOL EPOXIDES, AND OTHERDERIVATIVES OF BENZO[F]QUINOLINE AND BENZO[H]QUINOLINE, CANCER RES. 49(1):20-24,1989"
+NOCAS_M210,EPA1,1,-1,,OC[C@H](O)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+18296-44-1,EPA1,1,-1,"VALTRATE",CC(C)CC(=O)O[C@@H]1OC=C(COC(=O)C)C2=C[C@H](OC(=O)CC(C)C)[C@]3(CO3)[C@@H]12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+13608-87-2,VITIC,1,-1,,CC(=O)c1ccc(Cl)c(Cl)c1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+1622-57-7,EPA1,1,-1,,Cn1c(N)nc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26676-89-1,CCRIS,0,-1,,OC1COC2(O)C1OC(=O)C2(O)Cc3c[nH]c4ccccc34,"MUSK,SRR, PREOBRAZHENSKAYA,MN, BELITSKY,GA, KOROLEV,AM, LYTCHEVA,TA,KHITROVO, IA AND JOHNSON,IT, THE CLASTOGENIC AND MUTAGENIC EFFECTS OF ASCORBIGENAND 1'-METHYLASCORBIGEN, MUTAT. RES. 323(1-2):69-74, 1994"
+201-06-9,EPA1,1,-1,,C1=Cc2cc3ccccc3c4cccc1c24,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+120-57-0,VITIC,0,-1,"PIPERONAL",O=Cc1ccc2OCOc2c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+23740-25-2,EPA1,1,-1,"LANUGINOS",COc1ccc2c(c1)C(=O)c3nccc4cc5OCOc5c2c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+59405-62-8,CCRIS,0,-1,,CN(C)c1ccc(N=Nc2cccnc2)c(NC(=O)C)c1,"SHAHIN,MM, MUTAGENICITY OF STRUCTURALLY RELATED PHENYLAZO-3-PYRIDINESIN SALMONELLA TYPHIMURIUM, CELL BIOL. TOXICOL. 9(1):33-47, 1993"
+1172-18-5,VITIC,0,-1,"FLURAZEPA,FAZEPAHCL",CCN(CC)CCN1C(=O)CN=C(c2ccccc2F)c3cc(Cl)ccc13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+17696-11-6,VITIC,1,-1,,OC(=O)CCCCCCCBr,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+448-97-5,EPA1,1,-1,,Nc1ccc(cc1F)c2ccc(N)c(F)c2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+133-18-6,VITIC,0,-1,,Nc1ccccc1C(=O)OCCc2ccccc2,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+17418-58-5,VITIC,1,-1,,Nc1c(Oc2ccccc2)cc(O)c3C(=O)c4ccccc4C(=O)c13,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3118-97-6,EPA1,1,-1,"SUDAN-2",Cc1ccc(N=Nc2c(O)ccc3ccccc23)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+21247-98-3,EPA1,1,-1,,OCc1c2ccccc2c3ccc4cccc5ccc1c3c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98601-00-4,CCRIS,1,-1,,Cc1cc2ccccc2c3cc4C=CC(O)C(O)c4cc13,"MUSHTAQ,M, FU,PP, MILLER,DW AND YANG,SK, METABOLISM OF6-METHYLBENZ[A]ANTHRACENE BY RAT LIVER MICROSOMES AND MUTAGENICITY OFMETABOLITES, CANCER RES. 45(9): 4006-4014, 1985"
+4559-64-2,EPA1,1,-1,,Nc1cc2nc3ccc(Cl)cc3nc2cc1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+14047-09-7,CCRIS,0,-1,,Clc1ccc(cc1Cl)N=Nc2ccc(Cl)c(Cl)c2,"MCMILLAN,DC, SHADDOCK,JG, HEFLICH,RH, CASCIANO,DA AND HINSON,JA,EVALUATION OF PROPANIL AND ITS N-OXIDIZED DERIVATIVES FOR GENOTOXICITY IN THESALMONELLA TYPHIMURIUM REVERSION, CHINESE HAMSTER OVARY/HYPOXANTHINE GUANINEPHOSPHORIBOSYL TRANSFERASE, AND RAT HEPATOCYTE/DNA REPAIR ASSAYS, FUNDAM. APPL.TOXICOL. 11(3): 429-439, 1988"
+148193-31-1,EPA1,1,-1,,Nc1cccc2c(Cl)nsc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5234-06-0,CCRIS,1,-1,,C(Oc1ccc2ccccc2c1)C3CO3,"ROSMAN,LB, CHAKRABORTY,PK, MESSERLY,EA AND SINSHEIMER,JE, MUTAGENICITYOF AROMATIC GLYCIDYL ETHERS WITH SALMONELLA, MUTAT. RES. 206(1):115-125,1988"
+23834-30-2,CCRIS,1,-1,,CN(C)CCN(C)N=O,"LIJINSKY,W, KOVATCH,RM AND SAAVEDRA,JE, CARCINOGENESIS AND MUTAGENESISBY N- NITROSO COMPOUNDS HAVING A BASIC CENTER, CANCER LETT. 63(2):101-107,1992"
+2851-80-1,EPA1,0,-1,,Cc1ccc2c(Cc3cc(C)ccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+93-58-3,VITIC,0,-1,"MEBENZOAT",COC(=O)c1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+98736-48-2,CCRIS,1,-1,,CN(Cc1cccc(c1)C(F)(F)F)N=O,"SINGER,GM, ANDREWS,AW AND GUO,SM, QUANTITATIVE STRUCTURE-ACTIVITYRELATIONSHIP OF THE MUTAGENICITY OF SUBSTITUTED N-NITROSO-N-BENZYLMETHYLAMINES:POSSIBLE IMPLICATIONS FOR CARCINOGENICITY, J. MED. CHEM. 29(1):40-44,1986"
+6334-18-5,EPA1,0,-1,,Clc1cccc(C=O)c1Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+150-69-6,VITIC,0,-1,"DULCIN",CCOc1ccc(NC(=O)N)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+22996-17-4,CCRIS,1,-1,,Nc1ccc(CO)c(c1)[N+](=O)[O-],"MORI,M, MIYAHARA,T, MOTO-O,K, FUKUKAWA,M, KOZUKA,H, MIYAGOSHI,M ANDNAGAYAMA,T, MUTAGENICITY OF URINARY METABOLITES OF 2,4-DINITROTOLUENE TOSALMONELLA TYPHIMURIUM, CHEM. PHARM. BULL. 33(10):4556-4563, 1985"
+53950-62-2,CCRIS,0,-1,,ON(C=O)c1ccc(Cl)c(Cl)c1,"MCMILLAN,DC, SHADDOCK,JG, HEFLICH,RH, CASCIANO,DA AND HINSON,JA,EVALUATION OF PROPANIL AND ITS N-OXIDIZED DERIVATIVES FOR GENOTOXICITY IN THESALMONELLA TYPHIMURIUM REVERSION, CHINESE HAMSTER OVARY/HYPOXANTHINE GUANINEPHOSPHORIBOSYL TRANSFERASE, AND RAT HEPATOCYTE/DNA REPAIR ASSAYS, FUNDAM. APPL.TOXICOL. 11(3): 429-439, 1988"
+4403-90-1,EPA3,1,-1,,Cc1ccc(Nc2ccc(N)c3C(=O)c4ccccc4C(=O)c23)c(c1)S(=O)(=O)O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+1732-29-2,EPA1,1,-1,,Oc1ccc2ccc3ccc(c4ccc1c2c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+96301-34-7,CCRIS,0,1,,CC1=CC(=O)C=C2CCC3C4CCC(=O)C4(C)CCC3C12C,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+133762-83-1,CCRIS,1,-1,,OC(CN=N#N)Cn1cnc2c(Cl)ncnc12,"GICHNER,T, HOLY,A, SPASSOVA,M, VELEMINSKY,J AND GRUZ,P, THEMUTAGENICITY OF AZIDO DERIVATIVES OF MONOSACCHARIDES AND ALCOHOLS AND OFN-(3-AZIDO-2- HYDROXYPROPYL) DERIVATIVES OF PURINES AND PYRIMIDINES INARABIDOPSIS THALIANA AND IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 6(1):55-58,1991"
+128-66-5,VITIC,0,-1,,O=C1c2ccccc2c3ccc4C(=O)c5ccccc5c6ccc1c3c46,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+160543-08-8,CCRIS,1,-1,,Cc1c2ccc(CO)cc2nc3c1ccc4ccccc34,"YE,Y, SCHARPING,CE AND HOLDER,GM, THE HEPATIC METABOLISM OF TWOCARCINOGENIC DIMETHYLBENZ[C]ACRIDINES IN CONTROL AND INDUCED RATS: THEDISTRIBUTION AND THE MUTAGENICITY OF METABOLITES, CARCINOGENESIS 16(4):787-793,1995"
+133591-38-5,EPA1,1,-1,,Cc1ccc(C)c2c3cc(ccc3[nH]c12)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+155164-68-4,CCRIS,0,-1,,COc1ccc(cc1)C(=O)N2N=CC(=C(Cl)C2=O)Cl,"CARMELLINO,ML, MASSOLINI,G, PAGANI,G, ZANI,F AND LERI,G, FUNGICIDALAND GENOTOXIC ACTIVITY OF NEW SUBSTITUTED PYRIDAZINONES, FARMACO48(10):1427-1438, 1993"
+69140-51-8,CCRIS,0,-1,,CCC1OC1c2ccccc2,"KRAEMER,A, PUDIL,J, FRANK,H, OESCH,F AND GLATT,H, SOME SUBSTRATES ANDINHIBITORS OF CYTOSOLIC EPOXIDE HYDROLASE INDUCE SISTER-CHROMATID EXCHANGES INMAMMALIAN CELLS, BUT DO NOT INDUCE GENE MUTATIONS IN SALMONELLA TYPHIMURIUM ANDV79 CELLS, MUTAT. RES. 290(2):165-174, 1993"
+101-73-5,VITIC,0,-1,,CC(C)Oc1ccc(Nc2ccccc2)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+111070-55-4,CCRIS,1,-1,,[O-][N+](=O)c1oc(\C=N\n2cccn2)cc1,"ALEJANDRE-DURAN,E, CLARAMUNT,RM, SANZ,D, VILAPLANA,MJ, MOLINA,P ANDPUEYO,C, STUDY ON THE MUTAGENICITY OF NIFURTIMOX AND EIGHT DERIVATIVES WITH THEL-ARABINOSE RESISTANCE TEST OF SALMONELLA TYPHIMURIUM, MUTAT. RES. 206(2):193-200, 1988"
+NOCAS_M163,EPA1,1,-1,,O[C@@H]1CC(=O)c2c(O)ccc3c4ccc(O)c5C(=O)CC[C@H](c45)[C@@]1(O)c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+107673-63-2,EPA1,1,-1,,[O-][N+](=O)C1=Cc2c3ccc4ccccc4c3cc5cccc1c25,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+102-32-9,EPA1,1,-1,"DOPAC",OC(=O)Cc1ccc(O)c(O)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1499-54-3,EPA3,1,-1,,ONC(=O)CNC(=O)c1ccccc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+6792-33-2,CCRIS,0,-1,"ACLAR",FC(=C(F)Cl)F,"GODIN,CS, MYHR,C, LAWLOR,TE, YOUNG,RR AND MURLI,H, GENOTOXICITYASSESSMENT OF CHLOROTRIFLUOROETHYLENE TETRAMER ACID USING A BATTERY OF IN VITROAND IN VIVO/IN VITRO ASSAYS, ARMSTRONG AEROSPACE MEDICAL RESEARCH LABORATORY,WRIGHT- PATTERSON AIR FORCE BASE, REPORT NO. AAMRL-TR-90-069, NTIS AD-A240492,1990"
+NOCAS_M567,EPA1,0,-1,,CN1[C@@H](CSCC(F)(F)F)Nc2cc(Cl)c(cc2S1(=O)=O)S(=O)(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91828-72-7,EPA1,1,-1,,O[C@@H]1C=Cc2c(ccc3c4ccccc4c(cc23)[N+](=O)[O-])[C@H]1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+103-34-4,CCRIS,0,-1,"DR0008045",C1CN(CCO1)SSN2CCOCC2,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+14385-22-9,CCRIS,1,-1,,CC(C)C(=O)N(O)c1ccc(Cl)cc1,"WEI,CI, COHEN,MD, SWARTZ,DD, FERNANDO,SY AND CORBETT,MD, MUTAGENICITYOF SOME MONOAROMATIC HYDROXAMIC ACIDS, TOXICOL. LETT. 24(1):111-116,1985"
+58139-47-2,EPA2,0,-1,,OCCN(CCO)c1nc(nc2ccccc12)c3cccs3,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+148317-76-4,CCRIS,0,-1,"ORACINE",OCCNCCN1C(=O)c2ccccc2C3=C1c4ccccc4C3=O,"MARHAN,J, MUTAGENICITY OF CYTOSTATIC DRUGS IN A BACTERIAL SYSTEM. I.AMES TEST, FOLIA MICROBIOL. 40(5):457-461, 1995"
+999-29-1,EPA1,1,-1,,CCOC(=O)CNC(=O)C=[N+]=[N-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3366-65-2,EPA1,1,-1,,Nc1ccc2c(ccc3ccccc23)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2386-90-5,EPA3,0,-1,,C1C[C@@H]2O[C@@H]2[C@H]1O[C@H]3CC[C@@H]4O[C@H]34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+139-59-3,EPA1,1,-1,,Nc1ccc(Oc2ccccc2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7209-38-3,CCRIS,0,-1,,NCCCN1CCN(CCCN)CC1,"JAPAN CHEMICAL INDUSTRY ECOLOGY- TOXICOLOGY AND INFORMATION    CENTER,JAPAN, MUTAGENICITY TEST DATA OF EXISTING    CHEMICAL SUBSTANCES BASED ON THETOXICITY INVESTIGATION OF    THE INDUSTRIAL SAFETY AND HEALTH LAW,1996"
+687-48-9,EPA1,1,-1,,CCOC(=O)N(C)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+554-14-3,EPA1,0,-1,"METHIOPH2",Cc1cccs1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+10026-04-7,CCRIS,0,-1,,Cl[Si](Cl)(Cl)Cl,"ISQUITH,A, MATHESON,D AND SLESINSKI,R, GENOTOXICITY STUDIES ONSELECTED ORGANOSILICON COMPOUNDS. IN VITRO ASSAYS, FOOD CHEM. TOXICOL.26(3):255-261, 1988"
+67-56-1,VITIC,0,-1,"METHANOL",CO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+320-51-4,EPA1,0,-1,,Nc1ccc(Cl)c(c1)C(F)(F)F,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115-07-1,VITIC,1,-1,,CC=C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+5343-65-7,EPA1,0,-1,,Cc1ccc(NC(=O)CBr)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1951-56-0,EPA3,1,-1,,CC(C)NC(=O)\C=C/c1oc(cc1)[N+](=O)[O-],"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+142713-65-3,CCRIS,1,-1,,COc1ccc(CNC(=O)C(C)Br)cc1OC,"DOLZANI,L, TAMARO,M, LAGATOLLA,C, MONTI-BRAGADIN,C, CAVICCHIONI,G,MARCHETTI,P AND D'ANGELI,F, STRUCTURE-ACTIVITY RELATIONSHIP IN THE MUTAGENICEFFECT OF CHIRAL OR RACEMIC 2-BROMOPROPANAMIDES ON SALMONELLA TYPHIMURIUM,ENVIRON. MOL. MUTAGEN. 19(4):311-315, 1992"
+93673-39-3,EPA1,1,-1,,Oc1cccc2c1ccc3c4C=Cc5cccc(cc23)c45,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+108342-09-2,EPA1,1,-1,,N[C@H](CN=[N+]=[N-])C(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+78859-43-5,CCRIS,1,-1,"BUDRALAZI",CC(=C\C(=N\Nc1nncc2ccccc12)\C)C,"KITAMURA,J, MORI,H, SUGIE,S AND KAWAI,K, GENETIC TOXICITY OF SEVERALANTIHYPERTENSIVE DRUGS POSSESSING A HYDRAZINE GROUP, RES. COMMUN. CHEM. PATHOL.PHARMACOL. 49(3):415-422, 1985"
+58337-49-8,CCRIS,1,-1,,CC(=O)NC(CSCCCl)C(=O)O,"HUMPHREYS,WG, KIM,DH, CMARIK,JL, SHIMADA,T AND GUENGERICH,FP,COMPARISON OF THE DNA-ALKYLATING PROPERTIES AND MUTAGENIC RESPONSES OF A SERIESOF S-(2-HALOETHYL)-SUBSTITUTED CYSTEINE AND GLUTATHIONE DERIVATIVES,BIOCHEMISTRY 29(45):10342-10350, 1990"
+22506-53-2,EPA1,1,-1,,[O-][N+](=O)c1ccc2c(c1)c3ccc(c4cccc2c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+4568-28-9,VITIC,0,-1,"ALSTEARAT,CASTEARAT,CHOLINSTE,CHOLISSAL,CUSTEARAT,MGSTEARAT,DR9500288,NASTEARAT,STEARATE,STEARTROL,ZNSTEARAT",CCCCCCCCCCCCCCCCCC(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+100-32-3,EPA3,1,-1,,[O-][N+](=O)c1ccc(SSc2ccc(cc2)[N+](=O)[O-])cc1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+3208-16-0,EPA1,0,-1,,CCc1occc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+111959-96-7,CCRIS,1,-1,,ClC(=C(Cl)\C(=C(/Cl)\SCc1ccccc1)\Cl)Cl,"VAMVAKAS,S, DEKANT,W AND ANDERS,MW, MUTAGENICITY OF BENZYL S-HALOALKYLAND S-HALOALKENYL SULFIDES IN THE AMES TEST, BIOCHEM. PHARMACOL. 38(6):935-939,1989"
+10285-07-1,CCRIS,0,-1,,CC(C)C(O)(C(C)O)C(=O)OCC1=CCN2CCC(O)C12,"YAMANAKA,H NAGAO,M AND SUGIMURA,T, MUTAGENICITY OF PYRROLIZIDINEALKALOIDS IN THE SALMONELLA/MAMMALIAN-MICROSOME TEST, MUTAT. RES. 68(3):211-216,1979"
+93-46-9,VITIC,1,-1,,N(c1ccc(Nc2ccc3ccccc3c2)cc1)c4ccc5ccccc5c4,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2698-41-1,EPA2,1,-1,"CSGAS",Clc1ccccc1C=C(C#N)C#N,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+27730-00-3,CCRIS,0,-1,,Brc1ccc(cc1)C2OC2C(=O)c3ccccc3,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+27046-19-1,CCRIS,1,-1,"KETOCYCL4",ClCCN(CCCl)P1(=O)NC(=O)CCO1,"WINCKLER,K, OBE,G, MADLE,S AND NAU,H, MUTAGENIC ACTIVITIES OFCYCLOPHOSPHAMIDE (NSC-26271) AND ITS MAIN METABOLITES IN SALMONELLA TYPHIMURIUM,HUMAN PERIPHERAL LYMPHOCYTES AND CHINESE HAMSTER OVARY CELLS, MUTAT. RES.129(1):47-55, 1984"
+93-52-7,CCRIS,1,-1,,BrCC(Br)c1ccccc1,"ZOETEMELK,CEM, MOHN,GR, VAN DER GEN,A AND BREIMER,DD, 1,2-DIBROMOCOMPOUNDS. THEIR MUTAGENICITY IN SALMONELLA STRAINS DIFFERING IN GLUTATHIONECONTENT AND THEIR ALKYLATING POTENTIAL, BIOCHEM. PHARMACOL. 36(11):1829-1835,1987"
+17455-21-9,CCRIS,0,-1,,C1CCC2OCCOCCOC3CCCCC3OCCOCCOCCOC2C1,"ARENAZ,P, BITTICKS,L, PANNELL,K AND GARCIA,S, GENOTOXIC POTENTIAL OFCROWN ETHERS IN SALMONELLA TYPHIMURIUM, MUTAGENESIS 4(6), 437-8, 1989"
+81-15-2,CCRIS,0,-1,,Cc1c(c(C)c(c(c1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-])[N+](=O)[O-],"NAIR,J, OHSHIMA,H, MALAVEILLE,C, FRIESEN,M, O'NEILL,IK, HAUTEFEUILLE,AAND BARTSCH,H, IDENTIFICATION, OCCURRENCE AND MUTAGENICITY IN SALMONELLATYPHIMURIUM OF TWO SYNTHETIC NITROARENES, MUSK AMBRETTE AND MUSK XYLENE, ININDIAN CHEWING TOBACCO AND BETEL QUID, FOOD CHEM. TOXICOL. 24(1):27-31,1986"
+3102-87-2,EPA1,0,-1,"DIAMDUROL",Cc1c(C)c(N)c(C)c(C)c1N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+288-32-4,EPA1,0,-1,"ACIZOLE,COBAZOLE,IMIDAZOLE,KP-418",c1c[nH]cn1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+158729-20-5,CCRIS,0,-1,,Cc1ccccc1NS(=O)(=O)c2cccc3cccnc23,"ZANI,F AND CARMELLINO,ML, ANTIMICROBIAL AND GENOTOXIC PROPERTIES OFQUINOLINE DERIVATIVES, BOLL. CHIM. FARM. 133(5):328-338, 1994"
+2564-65-0,EPA1,1,-1,,OCc1c2ccccc2c(CO)c3c1ccc4ccccc34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+5000-65-7,EPA1,0,-1,,COc1cccc(c1)C(=O)CBr,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+68688-86-8,EPA3,1,-1,,Cc1ccc2cc3c4[C@H](O)[C@H](O)C=Cc4ccc3c5CCc1c25,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+155014-06-5,CCRIS,1,-1,,CC(=O)Nc1cccc2cc(F)cnc12,"SAEKI,K, KAMIYA,M, SENGOKU,Y, TAKAHASHI,K AND KAWAZOE,Y, MUTAGENICITYOF FLUORINE-SUBSTITUTED AMINOQUINOLINES, HEN'IGENSEI SHIKEN 2(4):234-238,1993"
+79305-82-1,EPA1,1,-1,,Nc1ccc(\C=C\c2cccc(N)c2)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+90147-21-0,CCRIS,1,-1,,CC(C)OC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+83-72-7,VITIC,1,-1,"LANSONENA,LAWSONE",OC1=CC(=O)C(=O)c2ccccc12,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+4080-31-3,EPA3,1,-1,,Cl\C=C/C[N+]12CN3CN(CN(C3)C1)C2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+96-98-0,VITIC,1,-1,,Cc1ccc(cc1[N+](=O)[O-])C(=O)O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+43000-65-3,EPA1,1,-1,,C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](CC[C@]34C)OC(=O)Cc5ccc(cc5)N(CCCl)CCCl)[C@@H]1CCC(=O)N2,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+2592-95-2,EPA1,0,-1,"DR9808199",On1nnc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+85-22-3,VITIC,0,-1,,CCc1c(Br)c(Br)c(Br)c(Br)c1Br,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+106-51-4,VITIC,0,-1,"BENZOQUIN",O=C1C=CC(=O)C=C1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7782-50-5,EPA2,0,-1,"CHLORINE",ClCl,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+90-15-3,EPA3,0,-1,"NAPHTHOLA",Oc1cccc2ccccc12,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+2589-39-1,EPA1,1,-1,,Cc1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+67910-07-0,EPA1,1,-1,"HOMOBALDR",CC(C)CC(=O)OCc1cocc2c(C=O)ccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+151378-32-4,EPA1,1,-1,,O[C@@H]1[C@@H](O)c2cccc3c4c(ccc5ccccc45)[C@]6(O[C@H]16)c23,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51-03-6,VITIC,0,-1,"PIPERONYL",CCCCOCCOCCOCc1cc2OCOc2cc1CCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+563-04-2,VITIC,0,-1,,Cc1cccc(OP(=O)(Oc2cccc(C)c2)Oc3cccc(C)c3)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3228-99-7,EPA1,0,-1,,ClCC(CCl)(CCl)CCl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+125847-45-2,CCRIS,0,-1,,OC1C=Cc2ccc3c4ccccc4sc3c2C1O,"MISRA,B AND AMIN,S, SYNTHESIS AND MUTAGENICITY OF TRANS-DIHYDRODIOLMETABOLITES OF BENZO[B]NAPHTHO[2,1-D]THIOPHENE, CHEM. RES. TOXICOL. 3(2):93-97,1990"
+100-43-6,EPA1,0,-1,,C=Cc1ccncc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+26638-28-8,VITIC,0,-1,,CCCCCCCCC(Cl)CCC(Cl)CC(Cl)C(Cl)C(Cl)CC(=O)OC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+2255-17-6,EPA1,1,-1,,COP(=O)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51-02-5,EPA2,0,-1,"PRONETALO,PRONETHCL",CC(C)NCC(O)c1ccc2ccccc2c1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+3114-70-3,CCRIS,0,-1,,N[C@@H]1CC[C@@H](N)CC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+7269-57-0,EPA1,1,-1,,Nc1nc(NO)c2[nH]cnc2n1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51640-90-5,CCRIS,1,-1,,[O-][N+](=O)c1cccc2c1OC(=O)c3ccccc23,"WATANABE,T, KOHAN,MJ, WALSH,D, BALL,LM, DEMARINI,DM AND LEWTAS,J,MUTAGENICITY OF NITRODIBENZOPYRANONES IN THE SALMONELLA PLATE-INCORPORATION ANDMICROSUSPENSION ASSAYS, MUTAT. RES. 345(1,2):1-9, 1995"
+2385-85-5,EPA1,0,-1,,ClC1(Cl)[C@@]2(Cl)[C@]3(Cl)[C@@]4(Cl)C(Cl)(Cl)[C@]5(Cl)[C@@](Cl)([C@@]1(Cl)[C@]35Cl)[C@@]24Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+19246-18-5,CCRIS,1,-1,,NC(CS)C(=O)NCC(=O)O,"STARK,AA, ARAD,A, SISKINDOVICH,S, PAGANO,DA AND ZEIGER,E, EFFECT OF PHON MUTAGENESIS BY THIOLS IN SALMONELLA TYPHIMURIUM TA102, MUTAT. RES.224(1):89-94, 1989"
+104671-59-2,EPA1,1,-1,,CNC(=O)ONC(=O)C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+578-46-1,VITIC,0,-1,,Cc1ccc(c(N)c1)[N+](=O)[O-],"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78400-41-6,CCRIS,1,-1,,Cc1ccc2cc3c4ccccc4C5NC5c3c6CCc1c26,"GLATT,H, LUDEWIG,G, PLATT,KL, WAECHTER,F, YONA,I, BEN-SHOSHAN,S,JERUSHALMY, P, BLUM,J AND OESCH,F, ARENE IMINES, A NEW CLASS OF EXCEPTIONALLYPOTENT MUTAGENS IN BACTERIAL AND MAMMALIAN CELLS, CANCER RES. 45(6):2600-2607,1985"
+394-70-7,EPA1,1,-1,,Fc1ccnc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+479-50-5,EPA1,1,-1,"LUCANTHON,LUCANTHCL",CCN(CC)CCNc1ccc(C)c2Sc3ccccc3C(=O)c12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+576-26-1,VITIC,0,-1,"DIMEPHE26",Cc1cccc(C)c1O,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+109-87-5,VITIC,0,-1,"METHYLAL",COCOC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+145531-23-3,CCRIS,1,-1,,NCCCS(=O)(=O)Nc1ccc(Nc2c3ccc(cc3nc4cc(ccc24)N=N#N)N=N#N)cc1,"IWAMOTO,Y, FERGUSON,LR, POGAI,HB, UZUHASHI,T, KURITA,A, YANGIHARA,YAND DENNY, WA, MUTAGENIC ACTIVITIES OF AZIDO ANALOGS OF AMSACRINE AND OTHER9-ANILINOACRIDINES IN SALMONELLA TYPHIMURIUM AND THEIR ENHANCEMENT BYPHOTOIRRADIATION, MUTAT. RES. 280(4):233-244, 1992"
+105427-04-1,CCRIS,0,-1,,CCOC(=O)CNC(=O)C(C)(C)Br,"DOLZANI,L, TAMARO,M, MONTI-BRAGADIN,C, CAVICCHIONI,G, VECCHIATI,G ANDD'ANGELI,F, SELECTIVE MUTAGENIC ACTIVITY OF 2-BROMO-PROPANAMIDES ON SALMONELLATYPHIMURIUM, MUTAT. RES. 172(1):29-36, 1986"
+123-33-1,EPA2,0,-1,,Oc1ccc(O)nn1,"HELMA, C, CRAMER, T, KRAMER, S, AND DE RAEDT, L, DATA MINING AND MACHINE LEARNING TECHNIQUES FOR THE IDENTIFICATION OF MUTAGENICITY INDUCING SUBSTRUCTURES AND STRUCTURE ACTIVITY RELATIONSHIPS OF NONCONGENERIC COMPOUNDS. J. CHEM. INF. COMPUT. SCI. 44: 1402-1411, 2004"
+87-59-2,VITIC,1,-1,,Cc1cccc(N)c1C,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+577-71-9,EPA1,1,-1,,Oc1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+529-19-1,VITIC,0,-1,,Cc1ccccc1C#N,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+140-67-0,VITIC,0,-1,"ESTRAGOLE",COc1ccc(CC=C)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+54083-22-6,EPA1,1,-1,,COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)\C(=N\NC(=O)c6ccccc6)\C,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+3778-76-5,EPA1,1,-1,"KB-1,TODRALHCL",CCOC(=O)NNc1nncc2ccccc12,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+91182-09-1,CCRIS,1,-1,,CCCCNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],"STURDIK,E, ROSENBERG,M, STIBRANYI,L, BALAZ,S, CHRENO,O, EBRINGER,L,ILAVSKY, D AND VEGH,D, STRUCTURE-MUTAGENICITY RELATIONSHIPS OF5-NITRO-2-FURYLETHYLENES IN SALMONELLA TYPHIMURIUM TA98, CHEM.-BIOL. INTERACT.53(1-2):145-153, 1985"
+427-51-0,CCRIS,0,1,,CC(=O)OC1(CCC2C3C=C(Cl)C4=CC(=O)C5CC5C4(C)C3CCC12C)C(=O)C,"LANG,R AND REIMANN,R, STUDIES FOR A GENOTOXIC POTENTIAL OF SOMEENDOGENOUS AND EXOGENOUS SEX STEROIDS. I. COMMUNICATION: EXAMINATION FOR THEINDUCTION OF GENE MUTATIONS USING THE AMES SALMONELLA/MICROSOME TEST AND THEHGPRT TEST IN V79 CELLS, ENVIRON. MOL. MUTAGEN. 21(3):272-304, 1993"
+56-81-5,VITIC,0,-1,"CAPMMCM90,DR0002026,GLYCEROBI,TAGAT-S,ZNMONOGLY",OCC(O)CO,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+99803-60-8,EPA1,1,-1,,COP(=S)(OC)Oc1ccc(N=O)c(C)c1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+128233-25-0,CCRIS,0,-1,,CN1C=CN(COCCC(C)(C)[N+](=O)[O-])C1\C=N\O,"SEBASTIAN,SE AND KORTE,DW, MUTAGENIC POTENTIAL OF2-HYDROXYIMINOMETHYL-3-METHYL-1-[2-(3-METHYL-3-NITROBUTYLOXYMETHYL)]-IMIDAZOLIUM CHLORIDE (WR#255,737)IN THE AMES SALMONELLA/MAMMALIAN MICROSOME MUTAGENICITY TEST, LETTERMAN ARMYINSTITUTE OF RESEARCH, LAIR-IR-361:TOXICOLOGYSER-206, MAY 1989"
+86711-50-4,CCRIS,0,-1,,O=C(C1OC1c2ccc(Oc3ccccc3)cc2)c4ccccc4,"RASHID,KA, MULLIN,CA AND MUMMA,RO, STRUCTURE-MUTAGENICITYRELATIONSHIPS OF CHALCONES AND THEIR OXIDES IN THE SALMONELLA ASSAY, MUTAT. RES.169(3):71-79, 1986"
+7203-90-9,EPA1,1,-1,,CN(C)N=Nc1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+112-95-8,VITIC,0,-1,,CCCCCCCCCCCCCCCCCCCC,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+118-91-2,VITIC,0,-1,"DR9802146",OC(=O)c1ccccc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+85815-37-8,EPA1,0,-1,"450191-S,RILMAZHCL",CN(C)C(=O)c1nc(CNC(=O)CN)n(n1)c2ccc(Cl)cc2C(=O)c3ccccc3Cl,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+115091-98-0,CCRIS,1,-1,,CCCC\C=C\C=C\C=C\C=C\C=C\OC,"PETERS,JH, RICCIO,ES, STEWART,KR AND REIST,EJ, MUTAGENIC ACTIVITIES OFFECAPENTAENE DERIVATIVES"
+1912-32-9,CCRIS,1,-1,"BUTYLMESI",CCCCOS(=O)(=O)C,"GLOWIENKE,S, FRIAUFF,W, ALLMENDINGER,T, MARTUS,HJ, SUTER,W ANDMUELLER,L, STRUCTURE-ACTIVITY CONSIDERATIONS AND IN VITRO APPROACHES TO ASSESSTHE GENOTOXICTY OF 19 METHANE-, BENZENE- AND TOLUENESULFONIC ACID ESTERS, MUTAT.RES. 581(1-2):23-34, 2005"
+3807-77-0,CCRIS,1,-1,,[O-][N+](=O)c1ccc2cccc3CCc1c23,"VANCE,WA AND LEVIN,DE, STRUCTURAL FEATURES OF NITROAROMATICS THATDETERMINE MUTAGENIC ACTIVITY IN SALMONELLA TYPHIMURIUM, ENVIRON. MUTAGEN.6(6):797-811, 1984"
+142-04-1,VITIC,0,-1,"ANILINE",Nc1ccccc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+69658-17-9,EPA3,1,-1,,Oc1ccc2C(=O)c3cccc4c(O)ccc(c2c1)c34,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+84-58-2,EPA1,0,-1,,ClC1=C(Cl)C(=O)C(=C(C#N)C1=O)C#N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51-79-6,EPA1,1,-1,"BIOMER,POLYURETH",CCOC(=O)N,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+17886-25-8,CCRIS,1,-1,,C(N1CCN=N1)c2ccccc2,"SMITH,RH,JR, WLADKOWSKI,BD, TAYLOR,JE, THOMPSON,EJ, PRUSKI,B,KLOSE,JR, ANDREWS,AW AND MICHEJDA,CJ, ACID-CATALYZED DECOMPOSITION OF1-ALKYLTRIAZOLINES: A MECHANISTIC STUDY, J. ORG. CHEM. 58(8):2097-2103,1993"
+131431-60-2,CCRIS,0,-1,,CN1C=CN(CCS(=O)(=O)C)C1\C=N\O,"ORNER,G, NIEDING,WJ AND KORTE,DW, MUTAGENIC POTENTIAL OF2-HYDROXYIMINOMETHYL- 3-METHYL-1-(2-METHYLSULFONYLETHYL)IMIDAZOLIUM CHLORIDE INTHE AMES SALMONELLA/ MAMMALIAN MICROSOME MUTAGENICITY TEST, U.S. ARMY MEDICALRESEARCH AND DEVELOPMENT COMMAND, NTIS AD-A214317, 1989"
+320-67-2,EPA3,1,-1,"AZACYTIDI",NC1=NC(=O)N(C=N1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+3252-43-5,EPA3,1,-1,,BrC(Br)C#N,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+106671-89-0,EPA1,1,-1,,[O-][N+](=O)c1c(nc2sccn12)c3ccc(Cl)cc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+51940-44-4,EPA1,1,-1,"PIPEMIDAT",CCN1C=C(C(=O)O)C(=O)c2cnc(nc12)N3CCNCC3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+932-83-2,EPA1,1,-1,,O=NN1CCCCCC1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+30269-02-4,EPA1,1,-1,,Nc1ccc2ccc3ccc(c4ccc1c2c34)[N+](=O)[O-],"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+98-56-6,VITIC,0,-1,,FC(F)(F)c1ccc(Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+78-98-8,EPA1,1,-1,"METHYLGLY",CC(=O)C=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+611-06-3,VITIC,1,-1,,[O-][N+](=O)c1ccc(Cl)cc1Cl,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+3087-16-9,EPA1,0,-1,,CN(C)c1ccc(cc1)C(=C2C=CC(=[N+](C)C)C=C2)c3c(O)c(cc4cc(ccc34)S(=O)(=O)O)S(=O)(=O)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+134998-78-0,CCRIS,1,-1,,CC(=O)Oc1c(OC(=O)C)c2c(ccc3c4ccccc4c5cccc1c5c23)[N+](=O)[O-],"JUNG,H, SHAIKH,AU, HEFLICH,RH AND FU,PP, NITRO GROUP ORIENTATION,REDUCTION POTENTIAL, AND DIRECT-ACTING MUTAGENICITY OF NITRO-POLYCYCLIC AROMATICHYDRO- CARBONS, ENVIRON. MOL. MUTAGEN. 17(3):169-180, 1991"
+123-01-3,EPA1,0,-1,,CCCCCCCCCCCCc1ccccc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+56681-55-1,CCRIS,0,-1,,CCc1cccc(CC)c1N(COC)C(=O)CO,"TESSIER,DM AND CLARK,JM, QUANTITATIVE ASSESSMENT OF THE MUTAGENICPOTENTIAL OF ENVIRONMENTAL DEGRADATIVE PRODUCTS OF ALACHLOR, J. AGRIC. FOODCHEM. 43(9): 2504-2512, 1995"
+103667-52-3,CCRIS,0,-1,,CC1CC2=C(C3C(C=C(C)C2=O)C(CCC3=C)C(=C)C)C1=O,"ROJANAPO,W, PIMBUA,J, GLINSUKON,T, NAENGCHOMNONG,W ANDTHEBTARANONTH,Y, FAILURE OF DITERPENES FROM JATROPHA CURCAS TO INDUCE MUTATIONIN SALMONELLA TYPHIMURIUM TA98 AND TA100, RES. COMMUN. CHEM. PATHOL. PHARMACOL.58(3):397-400, 1987"
+121-73-3,CCRIS,0,-1,,[O-][N+](=O)c1cccc(Cl)c1,"KAWAI,A, GOTO,S, MATSUMOTO,Y AND MATSUSHITA,H, MUTAGENICITY OFALIPHATIC AND AROMATIC NITRO COMPOUNDS, SANGYO IGAKU 29(1):34-55,1987"
+501-30-4,EPA1,1,-1,,OCC1=CC(=O)C(=CO1)O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+106-48-9,VITIC,0,-1,"CLPHENOLP",Oc1ccc(Cl)cc1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+7570-86-7,EPA1,1,-1,,O=C([C@H]1O[C@@H]1c2ccccc2)c3ccccc3,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+823-86-9,EPA1,0,-1,,ONc1ccc(Cl)cc1,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+1982-49-6,EPA3,0,-1,,C[C@@H]1CCCC[C@H]1NC(=O)Nc2ccccc2,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+74992-96-4,CCRIS,0,-1,,Clc1cccc2c1oc3ccccc23,"MATSUMOTO,M, ANDO,M AND OHTA,Y, MUTAGENICITY OFMONOCHLORODIBENZOFURANS DETECTED IN THE ENVIRONMENT, TOXICOL. LETT. 40(1):21-28,1988"
+20098-48-0,VITIC,1,-1,,[O-][N+](=O)c1cc(Cl)c(Cl)c(Cl)c1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+363-49-5,EPA3,1,-1,,CC(=O)Nc1ccc2c(Cc3cc(O)ccc23)c1,"FENG, J, LURATI, L, OUYANG, H, ROBINSON, T, WANG, Y, YUAN, S AND YOUNG, S. PREDICTIVE TOXICOLOGY: BENCHMARKING MOLECULAR DESCRIPTORS AND STATISTICAL METHODS. J. CHEM. INF. COMPUT. SCI. 43: 1463-1470, 2003"
+37319-17-8,CCRIS,0,-1,,COC1COC(COCC2COC(OC)C(OS(=O)(=O)O)C2OS(=O)(=O)O)C(OS(=O)(=O)O)C1OS(=O)(=O)O,"NCI/NTP CARCINOGENESIS TECHNICAL REPORT SERIES, NATIONAL CANCERINSTITUTE/NATIONAL TOXICOLOGY PROGRAM, U.S. DEPARTMENT OF HEALTH AND HUMANSERVICES, TR-512 Y02"
+117333-21-8,CCRIS,1,-1,,OC(Cc1cn(N=O)c2ccccc12)C(=O)O,"OHARA,H, MIZUNO,M, DANNO,G, KANAZAWA,K, YOSHIOKA,T AND NATAKE,M,MUTAGEN FORMED FROM TRYPTOPHAN REACTED WITH SODIUM NITRITE IN ACIDIC SOLUTION,MUTAT. RES. 206(1):65-71, 1988"
+10605-21-7,VITIC,1,-1,"CARBENDAZ",COC(=O)Nc1nc2ccccc2[nH]1,"JUDSON, PN, COOKE, PA, DOERRER, NG, GREENE, N, HANZLIK, RP, HARDY, C, HARTMANN, A, HINCHLIFFE, D, HOLDER, J, MUELLER, L, STEGER-HARTMANN, T, ROTHFUSS, A, SMITH, M, THOMAS, K, VESSEY, JD AND ZEIGER E. TOWARDS THE CREATION OF AN INTERNATIONAL TOXICOLOGY INFORMATION CENTRE. TOXICOLOGY 213(1-2):117-28, 2005"
+103393-71-1,EPA1,1,-1,,ClCc1cccc2c3cccc4cccc(c12)c34,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
+621-64-7,EPA1,1,-1,,CCCN(CCC)N=O,"KAZIUS, J, MCGUIRE, R AND BURSI, R. DERIVATION AND VALIDATION OF TOXICOPHORES FOR MUTAGENICITY PREDICTION. J. MED. CHEM. 48: 312-320, 2005"
diff --git a/data/parts/hansen.csv b/data/parts/hansen.csv
new file mode 100644
index 0000000..7a80d06
--- /dev/null
+++ b/data/parts/hansen.csv
@@ -0,0 +1,6513 @@
+ID,SMILES,Mutagenicity
+2475-33-4,O=C1c2ccccc2C(=O)c3c1ccc4c3[nH]c5c6C(=O)c7ccccc7C(=O)c6c8[nH]c9c%10C(=O)c%11ccccc%11C(=O)c%10ccc9c8c45,non-mutagenic
+820-75-7,NNC(=O)CNC(=O)\C=N\#N,mutagenic
+2435-76-9,O=C1NC(=O)\C(=N/#N)\C=N1,mutagenic
+817-99-2,NC(=O)CNC(=O)\C=N\#N,mutagenic
+116539-70-9,CCCCN(CC(O)C1=C\C(=N/#N)\C(=O)C=C1)N=O,mutagenic
+115-02-6,NC(COC(=O)\C=N/#N)C(=O)O,mutagenic
+122341-55-3,CCN(CC(O)C1=CC(=O)\C(=N\#N)\C=C1)N=O,mutagenic
+105149-00-6,CC(=O)OC1(CCC2C3C=C(Cl)C4=CC(=O)OCC4(C)C3CCC12C)C(=O)C,non-mutagenic
+108-78-1,Nc1nc(N)nc(N)n1,non-mutagenic
+2425-85-6,Cc1ccc(N=Nc2c(O)ccc3ccccc23)c(c1)[N+](=O)[O-],mutagenic
+67019-24-3,CC(C)CC(=O)Nc1snc2ccccc12,non-mutagenic
+83-41-0,Cc1cccc(c1C)[N+](=O)[O-],mutagenic
+3836-23-5,CCCCCCC(=O)OC1(CCC2C3CCC4=CC(=O)CCC4C3CCC12C)C#C,non-mutagenic
+108-03-2,CCC[N+](=O)[O-],non-mutagenic
+70585-52-3,OC(=O)c1cc(cc2cccnc12)[N+](=O)[O-],mutagenic
+87425-68-1,OC1C=Cc2c(ccc3c(Br)c4ccccc4cc23)C1O,mutagenic
+24370-25-0,NC(=O)Nc1nc2ccccc2[nH]1,mutagenic
+NOCAS_M453,C[C@@H](O)CCC(=O)c1cocc1,non-mutagenic
+4106-66-5,Nc1ccc2c(oc3ccccc23)c1,mutagenic
+1576-67-6,Cc1ccc2ccc3ccc(C)cc3c2c1,mutagenic
+146177-65-3,Cc1cc2c(nc(N)n2C)c3ncc(nc13)c4ccccc4,mutagenic
+112380-29-7,CCN(N=O)\C(=N\O)\C=O,mutagenic
+484-23-1,NNc1nnc(NN)c2ccccc12,mutagenic
+110-26-9,C=CC(=O)NCNC(=O)C=C,mutagenic
+88020-91-1,OCc1cc2c3ccccc3c4cccc(c1)c24,non-mutagenic
+28652-72-4,Cc1ccccc1c2ccccc2,non-mutagenic
+67278-88-0,CC1C2C3C(C)C4C(=O)C56C(=O)c7c(O)cc(C)cc7C(=O)C35C1C(=O)C68C(=O)c9c(O)cc(C)cc9C(=O)C248,non-mutagenic
+542-02-9,Cc1nc(N)nc(N)n1,non-mutagenic
+1007-28-9,CCNc1nc(N)nc(Cl)n1,non-mutagenic
+64188-65-4,C1CCC(CC1)N2C3C2c4ccccc4c5ccccc35,mutagenic
+122-56-5,CCCCB(CCCC)CCCC,mutagenic
+111348-61-9,CC(=O)NC(CSC(=C(Cl)Cl)Cl)C(=O)O,mutagenic
+29350-73-0,CC(C)[C@@H]1CC[C@H](C)[C@@H]2CC[C@H](C)C[C@@H]12,mutagenic
+63980-20-1,CCNN=NCC,mutagenic
+554-84-7,Oc1cccc(c1)[N+](=O)[O-],mutagenic
+13177-32-7,[O-][N+](=O)c1ccc2c(c1)c3cccc4cccc2c34,mutagenic
+98-00-0,OCc1occc1,non-mutagenic
+NOCAS_M204,C(Cc1ccc(cc1)c2ccccc2)[C@H]3CO3,mutagenic
+37515-51-8,Oc1cc2c3ccccc3ccc2c4ccccc14,mutagenic
+842-07-9,Oc1ccc2ccccc2c1N=Nc3ccccc3,mutagenic
+NOCAS_M566,N[C@@H]1CC[C@@H](C[C@@H]2CC[C@@H](N)CC2)CC1,non-mutagenic
+2213-00-5,COC(=O)C12CC1(C=O)C(=CC3CC(C)(C)CC23)C=O,mutagenic
+535-11-5,CCOC(=O)C(C)Br,mutagenic
+21362-69-6,COC1(CCCC1)OC2CCC3C4CCC5CC6SC6CC5(C)C4CCC23C,non-mutagenic
+92280-01-8,CCN(CCCl)CCCNc1c2CCCCc2nc3ccccc13,mutagenic
+145763-35-5,C\C(=C/C(=C/C1=CCOC1=O)/C)\C=C\C=C(/C)\C(=O)C23OC2C(O)(CCO)NC3=O,mutagenic
+944-22-9,CCO[P@](=S)(CC)Sc1ccccc1,non-mutagenic
+5131-58-8,Nc1ccc(c(N)c1)[N+](=O)[O-],mutagenic
+919-86-8,CCSCCSP(=O)(OC)OC,non-mutagenic
+118-90-1,Cc1ccccc1C(=O)O,non-mutagenic
+26002-80-2,CC(=CC1C(C(=O)OCc2cccc(Oc3ccccc3)c2)C1(C)C)C,mutagenic
+108-86-1,Brc1ccccc1,non-mutagenic
+88-53-9,Cc1cc(N)c(cc1Cl)S(=O)(=O)O,non-mutagenic
+6088-51-3,Oc1ccc2cc(SSc3ccc4cc(O)ccc4c3)ccc2c1,non-mutagenic
+112022-06-7,CN(C)CCNC(=O)c1cccc2C(=O)c3ccccc3C(=O)c12,mutagenic
+60877-79-4,Nc1snc2c(Cl)cc(Cl)cc12,mutagenic
+154159-06-5,ClCC1(C(Cl)Cl)C2CC(Cl)(Cl)C1(CC2(Cl)Cl)C(Cl)Cl,non-mutagenic
+602-06-2,Cc1cc(O)c2C(=O)c3c(O)cc(O)c(c3C(=O)c2c1)c4c(O)cc(O)c5C(=O)c6c(O)cc(C)cc6C(=O)c45,non-mutagenic
+107-30-2,COCCl,non-mutagenic
+59-89-2,O=NN1CCOCC1,mutagenic
+2479-46-1,Nc1ccc(Oc2cccc(Oc3ccc(N)cc3)c2)cc1,mutagenic
+101-54-2,Nc1ccc(Nc2ccccc2)cc1,non-mutagenic
+2849-98-1,CCCCCOC(=O)C(=C)C,non-mutagenic
+65-85-0,OC(=O)c1ccccc1,non-mutagenic
+5134-49-6,Nc1ncnc2c1ncn2Cc3ccc(cc3)[N+](=O)[O-],mutagenic
+203-64-5,C1c2cccc3ccc4cccc1c4c23,mutagenic
+321-60-8,Fc1ccccc1c2ccccc2,non-mutagenic
+11097-69-1,Clc1ccc(cc1Cl)c2ccc(Cl)c(Cl)c2Cl,non-mutagenic
+58775-50-1,CC(=CCc1ccc(O)c2C(=O)c3c(O)c4c(OC5OC=CC45O)cc3Oc12)C,mutagenic
+1222-05-5,CC1COCc2cc3c(cc12)C(C)(C)C(C)C3(C)C,non-mutagenic
+50892-23-4,Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C,non-mutagenic
+3025-77-2,Nc1ccc2ccccc2c1N=Nc3ccc(cc3)[N+](=O)[O-],mutagenic
+25316-40-9,COc1cccc2C(=O)c3c(O)c4CC(O)(CC(OC5CC(N)C(O)C(C)O5)c4c(O)c3C(=O)c12)C(=O)CO,mutagenic
+2467-03-0,Oc1ccc(Cc2ccccc2O)cc1,non-mutagenic
+2517-43-3,COC(C)CCO,non-mutagenic
+71708-92-4,CC(=O)N(O)c1ccc(Oc2ccccc2)cc1,mutagenic
+25058-17-7,CC(C)(c1ccc(OP(O)O)cc1)c2ccc(OP(O)O)cc2,non-mutagenic
+111-64-8,CCCCCCCC(=O)Cl,mutagenic
+5344-87-6,CC(C)(C)C(Br)C(=O)Nc1ccccc1,non-mutagenic
+138154-40-2,CCN(CC)CCNc1ccc2nc(C)n3c4ccc(O)cc4C(=O)c1c23,mutagenic
+139-94-6,CCNC(=O)Nc1ncc(s1)[N+](=O)[O-],mutagenic
+22897-08-1,COc1ccc(O)c2C(=O)c3c(OC)cc4O[C@@H]5OC=C[C@H]5c4c3Oc12,mutagenic
+71712-70-4,[O-][N+](=O)c1cc2Oc3cc(Cl)c(Cl)cc3Oc2cc1Cl,mutagenic
+80-62-6,COC(=O)C(=C)C,non-mutagenic
+102694-32-6,Oc1ccc2c3ccc(O)c4C(=O)C=C[C@@](O)([C@@H]5[C@H]6O[C@H]6C(=O)c1c25)c34,mutagenic
+598-55-0,COC(=O)N,non-mutagenic
+135561-93-2,Cc1cc(C)n(n1)c2[nH]nc(NN)c3c4ccccc4nc23,non-mutagenic
+191861-17-3,Fc1cnc2ccc3cccnc3c2c1,mutagenic
+64216-20-2,SC(NC(=O)NC(S)c1nc2ccccc2s1)c3nc4ccccc4s3,mutagenic
+34331-95-8,Cc1c2ccccc2c(CBr)c3ccccc13,mutagenic
+3198-41-2,Nc1cccc2cc3CCCCc3nc12,mutagenic
+96-33-3,COC(=O)C=C,non-mutagenic
+192705-52-5,CC(=O)Nc1c(O)cc2c3ccccc3c4cccc1c24,mutagenic
+94339-56-7,OC1Cc2cc3ccc4cccc5ccc(c2C=C1)c3c45,mutagenic
+115664-59-0,Oc1ccc2c(c1)c3ccc(c4cccc2c34)[N+](=O)[O-],mutagenic
+97509-29-0,OC1C=Cc2cc3ccccc3c(c2C1O)[N+](=O)[O-],non-mutagenic
+5858-81-1,Cc1ccc(N=Nc2c(O)c(cc3ccccc23)C(=O)O)c(c1)S(=O)(=O)O,non-mutagenic
+1733-13-7,CN=C1C=CC(=C(c2ccc(cc2)N(C)C)c3ccc(cc3)N(C)C)C=C1,non-mutagenic
+56986-36-8,CCCCN(COC(=O)C)N=O,mutagenic
+93285-74-6,C1CCC2=C(C1)c3cc4ccccc4c5cc6ccccc6c2c35,mutagenic
+22788-18-7,NP(=O)(OCCC(=O)O)N(CCCl)CCCl,mutagenic
+94887-71-5,Nc1c(O)cc(Cc2cc(Cl)c(N)c(OS(=O)(=O)O)c2)cc1Cl,non-mutagenic
+15980-15-1,C1CSCCO1,non-mutagenic
+636-21-5,Cc1ccccc1N,mutagenic
+486-25-9,O=C1c2ccccc2c3ccccc13,non-mutagenic
+286-62-4,C1CCCC2OC2CC1,non-mutagenic
+106589-50-8,C1Cc2c(C=C1)ccc3nc4ccc5ccccc5c4cc23,mutagenic
+110004-96-1,CS(=O)(=O)Nc1ccc(Nc2c3ccc(cc3nc4ccc(cc24)N=N#N)N=N#N)cc1,non-mutagenic
+154-69-8,CN(C)CCN(Cc1ccccc1)c2ccccn2,non-mutagenic
+64356-85-0,C\C=C(/Cl)\C1=CC(=O)C23CC2C(C)(C)OC3(O)C1=O,mutagenic
+59-05-2,CN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)NC(CCC(=O)O)C(=O)O,non-mutagenic
+103-69-5,CCNc1ccccc1,non-mutagenic
+52411-33-3,Nc1ccccc1SCCSc2ccccc2N,mutagenic
+89-73-6,ONC(=O)c1ccccc1O,mutagenic
+603-85-0,Nc1c(O)cccc1[N+](=O)[O-],non-mutagenic
+74518-99-3,CC(C)(C)c1ccc(\C=C\c2ccc(N)cc2)cc1,non-mutagenic
+1703-58-8,OC(=O)C[C@H]([C@H](CC(=O)O)C(=O)O)C(=O)O,mutagenic
+83-32-9,C1Cc2cccc3cccc1c23,non-mutagenic
+107210-40-2,CN(C)CCCNc1c2ccccc2nc3c(ccc(c13)[N+](=O)[O-])N(CCO)CCO,mutagenic
+7696-62-0,CCCCOc1ccc(cc1)N=O,mutagenic
+88-51-7,Cc1cc(c(N)cc1Cl)S(=O)(=O)O,mutagenic
+63-75-2,COC(=O)C1=CCCN(C)C1,mutagenic
+27108-42-5,CNC(=O)ON,mutagenic
+79-10-7,OC(=O)C=C,non-mutagenic
+141-82-2,OC(=O)CC(=O)O,non-mutagenic
+110-62-3,CCCCC=O,non-mutagenic
+21711-71-7,O=Nc1ccccc1c2ccccc2,mutagenic
+108612-45-9,CN(C1CCN(CC1)c2nc3ccccc3n2Cc4ccc(F)cc4)c5nccc(O)n5,non-mutagenic
+74407-29-7,CSC(C)(C)C(=O)NC(CS)C(=O)O,non-mutagenic
+4685-14-7,C[n+]1ccc(cc1)c2cc[n+](C)cc2,non-mutagenic
+66927-03-5,OC(CN=N#N)C(O)C(O)C(O)C=O,mutagenic
+149862-56-6,CCCCCNc1snc2ccccc12,non-mutagenic
+105-74-8,CCCCCCCCCCCC(=O)OOC(=O)CCCCCCCCCCC,non-mutagenic
+1325-37-7,Cc1ccc(cc1S(=O)(=O)O)[N+](=O)[O-],non-mutagenic
+98-47-5,OS(=O)(=O)c1cccc(c1)[N+](=O)[O-],non-mutagenic
+121-00-6,COc1ccc(O)c(c1)C(C)(C)C,non-mutagenic
+54455-37-7,[O-][N+](=O)c1ccc2C(=O)N(CCl)C(=O)c2c1,mutagenic
+21145-77-7,CC1CC(C)(C)c2cc(C(=O)C)c(C)cc2C1(C)C,non-mutagenic
+24471-48-5,OCc1cc2ccc3cccc4ccc(c1)c2c34,mutagenic
+145142-70-7,CCCCON(OC(=O)C)C(=O)c1ccc(cc1)c2ccccc2,mutagenic
+68-23-5,C[C@]12CC[C@H]3[C@@H](CCC4=C3CCC(=O)C4)[C@H]1CC[C@@]2(O)C#C,non-mutagenic
+91-15-6,N#Cc1ccccc1C#N,non-mutagenic
+142783-37-7,CC(=O)Nc1cc(ccc1C)N=[N+]([O-])c2ccc(C)c(NC(=O)C)c2,non-mutagenic
+123524-52-7,CC(C)OC(=O)C1=C(C)N=C(N)C(=C(O)OC2CN(C2)C(c3ccccc3)c4ccccc4)C1c5cccc(c5)[N+](=O)[O-],non-mutagenic
+64431-93-2,C1CN=C(N1)c2ccc(cc2)c3cc4ccc(cc4[nH]3)C5=NCCN5,non-mutagenic
+569-26-6,CC1CC2C(Cc3c[nH]c4cccc2c34)N(C)C1,mutagenic
+2499-95-8,CCCCCCOC(=O)C=C,non-mutagenic
+70055-49-1,CN(C)N=Nc1ccc(cc1)C(=O)O,non-mutagenic
+98-07-7,ClC(Cl)(Cl)c1ccccc1,mutagenic
+10094-45-8,CCCCCCCCCCCCCCCCCCNC(=O)CCCCCCCCCCC\C=C\CCCCCCCC,non-mutagenic
+2880-49-1,CC1(C)OC1COc2c3OC(=O)C=Cc3cc4ccoc24,non-mutagenic
+551-88-2,CCC(CC)[N+](=O)[O-],non-mutagenic
+106532-63-2,CCCC(=O)\N=C\1/SN(C(=O)CCC)c2ccc(cc12)[N+](=O)[O-],mutagenic
+104-85-8,Cc1ccc(cc1)C#N,non-mutagenic
+120812-49-9,[O-][N+](=O)c1ccc2ccc3ccc(c4c5ccccc5c1c2c34)[N+](=O)[O-],non-mutagenic
+148193-35-5,COc1nsc2cc(OCC3CO3)ccc12,mutagenic
+21811-73-4,OC(=O)c1c(Cl)c(Cl)c(Cl)c2Oc3c(Br)c(O)c(Br)cc3C(=O)c12,non-mutagenic
+13010-08-7,CCCCN(N=O)C(=N)N[N+](=O)[O-],mutagenic
+543-67-9,CCCON=O,mutagenic
+1085-98-9,CN(C)S(=O)(=O)N(SC(F)(Cl)Cl)c1ccccc1,non-mutagenic
+151378-33-5,OC1C2OC2C3=C(C=CC4C3c5cccc6cccc4c56)C1O,mutagenic
+117-08-8,Clc1c(Cl)c(Cl)c2C(=O)OC(=O)c2c1Cl,non-mutagenic
+7258-52-8,C1Cc2ccc3ccc4ccccc4c3c2C1,mutagenic
+151-18-8,NCCC#N,non-mutagenic
+84761-86-4,Clc1cccc2oc3ccccc3c12,non-mutagenic
+3353-08-0,C[C@@H]1C=Cc2c1ccc3c2ccc4ccccc34,mutagenic
+109-66-0,CCCCC,non-mutagenic
+108-39-4,Cc1cccc(O)c1,non-mutagenic
+119979-38-3,CCCC(=O)OCc1ccccc1[N+](=O)[O-],non-mutagenic
+100-39-0,BrCc1ccccc1,mutagenic
+120042-14-0,NC(CCN=N#N)C(=O)O,mutagenic
+109143-19-3,COc1ccc2oc(cc2c1N(CCCl)CCCl)[N+](=O)[O-],mutagenic
+7779-65-9,CC(C)CCOC(=O)\C=C/c1ccccc1,non-mutagenic
+88-16-4,FC(F)(F)c1ccccc1Cl,non-mutagenic
+1576-35-8,Cc1ccc(cc1)S(=O)(=O)NN,mutagenic
+354-33-6,FC(F)C(F)(F)F,non-mutagenic
+88-19-7,Cc1ccccc1S(=O)(=O)N,non-mutagenic
+636-26-0,Cc1cnc(S)nc1O,non-mutagenic
+97-00-7,[O-][N+](=O)c1ccc(Cl)c(c1)[N+](=O)[O-],mutagenic
+193-98-6,c1cc2ccc3cncc4ccc(c1)c2c34,mutagenic
+165606-93-9,ClC(=C1C(=O)NC(=O)C1(Cl)Cl)Cl,mutagenic
+84-56-0,c1ccc2cc3c(ccc4cccnc34)cc2c1,mutagenic
+2303-17-5,CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl,mutagenic
+95-68-1,Cc1ccc(N)c(C)c1,mutagenic
+NOCAS_M243,CN(C[C@H](O)CO)N=O,mutagenic
+56341-08-3,CC(C)(C)NCC(O)c1cc(Cl)c(N)c(c1)C(F)(F)F,non-mutagenic
+118-75-2,ClC1=C(Cl)C(=O)C(=C(Cl)C1=O)Cl,mutagenic
+15625-89-5,CCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C,mutagenic
+114488-79-8,CC12CCCC(C)(C1CCC34CC(O)(CCC23)C5(CO5)C4)C(=O)O,non-mutagenic
+NOCAS_M25,O[C@H]1C=Cc2c(ccc3c4cccc5cccc(c23)c45)[C@@H]1O,mutagenic
+125157-96-2,CC1C2C(=Nc3ccccc23)N(C)c4ccc(C)cc14,mutagenic
+1615-02-7,OC(=O)\C=C\c1ccc(Cl)cc1,non-mutagenic
+100-12-9,CCc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+628-94-4,NC(=O)CCCCC(=O)N,non-mutagenic
+159092-66-7,[O-][N+](=O)c1cccc2c1ccc3cccc(c23)[N+](=O)[O-],mutagenic
+84-74-2,CCCCOC(=O)c1ccccc1C(=O)OCCCC,non-mutagenic
+6052-68-2,OC(=O)C1Cc2c(CN1)[nH]c3ccccc23,non-mutagenic
+60254-83-3,CC(C)CC(NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)CN)C(=O)O,non-mutagenic
+115453-72-0,NC(CS\C(=C(/Cl)\C(Cl)(Cl)Cl)\Cl)C(=O)O,mutagenic
+220168-55-8,[O-][N+](=O)c1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,mutagenic
+536-90-3,COc1cccc(N)c1,mutagenic
+90147-31-2,CCCNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+4081-23-6,O=P1(Oc2ccccc2)OCc3ccccc3O1,mutagenic
+2150-54-1,Cc1cc(ccc1N=Nc2c(O)c3c(O)cc(cc3cc2S(=O)(=O)O)S(=O)(=O)O)c4ccc(N=Nc5c(O)c6c(O)cc(cc6cc5S(=O)(=O)O)S(=O)(=O)O)c(C)c4,non-mutagenic
+138-89-6,CN(C)c1ccc(cc1)N=O,mutagenic
+7239-21-6,CN(C)N=Nc1ccc(Br)cc1,mutagenic
+585-07-9,CC(=C)C(=O)OC(C)(C)C,non-mutagenic
+100-41-4,CCc1ccccc1,non-mutagenic
+3868-31-3,Nc1nc(O)c2nc(O)n(C3OC(CO)C(O)C3O)c2n1,non-mutagenic
+2693-46-1,Nc1ccc2c3ccccc3c4cccc1c24,mutagenic
+NOCAS_M387,CNCc1oc(CSCCN=C(NC[C@H](O)c2ccc(O)cc2)NS(=O)(=O)C)cc1,non-mutagenic
+17420-30-3,Nc1ccc(cc1C#N)[N+](=O)[O-],mutagenic
+2687-25-4,Cc1cccc(N)c1N,mutagenic
+NOCAS_M514,CCOC(=O)C[C@H](SP(=S)(OC)OC)C(=O)OCC,non-mutagenic
+578-66-5,Nc1cccc2cccnc12,mutagenic
+5102-83-0,CC(=O)C(N=Nc1ccc(cc1Cl)c2ccc(N=NC(C(=O)C)C(=O)Nc3ccc(C)cc3C)c(Cl)c2)C(=O)Nc4ccc(C)cc4C,non-mutagenic
+111-94-4,N#CCCNCCC#N,non-mutagenic
+78-84-2,CC(C)C=O,non-mutagenic
+24072-75-1,Nc1nc2cc(Cl)c(Cl)cc2s1,non-mutagenic
+637-69-4,COc1ccc(C=C)cc1,non-mutagenic
+66734-13-2,CCC(=O)OCC(=O)C1(OC(=O)CC)C(C)CC2C3C(Cl)CC4=CC(=O)C=CC4(C)C3C(O)CC12C,non-mutagenic
+611-35-8,Clc1ccnc2ccccc12,mutagenic
+126983-60-6,COC1=CC(=O)c2c([nH]cc3c4cnccc4nc23)C1=O,mutagenic
+199536-84-0,ClCC1=C(Br)C(=O)OC1,mutagenic
+27833-64-3,CN1CCN(CC1)C2=Nc3ccccc3Oc4ccc(Cl)cc24,non-mutagenic
+518-34-3,COc1cc2CCN(C)[C@H]3Cc4ccc(Oc5cc(C[C@@H]6N(C)CCc7cc(OC)c(OC)c(Oc(c1)c23)c67)ccc5OC)cc4,mutagenic
+23491-44-3,CN1CCN(CC1)c2ccc3[nH]c(nc3c2)c4ccc5[nH]c(nc5c4)c6ccc(O)cc6,non-mutagenic
+5908-27-0,OS(=O)(=O)C1=CC(=O)C(=O)c2ccccc12,mutagenic
+92569-06-7,Cc1ccc(cc1)S(=O)(=O)NC(=O)Nc2ncc(s2)[N+](=O)[O-],non-mutagenic
+1758-73-2,NC(=N)S(=O)O,non-mutagenic
+63017-87-8,Cc1c(ccc2ccccc12)[N+](=O)[O-],mutagenic
+139259-97-5,CC(=O)ON(OCc1ccc(Br)cc1)C(=O)c2ccccc2,mutagenic
+6607-30-3,CP1(C)NP(C)(C)NP(C)(C)N1,non-mutagenic
+67634-00-8,CC(C)CCOCC(=O)OCC=C,non-mutagenic
+NOCAS_M498,Cl[C@@H]1[C@H](Cl)[C@@H](Cl)[C@@H](Cl)[C@@H](Cl)[C@@H]1Cl,non-mutagenic
+93780-95-1,OC1C2OC2c3c(ccc4cc5ccc6ccccc6c5nc34)C1O,mutagenic
+50-28-2,C[C@]12CC[C@@H]3[C@@H](CCc4cc(O)ccc34)[C@H]1CC[C@@H]2O,non-mutagenic
+139-40-2,CC(C)Nc1nc(Cl)nc(NC(C)C)n1,non-mutagenic
+60-51-5,CNC(=O)CSP(=S)(OC)OC,mutagenic
+54484-90-1,CC[N+]([O-])(CC)CCNc1ccc(CO)c2Sc3ccccc3C(=O)c12,mutagenic
+30835-61-1,COc1cc2C(=O)CCc2c3c(C)cc4ccccc4c13,mutagenic
+938-73-8,CCOc1ccccc1C(=O)N,non-mutagenic
+61551-82-4,OS(=O)(=O)c1ccc2cc(Oc3ccc4cc(ccc4c3)S(=O)(=O)O)ccc2c1,non-mutagenic
+934-73-6,CS(=O)c1ccc(Cl)cc1,non-mutagenic
+99400-75-6,CCCCCCCC\C=C/CCCCCCCCN,mutagenic
+56-18-8,NCCCNCCCN,non-mutagenic
+111-41-1,NCCNCCO,mutagenic
+NOCAS_M134,COC(=O)[C@]12O[C@@]1(C)[C@@](O)(NC2=O)C(C)C,mutagenic
+64-67-5,CCOS(=O)(=O)OCC,mutagenic
+3571-31-1,COc1cc(O)c2C(=O)c3c(O)cc(C)cc3Cc2c1,mutagenic
+NOCAS_M488,CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@]2(O)C#C,non-mutagenic
+NOCAS_M133,Cc1ccc(OC[C@H]2CO2)cc1,mutagenic
+159092-71-4,[O-][N+](=O)c1ccc2c3ccccc3cc(c2c1)[N+](=O)[O-],mutagenic
+58-27-5,CC1=CC(=O)c2ccccc2C1=O,mutagenic
+101-67-7,CCCCCCCCc1ccc(Nc2ccc(CCCCCCCC)cc2)cc1,non-mutagenic
+89-59-8,Cc1ccc(Cl)cc1[N+](=O)[O-],non-mutagenic
+59901-89-2,O=C([C@@H]1CO1)c2ccc3OCOc3c2,mutagenic
+1551-44-6,CCCC(=O)OC1CCCCC1,non-mutagenic
+71424-66-3,CC1Cc2c(O)c(C)c3C4C(CCC(=C)c3c2C1=O)C4(C)C,non-mutagenic
+63710-09-8,CCC1(O)CC(OC2CC(C(OC3CC(O)C(O)C(C)O3)C(C)O2)N(C)C)c4c(O)c5C(=O)c6c(O)ccc(O)c6C(=O)c5cc4C1C(=O)OC,mutagenic
+124-19-6,CCCCCCCCC=O,non-mutagenic
+1982-67-8,CS(=N)(=O)CCC(N)C(=O)O,non-mutagenic
+98499-60-6,COc1ccccc1NCSC,mutagenic
+587-04-2,Clc1cccc(C=O)c1,non-mutagenic
+115217-02-2,CCC1=C(C(C)c2cc(O)ccc12)c3ccc(O)cc3,non-mutagenic
+26530-20-1,CCCCCCCCN1SC=CC1=O,non-mutagenic
+58-95-7,CC(C)CCCC(C)CCCC(C)CCCC1(C)CCc2c(C)c(OC(=O)C)c(C)c(C)c2O1,non-mutagenic
+20702-77-6,COc1ccc(CCC(=O)c2c(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc2O)cc1O,non-mutagenic
+253-52-1,c1ccc2cnncc2c1,non-mutagenic
+68041-18-9,OS(=O)(=O)OCc1c2ccccc2c3ccc4cccc5ccc1c3c45,mutagenic
+1074-12-0,O=CC(=O)c1ccccc1,mutagenic
+66041-61-0,Oc1ccc(cc1[N+](=O)[O-])c2ccc(O)c(c2)[N+](=O)[O-],non-mutagenic
+38612-16-7,[O-][N+](=O)c1cccc(COC(=O)c2ccccc2)c1,non-mutagenic
+109460-96-0,COC(=O)\C(=C\c1ccccc1Br)\C#N,non-mutagenic
+5408-55-9,[O-][N+](=O)c1ccc2c(oc3ccc(cc23)[N+](=O)[O-])c1,mutagenic
+35212-01-2,Cc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])N=[N+]([O-])c2cc(cc(c2C)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+504-78-9,C1CSCN1,mutagenic
+120314-14-9,OCCc1cn(N=O)c2ccccc12,mutagenic
+62783-49-7,CN(Cc1cccc(C)c1)N=O,mutagenic
+126-30-7,CC(C)(CO)CO,non-mutagenic
+2893-78-9,ClN1C(=O)NC(=O)N(Cl)C1=O,non-mutagenic
+3695-86-1,COC(=O)\C(=C\c1occc1)\C#N,non-mutagenic
+14078-41-2,COc1cc(c(O)c(c1)C(C)(C)C)c2cc(OC)cc(c2O)C(C)(C)C,non-mutagenic
+150-13-0,Nc1ccc(cc1)C(=O)O,non-mutagenic
+13684-63-4,COC(=O)Nc1cccc(OC(=O)Nc2cccc(C)c2)c1,mutagenic
+140-10-3,OC(=O)\C=C\c1ccccc1,non-mutagenic
+619-24-9,[O-][N+](=O)c1cccc(c1)C#N,mutagenic
+55898-15-2,COc1cc2CCN(C)c3cc4cc5OCOc5cc4c(c1OC)c23,non-mutagenic
+51630-58-1,CC(C)C(C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1)c3ccc(Cl)cc3,non-mutagenic
+2216-15-1,CCN(CC)c1ccc(cc1)[N+](=O)[O-],mutagenic
+145142-71-8,CCCCON(OC(=O)C)C(=O)c1ccc(cc1)C(C)(C)C,mutagenic
+13417-43-1,C\C=C(/C)\CCl,mutagenic
+53940-49-1,COc1cc(CC2CO2)ccc1O,mutagenic
+64625-66-7,Cc1c2ccccc2cc3c4C5OC5C(O)C(O)c4ccc13,mutagenic
+109-86-4,COCCO,non-mutagenic
+163275-58-9,Fc1cc2ccccc2c3ncccc13,mutagenic
+56-49-5,Cc1ccc2cc3c(ccc4ccccc34)c5CCc1c25,mutagenic
+104953-00-6,CC1(CO1)c2ccc(cc2)C#N,mutagenic
+55302-96-0,Cc1ccc(NCCO)cc1O,non-mutagenic
+496-14-0,C1OCc2ccccc12,mutagenic
+125369-82-6,Fc1ccc(cc1)\C(=C\C=C\c2ccccc2)\C#N,mutagenic
+133762-82-0,COC1=NC(=O)N(CC(O)CN=N#N)C=C1,mutagenic
+19881-18-6,[O-][N+](=O)c1ccc(Oc2ccc(cc2)N=C=S)cc1,mutagenic
+79-29-8,CC(C)C(C)C,non-mutagenic
+215-62-3,c1ccc2nc3c4ccccc4c5ccccc5c3cc2c1,mutagenic
+70-00-8,OC[C@H]1O[C@H](C[C@@H]1O)N2C=C(C(=O)NC2=O)C(F)(F)F,mutagenic
+100-61-8,CNc1ccccc1,non-mutagenic
+473-90-5,OC(=O)C(=O)C(=O)O,non-mutagenic
+202-98-2,C1c2cccc3ccc4c5ccccc5cc1c4c23,mutagenic
+128753-90-2,CC(=O)Oc1ccc2c(OC3(C)OOC23C)c1,mutagenic
+1777-84-0,CCOc1ccc(NC(=O)C)cc1[N+](=O)[O-],mutagenic
+16219-75-3,C\C=C\1/C[C@H]2C[C@@H]1C=C2,non-mutagenic
+132742-01-9,[O-][N+](=O)c1ccc2ccc3c4CCC=Cc4cc5ccc1c2c35,mutagenic
+136112-71-5,Nc1ncnc2c1nc(c3ccc(cc3)[N+](=O)[O-])n2c4ccc(cc4)[N+](=O)[O-],mutagenic
+100-64-1,ON=C1CCCCC1,mutagenic
+113124-70-2,COC1=CC(=O)c2c([nH]cc3c4ccccc4nc23)C1=O,mutagenic
+539-21-9,NC(=N)NNc1ccc(cc1)N=NC(=S)N,mutagenic
+3697-30-1,CCc1c2ccccc2cc3c1ccc4ccccc34,mutagenic
+78411-56-0,Cc1cnc2c(ccc3c2nc(N)n3C)n1,mutagenic
+14925-39-4,BrC(=C)C=O,mutagenic
+3741-15-9,[O-][N+](=O)c1ccnc2ccccc12,mutagenic
+166664-83-1,Cn1c(N)nc2nc3ncccc3cc12,non-mutagenic
+57-27-2,CN1CCC23C4Oc5c(O)ccc(CC1C2C=CC4O)c35,non-mutagenic
+78448-08-5,Oc1ccc2ccc3[nH]c4ccc5ccccc5c4c3c2c1,mutagenic
+112-30-1,CCCCCCCCCCO,non-mutagenic
+36712-35-3,[O-][N+](=O)c1ccc(c2ccccc2[N+](=O)[O-])c(c1)[N+](=O)[O-],mutagenic
+1711-06-4,Cc1cccc(c1)C(=O)Cl,mutagenic
+90301-59-0,OCC1OC(CC1O)N2C=C(CCCl)C(=O)NC2=O,mutagenic
+89795-79-9,Nc1cccc2cnsc12,mutagenic
+226237-61-2,COc1c2ccoc2[n+]([O-])c3ccccc13,non-mutagenic
+NOCAS_M104,COc1cc2O[C@@H]3OC=C[C@H]3c2c4Oc5cccc(O)c5C(=O)c14,mutagenic
+107-64-2,CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC,non-mutagenic
+49792-23-6,CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(C5CCC34C)C(=O)O)C2C1)C(=O)O,non-mutagenic
+17722-52-0,OC(=O)CCC(=O)Nc1ccc(Cl)cc1,non-mutagenic
+73931-96-1,OC(Cn1ccnc1)c2ccc(CCc3ccccc3)cc2,non-mutagenic
+126-73-8,CCCCOP(=O)(OCCCC)OCCCC,non-mutagenic
+56656-97-4,COC(=O)\C(=C\c1oc(Br)cc1)\C#N,non-mutagenic
+137-08-6,CC(C)(CO)C(O)C(=O)NCCC(=O)O,non-mutagenic
+1086-00-6,ClCc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+97576-08-4,O[C@@H]1C=Cc2c(cc3ccc4c(ccc5ccc2c3c45)[N+](=O)[O-])[C@H]1O,mutagenic
+91-19-0,c1ccc2nccnc2c1,mutagenic
+39653-72-0,N#CC1=Cc2cccc3cccc1c23,mutagenic
+548-08-3,CN1CCc2cc3OCOc3c4c5ccccc5CC1c24,mutagenic
+18172-67-3,CC1(C)C2CCC(=C)C1C2,non-mutagenic
+57-67-0,NC(=N)NS(=O)(=O)c1ccc(N)cc1,non-mutagenic
+6257-64-3,CN(C)c1ccc(cc1)N=Nc2ccc(cc2)N(C)C,non-mutagenic
+1250-95-9,CC(C)CCCC(C)C1CCC2C3CC4OC45CC(O)CCC5(C)C3CCC12C,mutagenic
+136861-00-2,Nc1cc(c(c2ccccc2)c(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+540-51-2,OCCBr,mutagenic
+2846-29-9,CC(C)CCCC(C)C1CCC2C3C(OO)C=C4CC(O)CCC4(C)C3CCC12C,mutagenic
+NOCAS_M36,C[C@@H](O)CN(C)c1ccc(NN)nn1,mutagenic
+92-69-3,Oc1ccc(cc1)c2ccccc2,mutagenic
+14901-07-6,CC(=O)\C=C/C1=C(C)CCCC1(C)C,non-mutagenic
+67508-87-6,COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@@H]([C@@H](O)[C@H](C)O5)N(C)C)c4c(O)c3C(=O)c12)C(=O)C,mutagenic
+97-52-9,COc1cc(ccc1N)[N+](=O)[O-],mutagenic
+NOCAS_M411,C\C=C/1\C[C@H](C)[C@](O)(CO)C(=O)OCC2=CC[N@@+]3([O-])CC[C@@H](OC1=O)[C@@H]23,non-mutagenic
+84305-41-9,COC1(NC(=O)CSCC(N)C(=O)O)C2SCC(=C(N2C1=O)C(=O)O)CSc3nnnn3C,non-mutagenic
+131206-89-8,CN(C)CCCN1C=CN(C)C1\C=N\O,non-mutagenic
+129812-29-9,CC12OOC1(C)c3c(O2)ccc4ccccc34,non-mutagenic
+131862-19-6,CN(C)CCNC(=O)c1cccc2nc(oc12)c3ccccc3,non-mutagenic
+627-30-5,OCCCCl,mutagenic
+40180-04-9,OC(=O)COc1ccc(C(=O)c2cccs2)c(Cl)c1Cl,non-mutagenic
+26446-35-5,CC(=O)OC[C@H](O)CO,mutagenic
+625-45-6,COCC(=O)O,non-mutagenic
+131-91-9,Oc1ccc2ccccc2c1N=O,non-mutagenic
+143922-97-8,Cc1c(N)cccc1N=Nc2cccc(N)c2C,mutagenic
+51-28-5,Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+5216-25-1,Clc1ccc(cc1)C(Cl)(Cl)Cl,mutagenic
+32116-25-9,CC(=O)c1ccc([nH]1)[N+](=O)[O-],mutagenic
+133762-78-4,Nc1ncnc2c1cnn2CC(O)CN=N#N,mutagenic
+98-96-4,NC(=O)c1cnccn1,non-mutagenic
+67737-62-6,OC1C2OC2c3c(ccc4ccccc34)C1O,mutagenic
+17831-71-9,C=CC(=O)OCCOCCOCCOCCOC(=O)C=C,non-mutagenic
+27746-63-0,Clc1cc(cc(Cl)c1Cl)N2C(=O)CCC2=O,non-mutagenic
+106264-79-3,CSc1cc(SC)c(N)c(C)c1N,mutagenic
+644-21-3,CCN(N)c1ccccc1,mutagenic
+112-36-7,CCOCCOCCOCC,non-mutagenic
+99675-03-3,COP(=S)(NC(C)C)Oc1ccccc1C(=O)OC(C)C,non-mutagenic
+110-05-4,CC(C)(C)OOC(C)(C)C,non-mutagenic
+77-46-3,CC(=O)Nc1ccc(cc1)S(=O)(=O)c2ccc(NC(=O)C)cc2,non-mutagenic
+117760-93-7,Nc1cc2c3C=C[C@@H](O)[C@H](O)c3ccc2c4ccccc14,mutagenic
+332397-22-5,N\C(=N/OS(=O)(=O)O)\c1ccccc1,non-mutagenic
+29852-26-4,ClCc1cc2cccc3ccc4c5ccccc5cc1c4c23,mutagenic
+138-59-0,O[C@H]1CC(=C[C@@H](O)[C@@H]1O)C(=O)O,non-mutagenic
+96563-09-6,CC1c2cc(C)ccc2c3ccc(C)cc13,non-mutagenic
+105708-68-7,CC(=O)OC1Cc2ccc3ccc4cccc5cc1c2c3c45,mutagenic
+2832-40-8,CC(=O)Nc1ccc(cc1)N=Nc2cc(C)ccc2O,mutagenic
+4543-63-9,CNC(=O)NOC(=O)NC,mutagenic
+1120-71-4,O=S1(=O)CCCO1,mutagenic
+147293-14-9,Cn1c(N)nc2c3cnccc3ccc12,mutagenic
+132059-51-9,OC1OC(=O)C(=C1C(Cl)Br)Cl,mutagenic
+126420-94-8,Cc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,mutagenic
+1135-14-4,Nc1ccc(Sc2ccccc2)cc1,mutagenic
+2508-23-8,CC(=O)N(O)c1ccc2ccccc2c1,mutagenic
+14308-65-7,CNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+128714-76-1,[O-][N+](=O)c1ccc2ccc3c4ccccc4c(c5ccc1c2c35)[N+](=O)[O-],mutagenic
+5410-97-9,[O-][N+](=O)c1ccc2c(oc3ccccc23)c1,mutagenic
+628-02-4,CCCCCC(=O)N,non-mutagenic
+161696-98-6,CNc1ccc2nccnc2c1C,mutagenic
+2403-28-3,O=C(\C=C\c1ccc(cc1)c2ccccc2)c3ccccc3,non-mutagenic
+56961-79-6,Cc1c(Cl)cnc2ccccc12,non-mutagenic
+42011-48-3,[O-][N+](=O)c1oc(cc1)c2csc(NC(=O)C(F)(F)F)n2,mutagenic
+55-98-1,CS(=O)(=O)OCCCCOS(=O)(=O)C,mutagenic
+39965-42-9,CC(C)(C)NC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+NOCAS_M229,CCOC[C@H]1CO1,mutagenic
+36504-65-1,O1[C@@H]2C=Cc3c(cc4ccc5cccc6ccc3c4c56)[C@H]12,mutagenic
+80-07-9,Clc1ccc(cc1)S(=O)(=O)c2ccc(Cl)cc2,non-mutagenic
+512-56-1,COP(=O)(OC)OC,mutagenic
+3308-64-3,Cc1ccc2cc3c(ccc4ccccc34)c5CC(O)c1c25,non-mutagenic
+99523-58-7,Cc1ccc2nsc(NC(=O)C(Cl)Cl)c2c1,mutagenic
+626-16-4,ClCc1cccc(CCl)c1,non-mutagenic
+67019-29-8,O=C(Nc1ccccc1)Nc2snc3ccccc23,non-mutagenic
+25973-55-1,CCC(C)(C)c1cc(c(O)c(c1)C(C)(C)CC)n2nc3ccccc3n2,non-mutagenic
+17455-26-4,C1CCC2OCCOCCOCCOCCOC3CCCCC3OCCOCCOCCOCCOC2C1,non-mutagenic
+19785-01-4,COc1ccc(OC)c(\C=C\C)c1,non-mutagenic
+599-79-1,OC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)S(=O)(=O)Nc3ccccn3,non-mutagenic
+253-53-2,c1cc2cnncc2cn1,non-mutagenic
+25377-72-4,CC\C=C\C,non-mutagenic
+13345-23-8,Oc1ccc2ccc3cc4ccccc4c5ccc1c2c35,mutagenic
+6606-59-3,CC(=C)C(=O)OCCCCCCOC(=O)C(=C)C,non-mutagenic
+93-08-3,CC(=O)c1ccc2ccccc2c1,non-mutagenic
+532-27-4,ClCC(=O)c1ccccc1,non-mutagenic
+105735-71-5,[O-][N+](=O)c1cccc2c3ccc(c4cccc(c12)c34)[N+](=O)[O-],mutagenic
+115340-67-5,OC(=O)\C(=C(/C=O)\C(Cl)Cl)\Cl,mutagenic
+521-31-3,Nc1cccc2c(O)nnc(O)c12,non-mutagenic
+99523-60-1,CCC(=O)Nc1snc2ccc(C)cc12,non-mutagenic
+39638-73-8,NC1=NC(=O)N(C=C1O)C2OC(CO)C(O)C2O,non-mutagenic
+81-11-8,Nc1ccc(\C=C/c2ccc(N)cc2S(=O)(=O)O)c(c1)S(=O)(=O)O,non-mutagenic
+569-57-3,COc1ccc(cc1)C(=C(c2ccc(OC)cc2)c3ccc(OC)cc3)Cl,non-mutagenic
+38777-13-8,CC(C)Oc1ccccc1OC(=O)N(C)N=O,mutagenic
+115664-55-6,Oc1ccc2c(ccc3c4ccccc4c1c23)[N+](=O)[O-],mutagenic
+NOCAS_M493,CC(C)[C@@H]1CC=C(C)[C@H]2CC=C(C)C[C@H]12,non-mutagenic
+614-00-6,CN(N=O)c1ccccc1,mutagenic
+131862-20-9,CN(C)CCNC(=O)c1cccc2oc(nc12)c3ccccc3,non-mutagenic
+NOCAS_M103,CCCC[C@@H](CC)COC(=O)c1ccc(N(C)C)c(c1)[N+](=O)[O-],mutagenic
+35367-38-5,Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2,non-mutagenic
+38134-58-6,NC(CCC(=O)NC(CSC(=O)NCCCl)C(=O)NCC(=O)O)C(=O)O,mutagenic
+96918-15-9,o1ccc2cc3ccc4cccc5ccc(c12)c3c45,mutagenic
+3365-85-3,Nc1ccc(cc1)c2ccc(cc2)c3ccc(N)cc3,mutagenic
+480-19-3,COc1cc(ccc1O)C2=C(O)C(=O)c3c(O)cc(O)cc3O2,non-mutagenic
+107-46-0,C[Si](C)(C)O[Si](C)(C)C,non-mutagenic
+124-26-5,CCCCCCCCCCCCCCCCCC(=O)N,non-mutagenic
+115781-42-5,Cc1cnc2ccc3c(nc(NC4OC(C(O)C(O)C4O)C(=O)O)n3C)c2n1,non-mutagenic
+1719-53-5,CC[Si](Cl)(Cl)CC,non-mutagenic
+1024-41-5,Cc1ccc(cc1)S(=O)(=O)OCc2ccccc2,non-mutagenic
+497-56-3,Cc1c(O)cc(cc1[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+5003-48-5,CC(=O)Nc1ccc(OC(=O)c2ccccc2OC(=O)C)cc1,non-mutagenic
+1165-39-5,COc1cc2OC3OC=CC3c2c4OC(=O)C5=C(CCOC5=O)c14,mutagenic
+118517-21-8,CC(C)CCCC(C)C1CCC2C3CC4N(N5C(=O)c6ccccc6C5=O)C47CC(Cl)CCC7(C)C3CCC12C,non-mutagenic
+111017-06-2,COc1cc2CCN(C=O)c3cc4ccccc4c(c1OC)c23,mutagenic
+286-99-7,C1CCCCCC2OC2CCCC1,non-mutagenic
+50438-75-0,CN(C)c1ccc(CCO)cc1,mutagenic
+101489-26-3,Oc1cccc2Oc3cc4OC5OCCC5c4c(O)c3C(=O)c12,non-mutagenic
+155798-37-1,CCN(CCCl)c1ccc(OCCCCCNc2c3ccccc3nc4ccccc24)cc1,mutagenic
+17526-33-9,CC(=O)OCc1c2ccccc2cc3ccc4ccccc4c13,mutagenic
+59-00-7,OC(=O)c1cc(O)c2cccc(O)c2n1,non-mutagenic
+872-50-4,CN1CCCC1=O,non-mutagenic
+573-56-8,Oc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+75-86-5,CC(C)(O)C#N,non-mutagenic
+NOCAS_M481,CC(C)C[C@@H](C)N,non-mutagenic
+51-45-6,NCCc1c[nH]cn1,non-mutagenic
+1596-84-5,CN(C)NC(=O)CCC(=O)O,non-mutagenic
+575-44-0,Oc1ccc2c(O)cccc2c1,mutagenic
+314-13-6,Cc1cc(ccc1N=Nc2ccc3c(cc(c(N)c3c2O)S(=O)(=O)O)S(=O)(=O)O)c4ccc(N=Nc5ccc6c(cc(c(N)c6c5O)S(=O)(=O)O)S(=O)(=O)O)c(C)c4,mutagenic
+151751-83-6,CCOC(=O)N(CCC=O)N=O,mutagenic
+27762-78-3,CCOC(C)C(=O)C(O)O,mutagenic
+25584-83-2,CC(O)COC(=O)C=C,non-mutagenic
+87436-71-3,OC1C=Cc2c(Br)c3ccc4ccccc4c3cc2C1O,non-mutagenic
+93-45-8,Oc1ccc(Nc2ccc3ccccc3c2)cc1,non-mutagenic
+6358-53-8,COc1ccc(OC)c(c1)N=Nc2c(O)ccc3ccccc23,mutagenic
+26538-44-3,C[C@H]1CCC[C@@H](O)CCCCCc2cc(O)cc(O)c2C(=O)O1,non-mutagenic
+602-38-0,[O-][N+](=O)c1cccc2cccc(c12)[N+](=O)[O-],mutagenic
+309-36-4,CCC#C[C@@H](C)[C@@]1(CC=C)C(=O)NC(=O)N(C)C1=O,non-mutagenic
+139259-94-2,CC(=O)ON(OCc1ccc(C)cc1)C(=O)c2ccccc2,mutagenic
+114451-08-0,Cn1c(nc2c3cccnc3ccc12)[N+](=O)[O-],mutagenic
+2784-86-3,CC(=O)Nc1ccc2c(Cc3ccccc23)c1O,non-mutagenic
+50834-39-4,CSCCC(NC(=O)COc1ccc(Cl)cc1Cl)C(=O)O,non-mutagenic
+111753-73-2,COc1ccc(cc1)C(=C(CCC(=O)O)C#N)c2ccc(OC)cc2,non-mutagenic
+27602-80-8,COc1ccc(CC2CO2)cc1OC,mutagenic
+117760-95-9,[O-][N+](=O)c1ccccc1SS\C(=C(/Cl)\C(=C(Cl)Cl)Cl)\Cl,mutagenic
+173428-76-7,CC(=O)c1ccc2N=C3N(Cc2c1)C(=O)c4ccccc34,mutagenic
+NOCAS_M528,O=C(C1CCCCC1)N2C[C@H]3N(CCc4ccccc34)C(=O)C2,non-mutagenic
+96563-10-9,CC1c2cc(F)ccc2c3ccc(F)cc13,mutagenic
+1892-54-2,Nc1ccc2ccc3ccccc3c2c1,mutagenic
+139259-95-3,CC(=O)ON(OCc1ccc(cc1)c2ccccc2)C(=O)c3ccccc3,mutagenic
+1174-72-7,O(c1ccccc1)[Si](Oc2ccccc2)(Oc3ccccc3)Oc4ccccc4,non-mutagenic
+187585-43-9,COc1ccc(cc1[N+](=O)[O-])C2=C(C(=O)c3ccccc3O2)[N+](=O)[O-],mutagenic
+1912-31-8,CCCOS(=O)(=O)C,mutagenic
+603-83-8,Cc1c(N)cccc1[N+](=O)[O-],mutagenic
+580-17-6,Nc1cnc2ccccc2c1,mutagenic
+58-85-5,OC(=O)CCCCC1SCC2NC(=O)NC12,non-mutagenic
+614-45-9,CC(C)(C)OOC(=O)c1ccccc1,mutagenic
+34798-80-6,CC(=O)C1(CCNCC1)c2ccccc2,non-mutagenic
+38579-27-0,NCCCCC(N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(CCCCN)C(=O)O,non-mutagenic
+87-90-1,ClN1C(=O)N(Cl)C(=O)N(Cl)C1=O,non-mutagenic
+122367-97-9,CC1CC2C(Cc3cn(CC4CC4)c5cc(Br)cc2c35)N(C)C1,non-mutagenic
+14692-41-2,Cn1cnc2c3cccnc3ccc12,mutagenic
+126370-96-5,Clc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,mutagenic
+51787-75-8,Nc1cc(ccc1c2ccc(cc2)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+74-85-1,C=C,non-mutagenic
+130-17-6,Cc1ccc2nc(sc2c1S(=O)(=O)O)c3ccc(N)cc3,mutagenic
+NOCAS_M137,OCN1[C@H](O)[C@@H](O)N(CO)C1=O,mutagenic
+97851-14-4,Oc1ccc(cc1[N+](=O)[O-])c2cccc(c2)[N+](=O)[O-],mutagenic
+102000-59-9,Nc1cccc(N)c1C(=O)O,mutagenic
+113058-38-1,Oc1ccc2c3ccccc3c4cc5ccccc5cc4c2c1,mutagenic
+106-38-7,Cc1ccc(Br)cc1,non-mutagenic
+3375-84-6,CC(O)CN1CC(C)OC1=O,non-mutagenic
+8047-99-2,CCNS(=O)(=O)c1ccccc1C,mutagenic
+85-84-7,Nc1ccc2ccccc2c1N=Nc3ccccc3,non-mutagenic
+612-57-7,Clc1ccc2ncccc2c1,mutagenic
+59901-90-5,CC(=O)O[C@H]([C@@H]1CO1)c2ccc3OCOc3c2,mutagenic
+141-32-2,CCCCOC(=O)C=C,non-mutagenic
+2921-88-2,CCOP(=S)(OCC)Oc1nc(Cl)c(Cl)cc1Cl,non-mutagenic
+2107-76-8,CC1=CC(=O)Oc2cc(O)cc(O)c12,non-mutagenic
+117-02-2,Cc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,mutagenic
+122365-36-0,Nc1c2ncn(c2nc[n+]1[O-])C(c3ccccc3)(c4ccccc4)c5ccccc5,mutagenic
+1672-88-4,[O-][N+](=O)c1oc(\C=C\C=N\N2CC(=O)NC2=O)cc1,mutagenic
+21229-99-2,ONc1ccc(Sc2ccccc2)cc1,mutagenic
+294-93-9,C1COCCOCCOCCO1,non-mutagenic
+2417-77-8,BrCc1c2ccccc2cc3ccccc13,mutagenic
+42397-65-9,[O-][N+](=O)c1ccc2ccc3ccc(c4ccc1c2c34)[N+](=O)[O-],mutagenic
+3845-76-9,CN(C)CCCNC(=O)C=C,non-mutagenic
+23043-60-9,Nc1cccc2nc3ccccc3c(N)c12,mutagenic
+101043-65-6,[O-][N+](=O)c1ccc2ccc3c(ccc4ccc1c2c34)N=O,mutagenic
+100-01-6,Nc1ccc(cc1)[N+](=O)[O-],mutagenic
+4531-49-1,COc1ccccc1NC(=O)C(N=Nc2ccc(cc2Cl)c3ccc(N=NC(C(=O)C)C(=O)Nc4ccccc4OC)c(Cl)c3)C(=O)C,non-mutagenic
+541-73-1,Clc1cccc(Cl)c1,non-mutagenic
+18868-66-1,CCc1c2ccccc2cc3ccc4ccccc4c13,non-mutagenic
+60687-93-6,CC(=O)NCCc1ccc(O)c(c1)c2c(O)c(O)c3C(=O)c4cc(O)c(C(=O)O)c(C(=O)O)c4C(=O)c3c2O,non-mutagenic
+2373-98-0,Nc1ccc(cc1O)c2ccc(N)c(O)c2,mutagenic
+33301-41-6,CS(=O)(=O)OC1CN(C1)C(c2ccccc2)c3ccccc3,mutagenic
+60-23-1,NCCS,non-mutagenic
+35077-51-1,CN(C(=O)C)c1ccc(cc1)N=Nc2ccc(cc2)N(C)C(=O)C,non-mutagenic
+299-11-6,C[n+]1c2ccccc2nc3ccccc13,mutagenic
+5275-46-7,CC(C)(N=O)[N+](=O)[O-],mutagenic
+111-49-9,C1CCCNCC1,non-mutagenic
+591-17-3,Cc1cccc(Br)c1,non-mutagenic
+120-32-1,Oc1ccc(Cl)cc1Cc2ccccc2,non-mutagenic
+104-94-9,COc1ccc(N)cc1,mutagenic
+NOCAS_M122,CCOP(=O)(OCC)[C@@H](C)NC(=O)N(CCCl)N=O,mutagenic
+3062-57-5,[O-][N+](=O)c1ccc2[nH]c3c(cccc3c2c1)[N+](=O)[O-],mutagenic
+NOCAS_M440,C[C@@H](O)C(=O)O,non-mutagenic
+139953-77-8,OC(=O)c1ccc(\C=N\n2nnc3c4ccccc4nc3c2O)cc1,mutagenic
+95-19-2,CCCCCCCCCCCCCCCCCC1=NCCN1CCO,non-mutagenic
+2243-47-2,Nc1cccc(c1)c2ccccc2,mutagenic
+495-18-1,ONC(=O)c1ccccc1,mutagenic
+140-31-8,NCCN1CCNCC1,non-mutagenic
+1204-68-8,Cc1ccc(cc1)N(CCCl)CCCl,non-mutagenic
+132172-58-8,OC1C=Cc2c(C1O)c3ccccc3c4cc5ccccc5cc24,mutagenic
+146724-32-5,COC(=O)c1cc2ccc3cccnc3c2[nH]1,non-mutagenic
+120812-46-6,[O-][N+](=O)c1ccc2ccc3cccc4c5CCCCc5c1c2c34,mutagenic
+608-93-5,Clc1cc(Cl)c(Cl)c(Cl)c1Cl,non-mutagenic
+965-52-6,Oc1ccc(cc1)C(=O)N\N=C\c2oc(cc2)[N+](=O)[O-],mutagenic
+138805-32-0,CC(=O)Nc1ccc(C)c(c1)N=[N+]([O-])c2cc(NC(=O)C)ccc2C,non-mutagenic
+315-22-0,C[C@H]1C(=O)O[C@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23,non-mutagenic
+135673-14-2,CC(=O)Nc1ccc(Oc2ccc(cc2)N=O)cc1,mutagenic
+302-70-5,C[N+]([O-])(CCCl)CCCl,mutagenic
+136-85-6,Cc1ccc2[nH]nnc2c1,non-mutagenic
+185376-54-9,Cc1c(NO)cc(NO)cc1[N+](=O)[O-],mutagenic
+143603-81-0,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3ccc(C)cc3,non-mutagenic
+71382-49-5,N1C2C1c3cc4c(ccc5ccccc45)cc3c6ccccc26,mutagenic
+19190-80-8,COC(=O)C1OC1c2ccccc2,mutagenic
+98-94-2,CN(C)C1CCCCC1,non-mutagenic
+42308-20-3,CC(Br)C(=O)Nc1ccccc1,mutagenic
+96687-77-3,OC(=O)C1CSC(N1C(=O)CCSSCCC(=O)N2C(CSC2c3ccccc3O)C(=O)O)c4ccccc4O,non-mutagenic
+NOCAS_M314,CN1C[C@@H](C=C2[C@@H]1Cc3c[nH]c4cccc2c34)C(=O)N[C@@]5(C)O[C@]6(O)[C@H]7CCCN7C(=O)[C@@H](Cc8ccccc8)N6C5=O,non-mutagenic
+607-57-8,[O-][N+](=O)c1ccc2c(Cc3ccccc23)c1,mutagenic
+34834-67-8,CN1C(CC(O)C1=O)c2cccnc2,non-mutagenic
+19337-19-0,CC(=O)Nc1ccc(cc1)C(=O)\C=C\c2ccccc2,non-mutagenic
+892-21-7,[O-][N+](=O)c1ccc2c3ccccc3c4cccc1c24,mutagenic
+111-84-2,CCCCCCCCC,non-mutagenic
+128531-59-9,CCN(CC)C(=S)SSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O,non-mutagenic
+603-50-9,CC(=O)Oc1ccc(cc1)C(c2ccc(OC(=O)C)cc2)c3ccccn3,non-mutagenic
+5850-89-5,Cc1ccc(N=Nc2c(O)ccc3ccccc23)c(c1)S(=O)(=O)O,non-mutagenic
+104499-47-0,CNCCN(Cc1ccc(OC)cc1)c2ccccn2,non-mutagenic
+139953-95-0,CCCO\C=C\C=C\C=C\C=C\C=C\CC,mutagenic
+13551-87-6,COC[C@H](O)Cn1ccnc1[N+](=O)[O-],mutagenic
+3648-20-2,CCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCC,non-mutagenic
+89300-15-2,CC\C=C\C=C\C=C\C=C\C=C\OCC(O)CO,mutagenic
+5166-35-8,CC(Cl)C(=C)C,mutagenic
+523-61-5,COc1c(C(=O)O)c(O)nc2ccccc12,non-mutagenic
+60-13-9,CC(N)Cc1ccccc1,non-mutagenic
+108-30-5,O=C1CCC(=O)O1,non-mutagenic
+495-48-7,[O-][N+](=Nc1ccccc1)c2ccccc2,mutagenic
+69245-38-1,CC[C@@]1(O)C[C@H](O[C@H]2C[C@@H]([C@H](O[C@H]3C[C@H](O)[C@H](O[C@@H]4O[C@@H](C)C(=CC4=N)O)[C@H](C)O3)[C@H](C)O2)N(C)C)c5c(O)c6C(=O)c7c(O)ccc(O)c7C(=O)c6cc5[C@H]1C(=O)OC,mutagenic
+97461-41-1,CC(C)(C)CNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+90-12-0,Cc1cccc2ccccc12,non-mutagenic
+3411-58-3,CCOC(=O)C(N)CS,mutagenic
+53737-95-4,O1C=C[C@H]2[C@@H]1Oc3ccccc23,mutagenic
+50-29-3,Clc1ccc(cc1)C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl,non-mutagenic
+53478-38-9,CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,mutagenic
+62-56-6,NC(=S)N,non-mutagenic
+95-83-0,Nc1ccc(Cl)cc1N,mutagenic
+77784-22-6,COc1ccc2c(cc3N(C)CCc4cc5OCOc5c2c34)c1OC,mutagenic
+23077-88-5,OCCOc1cc(O)c2C(=O)C(=C(Oc2c1)c3ccc(OCCO)c(OCCO)c3)O,non-mutagenic
+10125-76-5,O=Nc1ccc(cc1)c2ccccc2,mutagenic
+102-70-5,C=CCN(CC=C)CC=C,non-mutagenic
+79-36-7,ClC(Cl)C(=O)Cl,mutagenic
+3722-54-1,COc1ccc2Oc3cc(OC)cc(OC)c3C(=O)c2c1,mutagenic
+1122-62-9,CC(=O)c1ccccn1,non-mutagenic
+139259-98-6,CC(=O)ON(OCc1ccc(cc1)[N+](=O)[O-])C(=O)c2ccccc2,mutagenic
+8062-14-4,Nc1cc(N)c(cc1N=Nc2ccc(cc2)S(=O)(=O)N)N=Nc3ccc(cc3)S(=O)(=O)N,mutagenic
+84506-41-2,COC(=O)C(C)CN=N#N,mutagenic
+66842-41-9,C1O[C@@H]1c2cc3c4ccccc4ccc3c5ccccc25,mutagenic
+100-75-4,O=NN1CCCCC1,mutagenic
+83473-93-2,CSCCC(=O)N1C(CSC1c2ccccc2O)C(=O)O,non-mutagenic
+101688-02-2,[O-][N+](=O)c1oc2ccc3cc(ccc3c2c1)N(CCCl)CCCl,mutagenic
+138331-98-3,OC1OC(CN=N#N)C(O)C(O)C1O,mutagenic
+26675-46-7,FC(F)OC(Cl)C(F)(F)F,non-mutagenic
+121-57-3,Nc1ccc(cc1)S(=O)(=O)O,non-mutagenic
+155164-60-6,ClC1=C(Cl)C(=O)N(N=C1)S(=O)(=O)c2ccc(Cl)cc2,non-mutagenic
+104-40-5,CCCCCCCCCc1ccc(O)cc1,non-mutagenic
+37597-20-9,COc1cc2CCN(Cc2cc1OC)N=O,mutagenic
+6379-69-7,C\C=C\C(=O)OC1CC2OC3C=C(C)C(=O)CC3(C)C1(C)C24CO4,non-mutagenic
+52101-49-2,CC(=O)c1oc(c(c2ccccc2)c1c3ccccc3)[N+](=O)[O-],mutagenic
+599-07-5,CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C5CCC34C)C(=O)O)C2C1)C(=O)O,non-mutagenic
+491-64-5,COc1ccc2Oc3cc(O)cc(O)c3C(=O)c2c1,mutagenic
+130-80-3,CCC(=O)Oc1ccc(cc1)\C(=C(/CC)\c2ccc(OC(=O)CC)cc2)\CC,non-mutagenic
+710-25-8,NC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+124858-35-1,CC1CCc2c(N3CCC(O)CC3)c(F)cc4C(=O)C(=CN1c24)C(=O)O,non-mutagenic
+111-02-4,CC(=CCC\C(=C/CC\C(=C/CC\C=C(\C)/CC\C=C(\C)/CCC=C(C)C)\C)\C)C,non-mutagenic
+58-15-1,CN(C)C1=C(C)N(C)N(C1=O)c2ccccc2,mutagenic
+96-29-7,CC\C(=N/O)\C,mutagenic
+136-95-8,Nc1nc2ccccc2s1,non-mutagenic
+4813-50-7,CCCCOO,mutagenic
+24777-14-8,COc1cc(ccc1O)c2nc(c3ccccc3)c([nH]2)c4ccccc4,mutagenic
+396-01-0,Nc1nc(N)c2nc(c(N)nc2n1)c3ccccc3,non-mutagenic
+585-08-0,O1C2C1c3ccccc3c4ccccc24,mutagenic
+NOCAS_M94,C[C@@H]1[C@H](O)CCC2=CC(=O)[C@]3(O[C@H]3[C@@]12C)[C@H]4O[C@H]4CO,mutagenic
+89415-69-0,BrCCOC(=O)C(=O)OCCBr,mutagenic
+30461-65-5,Oc1cccc2Oc3c4[C@@H]5C=CO[C@H]5Oc4cc(O)c3C(=O)c12,mutagenic
+48134-75-4,C[n+]1ccc(cc1)c2ccccc2,non-mutagenic
+118-79-6,Oc1c(Br)cc(Br)cc1Br,non-mutagenic
+73536-69-3,COC(=O)c1cc(OC)c2OCOc2c1c3c4OCOc4c(OC)cc3C(=O)OC,non-mutagenic
+150446-00-7,Cc1c(\C=N\OCc2cccc(c2)[N+](=O)[O-])c3cc(ccc3n1Cc4ccccc4)[N+](=O)[O-],mutagenic
+4514-19-6,Cc1cc2c3ccccc3cc4ccc5cccc1c5c24,mutagenic
+280-57-9,C1CN2CCN1CC2,non-mutagenic
+458-37-7,COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O,non-mutagenic
+7576-88-7,Cc1nc2ccc(N)cc2nc1C,mutagenic
+NOCAS_M376,Cl[C@H]1C=C[C@@H]2[C@@H]1[C@@]3(Cl)C(=C(Cl)[C@]2(Cl)C3(Cl)Cl)Cl,non-mutagenic
+106532-77-8,[O-][N+](=O)c1cccc(c1)C(=O)\N=C\2/SN(C(=O)c3cccc(c3)[N+](=O)[O-])c4ccc(cc24)[N+](=O)[O-],mutagenic
+532-82-1,Nc1ccc(N=Nc2ccccc2)c(N)c1,mutagenic
+NOCAS_M326,C[C@@H](O)CO,non-mutagenic
+40809-41-4,CCC(CCCC(=O)O)COC(=O)c1ccccc1C(=O)O,non-mutagenic
+2148-31-4,CC(=O)NC(CS\C(=C\Cl)\Cl)C(=O)O,mutagenic
+106-63-8,CC(C)COC(=O)C=C,non-mutagenic
+345667-60-9,CCc1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+606-22-4,Nc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+75-99-0,CC(Cl)(Cl)C(=O)O,non-mutagenic
+133-07-3,ClC(Cl)(Cl)SN1C(=O)c2ccccc2C1=O,mutagenic
+147-24-0,CN(C)CCOC(c1ccccc1)c2ccccc2,non-mutagenic
+219-08-9,C1C=Cc2c1ccc3c2ccc4ccccc34,mutagenic
+16430-32-3,CC(=O)OCc1c2ccccc2cc3ccccc13,mutagenic
+3121-61-7,COCCOC(=O)C=C,non-mutagenic
+35282-68-9,CN(C)c1ccc(cc1)N=Nc2ccccc2CO,mutagenic
+107-18-6,OCC=C,non-mutagenic
+4901-51-3,Oc1cc(Cl)c(Cl)c(Cl)c1Cl,non-mutagenic
+121-60-8,CC(=O)Nc1ccc(cc1)S(=O)(=O)Cl,non-mutagenic
+84434-42-4,Cc1c(N)ccc(N=Nc2ccccc2)c1N,mutagenic
+111-24-0,BrCCCCCBr,mutagenic
+75-04-7,CCN,non-mutagenic
+107-07-3,OCCCl,mutagenic
+112-53-8,CCCCCCCCCCCCO,non-mutagenic
+1785-51-9,O=C1C=Cc2ccc3C(=O)C=Cc4ccc1c2c34,mutagenic
+149418-41-7,BrC1=C(Br)C(=O)OC1,mutagenic
+634-93-5,Nc1c(Cl)cc(Cl)cc1Cl,non-mutagenic
+191-30-0,c1ccc2c(c1)cc3ccc4cccc5c6ccccc6c2c3c45,mutagenic
+110-96-3,CC(C)CNCC(C)C,non-mutagenic
+88741-67-7,COc1ccc2C(=O)c3c(O)c(OC)cc4ccnc(c2c1)c34,mutagenic
+61-82-5,Nc1nc[nH]n1,non-mutagenic
+25413-02-9,CCOC(=O)CNC(=O)C(C)Br,mutagenic
+145531-22-2,NCCCS(=O)(=O)Nc1ccc(Nc2c3ccc(cc3nc4ccc(cc24)N=N#N)N=N#N)cc1,mutagenic
+74367-78-5,[O-][N+](=O)c1cc(CCl)cc(c1)[N+](=O)[O-],mutagenic
+NOCAS_M188,C[C@@H](O)[C@H](NC(=O)[C@H](C)[C@H](O)[C@H](C)NC(=O)[C@@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@H](N)C(=O)N)[C@@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCN[C@H](C)c7ccccc7,mutagenic
+7756-96-9,CCCCOC(=O)c1ccccc1N,non-mutagenic
+16354-50-0,CCc1c2ccccc2c(C)c3c1ccc4ccccc34,non-mutagenic
+93673-32-6,C1C2=C3C=CC=CC3=CC4=C5OC5=C(C24)c6ccccc16,mutagenic
+2998-23-4,CCCCCOC(=O)C=C,non-mutagenic
+926-06-7,CC(C)OS(=O)(=O)C,mutagenic
+2422-79-9,Cc1c2ccccc2cc3ccc4ccccc4c13,mutagenic
+86853-97-6,O=C1c2ccc3ccccc3c2c4c1ccc5ccccc45,mutagenic
+59405-31-1,OS(=O)(=O)CNc1ccc(cc1)N=Nc2cccnc2,non-mutagenic
+477-73-6,Cc1cc2nc3cc(C)c(N)cc3[n+](c4ccccc4)c2cc1N,mutagenic
+69-09-0,CN(C)CCCN1c2ccccc2Sc3ccc(Cl)cc13,non-mutagenic
+NOCAS_M393,COC(=C1[C@@H](C(=C(COC(=O)N)N=C1C)C(=O)OC(C)C)c2cccc(Cl)c2Cl)O,non-mutagenic
+16238-56-5,Cc1c2ccccc2c(CBr)c3ccc4ccccc4c13,mutagenic
+61788-44-1,C(=C\c1cccc(\C=C\c2ccccc2)c1)/c3ccccc3,non-mutagenic
+17024-19-0,[O-][N+](=O)c1ccc2ccc3ccccc3c2c1,mutagenic
+96287-03-5,Cc1cccn2c1nc3c(C)c(N)cnc23,mutagenic
+71422-67-8,Fc1cccc(F)c1C(=O)NC(=O)Nc2cc(Cl)c(Oc3ncc(cc3Cl)C(F)(F)F)c(Cl)c2,non-mutagenic
+NOCAS_M419,CCCCCCCCCCCCOC[C@H]1CO1,non-mutagenic
+114414-79-8,CC1C2C(=Nc3ccccc23)N(C)c4ccccc14,mutagenic
+3697-24-3,Cc1cc2ccccc2c3ccc4ccccc4c13,mutagenic
+844-26-8,Oc1c(Cl)cc(Cl)cc1S(=O)c2cc(Cl)cc(Cl)c2O,mutagenic
+14160-38-4,CC(C)(C)C1=CC(=O)C=C(C1=O)C2=CC(=O)C=C(C2=O)C(C)(C)C,mutagenic
+2444-36-2,OC(=O)Cc1ccccc1Cl,non-mutagenic
+26266-68-2,CCC(CCC=C)C=O,non-mutagenic
+1698-60-8,NC1=C(Cl)C(=O)N(N=C1)c2ccccc2,non-mutagenic
+20830-81-3,COc1cccc2C(=O)c3c(O)c4CC(O)(CC(OC5CC(N)C(O)C(C)O5)c4c(O)c3C(=O)c12)C(=O)C,mutagenic
+67464-46-4,N1C2C1c3ccccc3c4ccccc24,mutagenic
+NOCAS_M125,O1[C@@H]2[C@H]1c3c4ccccc4cc5c6ccccc6cc2c35,mutagenic
+60-93-5,COc1ccc2nccc([C@@H](O)[C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1,non-mutagenic
+91687-67-1,CC(Br)C(=O)NCc1ccc(Cl)cc1,mutagenic
+70955-02-1,NNC(=O)CNc1ccc2ccccc2c1,non-mutagenic
+138542-40-2,[O-][N+](=O)c1cc2ccc3cc4ccccc4c5ccc(c1)c2c35,mutagenic
+105427-01-8,CC1(CO1)C(=O)Nc2ccccc2,mutagenic
+66-22-8,Oc1ccnc(O)n1,non-mutagenic
+162050-11-5,COC(=O)C1O\C(=N/O)\C(=C1Cl)Cl,non-mutagenic
+97546-74-2,CC1(C)CC(C(=O)NC(CO)C(O)CO)C(C)(C)[N+]1=O,non-mutagenic
+88492-34-6,Nc1ncnc2c1ncn2CC(O)CN=N#N,mutagenic
+17528-53-9,OC(=O)COc1ccc(cc1)N(CCCl)CCCl,mutagenic
+103616-17-7,OC(=O)C1=C(O)C(=O)C=CO1,non-mutagenic
+602-01-7,Cc1cccc(c1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+128753-91-3,CC(=O)Oc1ccc2OC3(C)OOC3(C)c2c1,mutagenic
+107097-80-3,CCCCCN(CCCOC)C(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1,non-mutagenic
+30418-53-2,C=CC(=O)c1ccc2OCOc2c1,non-mutagenic
+469-83-0,C[C@@]12CCc3occc3C1CC[C@@]45CC(CCC24)C(O)(CO)C5,non-mutagenic
+65847-03-2,COc1c2ccoc2nc3c(O)c4OCOc4c(CC=C(C)C)c13,non-mutagenic
+696-54-8,O\N=C\c1ccncc1,non-mutagenic
+33979-15-6,CC1\C=C(\C=C)/C(=O)OC2CC[N+]3(C)CC=C(COC(=O)C1(C)OC(=O)C)C23O,mutagenic
+142-84-7,CCCNCCC,non-mutagenic
+NOCAS_M37,N[C@H](CCC(=O)N[C@H](CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)NCC(=O)O)C(=O)O,mutagenic
+33203-82-6,CCN(CC)c1ccc2nc3ccc(cc3[o+]c2c1)N(CC)CC,mutagenic
+109143-20-6,COc1ccc(N(CCCl)CCCl)c2cc(oc12)[N+](=O)[O-],mutagenic
+124617-85-2,CCCCCCCCON(OC(=O)C)C(=O)c1ccccc1,mutagenic
+6795-16-0,COc1cc2OC3OCCC3c2c4Oc5cccc(O)c5C(=O)c14,non-mutagenic
+531-85-1,Nc1ccc(cc1)c2ccc(N)cc2,mutagenic
+625-86-5,Cc1oc(C)cc1,non-mutagenic
+16339-05-2,CCCCCN(CCCC)N=O,mutagenic
+98046-72-1,Cc1cccn2c1nc3c(C)c(NO)cnc23,mutagenic
+303-47-9,C[C@H]1Cc2c(Cl)cc(C(=O)N[C@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1,non-mutagenic
+97606-15-0,N1C2C1c3cscc3c4cscc24,mutagenic
+NOCAS_M191,Clc1ccc(CC[C@H]2CO2)cc1,mutagenic
+134959-60-7,Cc1ccc(\N=C\c2cccc3cccnc23)c(c1)C(=O)O,non-mutagenic
+121-69-7,CN(C)c1ccccc1,non-mutagenic
+253-73-6,c1cnc2cnncc2c1,non-mutagenic
+96-26-4,OCC(=O)CO,mutagenic
+100-21-0,OC(=O)c1ccc(cc1)C(=O)O,non-mutagenic
+20927-95-1,[O-][N+](=O)c1ccc2oc3ccccc3c2c1,mutagenic
+553-24-2,CN(C)c1ccc2nc3cc(C)c(N)cc3nc2c1,mutagenic
+114020-51-8,COc1cccc2c1CC(c3ccc4OCOc4c23)[N+](=O)[O-],mutagenic
+528-75-6,[O-][N+](=O)c1ccc(C=O)c(c1)[N+](=O)[O-],mutagenic
+6217-19-2,CCN(CC)c1ccc(cc1)[N+]#N,mutagenic
+121-14-2,Cc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+1912-24-9,CCNc1nc(Cl)nc(NC(C)C)n1,non-mutagenic
+162022-91-5,COc1nncc2ccncc12,non-mutagenic
+NOCAS_M308,N[C@@H](Cc1ccc(O)c(c1)[N+](=O)[O-])C(=O)O,non-mutagenic
+69658-91-9,CN(N=O)c1cccnc1,non-mutagenic
+101-72-4,CC(C)Nc1ccc(Nc2ccccc2)cc1,non-mutagenic
+151910-75-7,OC1C=Cc2c(ccc3cc4c(cc23)C(O)C(O)c5ccccc45)C1O,non-mutagenic
+4399-80-8,CC1(C)CC(C(=O)N)C(C)(C)N1O,non-mutagenic
+159092-69-0,[O-][N+](=O)c1ccc2c(ccc3ccc(cc23)[N+](=O)[O-])c1,mutagenic
+127-90-2,ClC(COCC(Cl)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,mutagenic
+1222-98-6,[O-][N+](=O)c1ccc(\C=C\C(=O)c2ccccc2)cc1,mutagenic
+194-03-6,c1cc2ccc3cccc4ncc(c1)c2c34,mutagenic
+67411-86-3,OCc1cc2ccccc2c3ccc4ccccc4c13,mutagenic
+150446-03-0,Cc1c(\C=N\OCc2ccccc2)c3cc(ccc3n1Cc4cccc(c4)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+92-06-8,c1ccc(cc1)c2cccc(c2)c3ccccc3,non-mutagenic
+110-72-5,CCNCCN,non-mutagenic
+130942-88-0,Cc1c2ccccc2c(COS(=O)(=O)O)c3ccccc13,mutagenic
+113163-24-9,C1Cc2ccc3cccnc3c2C4OC14,mutagenic
+2045-52-5,CN(C)CCN(Cc1ccccc1)c2ccccc2,non-mutagenic
+112-92-5,CCCCCCCCCCCCCCCCCCO,non-mutagenic
+187585-11-1,COc1ccc(cc1N)C2=C(N)C(=O)c3ccccc3O2,mutagenic
+6807-96-1,Oc1cc(O)c2C(=O)c3c(O)c4[C@@H]5C=CO[C@@H]5Oc4cc3C(=O)c2c1,mutagenic
+98499-61-7,CSCNc1ccccc1C(=O)C,non-mutagenic
+531-75-9,OC[C@H]1O[C@@H](Oc2cc3C=CC(=O)Oc3cc2O)[C@H](O)[C@@H](O)[C@@H]1O,non-mutagenic
+117-79-3,Nc1ccc2C(=O)c3ccccc3C(=O)c2c1,mutagenic
+98-30-6,CS(=O)(=O)c1ccc(O)c(N)c1,non-mutagenic
+118244-44-3,CC(=CCC\C(=C\CC\C(=C\C(=O)OCC(=O)C1(O)CCC2C3CCC4=CC(=O)C=CC4(C)C3C(O)CC12C)\C)\C)C,non-mutagenic
+27729-95-9,COc1ccc(cc1)[C@H]2O[C@@H]2C(=O)c3ccccc3,mutagenic
+384-22-5,[O-][N+](=O)c1ccccc1C(F)(F)F,non-mutagenic
+16650-32-1,Fc1ccc(F)c2ncccc12,mutagenic
+24167-40-6,CCN(CC)CCn1nc2c3ccc(Cl)cc3Sc4c(CO)ccc1c24,mutagenic
+129665-16-3,[O-][n+]1c2ccccc2c3ccc4cccc5ccc1c3c45,mutagenic
+128669-18-1,CN1C=CN(CCOCC#C)C1\C=N\O,non-mutagenic
+105708-73-4,CC(=O)OCc1c2cccc3ccc4cc5cccc6ccc1c(c56)c4c23,mutagenic
+6795-27-3,CC(=O)N\N=C\C1=CN(O)c2ccccc2N1O,mutagenic
+NOCAS_M153,Cl[C@@H]1CN(C[C@H]1Cl)N=O,mutagenic
+2243-62-1,Nc1cccc2c(N)cccc12,mutagenic
+14919-77-8,NC(CO)C(=O)NNCc1ccc(O)c(O)c1O,mutagenic
+611-23-4,Cc1ccccc1N=O,mutagenic
+60877-91-0,Oc1cccc(\C=N\c2snc3ccccc23)c1,mutagenic
+835-71-2,Cc1ccc(cc1)c2oc3ccccc3n2,non-mutagenic
+14204-98-9,CNc1ccc2ncccc2c1N,non-mutagenic
+16169-16-7,ONc1ccc(cc1)[N+](=O)[O-],mutagenic
+122-80-5,CC(=O)Nc1ccc(N)cc1,mutagenic
+716-53-0,Clc1c2ccccc2cc3ccccc13,mutagenic
+NOCAS_M295,CCCCOC[C@H]1CO1,mutagenic
+85-98-3,CCN(C(=O)N(CC)c1ccccc1)c2ccccc2,non-mutagenic
+128-37-0,Cc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C,non-mutagenic
+58-19-5,CC1CC2(C)C(CCC3C4CCC(O)C4(C)CCC23)CC1=O,non-mutagenic
+NOCAS_M559,CC[C@@H](C)N,non-mutagenic
+62573-57-3,CCC(CC)c1cccc(OC(=O)N(C)N=O)c1,mutagenic
+147974-61-6,CC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)C)ccc1N,mutagenic
+97-18-7,Oc1c(Cl)cc(Cl)cc1Sc2cc(Cl)cc(Cl)c2O,non-mutagenic
+25413-64-3,CCCCN(CCC)N=O,mutagenic
+116169-87-0,Cn1ccnc1N=O,mutagenic
+130536-37-7,O1C2C=Cc3ncccc3C12,non-mutagenic
+3688-79-7,COc1ccc2c3ccccc3C(=O)c4cccc1c24,mutagenic
+35945-34-7,CCN(CC)c1ccc(cc1)N=Nc2ccc(cc2C#N)[N+](=O)[O-],mutagenic
+57-92-1,CNC1C(O)C(O)C(CO)OC1OC2C(OC3C(O)C(O)C(N=C(N)N)C(O)C3N=C(N)N)OC(C)C2(O)C=O,mutagenic
+26093-31-2,CC1=CC(=O)Oc2cc(N)ccc12,non-mutagenic
+95331-48-9,CC(=O)N(O)c1ccc2ccc3cccc4ccc1c2c34,mutagenic
+90243-66-6,CC1SCC(NC1=O)C(=O)NC(Cc2c[nH]cn2)C(=O)N3CCCC3C(=O)N,non-mutagenic
+3366-61-8,CC(=O)Nc1ccc(cc1)c2ccc(N)cc2,mutagenic
+834-28-6,NC(=N)N=C(N)NCCc1ccccc1,non-mutagenic
+1155-38-0,Cc1c2C3OC3c4ccccc4c2cc5ccccc15,mutagenic
+132172-57-7,OC1C=Cc2c(C1O)c3cc4ccccc4cc3c5ccccc25,mutagenic
+NOCAS_M486,CCCC[C@@H](CC)COC(=O)CCCCCCCCC(=O)OC[C@H](CC)CCCC,non-mutagenic
+18024-11-8,Cc1ccc(C)c2c1c3ccccc3n2C,mutagenic
+36099-26-0,C1O[C@@H]1c2ccc(cc2)c3ccccc3,mutagenic
+527-17-3,CC1=C(C)C(=O)C(=C(C)C1=O)C,non-mutagenic
+106-42-3,Cc1ccc(C)cc1,non-mutagenic
+146-22-5,[O-][N+](=O)c1ccc2NC(=O)CN=C(c3ccccc3)c2c1,non-mutagenic
+6325-54-8,ClCc1c2ccccc2cc3c1ccc4ccccc34,mutagenic
+498-02-2,COc1cc(ccc1O)C(=O)C,non-mutagenic
+95-87-4,Cc1ccc(C)c(O)c1,non-mutagenic
+13345-62-5,Cc1c2ccccc2c(CCl)c3ccc4ccccc4c13,mutagenic
+314084-63-4,CCc1cc(cc(CC)c1N)c2ccccc2,non-mutagenic
+121625-58-9,CC1=CC2CCCCC2c3ccccc13,mutagenic
+110044-40-1,Cc1cc2c3C4OC4C(O)C(O)c3ccc2c5ccccc15,non-mutagenic
+71-23-8,CCCO,non-mutagenic
+2798-25-6,COc1cc(O)c2C(=O)c3c(O)ccc(O)c3Oc2c1,mutagenic
+99-09-2,Nc1cccc(c1)[N+](=O)[O-],mutagenic
+16757-81-6,Cc1ccc2ccc3c4ccccc4cc5ccc1c2c35,mutagenic
+11042-64-1,COc1cc(\C=C\C(=O)OC2CCC34CC35CCC6(C)C(CCC6(C)C5CCC4C2(C)C)C(C)CCC=C(C)C)ccc1O,non-mutagenic
+7319-59-7,CC(=O)OC1Cc2c(C)ccc3cc4c(ccc5ccccc45)c1c23,mutagenic
+NOCAS_M186,C[C@@H](O)[C@H](NC(=O)[C@@H](C)[C@@H](O)[C@@H](C)NC(=O)[C@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@@H](N)C(=O)N)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCCN=C(N)N,mutagenic
+22181-94-8,CCOC(=O)CNC(=O)CCCCSc1[nH]cnc2ncnc12,non-mutagenic
+NOCAS_M412,CCCCCCCCCCCCCC[C@H]1CO1,non-mutagenic
+70-34-8,[O-][N+](=O)c1ccc(F)c(c1)[N+](=O)[O-],mutagenic
+5381-79-3,Cn1cnc2ccc(cc12)[N+](=O)[O-],mutagenic
+57541-73-8,Br[C@H]1CCN(C[C@@H]1Br)N=O,mutagenic
+67019-20-9,CCC(=O)Nc1snc2ccccc12,non-mutagenic
+86-42-0,CCN(CC)Cc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1O,non-mutagenic
+69686-05-1,C[C@H]1O[C@@H](Oc2cc(O)c3C(=O)c4c(O)cc(C)cc4C(=O)c3c2)[C@H](O)[C@@H](O)[C@@H]1O,mutagenic
+67-66-3,ClC(Cl)Cl,non-mutagenic
+142713-63-1,COc1ccc(CNC(=O)C(C)Br)cc1,mutagenic
+477-30-5,CNC1CCc2cc(OC)c(OC)c(OC)c2C3=CC=C(OC)C(=O)C=C13,non-mutagenic
+118-74-1,Clc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,non-mutagenic
+67587-52-4,OC1CN(CCO1)N=O,mutagenic
+6943-00-6,Clc1ccc(cc1)N2C(=O)CCC2=O,non-mutagenic
+220168-45-6,Clc1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,mutagenic
+6483-86-9,OS(=O)(=O)c1ccc2C(=O)c3c(cccc3[N+](=O)[O-])C(=O)c2c1,mutagenic
+10087-89-5,O=C(NC1CCCCC1)OC(C#C)(c2ccccc2)c3ccccc3,mutagenic
+10387-13-0,ClCc1c2ccccc2c(CCl)c3ccccc13,mutagenic
+55380-34-2,C[C@@H]1CN(C[C@H](C)N1N=O)N=O,mutagenic
+98-46-4,[O-][N+](=O)c1cccc(c1)C(F)(F)F,non-mutagenic
+111955-22-7,OC1COC(NCCc2c[nH]c3ccccc23)C(O)C1O,mutagenic
+327-97-9,O[C@H]1C[C@](O)(C[C@@H](OC(=O)\C=C/c2ccc(O)c(O)c2)[C@@H]1O)C(=O)O,non-mutagenic
+116-66-5,Cc1c(cc2c(c1[N+](=O)[O-])C(C)(C)CC2(C)C)[N+](=O)[O-],non-mutagenic
+133960-22-2,COC(=O)c1oc(N(O)C(=O)C)c(c2ccccc2)c1c3ccccc3,non-mutagenic
+NOCAS_M235,O[C@H]1CO[C@H]([C@H](O)[C@@H]1O)N(N=O)c2ccc(cc2)[N+](=O)[O-],mutagenic
+484-78-6,NC(CC(=O)c1cccc(O)c1N)C(=O)O,non-mutagenic
+50-00-0,C=O,mutagenic
+56222-35-6,O[C@@H]1CCN(C1)N=O,mutagenic
+132-27-4,Oc1ccccc1c2ccccc2,non-mutagenic
+18172-33-3,CC(=O)C1=C(O)C2C3C(Cc4cccc5[nH]cc3c45)C(C)(C)N2C1=O,mutagenic
+107673-65-4,[O-][N+](=O)C1=Cc2c3c1cccc3cc4ccc5ccccc5c24,mutagenic
+24930-41-4,c1ccc2c(c1)nc3ccc4cccc5ccc2c3c45,mutagenic
+52021-61-1,CC(=O)OCC[C@@H](C=O)c1c(O)cc2C(=O)c3cc(O)cc(O)c3C(=O)c2c1O,mutagenic
+146795-26-8,COc1ccc(NC(=O)c2csc(c2)[N+](=O)[O-])cc1,mutagenic
+116-31-4,C\C(=C\C=O)\C=C/C=C(/C)\C=C/C1=C(C)CCCC1(C)C,mutagenic
+115655-93-1,CC(=CCC[C@@](C)(O)[C@H]1CCC=CC1=O)C,mutagenic
+43047-59-2,CCN(CC)CCn1nc2ccc(CO)c3c4ccc(Cl)cc4Sc1c23,mutagenic
+94-45-1,CCOc1ccc2nc(N)sc2c1,mutagenic
+1260-17-9,Cc1c(C(=O)O)c(O)cc2C(=O)c3c(O)c(O)c([C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)c(O)c3C(=O)c12,mutagenic
+1918-00-9,COc1c(Cl)ccc(Cl)c1C(=O)O,non-mutagenic
+56980-94-0,CC(=O)c1cc(N)ccc1OCC(O)CNC(C)(C)C,non-mutagenic
+16423-68-0,Oc1c(I)cc2c(Oc3c(I)c(O)c(I)cc3C24OC(=O)c5ccccc45)c1I,non-mutagenic
+1468-95-7,OCc1c2ccccc2cc3ccccc13,mutagenic
+75-75-2,CS(=O)(=O)O,non-mutagenic
+2050-92-2,CCCCCNCCCCC,non-mutagenic
+146-56-5,OCCN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1,non-mutagenic
+23043-62-1,Nc1ccc2nc3ccccc3c(N)c2c1,mutagenic
+7790-98-9,[O-]Cl(=O)(=O)=O,non-mutagenic
+98-55-5,CC1=CCC(CC1)C(C)(C)O,non-mutagenic
+2226-96-2,CC1(C)CC(O)CC(C)(C)N1O,mutagenic
+126370-99-8,COc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,mutagenic
+154-41-6,C[C@@H](N)[C@@H](O)c1ccccc1,non-mutagenic
+106-23-0,CC(CCC=C(C)C)CC=O,non-mutagenic
+6850-22-2,Cn1cc2ccc(cc2n1)[N+](=O)[O-],mutagenic
+73936-27-3,Fc1ccc(cc1)C(=O)[C@H]2O[C@@H]2c3ccccc3,mutagenic
+117-84-0,CCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC,non-mutagenic
+17924-92-4,C[C@H]1CCCC(=O)CCC\C=C/c2cc(O)cc(O)c2C(=O)O1,non-mutagenic
+135-51-3,Oc1cc2ccc(cc2cc1S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+89641-97-4,[O-][N+](=O)c1cccc2cnsc12,mutagenic
+852-20-0,Oc1c(Sc2cc(Cl)cc(c2O)[N+](=O)[O-])cc(Cl)cc1[N+](=O)[O-],non-mutagenic
+70021-99-7,[O-][N+](=O)c1ccc2ccc3cc4ccccc4c5ccc1c2c35,mutagenic
+139953-78-9,COC(=O)c1ccc(\C=N\n2nnc3c4ccccc4nc3c2O)cc1,mutagenic
+2746-81-8,CCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1,non-mutagenic
+96918-27-3,[O-][N+](=O)c1oc2cc3ccc4cccc5ccc(c2c1)c3c45,mutagenic
+86831-65-4,CCN(CC)N(O)N=O,mutagenic
+6287-38-3,Clc1ccc(C=O)cc1Cl,non-mutagenic
+75965-74-1,COc1ccc2c(ccc3oc(cc23)[N+](=O)[O-])c1,mutagenic
+16339-07-4,CN1CCN(CC1)N=O,mutagenic
+34049-50-8,CNc1ccc(cc1)N=Nc2ccc(NC)cc2,non-mutagenic
+6149-34-4,Nc1ccc(Nc2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+94-81-5,Cc1cc(Cl)ccc1OCCCC(=O)O,non-mutagenic
+110-80-5,CCOCCO,non-mutagenic
+632-79-1,Brc1c(Br)c(Br)c2C(=O)OC(=O)c2c1Br,non-mutagenic
+94-52-0,[O-][N+](=O)c1ccc2[nH]cnc2c1,mutagenic
+552-89-6,[O-][N+](=O)c1ccccc1C=O,mutagenic
+99-96-7,OC(=O)c1ccc(O)cc1,non-mutagenic
+68-22-4,CC12CCC3C(CCC4=CC(=O)CCC34)C1CCC2(O)C#C,non-mutagenic
+99-34-3,OC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+24938-64-5,Nc1ccc(NC(=O)c2ccc(cc2)C(=O)O)cc1,non-mutagenic
+6029-82-9,C\C=C(/C)\C(=O)OC1CCN2CC=C(CO)C12,non-mutagenic
+79-01-6,ClC=C(Cl)Cl,non-mutagenic
+23245-64-9,[O-][N+](=O)c1cccc2c(cccc12)C#N,mutagenic
+41069-00-5,[O-][N+](=O)c1ccc(cc1)C(=O)[C@H]2O[C@@H]2c3ccccc3,mutagenic
+67-48-1,C[N+](C)(C)CCO,non-mutagenic
+130796-74-6,OCC1OC(C(O)C1O)n2cnc3c(NCC(O)COc4cccc5ccccc45)ncnc23,non-mutagenic
+58430-01-6,Cc1cc2nc3c(ccc4ccccc34)c(C)c2cc1C,mutagenic
+107-86-8,CC(=CC=O)C,non-mutagenic
+2648-51-3,ClC(=CC=O)Cl,mutagenic
+23703-14-2,C(C1CO1)c2ccc(cc2)c3ccccc3,mutagenic
+NOCAS_M539,CCCCCCCCCCCCCCCC[C@H]1CO1,non-mutagenic
+11012-59-2,C\C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)\C=C\C=C(\C)/C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O,non-mutagenic
+118517-20-7,CC(C)CCC[C@@H](C)[C@@H]1CC[C@H]2[C@@H]3C[C@@H]4N(N5C(=O)c6ccccc6C5=O)[C@@]47C[C@H](CC[C@]7(C)[C@H]3CC[C@]12C)OC(=O)C,mutagenic
+89-57-6,Nc1ccc(O)c(c1)C(=O)O,non-mutagenic
+603-34-9,c1ccc(cc1)N(c2ccccc2)c3ccccc3,non-mutagenic
+57333-96-7,CC(C)C(O)CCC(C)C1CCC2\C(=C\C=C\3/CC(O)CC(O)C3=C)\CCCC12C,non-mutagenic
+824-69-1,Oc1cc(Cl)c(O)cc1Cl,non-mutagenic
+77-99-6,CCC(CO)(CO)CO,non-mutagenic
+4861-85-2,CC(C)OC(=O)Cc1ccccc1,non-mutagenic
+104010-37-9,CO\N=C(/C(=O)NC1C2SCC(=C(N2C1=O)C(=O)O)CSC(=O)c3occc3)\c4csc(N)n4,non-mutagenic
+7119-89-3,[O-][N+](=O)C(Cl)Cl,mutagenic
+87-25-2,CCOC(=O)c1ccccc1N,non-mutagenic
+38915-58-1,ClCCNCCCNc1c2ccccc2nc3c1ccc4cccnc34,mutagenic
+123442-39-7,COc1cc2OC(=C(O)C(=O)c2cc1OC)c3ccc(O)cc3,non-mutagenic
+120-66-1,CC(=O)Nc1ccccc1C,mutagenic
+143-67-9,CCC1(O)CC2CN(CCc3c([nH]c4ccccc34)C(C2)(C(=O)OC)c5cc6c(cc5OC)N(C)C7C(O)(C(OC(=O)C)C8(CC)C=CCN9CCC67C89)C(=O)OC)C1,non-mutagenic
+110004-69-8,COc1cc(NS(=O)(=O)C)ccc1Nc2c3ccc(cc3nc4c(C)cccc24)N=N#N,mutagenic
+17902-23-7,FC1=CN(C2CCCO2)C(=O)NC1=O,non-mutagenic
+151-56-4,C1CN1,mutagenic
+116355-84-1,CCCCC(C)C(OC(=O)CC(CC(=O)O)C(=O)O)C(CC(C)CCCCCCC(O)CC(O)C(C)N)OC(=O)CC(CC(=O)O)C(=O)O,non-mutagenic
+92116-66-0,Cc1cnc2ccc3c(ncn3C)c2n1,non-mutagenic
+134109-02-7,OC1C=Cc2cc3c(ccc4ccccc34)c(Cl)c2C1O,non-mutagenic
+132-64-9,o1c2ccccc2c3ccccc13,non-mutagenic
+874-60-2,Cc1ccc(cc1)C(=O)Cl,mutagenic
+123-75-1,C1CCNC1,non-mutagenic
+4075-79-0,CC(=O)Nc1ccc(cc1)c2ccccc2,mutagenic
+2085-88-3,CC1(CO1)c2ccccc2,mutagenic
+1516-71-8,Cn1c(N=N#N)nc2c3ccccc3ccc12,mutagenic
+101821-43-6,NC(=N)c1ccc2c(N)c([nH]c2c1)C(=N)N,non-mutagenic
+NOCAS_M475,O[C@H]1N=C(c2ccccc2)c3cc(Cl)ccc3NC1=O,non-mutagenic
+64099-27-0,COc1nsc2c(N)cccc12,mutagenic
+592-62-1,CC(=O)OCN=[N+](C)[O-],non-mutagenic
+187537-22-0,CC(=O)NCC(O)COc1cccc2ccccc12,non-mutagenic
+17075-03-5,Nc1cc2cccc3ccc4cccc1c4c23,mutagenic
+463-04-7,CCCCCON=O,mutagenic
+109-21-7,CCCCOC(=O)CCC,non-mutagenic
+25013-16-5,COc1ccc(O)cc1C(C)(C)C,non-mutagenic
+87185-24-8,[O-][N+](=O)c1cc2cccc(c2cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+57409-54-8,CC(Br)(CO)CBr,non-mutagenic
+3033-77-0,C[N+](C)(C)CC1CO1,mutagenic
+128753-99-1,CC12OOC1(COC(=O)Nc3ccc(Cl)cc3)Oc4ccccc24,mutagenic
+109-02-4,CN1CCOCC1,non-mutagenic
+39781-21-0,Cc1ccc(cc1C)N=Nc2c(O)ccc3ccccc23,non-mutagenic
+58336-35-9,O=C1Oc2c3CCCN4CCCc(cc2C=C1)c34,mutagenic
+541-59-3,O=C1NC(=O)C=C1,mutagenic
+103393-70-0,ClCc1cc2c3ccccc3c4cccc(c1)c24,mutagenic
+125369-79-1,Clc1ccc(cc1)\C(=C\C=C\c2ccccc2)\C#N,mutagenic
+2586-60-9,Nc1ccc2cc(cc(O)c2c1N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5c(N)ccc6cc(cc(O)c56)S(=O)(=O)O)S(=O)(=O)O,mutagenic
+534-07-6,ClCC(=O)CCl,mutagenic
+134308-13-7,Cc1ccc(cc1)C(=O)c2cc(O)c(O)c(c2)[N+](=O)[O-],non-mutagenic
+1239-45-8,CC[n+]1c(c2ccccc2)c3cc(N)ccc3c4ccc(N)cc14,mutagenic
+159092-74-7,[O-][N+](=O)c1cccc2cc(c3ccccc3c12)[N+](=O)[O-],mutagenic
+502-65-8,CC(=CCC\C(=C\C=C\C(=C\C=C\C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C=C(/C)\CCC=C(C)C)\C)\C)\C)C,non-mutagenic
+64808-48-6,OC(=O)c1ccccc1Nc2cc(Cl)ccc2C(=O)O,non-mutagenic
+108-73-6,Oc1cc(O)cc(O)c1,non-mutagenic
+72-14-0,Nc1ccc(cc1)S(=O)(=O)Nc2nccs2,non-mutagenic
+13164-04-0,CC(C)(O)C1Cc2cc3C=C(C(=O)Oc3cc2O1)C(C)(C)C=C,mutagenic
+2457-47-8,Clc1cncc(Cl)c1,non-mutagenic
+100129-07-5,CC(Br)C(=O)N(C)Cc1ccccc1,non-mutagenic
+756-79-6,COP(=O)(C)OC,non-mutagenic
+67-64-1,CC(=O)C,non-mutagenic
+31698-14-3,OC[C@H]1O[C@H]2[C@@H](OC3=NC(=N)C=CN23)[C@@H]1O,non-mutagenic
+60-24-2,OCCS,non-mutagenic
+736-31-2,[O-][N+](=O)c1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+70786-65-1,CC(=O)N(O)c1ccccc1C,mutagenic
+64810-99-7,OS(=O)(=O)Oc1ccc2ccc3cc4ccccc4c5ccc1c2c35,mutagenic
+NOCAS_M247,CC(C)(C)OC(=O)[C@H](N)CN=[N+]=[N-],mutagenic
+16452-01-0,COc1cc(N)ccc1C,mutagenic
+110520-17-7,c1ccc2c(c1)c3ccccc3c4cc5cnccc5cc24,mutagenic
+132663-51-5,CCC(=O)OCc1ccccc1[N+](=O)[O-],non-mutagenic
+158729-22-7,Clc1ccccc1NS(=O)(=O)c2cccc3cccnc23,non-mutagenic
+148193-30-0,Nc1ccc2snc(Cl)c2c1,mutagenic
+26921-17-5,CC(C)(C)NCC(O)COc1nsnc1N2CCOCC2,non-mutagenic
+106671-91-4,Clc1ccc(cc1)c2nc3sccn3c2N=O,mutagenic
+128753-94-6,OCC12OOC1(CO)c3ccccc3O2,non-mutagenic
+NOCAS_M136,CC[C@@H](C)NC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+84-65-1,O=C1c2ccccc2C(=O)c3ccccc13,mutagenic
+64201-63-4,O[C@H]1[C@H](O)[C@H](O[C@H]([C@@H]1O)C(=O)O)N(O)c2ccc(cc2)c3ccccc3,mutagenic
+484-29-7,COc1c2ccoc2nc3ccccc13,mutagenic
+121010-10-4,CC(C)(C)NCC(O)COc1ccccc1C2=CCCC2,non-mutagenic
+4635-87-4,C\C=C\CC#N,non-mutagenic
+41093-60-1,C[C@@]12CCC[C@](C)([C@H]1CC[C@]34CC(=C)[C@](CC[C@@H]23)(C4)O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(=O)O,non-mutagenic
+74-96-4,CCBr,mutagenic
+10228-40-7,Cc1cc(O)c2C(=O)c3c(O)c(O)c(O)cc3C(=O)c2c1,non-mutagenic
+NOCAS_M168,C[C@@H](O)CBr,mutagenic
+109875-47-0,Nc1nc(nc2c1ncn2C3OC(CO)C(O)C3O)c4cccc(c4)[N+](=O)[O-],mutagenic
+188699-57-2,COc1nc2cccc(CBr)c2nc1OC,mutagenic
+51938-12-6,CCCN(CCCCO)N=O,mutagenic
+32066-79-8,Cc1ccc(cc1)[N+]#N,mutagenic
+23282-20-4,CC1=CC2OC3C(O)C(O)C(C)(C34CO4)C2(CO)C(O)C1=O,non-mutagenic
+612-23-7,[O-][N+](=O)c1ccccc1CCl,mutagenic
+24385-10-2,COc1cccc2C(=O)c3c(O)c4CC(O)(CC(O)c4c(O)c3C(=O)c12)C(=O)CO,mutagenic
+166546-20-9,CN1CCN(CC1)c2ccc3[nH]c(Cc4ccc5[nH]c(nc5c4)c6ccc(cc6)N(CCCl)CCCl)nc3c2,non-mutagenic
+624-83-9,CN=C=O,non-mutagenic
+64-69-7,OC(=O)CI,mutagenic
+13345-21-6,Oc1ccc2ccc3c4ccccc4cc5ccc1c2c35,mutagenic
+106-97-8,CCCC,non-mutagenic
+161696-99-7,CNc1ccc2nc(C)cnc2c1C,mutagenic
+1488-21-7,C1CC23OC2(C1)C=CC=C3,mutagenic
+135086-91-8,Oc1c2nc3ccccc3c2nnn1\N=C\c4ccc(cc4)[N+](=O)[O-],mutagenic
+83-44-3,CC(CCC(=O)O)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(O)C12C,mutagenic
+92-66-0,Brc1ccc(cc1)c2ccccc2,non-mutagenic
+19331-27-2,[O-][N+](=O)c1ccc2c(Cl)nsc2c1,mutagenic
+4298-16-2,CN[C@@H](C)Cc1ccccc1,non-mutagenic
+99-99-0,Cc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+173450-39-0,CCOCCOC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OCCOCC)ccc1N,non-mutagenic
+25917-90-2,COc1cc(N)c(cc1N)[N+](=O)[O-],mutagenic
+2580-78-1,Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc4cccc(c4)S(=O)(=O)CCOS(=O)(=O)O)cc1S(=O)(=O)O,mutagenic
+78-97-7,CC(O)C#N,non-mutagenic
+98931-07-8,CC1CC2C(Cc3cn(CC=C)c4cccc2c34)N(C1)C#N,mutagenic
+56183-12-1,OC1C(O)c2cccc3ccc4cccc1c4c23,non-mutagenic
+3688-53-7,NC(=O)\C(=C/c1oc(cc1)[N+](=O)[O-])\c2occc2,mutagenic
+127923-98-2,OC(C(O)C(=O)OCCBr)C(=O)OCCBr,mutagenic
+50-70-4,OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO,non-mutagenic
+119143-43-0,C1Cc2ccc3ncccc3c2C4OC14,mutagenic
+61203-01-8,CC(=O)C(=C)Br,mutagenic
+538-74-9,C(SCc1ccccc1)c2ccccc2,non-mutagenic
+163275-62-5,Fc1cnc2c(c1)cc(F)c3ccccc23,non-mutagenic
+34424-65-2,CC(O)\C=C\C=O,mutagenic
+150446-02-9,Cc1c(\C=N\OCc2ccc(Cl)cc2)c3cc(ccc3n1Cc4ccccc4)[N+](=O)[O-],non-mutagenic
+63019-40-9,Oc1cccc2ccc3c4ccccc4ccc3c12,mutagenic
+50-18-0,ClCCN(CCCl)[P@]1(=O)NCCCO1,mutagenic
+108670-79-7,CC\C=C\C=C\C=C\C=C\C=O,non-mutagenic
+134-29-2,COc1ccccc1N,mutagenic
+NOCAS_M93,C[C@H]1CS(=O)(=O)CCN1\N=C\c2oc(cc2)[N+](=O)[O-],mutagenic
+145-49-3,Nc1ccc(O)c2C(=O)c3c(N)ccc(O)c3C(=O)c12,mutagenic
+30095-63-7,CCC1(C)CO1,non-mutagenic
+922-63-4,CCC(=C)C=O,mutagenic
+60877-83-0,Oc1ccc(\C=N\c2snc3c(Cl)cc(Cl)cc23)cc1,mutagenic
+87-29-6,Nc1ccccc1C(=O)OC\C=C\c2ccccc2,non-mutagenic
+91-63-4,Cc1ccc2ccccc2n1,mutagenic
+124-48-1,ClC(Br)Br,non-mutagenic
+91137-28-9,Cc1ccc2ccc(cc2c1)[N+](=O)[O-],mutagenic
+80909-78-0,CC1(CO1)c2ccc(Br)cc2,non-mutagenic
+548-04-9,Cc1cc(O)c2C(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6C(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c56,non-mutagenic
+108-18-9,CC(C)NC(C)C,non-mutagenic
+2016-88-8,NC(=N)NC(=O)c1nc(Cl)c(N)nc1N,mutagenic
+4403-61-6,C\C=C(\C)/C#N,non-mutagenic
+27776-01-8,Cc1ccc(Cc2ccccc2)cc1,non-mutagenic
+98736-47-1,CN(Cc1cccc(Br)c1)N=O,mutagenic
+116505-02-3,CC(=O)ON(C(=O)C)c1ccc(Sc2ccccc2)cc1,mutagenic
+NOCAS_M464,CCC[C@@H](O)[C@@H](CC)CO,non-mutagenic
+13114-72-2,CNC(=O)N(c1ccccc1)c2ccccc2,non-mutagenic
+NOCAS_M139,C1C[C@@H]2O[C@@H]2C[C@@H]1[C@H]3CO3,mutagenic
+108-90-7,Clc1ccccc1,non-mutagenic
+97-32-5,COc1ccc(cc1[N+](=O)[O-])C(=O)Nc2ccccc2,mutagenic
+81-20-9,Cc1cccc(C)c1[N+](=O)[O-],non-mutagenic
+133831-60-4,[O-][N+](=O)c1ccccc1SSC(=C(Cl)Cl)Cl,mutagenic
+6369-59-1,Cc1cc(NOS(=O)(=O)O)ccc1N,mutagenic
+69-74-9,NC1=NC(=O)N(C=C1)C2OC(CO)C(O)C2O,non-mutagenic
+4873-56-7,CC(C)COS(=O)(=O)c1ccc(C)cc1,non-mutagenic
+112022-07-8,CN(C)CCNC(=O)c1cccc2C(=O)c3ccccc3Sc12,mutagenic
+55256-53-6,CC(C)(O)CCc1ccc(O)c2C(=O)c3c(O)c4c(OC5OC=CC45O)cc3Oc12,mutagenic
+91-13-4,BrCc1ccccc1CBr,non-mutagenic
+119-36-8,COC(=O)c1ccccc1O,mutagenic
+110-52-1,BrCCCCBr,mutagenic
+4238-71-5,C(c1ccccc1)n2ccnc2,mutagenic
+1464-53-5,CCC12OC1O2,mutagenic
+67-03-8,Cc1ncc(C[n+]2csc(CCO)c2C)c(N)n1,non-mutagenic
+50-89-5,CC1=CN(C2CC(O)C(CO)O2)C(=O)NC1=O,non-mutagenic
+105802-11-7,Cc1c(c2ccccc2c3ccc4ccccc4c13)[N+](=O)[O-],mutagenic
+494-90-6,CC1CCc2c(C)coc2C1,non-mutagenic
+32828-84-5,CN(C)C1Cc2cccc3cccc(C1)c23,mutagenic
+131841-09-3,COCCOCCOP1(NP(NP(N1)(OCCOCCOC)OCCOCCOC)(OCCOCCOC)OCCOCCOC)OCCOCCOC,non-mutagenic
+99766-47-9,CCc1cccc(CC)c1N=O,mutagenic
+118-55-8,Oc1ccccc1C(=O)Oc2ccccc2,non-mutagenic
+118354-50-0,COc1ccc2C3OC3C4CCCCC4c2c1,non-mutagenic
+NOCAS_M156,CC[C@@H](O)\C=C\C=C\C=C\C=C\C=O,mutagenic
+581-28-2,Nc1ccc2nc3ccccc3cc2c1,mutagenic
+10184-51-7,Cn1cnc2C(=N)[N+](=O)[CH-]Nc12,mutagenic
+394-68-3,Fc1cccc2cccnc12,mutagenic
+142044-41-5,OC1CC=Cc2cccnc12,non-mutagenic
+115664-50-1,Oc1ccc2c3ccccc3c4c(ccc5ccc1c2c45)[N+](=O)[O-],mutagenic
+119584-53-1,O=C(CN1C(=O)Sc2ccccc12)OCc3ccccc3,non-mutagenic
+1795-83-1,CC(=O)N(O)c1ccccc1,non-mutagenic
+20020-02-4,Clc1c(Cl)c(Cl)c2ccccc2c1Cl,non-mutagenic
+1805-02-3,COc1ccc2c(c1)nc(N)n2C,mutagenic
+110207-65-3,CCOC(=O)c1c2c(nn[n+]1[O-])c3ccccc3n2C,mutagenic
+64188-64-3,C(N1C2C1c3ccccc3c4ccccc24)c5ccccc5,mutagenic
+6051-98-5,O=C1c2ccccc2c3c1ccc4ccccc34,mutagenic
+1120-21-4,CCCCCCCCCCC,non-mutagenic
+611-53-0,NC1=NC(=O)N(C=C1I)C2CC(O)C(CO)O2,non-mutagenic
+56719-24-5,COC(=O)\C(=C(/OP(=O)(OC)OC)\c1cc(Cl)ccc1Cl)\Cl,non-mutagenic
+73-03-0,Nc1ncnc2c1ncn2C3OC(CO)CC3O,mutagenic
+93943-58-9,CC(CC1=C(COC1O)C=O)C2=CCC(C)(C)C2,non-mutagenic
+NOCAS_M264,OC[C@H](Cl)CCl,mutagenic
+1609-47-8,CCOC(=O)OC(=O)OCC,non-mutagenic
+4816-14-2,NC(=N)c1ccc(cc1)c2cc3ccc(cc3s2)C(=N)N,non-mutagenic
+6926-47-2,N#N=NC(c1ccccc1)c2ccccc2,mutagenic
+108-50-9,Cc1cncc(C)n1,mutagenic
+106532-70-1,CCCCCCCCCC(=O)\N=C\1/SN(C(=O)CCCCCCCCC)c2ccc(cc12)[N+](=O)[O-],mutagenic
+NOCAS_M294,FC[C@H]1CO1,mutagenic
+17372-87-1,OC(=O)c1ccccc1C2=C3C=C(Br)C(=O)C(=C3Oc4c(Br)c(O)c(Br)cc24)Br,mutagenic
+108319-06-8,CC1CN(CCN1)c2cc3N(C=C(C(=O)O)C(=O)c3cc2F)c4ccc(F)cc4F,mutagenic
+163275-66-9,Fc1cccc2c1ccc3ncccc23,mutagenic
+51-52-5,CCCc1cc(O)nc(S)n1,non-mutagenic
+134998-79-1,[O-][N+](=O)c1cc2cccc3c4CCCCc4c5cccc1c5c23,mutagenic
+2416-94-6,Cc1ccc(C)c(O)c1C,non-mutagenic
+125701-97-5,COc1ccc(cc1)c2nc([nH]c2c3ccc(OC)cc3)c4ccc(C)cc4C,mutagenic
+125974-01-8,ClCC1=C(Cl)C(=O)OC1,mutagenic
+2277-92-1,Oc1c(Cl)cc(Cl)cc1NC(=O)c2c(O)c(Cl)cc(Cl)c2Cl,non-mutagenic
+98-92-0,NC(=O)c1cccnc1,non-mutagenic
+151109-62-5,O[C@H]1C=Cc2c(ccc3c4CCC(=O)c4cc(c23)C(F)(F)F)[C@@H]1O,mutagenic
+140-03-4,CCCCCCC(C\C=C\CCCCCCCC(=O)OC)OC(=O)C,non-mutagenic
+563-12-2,CCOP(=S)(OCC)SCSP(=S)(OCC)OCC,non-mutagenic
+111-83-1,CCCCCCCCBr,non-mutagenic
+57074-49-4,CCO[C@@H]1C[C@@H]2[C@@H](C)C[C@H]3OC(=O)C(=C)[C@H]3C[C@@]2(C)[C@H](OCC)O1,mutagenic
+3031-74-1,CCOO,mutagenic
+575-43-9,Cc1ccc2c(C)cccc2c1,non-mutagenic
+1152-48-3,[O-][N+](=O)c1ccc(cc1)C(=O)\C=C\c2ccccc2,mutagenic
+96-64-0,CC(OP(=O)(C)F)C(C)(C)C,non-mutagenic
+NOCAS_M345,C[C@@H](CN1c2ccccc2Sc3ccccc13)N(C)C,non-mutagenic
+16306-16-4,Oc1ccc2c3ccccc3C(=O)c4cccc1c24,mutagenic
+60991-01-7,[O-][N+](=O)c1cccc(\C=N\c2snc3ccccc23)c1,mutagenic
+139259-92-0,CC(=O)ON(OCc1ccc(Oc2ccccc2)cc1)C(=O)c3ccccc3,mutagenic
+76-15-3,FC(F)(F)C(F)(F)Cl,non-mutagenic
+97389-17-8,Cc1cnc2c(cc(C)c3c2nc(N)n3C)n1,mutagenic
+86854-01-5,O=C1c2c(ccc3ccccc23)c4ccc5ccccc5c14,non-mutagenic
+92279-99-7,COc1cccc2c(NCCCNCCCl)c3ccccc3nc12,mutagenic
+480-81-9,C\C=C/1\CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3CC[C@H](OC1=O)[C@@H]23,mutagenic
+6638-64-8,[O-][N+](=O)c1ccc2c(OC(=O)c3ccccc23)c1,mutagenic
+298-81-7,COc1c2OC(=O)C=Cc2cc3ccoc13,mutagenic
+70-18-8,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O,mutagenic
+933-75-5,Oc1c(Cl)ccc(Cl)c1Cl,non-mutagenic
+63785-41-1,OS(=O)(=O)Oc1ccc2cc3ccc4cccc5ccc(c2c1)c3c45,non-mutagenic
+NOCAS_M282,C(Oc1cccc(OC[C@H]2CO2)c1)[C@H]3CO3,mutagenic
+133-49-3,Sc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,non-mutagenic
+NOCAS_M19,O1[C@H]2C=Cc3cccnc3[C@@H]12,mutagenic
+530-75-6,CC(=O)Oc1ccccc1C(=O)Oc2ccccc2C(=O)O,non-mutagenic
+78-38-6,CCOP(=O)(CC)OCC,non-mutagenic
+140-66-9,CC(C)(C)CC(C)(C)c1ccc(O)cc1,non-mutagenic
+13104-21-7,COP(=O)(OC)O\C(=C/Br)\c1ccc(Cl)cc1Cl,non-mutagenic
+137-17-7,Cc1cc(C)c(N)cc1C,mutagenic
+81-49-2,Nc1c(Br)cc(Br)c2C(=O)c3ccccc3C(=O)c12,mutagenic
+NOCAS_M500,CCCCCCCC[C@H]1CO1,non-mutagenic
+126-33-0,O=S1(=O)CCCC1,non-mutagenic
+119613-62-6,CCc1cc2ccccc2c3ccc4C(O)C(O)C5OC5c4c13,mutagenic
+94574-56-8,CC(=O)OCc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,mutagenic
+69657-89-2,CCc1ccccc1Nc2ccc(Nc3ccccc3CC)c4C(=O)c5c(O)ccc(O)c5C(=O)c24,mutagenic
+28352-32-1,C1CCC2C(C1)C3OC3c4ccccc24,non-mutagenic
+522-19-0,COc1cc(OC)c2nc3occc3c(OC)c2c1,mutagenic
+18028-56-3,Cc1ccc2[nH]c3c(C)ccc(C)c3c2c1,mutagenic
+6441-91-4,Nc1ccc2cc(cc(O)c2c1N=Nc3ccc(cc3S(=O)(=O)O)[N+](=O)[O-])S(=O)(=O)O,non-mutagenic
+3058-37-5,CN=NO,mutagenic
+159092-79-2,[O-][N+](=O)c1ccc2c3cccc(c3cc(c2c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+101-77-9,Nc1ccc(Cc2ccc(N)cc2)cc1,mutagenic
+124-09-4,NCCCCCCN,non-mutagenic
+3029-19-4,O=Cc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+109-57-9,NC(=S)NCC=C,non-mutagenic
+55256-57-0,CC(C)(O)CCc1ccc(O)c2C(=O)c3c(O)c4C5C=COC5Oc4cc3Oc12,mutagenic
+1030-27-9,CN(C)c1ccc(\C=C\C(=O)c2ccccc2)cc1,non-mutagenic
+17526-17-9,CCOCc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,mutagenic
+NOCAS_M533,CCO[P@](=O)(NC(C)C)Oc1ccc(SC)c(C)c1,non-mutagenic
+98601-02-6,Cc1cc2c(O)cccc2c3cc4C(O)C(O)C=Cc4cc13,mutagenic
+885-11-0,CN1N(C(=O)C(=C1C)N=O)c2ccccc2,mutagenic
+5234-68-4,CC1=C(SCCO1)C(=O)Nc2ccccc2,non-mutagenic
+823-40-5,Cc1c(N)cccc1N,mutagenic
+120042-13-9,CC(N)(CN=[N+]=[N-])C(=O)O,mutagenic
+66552-77-0,Cc1cc2c(C)c3ccccc3c(C)c2cc1C,mutagenic
+5557-27-7,COc1cc(OC)c2C(=O)c3c(O)ccc(OC)c3Oc2c1,mutagenic
+434-07-1,C[C@]1(O)CC[C@@H]2[C@@H]3CC[C@H]4CC(=C(C[C@]4(C)[C@H]3CC[C@]12C)C=O)O,non-mutagenic
+3179-90-6,OCCNc1ccc(NCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12,mutagenic
+117929-14-3,[O-][N+](=O)c1cc2CCc3cccc4ccc(c1)c2c34,mutagenic
+56856-83-8,CN(COC(=O)C)N=O,mutagenic
+68162-37-8,COC(=O)\C(=C\c1oc(cc1)[N+](=O)[O-])\[N+](=O)[O-],mutagenic
+13810-83-8,OC(=O)c1c(Br)c(Br)c(Br)c(Br)c1C(=O)O,non-mutagenic
+134959-55-0,O=C(OCc1ccccc1)c2cccc3cccnc23,non-mutagenic
+138580-48-0,CN1CCN(CC1)C2=CC(=O)c3[nH]c(C)c4c5ccccc5nc4c3C2=O,mutagenic
+NOCAS_M30,O1[C@@H]2C=CC=C[C@H]12,mutagenic
+2922-83-0,NC(CC(=O)c1ccccc1N)C(=O)O,non-mutagenic
+57-68-1,Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1,non-mutagenic
+212-54-4,C1c2ccccc2c3ccc4ccc5ccccc5c4c13,mutagenic
+91-59-8,Nc1ccc2ccccc2c1,mutagenic
+613-47-8,ONc1ccc2ccccc2c1,mutagenic
+199536-82-8,ClC1=C(COC1=O)C(Br)Br,mutagenic
+99-76-3,COC(=O)c1ccc(O)cc1,non-mutagenic
+27451-21-4,CC(=O)N(O)c1ccc(C)cc1,non-mutagenic
+111-92-2,CCCCNCCCC,non-mutagenic
+62641-68-3,CCOC(=O)N(CCO)N=O,mutagenic
+173450-36-7,CCCOC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OCCC)ccc1N,non-mutagenic
+135-19-3,Oc1ccc2ccccc2c1,non-mutagenic
+87-82-1,Brc1c(Br)c(Br)c(Br)c(Br)c1Br,non-mutagenic
+91549-71-2,CN(C)CCNC(=O)c1ccc2c(N)c3ccccc3nc2c1,non-mutagenic
+57471-01-9,CC(=O)c1cc(NC(=O)NC(C)(C)C)ccc1OCC(O)CNC(C)(C)C,non-mutagenic
+19111-89-8,CN(C)C(N(C)C)(c1ccccc1)c2ccccc2,non-mutagenic
+144-82-1,Cc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1,non-mutagenic
+580-20-1,Oc1ccc2cccnc2c1,non-mutagenic
+NOCAS_M467,CC(C)(Oc1ccc(cc1)[C@H]2CCCc3ccccc23)C(=O)O,non-mutagenic
+91379-15-6,CCCC\C=C\C=C\C=C\C=C\C=C\OCC(O)CO,mutagenic
+6217-22-7,O=C1C(=O)c2cccc3ccc4cccc1c4c23,non-mutagenic
+55984-51-5,CN(CC(=O)C)N=O,mutagenic
+26444-49-5,Cc1cccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)c1,non-mutagenic
+6926-44-9,[N-]=[N+]=NCCc1ccccc1,mutagenic
+1211-40-1,Nc1ccc(cc1)c2ccc(cc2)[N+](=O)[O-],mutagenic
+112022-10-3,CN(C)CCNC(=O)c1cccc2Oc3ccccc3Oc12,mutagenic
+144-83-2,Nc1ccc(cc1)S(=O)(=O)Nc2ccccn2,non-mutagenic
+2122-77-2,OCCOc1cc(Cl)c(Cl)cc1Cl,non-mutagenic
+75-21-8,C1CO1,mutagenic
+84174-22-1,CN(Cc1ccc(Cl)cc1)N=O,mutagenic
+152-18-1,COP(=S)(OC)OC,non-mutagenic
+83-46-5,CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,non-mutagenic
+94740-40-6,CC(=O)N1CCC[C@H]1C(=O)N(CC(=O)O)N=O,mutagenic
+50656-61-6,CC1C=C(C=O)C(=CC2CC(C)(C)CC12)C=O,non-mutagenic
+124390-37-0,Cc1cc2ccccc2c3cc(c4ccccc4c13)[N+](=O)[O-],mutagenic
+126370-98-7,COc1cccc(CN2C3C2c4ccccc4c5ccccc35)c1,mutagenic
+128-39-2,CC(C)(C)c1cccc(c1O)C(C)(C)C,non-mutagenic
+14628-90-1,COC1=CC=C(C=CC1=O)[N+](=O)[O-],mutagenic
+23355-97-7,C[C@@H]1O[C@H]1c2ccccc2,non-mutagenic
+1214-39-7,C(Nc1[nH]cnc2ncnc12)c3ccccc3,non-mutagenic
+38861-78-8,CC(C)Cc1ccc(cc1)C(=O)C,non-mutagenic
+61477-96-1,CCN1CCN(C(=O)NC(C(=O)NC2C3SC(C)(C)C(N3C2=O)C(=O)O)c4ccccc4)C(=O)C1=O,non-mutagenic
+98911-08-1,CC(=O)N(O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1,mutagenic
+525-64-4,Nc1ccc2c(Cc3cc(N)ccc23)c1,mutagenic
+53693-68-8,CCN(CC)c1ccc(cc1)c2ccc(cc2)c3ccc(cc3)c4ccc(cc4)N(CC)CC,non-mutagenic
+80115-73-7,CCC(=O)N(O)c1ccc(cc1)c2ccccc2,mutagenic
+79560-36-4,COCc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,mutagenic
+36193-75-6,Nc1cnc2ccc3ccccc3c2c1,mutagenic
+55-55-0,CNc1ccc(O)cc1,mutagenic
+142-83-6,C\C=C/C=C\C=O,mutagenic
+524-42-5,O=C1C=Cc2ccccc2C1=O,mutagenic
+132832-26-9,OC1C2OC2c3cc4c5ccccc5c6ccccc6c4cc3C1O,mutagenic
+NOCAS_M535,CCCCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)CC[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)O[C@H]1[C@H](O)[C@@H](CO)O[C@@H](O)[C@H]1NC(=O)C)C(=O)N)C(=O)O,non-mutagenic
+2314-61-6,S=C1SC=C(S1)c2ccccc2,non-mutagenic
+71-43-2,c1ccccc1,non-mutagenic
+4938-72-1,CC(C)COC(=O)COc1cc(Cl)c(Cl)cc1Cl,non-mutagenic
+933-78-8,Oc1cc(Cl)cc(Cl)c1Cl,non-mutagenic
+105553-32-0,CN(N=O)N(C(=O)\C(=N/O)\C(=O)C)c1ccccc1,mutagenic
+55-38-9,COP(=S)(OC)Oc1ccc(SC)c(C)c1,non-mutagenic
+7493-63-2,Nc1ccccc1C(=O)OCC=C,non-mutagenic
+520-26-3,COc1ccc(cc1O)C2CC(=O)c3c(O)cc(OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)cc3O2,non-mutagenic
+NOCAS_M392,C=C[C@H]1CCC=CC1,non-mutagenic
+16804-85-6,C1CCC2C(C1)C=Cc3ccccc23,mutagenic
+1088-56-8,CN1C2=NC(=O)NC(=O)C2=Nc3cc(C)c(C)cc13,mutagenic
+NOCAS_M472,NC(=O)CN1C[C@H](O)CC1=O,non-mutagenic
+110-94-1,OC(=O)CCCC(=O)O,non-mutagenic
+97-53-0,COc1cc(CC=C)ccc1O,non-mutagenic
+95791-46-1,Clc1cc2c3ccccc3ccc2c4ccccc14,mutagenic
+96-17-3,CCC(C)C=O,non-mutagenic
+13071-79-9,CCOP(=S)(OCC)SCSC(C)(C)C,non-mutagenic
+1300-72-7,Cc1ccc(cc1C)S(=O)(=O)O,non-mutagenic
+102059-18-7,CC(=O)Nc1ccc(\C=C\C(=O)c2ccccc2)cc1,mutagenic
+3524-68-3,OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C,non-mutagenic
+120-80-9,Oc1ccccc1O,non-mutagenic
+107817-59-4,NC(CSC\C=C\Cl)C(=O)O,non-mutagenic
+NOCAS_M111,CC(=O)O[C@@H]1Cc2c3ccc4ccccc4c3cc5ccc(C)c1c25,mutagenic
+32795-84-9,Brc1c2ccccc2cc3c1ccc4ccccc34,mutagenic
+879-39-0,[O-][N+](=O)c1cc(Cl)c(Cl)c(Cl)c1Cl,non-mutagenic
+5296-38-8,C(Oc1ccc(Cc2ccccc2)cc1)C3CO3,mutagenic
+55556-92-8,O=NN1CCC=CC1,mutagenic
+275795-16-9,CC(C)(C)c1cc(ccc1N=O)c2ccccc2,mutagenic
+26471-62-5,Cc1cc(cc(c1)C#N=O)C#N=O,mutagenic
+60967-89-7,O[C@@H]1C=Cc2c(ccc3cc4ccccc4cc23)[C@H]1O,mutagenic
+19996-03-3,ClCc1c2ccccc2c(Cl)c3ccccc13,mutagenic
+42713-66-6,N[C@H](CCCN(N=O)C(=O)N)C(=O)O,mutagenic
+96018-75-6,ON(C=O)c1cccc(Cl)c1,non-mutagenic
+17455-23-1,C1CCC2OCCOCCOCCOC3CCCCC3OCCOCCOCCOC2C1,non-mutagenic
+3290-92-4,CCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C,mutagenic
+78658-61-4,CCCCN(CC(O)c1ccc(O)cc1)N=O,non-mutagenic
+53499-68-6,CNc1ccc(cc1)N=Nc2ccc(cc2)N(C)C(=O)C,mutagenic
+6755-16-4,CCNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+84-69-5,CC(C)COC(=O)c1ccccc1C(=O)OCC(C)C,non-mutagenic
+129117-54-0,COc1ccc2[nH]c3c(C)cc(N)c(C)c3c2c1,mutagenic
+55-80-1,CN(C)c1ccc(cc1)N=Nc2cccc(C)c2,mutagenic
+24085-06-1,CC(=O)OCc1cc(ccc1OC(=O)C)C(=O)C,mutagenic
+57470-78-7,CCN(CC)C(=O)Nc1ccc(OCC(O)CNC(C)(C)C)c(c1)C(=O)C,non-mutagenic
+1684-40-8,Nc1c2CCCCc2nc3ccccc13,mutagenic
+535-83-1,C[n+]1cccc(c1)C(=O)O,non-mutagenic
+86-00-0,[O-][N+](=O)c1ccccc1c2ccccc2,non-mutagenic
+NOCAS_M334,CC(=O)O[C@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)C#C,non-mutagenic
+88847-89-6,Nc1nc(O)c2nc(O)n(C3CC(O)C(CO)O3)c2n1,non-mutagenic
+35509-27-4,N#Cc1cccc2cccnc12,mutagenic
+25870-67-1,[O-][N+](=O)c1ccc(\C=C\C(=O)c2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+1768-31-6,ClC(Cl)C(=O)C(Cl)(Cl)Cl,mutagenic
+108278-71-3,NC(=O)N(CCC(=O)O)N=O,mutagenic
+105-13-5,COc1ccc(CO)cc1,non-mutagenic
+39147-43-8,Oc1ccc2cc3c4ccccc4c5ccccc5c3cc2c1,mutagenic
+2403-27-2,Brc1ccc(cc1)C(=O)\C=C\c2ccccc2,non-mutagenic
+1849-36-1,[O-][N+](=O)c1ccc(S)cc1,mutagenic
+108618-29-7,Nc1ccc(\C=C\c2ccc(cc2)C#N)cc1,mutagenic
+99-59-2,COc1ccc(cc1N)[N+](=O)[O-],mutagenic
+77-95-2,O[C@@H]1C[C@@](O)(C[C@H](O)[C@H]1O)C(=O)O,non-mutagenic
+10443-65-9,OC(=O)C(=C)Br,non-mutagenic
+24191-98-8,CN1CC(O)c2cc3OCOc3c4c5ccccc5CC1c24,mutagenic
+59405-51-5,Cc1cc(N=Nc2cccnc2)c(N)cc1N,mutagenic
+2528-36-1,CCCCOP(=O)(OCCCC)Oc1ccccc1,non-mutagenic
+123-51-3,CC(C)CCO,non-mutagenic
+60-09-3,Nc1ccc(cc1)N=Nc2ccccc2,mutagenic
+69658-13-5,OC(=O)CSc1ccc2c3ccccc3C(=O)c4cccc1c24,mutagenic
+1904-98-9,Nc1nc(N)c2[nH]cnc2n1,non-mutagenic
+612-24-8,[O-][N+](=O)c1ccccc1C#N,non-mutagenic
+64896-26-0,OC(=O)c1ccc(cc1)N=Nc2ccc(O)c(c2)C(=O)O,non-mutagenic
+612-41-9,OC(=O)\C=C\c1ccccc1[N+](=O)[O-],non-mutagenic
+130-13-2,Nc1ccc(c2ccccc12)S(=O)(=O)O,non-mutagenic
+83-75-0,CCOC(=O)OC(C1CC2CCN1CC2C=C)c3ccnc4ccc(OC)cc34,non-mutagenic
+32306-29-9,CCOP(=O)(OCC)Oc1cc(on1)c2ccccc2,non-mutagenic
+131229-61-3,CCCCON(OC(=O)C)C(=O)c1ccc(C)cc1,mutagenic
+53175-28-3,C\C=C(/Cl)\C=O,mutagenic
+112368-25-9,OC(=O)CCC(=O)Nc1ccc(Cl)c(Cl)c1Cl,non-mutagenic
+51568-18-4,CC(=O)CC(=O)CCC(=O)O,non-mutagenic
+122551-89-7,ClC(Cl)C1=C(Cl)C(=O)OC1,mutagenic
+2082-81-7,CC(=C)C(=O)OCCCCOC(=O)C(=C)C,non-mutagenic
+5598-15-2,CCOP(=O)(OCC)Oc1nc(Cl)c(Cl)cc1Cl,non-mutagenic
+633-03-4,CCN(CC)c1ccc(cc1)C(=C2C=CC(=[N+](CC)CC)C=C2)c3ccccc3,mutagenic
+111-40-0,NCCNCCN,non-mutagenic
+155164-59-3,COc1ccc(cc1)S(=O)(=O)N2N=CC(=C(Cl)C2=O)Cl,non-mutagenic
+569-61-9,Nc1ccc(cc1)C(=C2C=CC(=N)C=C2)c3ccc(N)cc3,mutagenic
+95-14-7,c1ccc2[nH]nnc2c1,mutagenic
+3160-37-0,CC(=O)\C=C/c1ccc2OCOc2c1,non-mutagenic
+145439-00-5,CN(N=O)C(=O)c1c(ncn1C)N(C)C(=O)OC(C)(C)C,mutagenic
+2498-76-2,Cc1ccc2ccc3cc4ccccc4cc3c2c1,mutagenic
+399-10-0,Fc1ccc(cc1)C(=O)\C=C\c2ccccc2,non-mutagenic
+3342-98-1,Cc1ccc2cc3c(ccc4ccccc34)c5[C@@H](O)Cc1c25,mutagenic
+NOCAS_M271,CC[C@]1(O)C[C@@H](O)c2c(O)c3C(=O)c4c(O)cccc4C(=O)c3cc2[C@@H]1C(=O)OC,mutagenic
+14992-81-5,Clc1c(Cl)c(Cl)c(C=C)c(Cl)c1Cl,non-mutagenic
+60-12-8,OCCc1ccccc1,non-mutagenic
+123-38-6,CCC=O,non-mutagenic
+2386-87-0,O=C(OCC1CCC2OC2C1)C3CCC4OC4C3,mutagenic
+105453-64-3,OC1C=Cc2c(ccc3cc4c(ccc5ccccc45)cc23)C1O,mutagenic
+999-81-5,C[N+](C)(C)CCCl,non-mutagenic
+85-91-6,CNc1ccccc1C(=O)OC,non-mutagenic
+621-52-3,CCOc1cccc(c1)[N+](=O)[O-],non-mutagenic
+79660-72-3,CN1CCN(CC1)c2c(F)cc3C(=O)C(=CN(CCF)c3c2F)C(=O)O,mutagenic
+25703-79-1,CC(O)COC(=O)C(=C)C,non-mutagenic
+73341-53-4,Cc1cccn2c1nc3ccc(NO)nc23,mutagenic
+4460-86-0,COc1cc(OC)c(C=O)cc1OC,non-mutagenic
+148193-36-6,COc1nsc2c(OCC3CO3)cccc12,mutagenic
+58-93-5,NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1Cl,non-mutagenic
+105453-63-2,OC1C=Cc2ccc3cc4c(ccc5ccccc45)cc3c2C1O,mutagenic
+616-44-4,Cc1ccsc1,non-mutagenic
+1467-79-4,CN(C)C#N,non-mutagenic
+61422-45-5,CCCCCCNC(=O)N1C=C(F)C(=O)NC1=O,non-mutagenic
+35142-06-4,COC(=O)c1cc2OCOc2c3c1ccc4c(OC)cccc34,mutagenic
+24260-08-0,CCOC1=CC(=O)C(=CC1=O)NC(=O)C,mutagenic
+75-95-6,BrC(Br)C(Br)(Br)Br,non-mutagenic
+1007-36-9,CNC(=O)Nc1ccccc1,non-mutagenic
+3102-70-3,Cc1cc(C)c(N)c(C)c1N,mutagenic
+2163-68-0,CCNc1nc(O)nc(NC(C)C)n1,non-mutagenic
+127-00-4,C[C@@H](O)CCl,mutagenic
+5869-25-0,Nc1ccc2c3cccc4cccc(c2c1)c34,mutagenic
+625-48-9,OCC[N+](=O)[O-],mutagenic
+131-57-7,COc1ccc(C(=O)c2ccccc2)c(O)c1,non-mutagenic
+88-99-3,OC(=O)c1ccccc1C(=O)O,non-mutagenic
+116374-66-4,CN(C)CCCNc1c2ccccc2nc3c(F)ccc(c13)[N+](=O)[O-],mutagenic
+132929-89-6,[O-][N+](=O)c1ccc2ccc3cc4C=CCCc4c5ccc1c2c35,mutagenic
+153260-28-7,CC1(C)Cc2ncccc2c3nc(N)sc13,mutagenic
+NOCAS_M377,CCCC[C@@H](CC)COC(=O)C=C,non-mutagenic
+60877-90-9,Oc1ccccc1\C=N\c2snc3ccccc23,non-mutagenic
+53-95-2,CC(=O)N(O)c1ccc2c(Cc3ccccc23)c1,mutagenic
+101-18-8,Oc1cccc(Nc2ccccc2)c1,non-mutagenic
+95-06-7,CCN(CC)C(=S)SCC(=C)Cl,mutagenic
+115-39-9,Oc1c(Br)cc(cc1Br)C2(OS(=O)(=O)c3ccccc23)c4cc(Br)c(O)c(Br)c4,non-mutagenic
+38434-77-4,CCN(N=O)C#N,mutagenic
+762-75-4,CC(C)(C)OCO,non-mutagenic
+111712-46-0,CC(Br)(CBr)COP(=O)(OCC(C)(Br)CBr)OCC(C)(Br)CBr,non-mutagenic
+50-07-7,CO[C@]12[C@H]3N[C@H]3CN1C4=C([C@@H]2COC(=O)N)C(=O)C(=C(C)C4=O)N,mutagenic
+124-07-2,CCCCCCCC(=O)O,non-mutagenic
+98033-21-7,Cn1ccc2c1ccc3ccc4ccc(O)cc4c23,mutagenic
+2517-98-8,CC(=O)OCc1c2ccccc2c(C)c3c1ccc4ccccc34,mutagenic
+14703-71-0,Nc1cccc(O)c1[N+](=O)[O-],non-mutagenic
+218-34-8,c1cnc2c(c1)ccc3c2ccc4cccnc34,mutagenic
+8003-03-0,NC1=NC(=O)N(C=C1)[C@@H]2O[C@H](COP(=O)(O)O[C@@H]3[C@@H](CO)O[C@H]([C@@H]3O)n4cnc5c(N)ncnc45)[C@@H](O)[C@H]2O,non-mutagenic
+205-99-2,c1ccc2c(c1)c3cccc4c5ccccc5cc2c34,mutagenic
+NOCAS_M312,Cc1cccc(OC[C@@H](O)CNC(C)(C)C)c1C,non-mutagenic
+113202-60-1,CC(=O)Oc1cc(C=O)cc2N3CC4C(N4C(=O)C)C(OC(=O)C)(O3)C(COC(=O)N)c12,mutagenic
+119239-65-5,OC1C2OC2c3ccc4ncccc4c3C1O,non-mutagenic
+100-22-1,CN(C)c1ccc(cc1)N(C)C,mutagenic
+68268-20-2,CCCN(C(=O)CCCl)c1snc2ccccc12,mutagenic
+4213-45-0,COc1ccc2nc3cc(Cl)ccc3c(NC(C)CCCN(CCCl)CCCl)c2c1,mutagenic
+121-66-4,Nc1ncc(s1)[N+](=O)[O-],mutagenic
+141511-28-6,[O-][N+](=O)c1cc2CCc3cc4CCCCc4c5CCc(c1)c2c35,mutagenic
+124-30-1,CCCCCCCCCCCCCCCCCCN,non-mutagenic
+96-67-3,Nc1cc(cc(c1O)S(=O)(=O)O)[N+](=O)[O-],non-mutagenic
+61695-72-5,C1O[C@@H]1c2c3ccccc3cc4c2ccc5ccccc45,mutagenic
+60-82-2,Oc1ccc(CCC(=O)c2c(O)cc(O)cc2O)cc1,non-mutagenic
+111-71-7,CCCCCCC=O,non-mutagenic
+NOCAS_M6,COc1cc(cc(OC)c1O)[C@H]2[C@H]3[C@H](COC3=O)[C@H](O[C@@H]4O[C@@H]5CO[C@H](O[C@H]5[C@H](O)[C@@H]4O)c6cccs6)c7cc8OCOc8cc27,mutagenic
+75-62-7,ClC(Cl)(Cl)Br,mutagenic
+NOCAS_M508,CC[C@@H]1NC(=O)c2cc(c(Cl)cc2N1)S(=O)(=O)N,non-mutagenic
+61875-33-0,Cc1cccc2nc(O)c(O)nc12,mutagenic
+2876-24-6,[O-][N+](=O)c1cccc2nc3ccccc3nc12,mutagenic
+102873-32-5,[O-][N+](=O)c1cccc(c1)c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-],mutagenic
+98736-50-6,CN(Cc1ccc(Br)cc1)N=O,mutagenic
+630125-99-4,CNc1cc(Oc2ccc(N)cc2)ncn1,mutagenic
+613-35-4,CC(=O)Nc1ccc(cc1)c2ccc(NC(=O)C)cc2,mutagenic
+6312-87-4,CC(=O)Nc1ccc(Oc2ccccc2)cc1,mutagenic
+3244-54-0,[O-][N+](=O)c1ccc2[nH]c3ccc(cc3c2c1)[N+](=O)[O-],mutagenic
+1447-88-7,COc1c(O)cc2OC(=CC(=O)c2c1O)c3ccc(O)cc3,non-mutagenic
+172374-60-6,CC(=O)Nc1ccc(Oc2ccc(cc2)N(OC(=O)C)C(=O)C)cc1,mutagenic
+57-10-3,CCCCCCCCCCCCCCCC(=O)O,non-mutagenic
+18699-02-0,CC(=O)Nc1ccc(CC(=O)O)cc1,non-mutagenic
+90-05-1,COc1ccccc1O,non-mutagenic
+160543-23-7,Cc1ccc2c(C)c3C(O)C(O)c4ccccc4c3nc2c1,non-mutagenic
+113698-18-3,COC1=CC(=O)c2c(nc(C)c3c4CCCCc4[nH]c23)C1=O,mutagenic
+106-02-5,O=C1CCCCCCCCCCCCCCO1,non-mutagenic
+14901-08-7,C[N+](=NC[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O)[O-],non-mutagenic
+107-05-1,ClCC=C,mutagenic
+94840-66-1,NC(CSC(F)(F)C(F)F)C(=O)O,non-mutagenic
+106686-63-9,COc1cccc(\C=C\C)c1OC,mutagenic
+100-25-4,[O-][N+](=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+476-46-0,Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1O,mutagenic
+55-21-0,NC(=O)c1ccccc1,non-mutagenic
+102-82-9,CCCCN(CCCC)CCCC,non-mutagenic
+63019-39-6,Oc1ccc2ccc3c4ccccc4ccc3c2c1,mutagenic
+207-09-0,c1ccc2nc3c(cc2c1)c4cccc5cccc3c45,non-mutagenic
+103942-97-8,CN(C)CCNC(=O)c1cccc2nc3ccccc3nc12,mutagenic
+8001-35-2,ClC[C@]1(C(Cl)Cl)[C@@H]2CC(Cl)(Cl)[C@@]1(CCl)[C@H](Cl)[C@@H]2Cl,mutagenic
+51276-85-8,Nc1nc2cc(O)ccc2[nH]1,mutagenic
+645-62-5,CCC\C=C(\CC)/C=O,non-mutagenic
+141-86-6,Nc1cccc(N)n1,mutagenic
+992-59-6,Cc1cc(ccc1N=Nc2cc(c3ccccc3c2N)S(=O)(=O)O)c4ccc(N=Nc5cc(c6ccccc6c5N)S(=O)(=O)O)c(C)c4,non-mutagenic
+1820-59-3,[O-][N+](=O)c1ccc(c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])c(c1)[N+](=O)[O-],mutagenic
+24085-08-3,CC(C)(C)N(CC(=O)c1ccc(O)c(CO)c1)Cc2ccccc2,mutagenic
+1679-41-0,C\C(=C/C=O)\Cl,mutagenic
+36133-88-7,CC(=O)NCc1onc(n1)c2oc(cc2)[N+](=O)[O-],mutagenic
+150445-96-8,[O-][N+](=O)c1ccc2c(c1)nc(\C=N\OCc3ccccc3[N+](=O)[O-])n2Cc4ccccc4,mutagenic
+97919-22-7,Nc1ccc(cc1)S(=O)(=O)Nc2cnc3c(Cl)cccc3n2,non-mutagenic
+2942-42-9,[O-][N+](=O)c1cccc2c[nH]nc12,mutagenic
+36167-69-8,COc1ccc2nc3cc(Cl)ccc3c(NCCCNCCCl)c2n1,mutagenic
+122365-35-9,Nc1c2ncn(C(c3ccccc3)c4ccccc4)c2nc[n+]1[O-],mutagenic
+110-58-7,CCCCCN,non-mutagenic
+17369-59-4,CC\C=C\1/OC(=O)c2ccccc12,mutagenic
+107027-31-6,CN(C)CCNC(=O)c1cccc2ncc(nc12)c3ccccc3,mutagenic
+51264-14-3,COc1cc(NS(=O)(=O)C)ccc1Nc2c3ccccc3nc4ccccc24,mutagenic
+68931-03-3,CCCCCCCOc1ccccc1NC(=O)OC(C)CN(CC)CC,non-mutagenic
+932-97-8,O=C1C=CC(=N#N)C=C1,mutagenic
+3113-71-1,Cc1cc(ccc1[N+](=O)[O-])C(=O)O,mutagenic
+NOCAS_M150,C=CCOC[C@H]1CO1,mutagenic
+NOCAS_M40,CC[C@@H](C)OC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+76024-59-4,OC1C(O)c2ccc3ccc4ccccc4c3c2C5OC15,mutagenic
+2516-93-0,CCCCOCC(=O)O,non-mutagenic
+56602-33-6,CN(C)[P+](On1nnc2ccccc12)(N(C)C)N(C)C,non-mutagenic
+118326-95-7,COc1ccc2C=CC3CCCCC3c2c1,mutagenic
+95-47-6,Cc1ccccc1C,non-mutagenic
+50264-69-2,OC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c3ccccc13,non-mutagenic
+118-82-1,CC(C)(C)c1cc(Cc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C,non-mutagenic
+814-78-8,CC(=C)C(=O)C,non-mutagenic
+NOCAS_M269,CCOc1ccc(NC(=O)C[C@@H](C)O)cc1,mutagenic
+64894-89-9,OC(=O)c1ccc(Nc2c3ccccc3nc4cc(ccc24)N=N#N)cc1,mutagenic
+5634-39-9,OC[C@@H]1CO[C@@H](CCI)O1,mutagenic
+146795-34-8,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2,mutagenic
+659-70-1,CC(C)CCOC(=O)CC(C)C,non-mutagenic
+1822-51-1,ClCc1ccncc1,non-mutagenic
+477-83-8,COc1c(CO)c(O)cc2C(=O)c3ccccc3C(=O)c12,mutagenic
+4606-98-8,Cc1ccc(COS(=O)(=O)c2ccc(C)cc2)cc1,non-mutagenic
+93-76-5,OC(=O)COc1cc(Cl)c(Cl)cc1Cl,non-mutagenic
+76-06-2,[O-][N+](=O)C(Cl)(Cl)Cl,mutagenic
+118354-49-7,Brc1ccc2C3CCCCC3C4OC4c2c1,non-mutagenic
+81760-45-4,CCCCCCCCCCCCCCCC(=O)OCC1(O)CC23CCC4c5ccoc5C=CC4(C)C2CCC1C3,non-mutagenic
+698-63-5,[O-][N+](=O)c1oc(C=O)cc1,mutagenic
+619-25-0,OCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+95-65-8,Cc1ccc(O)cc1C,non-mutagenic
+143347-57-3,CC12CCC=C(C=O)C1(C2)C=O,mutagenic
+123-09-1,CSc1ccc(Cl)cc1,non-mutagenic
+10517-47-2,CC(=O)c1ccc(NO)cc1,mutagenic
+149-91-7,OC(=O)c1cc(O)c(O)c(O)c1,non-mutagenic
+91540-30-6,C=CCN1C2C1c3ccccc3c4ccccc24,mutagenic
+16110-14-8,Cc1c2ccc3ccccc3c2cc4ccc(O)c(O)c14,mutagenic
+134998-71-3,CCC(CCC(C)O)COC(=O)CCCCC(=O)O,non-mutagenic
+99-56-9,Nc1ccc(cc1N)[N+](=O)[O-],mutagenic
+98644-23-6,OCc1c2ccccc2c(COS(=O)(=O)O)c3ccc4ccccc4c13,mutagenic
+1937-35-5,Nc1ccc2cc(cc(O)c2c1N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)S(=O)(=O)O)S(=O)(=O)O,mutagenic
+117-10-2,Oc1cccc2C(=O)c3cccc(O)c3C(=O)c12,mutagenic
+3159-62-4,OCCCCCCCCCCCCCCCCCC(=O)O,non-mutagenic
+125847-46-3,OC1C=Cc2c(ccc3c4ccccc4sc23)C1O,mutagenic
+366-29-0,CN(C)c1ccc(cc1)c2ccc(cc2)N(C)C,non-mutagenic
+134785-76-5,COC(=O)Nc1nc2cc(ccc2[nH]1)\C(=N\O)\c3ccc(F)cc3,mutagenic
+94495-71-3,COc1c(O)c2OC3OC=CC3c2c4OC(=O)C5=C(CCC5=O)c14,mutagenic
+113600-15-0,Fc1ccc2cc3c(cc2c1)c4cccc5cccc3c45,mutagenic
+78-67-1,CC(C)(N=NC(C)(C)C#N)C#N,non-mutagenic
+45021-77-0,C[N+](C)(C)CCCNC(=O)C=C,non-mutagenic
+590-46-5,C[N+](C)(C)CC(=O)O,non-mutagenic
+111-42-2,OCCNCCO,non-mutagenic
+84-60-6,Oc1ccc2C(=O)c3cc(O)ccc3C(=O)c2c1,non-mutagenic
+26196-45-2,Nc1cc(c(N)cc1Cl)[N+](=O)[O-],mutagenic
+NOCAS_M69,COP(=O)(OC)[C@H](O)C(Cl)(Cl)Cl,mutagenic
+67-45-8,[O-][N+](=O)c1oc(\C=N\N2CCOC2=O)cc1,mutagenic
+101126-67-4,[O-][N+](=O)c1c(Cl)cc2Oc3cc(Cl)c(Cl)cc3Oc2c1Cl,non-mutagenic
+29043-89-8,CCCCOCC=O,non-mutagenic
+NOCAS_M574,CCCC[C@@H](CC)COC(=O)\C=C\c1ccc(OC)cc1,non-mutagenic
+101910-34-3,CS(=O)CCC(=O)N1C(CSC1c2ccccc2O)C(=O)O,non-mutagenic
+94-26-8,CCCCOC(=O)c1ccc(O)cc1,non-mutagenic
+87261-28-7,OC1C=Cc2c(ccc3c(c4ccccc4cc23)[N+](=O)[O-])C1O,mutagenic
+613-92-3,N\C(=N/O)\c1ccccc1,mutagenic
+133-90-4,Nc1cc(Cl)cc(C(=O)O)c1Cl,mutagenic
+470-90-6,CCOP(=O)(OCC)O\C(=C/Cl)\c1ccc(Cl)cc1Cl,mutagenic
+80324-43-2,Nc1ccc(cc1)N=Nc2cccc(N)c2N,mutagenic
+78111-17-8,C[C@@H](C[C@H](O)[C@H]1O[C@@H]2CC[C@@]3(CC[C@@H](O3)\C=C\[C@@H](C)[C@@H]4CC(=C[C@@]5(O[C@H](C[C@@](C)(O)C(=O)O)CC[C@@H]5O)O4)C)O[C@H]2[C@H](O)C1=C)[C@H]6O[C@@]7(CCCCO7)CC[C@H]6C,non-mutagenic
+NOCAS_M360,CC(C)(Oc1ccc(cc1)[C@@H]2CC2(Cl)Cl)C(=O)O,non-mutagenic
+57609-64-0,Nc1ccc(cc1)C(=O)OCCCOC(=O)c2ccc(N)cc2,non-mutagenic
+91134-58-6,CC(C)COC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+99346-49-3,Oc1cnnc(O)n1,mutagenic
+1321-74-0,C=Cc1ccccc1C=C,non-mutagenic
+518-47-8,Oc1ccc2c(Oc3cc(O)ccc3C24OC(=O)c5ccccc45)c1,non-mutagenic
+97-90-5,CC(=C)C(=O)OCCOC(=O)C(=C)C,non-mutagenic
+143-07-7,CCCCCCCCCCCC(=O)O,non-mutagenic
+1204-41-7,Cc1ccccc1c2ccc(N)cc2,mutagenic
+75-96-7,OC(=O)C(Br)(Br)Br,mutagenic
+5907-38-0,CN(CS(=O)(=O)O)C1=C(C)N(C)N(C1=O)c2ccccc2,mutagenic
+70585-50-1,OC(=O)c1cc(I)cc2cccnc12,non-mutagenic
+NOCAS_M184,ClC(Cl)(Cl)[C@@H]1CO1,mutagenic
+106686-67-3,O=S(=O)(Cc1ccccc1)N2C3C2c4ccccc4c5ccccc35,mutagenic
+97931-40-3,OC1CCCc2c1c(c3ccc4cccc5ccc2c3c45)[N+](=O)[O-],non-mutagenic
+58-56-0,Cc1ncc(CO)c(CO)c1O,non-mutagenic
+16156-55-1,CC(C)CCOS(=O)(=O)C,mutagenic
+17172-88-2,BrC(C(=O)NCc1ccccc1)c2ccccc2,non-mutagenic
+4659-45-4,ClC(=O)c1c(Cl)cccc1Cl,mutagenic
+5460-35-5,NC1=CC(=O)C(=O)c2ccccc12,mutagenic
+13615-38-8,Cc1cc(c2ccccc2c1)[N+](=O)[O-],mutagenic
+421-20-5,COS(=O)(=O)F,mutagenic
+38083-17-9,CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n2ccnc2,non-mutagenic
+58-61-7,Nc1ncnc2c1ncn2C3OC(CO)C(O)C3O,non-mutagenic
+630-20-6,ClCC(Cl)(Cl)Cl,non-mutagenic
+146795-46-2,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2[N+](=O)[O-],mutagenic
+78-85-3,CC(=C)C=O,mutagenic
+790-60-3,O1c2c1c3cc4ccccc4cc3c5ccccc25,mutagenic
+1836-77-7,[O-][N+](=O)c1ccc(Oc2c(Cl)cc(Cl)cc2Cl)cc1,mutagenic
+NOCAS_M370,CC[C@@H](C)c1ccccc1O,non-mutagenic
+2461-43-0,C(Oc1ccccc1Cc2ccccc2)C3CO3,mutagenic
+10510-77-7,CC[n+]1c2ccccc2nc3ccccc13,mutagenic
+53043-28-0,CC1=CC2=C(C=O)C(=O)[C@](C)(O)[C@H](O)C2=CO1,mutagenic
+75586-70-8,C[n+]1c2ccccc2cc3ccc(N)cc13,mutagenic
+605-71-0,[O-][N+](=O)c1cccc2c(cccc12)[N+](=O)[O-],mutagenic
+3022-61-5,CC(=O)C1c2cccc(O)c2C(=O)c3c(O)cccc13,mutagenic
+1746-01-6,Clc1cc2Oc3cc(Cl)c(Cl)cc3Oc2cc1Cl,non-mutagenic
+92134-97-9,OCC(O)C(O)C(O)C(O)C1SCC(N1N=O)C(=O)O,non-mutagenic
+57-66-9,CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O,non-mutagenic
+96-99-1,OC(=O)c1ccc(Cl)c(c1)[N+](=O)[O-],mutagenic
+4205-90-7,Clc1cccc(Cl)c1NC2=NCCN2,non-mutagenic
+110-61-2,N#CCCC#N,non-mutagenic
+18523-48-3,OC(=O)CN=N#N,non-mutagenic
+406-90-6,FC(F)(F)COC=C,mutagenic
+136112-69-1,[O-][N+](=O)c1ccc(Nc2[nH]cnc3ncnc23)cc1,non-mutagenic
+NOCAS_M361,OC(=O)C[C@H](Cl)C(=O)O,non-mutagenic
+2657-25-2,Oc1ccc(cc1)C(=O)\C=C\c2ccccc2,non-mutagenic
+109-09-1,Clc1ccccn1,mutagenic
+475-54-7,CC1=C(O)C(=C(C(=O)C1=O)C2=C(O)C(=C(C)C(=O)C2=O)O)O,non-mutagenic
+2872-48-2,COc1cc(N)c2C(=O)c3ccccc3C(=O)c2c1N,mutagenic
+NOCAS_M105,C[C@@H](CN(C[C@H](C)OC(=O)C)N=O)OC(=O)C,mutagenic
+105360-93-8,Oc1cc2ccc3cccc4ccc(n1)c2c34,mutagenic
+120812-52-4,[O-][N+](=O)c1ccc2ccc3ccc(c4c5CCCCc5c1c2c34)[N+](=O)[O-],mutagenic
+999-97-3,C[Si](C)(C)N[Si](C)(C)C,non-mutagenic
+963-89-3,Cc1ccc2nc3c(ccc4ccccc34)c(C)c2c1,mutagenic
+7627-38-5,ClCc1cnc(Cl)nc1Cl,mutagenic
+146795-27-9,COc1cccc(NC(=O)c2csc(c2)[N+](=O)[O-])c1,mutagenic
+116-85-8,Nc1ccc(O)c2C(=O)c3ccccc3C(=O)c12,mutagenic
+92-52-4,c1ccc(cc1)c2ccccc2,non-mutagenic
+71400-33-4,[O-][N+](=O)c1ccc2Oc3cc(ccc3Oc2c1)[N+](=O)[O-],mutagenic
+105453-67-6,OC1C(O)c2cc3c(ccc4ccccc34)cc2c5ccccc15,mutagenic
+517-82-8,CCC1=C(O)C(=O)c2c(O)c(O)c(O)c(O)c2C1=O,mutagenic
+110-85-0,C1CNCCN1,non-mutagenic
+138580-44-6,Cc1nc2C(=O)C=CC(=O)c2c3[nH]c4ccccc4c13,mutagenic
+54755-20-3,Cc1ccc2c(cccc2c1)[N+](=O)[O-],mutagenic
+33100-27-5,C1COCCOCCOCCOCCO1,non-mutagenic
+13707-88-5,CC(C)NCC(O)COc1ccccc1CC=C,non-mutagenic
+91259-16-4,[O-][N+](=O)c1ccc2ccc3cccc4c5ccccc5c1c2c34,mutagenic
+78-34-2,CCOP(=S)(OCC)S[C@@H]1OCCO[C@H]1SP(=S)(OCC)OCC,mutagenic
+106-24-1,CC(=CCC\C(=C\CO)\C)C,non-mutagenic
+89-61-2,[O-][N+](=O)c1cc(Cl)ccc1Cl,mutagenic
+7083-63-8,Nc1cccc2Cc3ccccc3c12,mutagenic
+39932-99-5,CC12CCC3C(CCC4CC(O)CCC34C)C1CCC(=O)N2,non-mutagenic
+4465-94-5,OCCCNP(=O)(O)N(CCCl)CCCl,mutagenic
+115-20-8,OCC(Cl)(Cl)Cl,mutagenic
+149862-55-5,CCCCNc1snc2ccccc12,non-mutagenic
+103-70-8,O=CNc1ccccc1,non-mutagenic
+29743-15-5,CCCCOc1ccc(\C=N\c2ccc(CC)cc2)cc1,mutagenic
+490-91-5,CC(C)C1=CC(=O)C(=CC1=O)C,non-mutagenic
+766-40-5,OC1OC(=O)C(=C1Cl)Cl,mutagenic
+396-30-5,Fc1ccc2ncccc2c1,mutagenic
+100-13-0,[O-][N+](=O)c1ccc(C=C)cc1,mutagenic
+52101-36-7,COC(=O)c1occ(c2ccccc2)c1c3ccccc3,non-mutagenic
+25843-45-2,CN=[N+](C)[O-],mutagenic
+30039-44-2,CCC(=O)OCc1ccc(cc1)[N+](=O)[O-],mutagenic
+88-85-7,CCC(C)c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+83996-50-3,CCOC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1cccc(c1)N(CCCl)CCCl)NC(=O)[C@@H](N)Cc2ccc(F)cc2,mutagenic
+23102-68-3,O1C2C1c3cscc3c4cscc24,mutagenic
+62895-88-9,CC(C)OC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OC(C)C)ccc1N,non-mutagenic
+113163-21-6,OC1C=Cc2c(ccc3cccnc23)C1O,mutagenic
+25082-33-1,c1ccc2cc3c(ccc4ccncc34)cc2c1,mutagenic
+1143-38-0,Oc1cccc2Cc3cccc(O)c3C(=O)c12,non-mutagenic
+479-27-6,Nc1cccc2cccc(N)c12,mutagenic
+158366-45-1,CC(=O)c1cccn1[N+](=O)[O-],mutagenic
+100-53-8,SCc1ccccc1,non-mutagenic
+133561-39-4,Nc1ccc(c2ccc(cc2N)[N+](=O)[O-])c(c1)[N+](=O)[O-],mutagenic
+42522-72-5,Oc1c(Br)cc2c(Oc3c(Br)c(O)c(Br)cc3C24OS(=O)(=O)c5ccccc45)c1Br,mutagenic
+103-89-9,CC(=O)Nc1ccc(C)cc1,mutagenic
+122365-34-8,Nc1ncnc2c1ncn2C(c3ccccc3)c4ccccc4,mutagenic
+69304-47-8,OCC1OC(CC1O)N2C=C(\C=C\Br)C(=O)NC2=O,non-mutagenic
+220168-52-5,O=C(ON(OCc1ccccc1)C(=O)c2ccccc2)c3ccc(cc3)C#N,mutagenic
+118353-05-2,Nc1nc(O)c2ncn(C3CC(CO)C=C3)c2n1,non-mutagenic
+55481-88-4,COC(=O)c1c(O)c2ccccc2c3OC(C)(C)C=Cc13,mutagenic
+1663-39-4,CC(C)(C)OC(=O)C=C,non-mutagenic
+4368-56-3,Nc1c2C(=O)c3ccccc3C(=O)c2c(NC4CCCCC4)cc1S(=O)(=O)O,non-mutagenic
+NOCAS_M160,CCCC[C@@H]1C(=O)N(N(C1=O)c2ccc(O)cc2)c3ccccc3,mutagenic
+10318-26-0,O[C@H](CBr)[C@H](O)[C@H](O)[C@@H](O)CBr,mutagenic
+161697-01-4,CCc1nc2ccc(NC)c(C)c2nc1CC,mutagenic
+60110-37-4,CC(C)(Br)C(=O)NCc1ccccc1,non-mutagenic
+868-85-9,COP(=O)OC,mutagenic
+127-07-1,NC(=O)NO,mutagenic
+28553-12-0,CC(C)CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCC(C)C,non-mutagenic
+14953-63-0,Cn1cnc(c2ccccc2)c1[N+](=O)[O-],mutagenic
+98033-23-9,CNc1ccc2ccc3ccc(O)cc3c2c1,mutagenic
+93261-88-2,[O-][N+](=O)c1oc(C(=O)CBr)c(c2ccccc2)c1c3ccccc3,mutagenic
+91-44-1,CCN(CC)c1ccc2C(=CC(=O)Oc2c1)C,non-mutagenic
+146795-39-3,[O-][N+](=O)c1cc(cs1)C(=O)Nc2cccc(Cl)c2,mutagenic
+602-64-2,Oc1cc2C(=O)c3ccccc3C(=O)c2c(O)c1O,mutagenic
+591-35-5,Oc1cc(Cl)cc(Cl)c1,non-mutagenic
+24463-19-2,ClCc1c2ccccc2cc3ccccc13,mutagenic
+103630-35-9,CC(=C)C1CCC(=C)C2C1C=C(C)C(=O)C3=C2C(=O)C(C)(O)C3,non-mutagenic
+109-65-9,CCCCBr,mutagenic
+95-93-2,Cc1cc(C)c(C)cc1C,non-mutagenic
+136861-01-3,Nc1cc(N)c(c2ccccc2)c(c1)[N+](=O)[O-],mutagenic
+146795-32-6,CCc1cccc(NC(=O)c2csc(c2)[N+](=O)[O-])c1,mutagenic
+22216-66-6,COc1ccc([Se]c2ccc(OC)cc2)cc1,mutagenic
+NOCAS_M248,N1[C@@H]2[C@H]1c3cccc4cccc2c34,mutagenic
+129-79-3,[O-][N+](=O)c1ccc2c(c1)C(=O)c3cc(cc(c23)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+119-41-5,CCOC(=O)COc1ccc2C(=O)C=C(Oc2c1)c3ccccc3,non-mutagenic
+NOCAS_M318,Clc1ccc(CO[C@H](Cn2ccnc2)c3ccc(Cl)cc3Cl)cc1,non-mutagenic
+110-02-1,c1ccsc1,non-mutagenic
+420-46-2,CC(F)(F)F,non-mutagenic
+688-74-4,CCCCOB(OCCCC)OCCCC,non-mutagenic
+105-95-3,O=C1CCCCCCCCCCCC(=O)OCCO1,non-mutagenic
+13010-07-6,CCCN(N=O)C(=N)N[N+](=O)[O-],mutagenic
+64-18-6,OC=O,non-mutagenic
+76002-91-0,CC(C)(c1ccc(OCC(O)CO)cc1)c2ccc(OCC3CO3)cc2,mutagenic
+97-23-4,Oc1ccc(Cl)cc1Cc2cc(Cl)ccc2O,mutagenic
+74-83-9,CBr,mutagenic
+96346-61-1,CN(C)c1ccc(cc1)C2CC3(C)C(CCC3(O)CCCO)C4CCC5=CC(=O)CCC5=C24,non-mutagenic
+97975-05-8,OCC1OC(CC1O)N2C=C(CCCCl)C(=O)NC2=O,non-mutagenic
+123-72-8,CCCC=O,non-mutagenic
+106532-68-7,CCCCCC(=O)\N=C\1/SN(C(=O)CCCCC)c2ccc(cc12)[N+](=O)[O-],mutagenic
+54357-08-3,Cc1ccc2cc(ccc2c1)[N+](=O)[O-],mutagenic
+1124-33-0,[O-][N+](=O)c1cc[n+]([O-])cc1,mutagenic
+87-68-3,ClC(=C(Cl)C(=C(Cl)Cl)Cl)Cl,non-mutagenic
+25003-82-1,c1ccc2c(c1)ccc3cc4cnccc4cc23,mutagenic
+61064-66-2,ClNc1ccc2c(Cc3ccccc23)c1,mutagenic
+98046-75-4,[O-][N+](=O)c1cnc2c(c1)nc3ccccn23,mutagenic
+18028-55-2,Cc1ccc(C)c2c3ccccc3[nH]c12,mutagenic
+92130-56-8,Cc1cc2ncccc2c3ncn(C)c13,non-mutagenic
+480-54-6,C\C=C/1\C[C@H](C)[C@@](O)(CO)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@H]23,mutagenic
+712-12-9,CC(C)CNc1snc2ccccc12,non-mutagenic
+42135-22-8,[O-][N+](=O)c1ccc2C(=O)c3ccccc3c2c1,mutagenic
+153-78-6,Nc1ccc2c(Cc3ccccc23)c1,mutagenic
+17309-86-3,CN(C)c1ccc(cc1)N=Nc2ccc3[nH]ncc3c2,mutagenic
+49852-85-9,BrCc1c2ccccc2c3ccc4cccc5ccc1c3c45,mutagenic
+836-37-3,COC(=O)\C(=C\c1oc(cc1)[N+](=O)[O-])\C#N,mutagenic
+15254-64-5,Cc1cc(C)c2c(ccc3ccccc23)c1,mutagenic
+619-17-0,Nc1cc(ccc1C(=O)O)[N+](=O)[O-],mutagenic
+513-85-9,CC(O)C(C)O,non-mutagenic
+41340-19-6,CCC1(CC(=O)O)OCCc2c1[nH]c3c(C)cccc23,non-mutagenic
+3811-71-0,Nc1cc(N)c(cc1N=Nc2ccc(cc2)c3ccc(cc3)N=Nc4ccc(O)c(c4)C(=O)O)N=Nc5ccc(cc5)S(=O)(=O)O,mutagenic
+95969-40-7,C[N+]1([O-])CCC(=CC1)c2ccccc2,non-mutagenic
+6534-28-7,CC(=O)Nc1ccc(NC(=O)C)c2C(=O)c3ccccc3C(=O)c12,mutagenic
+357-57-3,COc1cc2N3[C@H]4[C@@H]5[C@@H](CC3=O)OCC=C6CN7CC[C@]4([C@H]7C[C@@H]56)c2cc1OC,non-mutagenic
+83407-42-5,CNc1c(C)cc2ncccc2c1N,non-mutagenic
+24953-56-8,COc1nncc2ccccc12,non-mutagenic
+83905-01-5,CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC3OC(C)CC(C3O)N(C)C)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O,non-mutagenic
+321-14-2,OC(=O)c1cc(Cl)ccc1O,non-mutagenic
+62641-67-2,C[C@H]1CN(N=O)C(=O)NC1=O,mutagenic
+94500-44-4,ClCc1cc2c3ccccc3cc4ccc5cccc1c5c24,mutagenic
+6223-35-4,CC(C)c1ccc(C)c2c(cc(C)c2c1)S(=O)(=O)O,non-mutagenic
+100-17-4,COc1ccc(cc1)[N+](=O)[O-],mutagenic
+NOCAS_M212,O1[C@@H]2C=Cc3c(ccc4c5C=Cc6cccc(cc34)c56)[C@H]12,mutagenic
+63642-50-2,O=C1CCCc2c1ccc3c2ccc4ccccc34,mutagenic
+108-45-2,Nc1cccc(N)c1,mutagenic
+140-79-4,O=NN1CCN(CC1)N=O,mutagenic
+56-93-9,C[N+](C)(C)Cc1ccccc1,non-mutagenic
+3173-72-6,O=C=Nc1cccc2c(cccc12)N=C=O,non-mutagenic
+112-55-0,CCCCCCCCCCCCS,non-mutagenic
+13395-02-3,COc1cccc2c1cc3NC(=O)c4cc5OCOc5c2c34,mutagenic
+505-29-3,C1CSCCS1,mutagenic
+NOCAS_M67,NC(=O)C1(O[C@H]1C(=O)c2ccccc2)C(=O)N,mutagenic
+101328-75-0,CCCCCn1cc2C[C@@H]3[C@H](C=C(C)CN3C)c4cccc1c24,mutagenic
+838-88-0,Cc1cc(Cc2ccc(N)c(C)c2)ccc1N,mutagenic
+75-87-6,ClC(Cl)(Cl)C=O,mutagenic
+16974-10-0,CCCCCC\C=C/CCCCCCOC(=O)C,non-mutagenic
+135-76-2,Oc1ccc2c(cccc2c1)S(=O)(=O)O,non-mutagenic
+5975-78-0,CC1CCCC(=O)CCCCCc2cc(O)cc(O)c2C(=O)O1,non-mutagenic
+56-53-1,CC\C(=C(\CC)/c1ccc(O)cc1)\c2ccc(O)cc2,non-mutagenic
+3025-52-3,CCN(CC)c1ccc(cc1)N=Nc2ccc(cc2)[N+](=O)[O-],mutagenic
+580-15-4,Nc1ccc2ncccc2c1,non-mutagenic
+98-91-9,OC(=S)c1ccccc1,non-mutagenic
+962-58-3,CCOP(=O)(OCC)Oc1cc(C)nc(n1)C(C)C,mutagenic
+4435-53-4,COC(C)CCOC(=O)C,non-mutagenic
+299-28-5,OCC(O)C(O)C(O)C(O)C(=O)O,non-mutagenic
+143603-80-9,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3ccc(O)cc3,mutagenic
+2645-07-0,OC(=O)CNC(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+108-80-5,O=C1NC(=O)NC(=O)N1,non-mutagenic
+84030-17-1,Oc1ccc2cc(cc(c2c1N=Nc3ccc(cc3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+1253-28-7,CCCCCC(=O)OC1(CCC2C3CCC4=CC(=O)CCC4C3CCC12C)C(=O)C,non-mutagenic
+55556-85-9,O[C@H]1CCCN(C1)N=O,mutagenic
+4252-78-2,ClCC(=O)c1ccc(Cl)cc1Cl,mutagenic
+73215-03-9,[O-][N+](=O)c1ccc(CNc2[nH]cnc3ncnc23)cc1,mutagenic
+13177-25-8,Nc1ccc2cccc3c4ccccc4c1c23,mutagenic
+37797-31-2,CC(=O)OCc1ccc(cc1)N=Nc2ccc(COC(=O)C)cc2,mutagenic
+111712-45-9,CC(OP(=O)(OC(C)C(Br)CBr)OC(C)C(Br)CBr)C(Br)CBr,mutagenic
+64920-32-7,O[C@@H]1C=Cc2ccc3c(ccc4ccccc34)c2[C@H]1O,mutagenic
+103946-55-0,C(OCC1CCC2OC2C1)C3CCC4OC4C3,mutagenic
+57309-27-0,CC1(N(O)c2ccccc2C1=O)c3ccccc3,non-mutagenic
+224-41-9,c1ccc2c(c1)ccc3cc4ccc5ccccc5c4cc23,mutagenic
+135105-89-4,COc1cc(OC)c2C3C=COC3Oc2c1,mutagenic
+630-16-0,BrCC(Br)(Br)Br,mutagenic
+142044-37-9,C[n+]1cccc2[C@@H]3O[C@@H]3C=Cc12,mutagenic
+3585-32-8,CNN=NC,mutagenic
+125372-29-4,Cc1cc2ncccc2c3nc(N=N#N)n(C)c13,mutagenic
+133743-71-2,COC(=O)C1=C(C)N=C(C)C(=C(O)OCCc2ccc(cc2)N3CCN(CC3)C(c4ccccc4)c5ccccc5)C1c6cccc(c6)[N+](=O)[O-],non-mutagenic
+134109-03-8,OC1C=Cc2c(ccc3c(Cl)c4ccccc4cc23)C1O,mutagenic
+42286-46-4,O=C1C(=O)c2cc3ccccc3c4ccc5cccc1c5c24,mutagenic
+101021-43-6,Cc1ccc2c(ccc3[nH]c4ccc5ccccc5c4c23)c1,mutagenic
+2782-91-4,CN(C)C(=S)N(C)C,non-mutagenic
+63224-45-3,CCCCCCCCCCCCCCN(OC(=O)C)c1ccc2c(Cc3ccccc23)c1,mutagenic
+463-51-4,C=C=O,mutagenic
+119239-64-4,OC1C(O)c2ccc3c(ccc[n+]3[O-])c2C4OC14,non-mutagenic
+2039-87-4,Clc1ccccc1C=C,non-mutagenic
+88746-58-1,BrCc1cc2c3ccccc3c4cccc(c1)c24,mutagenic
+90301-75-0,NC1=NC(=O)N(C=C1CCCl)C2CC(O)C(CO)O2,non-mutagenic
+4189-44-0,NC(=S(=O)=O)N,mutagenic
+191861-18-4,Fc1cnc2c(ccc3ncc(F)cc23)c1,non-mutagenic
+299-88-7,C\C(=C(/CCOC(=O)c1ccccc1)\SC(=O)c2ccccc2)\N(Cc3cnc(C)nc3N)C=O,non-mutagenic
+37364-66-2,C[C@@H](O)[C@H](NC(=O)[C@@H](C)[C@H](O)[C@@H](C)NC(=O)[C@@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@H](N)C(=O)N)[C@@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O[C@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)O,non-mutagenic
+618-87-1,Nc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+14918-69-5,Oc1c(Cl)c(Cl)c(O)c2C(=O)C=CC(=O)c12,mutagenic
+27321-96-6,CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OCCOCCO,non-mutagenic
+172374-59-3,CC(=O)Nc1ccc(Oc2ccc(cc2)N(O)C=O)cc1,mutagenic
+146795-42-8,[O-][N+](=O)c1cc(cs1)C(=O)Nc2cccc(Br)c2,mutagenic
+396-31-6,Fc1cnc2ccccc2c1,non-mutagenic
+5437-38-7,Cc1cccc(C(=O)O)c1[N+](=O)[O-],mutagenic
+122-69-0,O=C(OC\C=C\c1ccccc1)\C=C\c2ccccc2,mutagenic
+3689-24-5,CCOP(=S)(OCC)OP(=S)(OCC)OCC,mutagenic
+34433-31-3,NC(=O)c1cc[n+](COC[n+]2ccccc2\C=N\O)cc1,non-mutagenic
+117066-35-0,O[C@H]1[C@H](O)c2nc3ccc4ccccc4c3cc2c5ccccc15,non-mutagenic
+1116-40-1,CC(C)CN(CC(C)C)CC(C)C,non-mutagenic
+153654-34-3,Oc1c(cc2c3ccccc3[nH]c2c1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+589-15-1,BrCc1ccc(Br)cc1,non-mutagenic
+83-38-5,Clc1cccc(Cl)c1C=O,non-mutagenic
+102408-26-4,CNc1nc2c3cccnc3ccc2n1C,mutagenic
+66860-80-8,ClCC1(C(Cl)Cl)C2C(Cl)C(Cl)C1(C(Cl)Cl)C(Cl)C2Cl,non-mutagenic
+107-15-3,NCCN,mutagenic
+153260-24-3,Nc1nc2C3CCCNC3CCc2s1,non-mutagenic
+133-37-9,O[C@@H]([C@H](O)C(=O)O)C(=O)O,non-mutagenic
+54954-12-0,OC[C@H]1O[C@@H](Oc2cc(O)cc3Oc4c(O)ccc(O)c4C(=O)c23)[C@H](O)[C@@H](O)[C@@H]1O,mutagenic
+148-79-8,c1ccc2[nH]c(nc2c1)c3cscn3,mutagenic
+2438-72-4,CCCCOc1ccc(CC(=O)NO)cc1,mutagenic
+5709-67-1,[O-][N+](=O)c1nc2ccccc2[nH]1,mutagenic
+67730-11-4,Cc1cccn2c1nc3ccc(N)nc23,mutagenic
+5855-71-0,Nc1ccc(c2ccc(N)cc2[N+](=O)[O-])c(c1)[N+](=O)[O-],mutagenic
+159092-81-6,[O-][N+](=O)c1ccc2c(c1)cc(c3ccc(cc23)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+645-09-0,NC(=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+92-48-8,Cc1ccc2OC(=O)C=Cc2c1,non-mutagenic
+53-43-0,CC12CCC3C(CC=C4CC(O)CCC34C)C1CCC2=O,non-mutagenic
+100-65-2,ONc1ccccc1,mutagenic
+153654-32-1,Oc1c(cc2c3cc(ccc3[nH]c2c1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+623-10-9,Cc1ccc(NO)cc1,mutagenic
+91-23-6,COc1ccccc1[N+](=O)[O-],mutagenic
+119-39-1,Oc1nncc2ccccc12,non-mutagenic
+88-05-1,Cc1cc(C)c(N)c(C)c1,mutagenic
+809-73-4,CC(C)(C)C1=CC(=CC=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C=C(C1=O)C(C)(C)C,non-mutagenic
+111070-57-6,[O-][N+](=O)c1oc(\C=N\N2C(=O)C=C(C=C2c3ccccc3)c4ccccc4)cc1,mutagenic
+19322-27-1,CC1=C(O)C(=O)CO1,mutagenic
+NOCAS_M260,CC[C@@H](Cl)[N+](=O)[O-],mutagenic
+31383-81-0,COC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OC)ccc1N,mutagenic
+40855-12-7,OCCNCc1oc(cc1)[N+](=O)[O-],mutagenic
+149396-88-3,COc1cc(C(O)c2ncc([N+](=O)[O-])n2C)c(O)c(c1)C(C)(C)C,mutagenic
+88-89-1,Oc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+67604-48-2,Oc1ccc(cc1)C2CC(=O)c3c(O)cc(O)cc3O2,non-mutagenic
+122-48-5,COc1cc(CCC(=O)C)ccc1O,non-mutagenic
+134-72-5,CN[C@H](C)[C@@H](O)c1ccccc1,non-mutagenic
+62-31-7,NCCc1ccc(O)c(O)c1,mutagenic
+18829-55-5,CCCC\C=C\C=O,mutagenic
+58086-32-1,COC(=O)c1cccc2Oc3c4[C@@H]5C=CO[C@H]5Oc4cc(OC)c3C(=O)c12,mutagenic
+1845-30-3,CC1=CC(O)C2CC1C2(C)C,non-mutagenic
+163930-30-1,ICCc1ccc(OCc2ccccc2)cc1,mutagenic
+143603-75-2,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3cc(OC)c(OC)c(OC)c3,mutagenic
+NOCAS_M101,[O-][N+](=O)c1ccc(s1)[C@@H]2NC(=O)c3ccccc3N2,mutagenic
+129401-88-3,C=CC(=O)N1CCN(CC1)c2ccccc2,non-mutagenic
+39565-00-9,CC(=O)c1ccc(s1)[N+](=O)[O-],mutagenic
+290-37-9,c1cnccn1,non-mutagenic
+2523-37-7,CC1c2ccccc2c3ccccc13,mutagenic
+79-94-7,CC(C)(c1cc(Br)c(O)c(Br)c1)c2cc(Br)c(O)c(Br)c2,non-mutagenic
+107-25-5,COC=C,non-mutagenic
+152-84-1,OC1COC(OCC2OC(Oc3ccc4C(=O)c5ccccc5C(=O)c4c3O)C(O)C(O)C2O)C(O)C1O,non-mutagenic
+79-43-6,OC(=O)C(Cl)Cl,mutagenic
+82-05-3,O=C1c2ccccc2c3cccc4cccc1c34,mutagenic
+111712-47-1,CC(Br)C(Br)COP(=O)(OCC(Br)C(C)Br)OCC(Br)C(C)Br,mutagenic
+34256-82-1,CCOCN(C(=O)CCl)c1c(C)cccc1CC,non-mutagenic
+80-82-0,OS(=O)(=O)c1ccccc1[N+](=O)[O-],non-mutagenic
+106-30-9,CCCCCCC(=O)OCC,non-mutagenic
+39638-32-9,CC(C)(Cl)OC(C)(C)Cl,mutagenic
+4792-83-0,CCOc1ccc(cc1)N=[N+]([O-])c2ccc(OCC)cc2,non-mutagenic
+78448-07-4,Oc1ccc2c(ccc3[nH]c4ccc5ccccc5c4c23)c1,mutagenic
+82-50-8,OS(=O)(=O)c1cccc2C(=O)c3c(cccc3[N+](=O)[O-])C(=O)c12,mutagenic
+NOCAS_M174,CC(=C)C(=O)OC[C@H]1CO1,mutagenic
+125157-98-4,CC1C2C(=Nc3ccc(C)cc23)N(C)c4ccccc14,mutagenic
+21638-36-8,CC1CN(\N=C\c2oc(cc2)[N+](=O)[O-])C(=O)N1,mutagenic
+109621-21-8,COC(=O)C(CSCC(Br)c1ccccc1)NC(=O)C,non-mutagenic
+72-57-1,Cc1cc(ccc1N=Nc2c(O)c3c(N)cc(cc3cc2S(=O)(=O)O)S(=O)(=O)O)c4ccc(N=Nc5c(O)c6c(N)cc(cc6cc5S(=O)(=O)O)S(=O)(=O)O)c(C)c4,mutagenic
+140-49-8,CC(=O)Nc1ccc(cc1)C(=O)CCl,mutagenic
+2832-19-1,OCNC(=O)CCl,non-mutagenic
+497841-28-8,C[C@@H](Nc1[nH]cnc2nc(cc12)c3ccc(CCl)cc3)c4ccccc4,mutagenic
+96910-73-5,CC1C=C(C=O)C(=CC2(O)CC(C)(C)CC12)C=O,mutagenic
+25956-17-6,COc1cc(c(C)cc1N=Nc2c(O)ccc3cc(ccc23)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+57816-08-7,C1c2ccc3ccccc3c2Cc4ccc5ccccc5c14,mutagenic
+1149-99-1,CC1=C2C(O)C(C)(CO)C=C2C(=O)C(C)(O)C13CC3,mutagenic
+624-76-0,OCCI,mutagenic
+14882-94-1,CC(=O)OC(C)(C)C1Cc2cc3C=C(C(=O)Oc3cc2O1)C(C)(C)C=C,non-mutagenic
+100-03-8,OS(=O)c1ccc(Cl)cc1,non-mutagenic
+57-41-0,O=C1NC(=O)C(N1)(c2ccccc2)c3ccccc3,non-mutagenic
+835-64-3,Oc1ccccc1c2oc3ccccc3n2,non-mutagenic
+68268-44-0,CC(C)CN(C(=O)CCCl)c1snc2ccccc12,non-mutagenic
+91-93-0,COc1cc(ccc1N=C=O)c2ccc(N=C=O)c(OC)c2,mutagenic
+74940-61-7,COP(=O)(OC)C(OC(=O)CCl)C(Cl)(Cl)Cl,non-mutagenic
+393-77-1,Oc1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-],non-mutagenic
+62018-92-2,CCCCN(CCC(=O)O)N=O,mutagenic
+25074-67-3,Clc1ccc2c(oc3ccccc23)c1,mutagenic
+124878-08-6,COc1cc(OC)c(cc1OC)C2OC2C,mutagenic
+119-26-6,NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+522-06-5,COc1c2ccoc2nc3c(OC)c4OCOc4cc13,mutagenic
+119-15-3,Oc1ccc(Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])cc1,mutagenic
+75464-10-7,CCC(=O)C1c2cccc(O)c2C(=O)c3c(O)cccc13,mutagenic
+3626-29-7,OC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)c3ccc(cc3)N=Nc4ccc(N=Nc5ccc(O)c(c5)C(=O)O)c6cc(ccc46)S(=O)(=O)O,mutagenic
+158729-30-7,[O-][N+](=O)c1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1Cl,non-mutagenic
+67274-52-6,CC(=O)N(O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+334-48-5,CCCCCCCCCC(=O)O,non-mutagenic
+96563-01-8,NC(CSC(F)(F)C(F)Cl)C(=O)O,non-mutagenic
+482-27-9,COc1c2OC(=O)C=Cc2c(OC)c3ccoc13,non-mutagenic
+1563-66-2,CNC(=O)Oc1cccc2CC(C)(C)Oc12,non-mutagenic
+108283-47-2,CC(C)(C)OC(=O)C(N)CN=N#N,mutagenic
+94-80-4,CCCCOC(=O)COc1ccc(Cl)cc1Cl,non-mutagenic
+634-67-3,Nc1ccc(Cl)c(Cl)c1Cl,non-mutagenic
+31647-36-6,Cc1cc2cccc3ccc4c5ccccc5cc1c4c23,mutagenic
+1574-41-0,C\C=C/C=C,non-mutagenic
+611-33-6,Clc1cccc2cccnc12,mutagenic
+65271-80-9,OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12,mutagenic
+341-69-5,CN(C)CCO[C@H](c1ccccc1)c2ccccc2C,non-mutagenic
+NOCAS_M231,CCc1c(O)ccc2c3CCO[C@@](CC)(CC(=O)O)c3[nH]c12,mutagenic
+57-83-0,CC(=O)[C@H]1CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,non-mutagenic
+603-02-1,Cc1ccc(c(C)c1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+6300-61-4,Cc1cc(N=Nc2ccc(cc2)S(=O)(=O)O)c(N)cc1N,mutagenic
+5141-20-8,CCN(Cc1cccc(c1)S(=O)(=O)O)c2ccc(cc2)C(=C3C=CC(=[N+](CC)Cc4cccc(c4)S(=O)(=O)O)C=C3)c5ccc(cc5)S(=O)(=O)O,mutagenic
+13177-26-9,Nc1cc2c3ccccc3c4cccc(c1)c24,mutagenic
+10567-95-0,Cc1cc2c(C)c3ccccc3nc2c4ccccc14,mutagenic
+488-11-9,OC(=O)\C(=C(/Br)\C=O)\Br,mutagenic
+141-84-4,O=C1CSC(=S)N1,non-mutagenic
+58632-95-4,CC(C)(C)OC(=O)O\N=C(/C#N)\c1ccccc1,non-mutagenic
+106-95-6,BrCC=C,mutagenic
+314-40-9,CCC(C)N1C(=O)NC(=C(Br)C1=O)C,non-mutagenic
+53757-28-1,[O-][N+](=O)c1oc(cc1)c2cscn2,mutagenic
+2315-20-0,NC(=N)NN=C(\C=C/c1oc(cc1)[N+](=O)[O-])\C=C/c2oc(cc2)[N+](=O)[O-],mutagenic
+NOCAS_M526,ClC1=C(Cl)[C@@]2(Cl)[C@H]3COS(=O)OC[C@@H]3[C@]1(Cl)C2(Cl)Cl,non-mutagenic
+120-82-1,Clc1ccc(Cl)c(Cl)c1,non-mutagenic
+NOCAS_M456,COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@@H]([C@H](O)[C@H](C)O5)N6CCOC[C@H]6C#N)c4c(O)c3C(=O)c12)C(=O)CO,non-mutagenic
+98736-45-9,COc1cccc(CN(C)N=O)c1,mutagenic
+13007-92-6,[C-]#[O+],non-mutagenic
+38915-38-7,CCCCOc1ccc2nc3cc(Cl)ccc3c(NCCCNCCCl)c2n1,mutagenic
+108-69-0,Cc1cc(C)cc(N)c1,mutagenic
+58-90-2,Oc1c(Cl)cc(Cl)c(Cl)c1Cl,non-mutagenic
+2598-29-0,CC(=O)Oc1cccc2cccnc12,non-mutagenic
+34522-72-0,Fc1cc(F)c2cccnc2c1,mutagenic
+3179-47-3,CCCCCCCCCCOC(=O)C(=C)C,non-mutagenic
+579-07-7,CC(=O)C(=O)c1ccccc1,non-mutagenic
+27532-75-8,Cc1ccc2cc3ccccc3c(C)c2c1,mutagenic
+958-09-8,Nc1ncnc2c1ncn2C3CC(O)C(CO)O3,non-mutagenic
+75-33-2,CC(C)S,non-mutagenic
+4985-70-0,Clc1cccc2cc3ccccc3cc12,non-mutagenic
+72076-98-3,c1ccc2c(c1)cc3sc4cccc5ccc2c3c45,mutagenic
+91598-91-3,CC(=O)Nc1ccc2ccc3c(O)ccc4ccc1c2c34,mutagenic
+81-48-1,Cc1ccc(Nc2ccc(O)c3C(=O)c4ccccc4C(=O)c23)cc1,non-mutagenic
+86412-49-9,CC(=O)N(O)c1ccc(Cl)c(Cl)c1,non-mutagenic
+160543-04-4,OCc1ccc2nc3c(ccc4ccccc34)c(CO)c2c1,mutagenic
+27946-19-6,ClC(C(=O)NCc1ccccc1)c2ccccc2,mutagenic
+8065-41-6,C[C@@H](O)[C@@H](N)[C@H](O)[C@H](O)C=O,non-mutagenic
+3268-87-9,Clc1c(Cl)c(Cl)c2Oc3c(Cl)c(Cl)c(Cl)c(Cl)c3Oc2c1Cl,non-mutagenic
+4494-26-2,OCC1OC(CC1O)N2C=C(C=O)C(=O)NC2=O,non-mutagenic
+1689-71-0,O1C(C1c2ccccc2)c3ccccc3,non-mutagenic
+94500-53-5,OCc1cc2cccc3ccc4cc5ccccc5c1c4c23,non-mutagenic
+145627-70-9,OC1C(O)c2ccc3c4CCCc4ccc3c2C5OC15,mutagenic
+21655-84-5,Cc1nccc2c3ccccc3[nH]c12,mutagenic
+144605-96-9,COC(=O)C1Cc2c([nH]c3ccc(cc23)[N+](=O)[O-])C(C)N1N=O,mutagenic
+14097-03-1,CCN(CC[N+](C)(C)C)c1ccc(cc1)N=Nc2ccc(cc2Cl)[N+](=O)[O-],mutagenic
+35231-44-8,COc1ccc2C(=CC(=O)Oc2c1)CBr,non-mutagenic
+120209-97-4,Nc1ccc2nc3cc(N)ccc3nc2c1,mutagenic
+389104-59-0,CC(C)(C)c1c(N)ccc2c1Cc3ccccc23,non-mutagenic
+91-20-3,c1ccc2ccccc2c1,non-mutagenic
+150-76-5,COc1ccc(O)cc1,non-mutagenic
+98033-22-8,CN1CCc2c1ccc3ccc4ccc(O)cc4c23,mutagenic
+132742-04-2,[O-][N+](=O)c1ccc2ccc3c4C=CCCc4cc5ccc1c2c35,mutagenic
+NOCAS_M534,C[C@@H](O)CNC[C@@H](C)O,non-mutagenic
+51-17-2,c1ccc2[nH]cnc2c1,non-mutagenic
+66850-95-1,OC(=O)CCC(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C(=O)O,non-mutagenic
+152-20-5,COP(=O)(OC)SC,non-mutagenic
+19020-26-9,CCc1ccnc2ccccc12,non-mutagenic
+54556-98-8,CCCOC(C(=O)OC1CCN(C)CC1)(c2ccccc2)c3ccccc3,non-mutagenic
+34430-24-5,CCC[CH-][N+](=O)[O-],non-mutagenic
+843-55-0,Oc1ccc(cc1)C2(CCCCC2)c3ccc(O)cc3,non-mutagenic
+42509-80-8,CCOP(=S)(OCC)Oc1nc(Cl)n(n1)C(C)C,mutagenic
+2393-18-2,Nc1ccc(\C=C\C(=O)O)cc1,non-mutagenic
+352-11-4,Fc1ccc(CCl)cc1,non-mutagenic
+95-63-6,Cc1ccc(C)c(C)c1,non-mutagenic
+627-03-2,CCOCC(=O)O,non-mutagenic
+39501-62-7,ONc1ccc(Oc2ccccc2)cc1,mutagenic
+150-30-1,NC(Cc1ccccc1)C(=O)O,non-mutagenic
+91-95-2,Nc1ccc(cc1N)c2ccc(N)c(N)c2,mutagenic
+78996-87-9,Cc1cc2c(O)cccc2c3cc4ccccc4cc13,mutagenic
+81840-15-5,COc1ccc(cc1OC)C(=O)N2CCN(CC2)c3ccc4NC(=O)CCc4c3,non-mutagenic
+105-54-4,CCCC(=O)OCC,non-mutagenic
+4560-58-1,CC(CCC(=O)O)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(=O)C12C,non-mutagenic
+10353-98-7,[O-][N+](=O)c1ccc2cccc3C=Cc1c23,mutagenic
+2223-82-7,CC(C)(COC(=O)C=C)COC(=O)C=C,non-mutagenic
+103088-83-1,O=C1C=Cc2ccc3c(ccc4ccccc34)c2C1=O,mutagenic
+608-25-3,Cc1c(O)cccc1O,non-mutagenic
+85-83-6,Cc1ccccc1N=Nc2ccc(N=Nc3c(O)ccc4ccccc34)c(C)c2,mutagenic
+80266-02-0,COc1cc(NS(=O)(=O)C)ccc1Nc2c3ccccc3nc4cc(ccc24)N=N#N,mutagenic
+6754-13-8,C[C@@H]1C[C@H]2OC(=O)C(=C)[C@H]2[C@H](O)[C@]3(C)[C@H]1C=CC3=O,non-mutagenic
+2307-69-9,CC(C)OS(=O)(=O)c1ccc(C)cc1,mutagenic
+102877-14-5,Nc1cccc2nc3cccc(N)c3nc12,non-mutagenic
+NOCAS_M323,CN(C)CC[C@@H](c1ccccc1)c2ccccn2,non-mutagenic
+100-00-5,[O-][N+](=O)c1ccc(Cl)cc1,mutagenic
+13925-00-3,CCc1cnccn1,non-mutagenic
+58139-51-8,Nc1nc(cs1)c2cc(cs2)[N+](=O)[O-],mutagenic
+215226-73-6,OC(=O)\C(=C(\CCl)/C(Cl)Cl)\Cl,mutagenic
+556-18-3,Nc1ccc(C=O)cc1,non-mutagenic
+87976-77-0,OS(=O)(=O)OCc1c2ccccc2cc3c1ccc4ccccc34,mutagenic
+6837-97-4,Oc1ccc(Cl)c2C(=O)c3c(O)ccc(Cl)c3C(=O)c12,mutagenic
+156-51-4,OS(=O)(=O)ONNCCc1ccccc1,mutagenic
+4836-66-2,OCc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+156243-44-6,CNc1ccc2ncc(C)nc2c1C,mutagenic
+42464-80-2,CC(=O)Nc1cccc2ncccc12,non-mutagenic
+676-46-0,OC(CC(=O)O)C(=O)O,non-mutagenic
+160637-28-5,Cc1ccc2nc3c4C=CC(O)C(O)c4ccc3c(C)c2c1,mutagenic
+71439-68-4,C1CN=C(N\N=C\c2c3ccccc3c(\C=N\NC4=NCCN4)c5ccccc25)N1,mutagenic
+15444-20-9,COc1cc2ccnc3C(=O)c4ccccc4c(c1OC)c23,mutagenic
+1555-94-8,CCOc1cccc2cccnc12,non-mutagenic
+94-41-7,O=C(\C=C\c1ccccc1)c2ccccc2,non-mutagenic
+105-39-5,CCOC(=O)CCl,non-mutagenic
+131524-41-9,O\N=C\c1cccc[n+]1CCOCC#C,non-mutagenic
+527-61-7,CC1=CC(=O)C=C(C)C1=O,non-mutagenic
+555-77-1,ClCCN(CCCl)CCCl,non-mutagenic
+3077-85-8,[O-][N+](=O)c1ccc2[nH]c3ccccc3c2c1,mutagenic
+105928-88-9,NC(CN=N#N)C(=O)O,mutagenic
+90223-04-4,Cn1c(N)nc2cc(O)ccc12,non-mutagenic
+81593-11-5,CS(=O)(=O)N1C2C1c3ccccc3c4ccccc24,mutagenic
+4812-40-2,OCCn1c(CO)ncc1[N+](=O)[O-],mutagenic
+50-24-8,C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO,non-mutagenic
+149127-57-1,CCN=NC(C)(C)OO,non-mutagenic
+79-20-9,COC(=O)C,non-mutagenic
+79-00-5,ClCC(Cl)Cl,non-mutagenic
+100288-36-6,CC1C=C(C=O)C(C=O)C(O)C2CC(C)(C)CC12,non-mutagenic
+81-14-1,CC(=O)c1c(C)c(c(c(c1C)[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-],non-mutagenic
+1068-57-1,CC(=O)NN,mutagenic
+2835-95-2,Cc1ccc(N)cc1O,mutagenic
+107456-13-3,CCCCOC(=O)c1cccc2cccnc12,non-mutagenic
+343-27-1,COc1ccc2c(c1)[nH]c3c(C)nccc23,mutagenic
+87625-62-5,CC1CC2(OC3OC(CO)C(O)C(O)C3O)C=C(C)C4(CC4)C(C)(O)C2C1=O,mutagenic
+88598-58-7,[O-][N+](=O)c1c2CCCCc2c3ccc4cccc5ccc1c3c45,non-mutagenic
+149396-89-4,Cn1c(ncc1[N+](=O)[O-])C(O)c2cc(cc(c2O)C(C)(C)C)C(C)(C)C,non-mutagenic
+1838-56-8,CC(=O)Nc1cc2Cc3ccccc3c2cc1O,non-mutagenic
+7597-18-4,[O-][N+](=O)c1ccc2c[nH]nc2c1,mutagenic
+13675-34-8,CC(=C)C(=O)OCCCCCOC(=O)C(=C)C,non-mutagenic
+575-41-7,Cc1cc(C)c2ccccc2c1,non-mutagenic
+NOCAS_M471,CCCCCCCCCCCC[C@H]1CO1,non-mutagenic
+155164-67-3,Cc1ccc(cc1)C(=O)N2N=CC(=C(Cl)C2=O)Cl,non-mutagenic
+140460-97-5,OC1C2OC2c3c(ccc4cc5c(ccc6ccccc56)nc34)C1O,mutagenic
+138805-29-5,Cc1ccc(N)cc1N=Nc2cc(N)ccc2C,mutagenic
+51-44-5,OC(=O)c1ccc(Cl)c(Cl)c1,non-mutagenic
+36274-29-0,Cc1ncc2CCCc2n1,non-mutagenic
+357204-50-3,CCCCON(OC(=O)C)C(=O)c1ccc2ccccc2c1,mutagenic
+33868-17-6,CN(N=O)C#N,mutagenic
+1897-45-6,Clc1c(Cl)c(C#N)c(Cl)c(C#N)c1Cl,non-mutagenic
+271-89-6,o1ccc2ccccc12,non-mutagenic
+81-88-9,CCN(CC)c1ccc2c(c3ccccc3C(=O)O)c4ccc(cc4[o+]c2c1)N(CC)CC,mutagenic
+100-97-0,C1N2CN3CN(CN1C3)C2,mutagenic
+NOCAS_M460,C[N@+]1([O-])CCC[C@@H]1c2cccnc2,non-mutagenic
+2835-68-9,NC(=O)c1ccc(N)cc1,non-mutagenic
+4548-53-2,Cc1cc(C)c(cc1N=Nc2cc(c3ccccc3c2O)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+50618-02-5,COc1ccc(cc1)C2OC2C,mutagenic
+621-95-4,Nc1ccc(CCc2ccc(N)cc2)cc1,mutagenic
+218-01-9,c1ccc2c(c1)ccc3c4ccccc4ccc23,mutagenic
+24245-98-5,[O-][N+](=O)c1cccc2nscc12,mutagenic
+2437-29-8,CN(C)c1ccc(cc1)C(=C2C=CC(=[N+](C)C)C=C2)c3ccccc3,non-mutagenic
+117-61-3,Nc1ccc(c2ccc(N)cc2S(=O)(=O)O)c(c1)S(=O)(=O)O,non-mutagenic
+13132-28-0,[O-][N+](=O)C1=Cc2cccc3cccc1c23,mutagenic
+108-21-4,CC(C)OC(=O)C,non-mutagenic
+53757-30-5,[O-][N+](=O)c1oc(\C=C/c2csc(NC=O)n2)cc1,mutagenic
+116374-64-2,COC(=O)c1ccc(c2c(NCCCN(C)C)c3ccccc3nc12)[N+](=O)[O-],mutagenic
+17241-59-7,OCc1ccc2C(=O)c3ccccc3C(=O)c2c1,non-mutagenic
+54292-63-6,CCN(CC)c1ccc(cc1)N=Nc2cccnc2,non-mutagenic
+110-49-6,COCCOC(=O)C,mutagenic
+80214-83-1,CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC3OC(C)CC(C3O)N(C)C)C(C)(O)CC(C)\C(=N\OCOCCOC)\C(C)C(O)C1(C)O,non-mutagenic
+23537-16-8,Cc1cc(O)c2C(=C3C(=O)C4C(O)C5C6C(O)C(C(=O)C7=C(O)c8c(O)cc(C)cc8C(=O)C467)C35C(=O)c2c1)O,non-mutagenic
+613-50-3,[O-][N+](=O)c1ccc2ncccc2c1,mutagenic
+191861-16-2,Fc1cc2cccnc2c3cccnc13,mutagenic
+106532-69-8,CCCCCCCC(=O)\N=C\1/SN(C(=O)CCCCCCC)c2ccc(cc12)[N+](=O)[O-],mutagenic
+6149-33-3,Nc1ccc(Oc2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+17722-71-3,OC(=O)CCC(=O)Nc1ccc(Cl)c(Cl)c1,non-mutagenic
+79-41-4,CC(=C)C(=O)O,non-mutagenic
+607-59-0,CN(C)c1ccc(cc1)N=Nc2cccc3ccccc23,mutagenic
+54-88-6,CN(C)c1ccc(N=Nc2ccccc2)c(C)c1,mutagenic
+23250-39-7,Nc1c2ccccc2nc3ccc(Cl)cc13,mutagenic
+93106-60-6,CCN1CCN(CC1)c2cc3N(C=C(C(=O)O)C(=O)c3cc2F)C4CC4,mutagenic
+118745-12-3,CCC(=O)N(O)c1ccc(\C=C\c2ccccc2)cc1,mutagenic
+NOCAS_M218,BrC[C@@H](Br)COP(=O)(OC[C@H](Br)CBr)OC[C@H](Br)CBr,mutagenic
+74340-04-8,OC1C=Cc2c(cc3c4ccccc4c5c6ccccc6cc2c35)C1O,mutagenic
+4463-22-3,CC(=O)N(O)c1ccc(cc1)c2ccccc2,mutagenic
+2212-99-9,CC1(C)CC2C=C(C=O)C34CC3(C2C1)C(=O)OC4O,mutagenic
+NOCAS_M90,C[C@@]1(CO1)c2ccc(cc2)[N+](=O)[O-],mutagenic
+31464-26-3,CN(CCC#N)c1ccc(cc1)N=Nc2ccccc2,mutagenic
+26761-45-5,CCCCCCC(C)(C)C(=O)OC[C@@H]1CO1,mutagenic
+116-14-3,FC(=C(F)F)F,non-mutagenic
+138914-14-4,C[C@H](CO)[N+](=O)[O-],non-mutagenic
+2390-59-2,CCN(CC)c1ccc(cc1)C(=C2C=CC(=[N+](CC)CC)C=C2)c3ccc(cc3)N(CC)CC,mutagenic
+15356-70-4,CC(C)[C@H]1CC[C@H](C)C[C@@H]1O,non-mutagenic
+117066-30-5,OC1C=Cc2c(ccc3nc4ccc5ccccc5c4cc23)C1O,mutagenic
+NOCAS_M84,CC[C@@]12O[C@]1(C(=O)OC)C(=O)O[C@H]2C,mutagenic
+NOCAS_M245,CCCCCCOC[C@H]1CO1,mutagenic
+85977-49-7,CN(C)S(=O)(=O)CCNC(=O)N(CCCl)N=O,mutagenic
+57-50-1,OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O,non-mutagenic
+NOCAS_M461,CCCCCCCCC\C=C\C[C@H]1CC(=O)OC1=O,non-mutagenic
+183249-38-9,CC1C=Cc2ccc3ccc4ccccc4c3c12,non-mutagenic
+37151-16-9,Nc1nc(nc2c1ncn2C3OC(CO)C(O)C3O)c4ccc(cc4)[N+](=O)[O-],mutagenic
+151378-31-3,OC1C(O)c2cccc3c4cc5ccccc5cc4C6(OC16)c23,mutagenic
+1169-60-4,COC(=O)c1cc2OCOc2c3c4cccc(OC)c4cc(c13)[N+](=O)[O-],mutagenic
+NOCAS_M426,C[C@@H]1C(C)(C)c2cc(C)c(cc2C1(C)C)C(=O)C,non-mutagenic
+10396-63-1,OC1COC(Nc2ccc(cc2)[N+](=O)[O-])C(O)C1O,non-mutagenic
+110786-18-0,[O-][N+](=O)c1ccccc1COC(=O)c2ccccc2,non-mutagenic
+1609-93-4,OC(=O)\C=C\Cl,mutagenic
+81943-37-5,CC(=O)OCN(N=O)c1ccccc1,mutagenic
+96-54-8,Cn1cccc1,non-mutagenic
+574-25-4,OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(S)ncnc23,mutagenic
+144561-63-7,[O-][N+](=O)c1ccc2c(CCc3cc4CCCCc4cc23)c1,mutagenic
+357204-48-9,[O-][N+](=O)c1cccc(c1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,mutagenic
+137-07-5,Nc1ccccc1S,mutagenic
+88-44-8,Cc1ccc(N)c(c1)S(=O)(=O)O,non-mutagenic
+135086-92-9,Oc1c2nc3ccccc3c2nnn1\N=C\c4ccccc4,mutagenic
+56-04-2,Cc1cc(O)nc(S)n1,non-mutagenic
+NOCAS_M129,ClC(Cl)(Cl)SN1C(=O)[C@@H]2CC=CC[C@H]2C1=O,mutagenic
+6203-18-5,CN(C)c1ccc(\C=C\C=O)cc1,non-mutagenic
+16568-02-8,C\C=N\N(C)C=O,non-mutagenic
+NOCAS_M301,CCO[P@](=O)(Oc1ccc(cc1)[N+](=O)[O-])c2ccccc2,mutagenic
+789-07-1,[O-][N+](=O)c1cc2ccc3cccc4ccc(c1)c2c34,mutagenic
+142438-60-6,COC(=O)C12OC1(C)C(C)OC2=O,mutagenic
+65199-11-3,O=C1C=Cc2c(cc3ccc4cccc5ccc2c3c45)C1=O,mutagenic
+2106-54-9,OC(=O)C(F)(F)C(F)(Cl)C(F)(F)C(F)(Cl)C(F)(F)Cl,non-mutagenic
+2381-15-9,Cc1ccc2cc3ccc4ccccc4c3cc2c1,mutagenic
+10147-37-2,CC(C)S(=O)(=O)Cl,mutagenic
+16323-43-6,OC(=O)\C=C\c1ccc(\C=C\C(=O)O)cc1,non-mutagenic
+183249-39-0,O=C1CCc2c3CCCc3c4c(ccc5ccccc45)c12,non-mutagenic
+5116-24-5,OC[C@H]1O[C@H](C[C@H]1O)N2C=C(CO)C(=O)NC2=O,mutagenic
+18559-59-6,COc1cc(CC2NCCc3cc(O)c(O)cc23)cc(OC)c1OC,non-mutagenic
+18296-45-2,CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@H]1C[C@H](OC(=O)C)[C@]23CO3,mutagenic
+99124-76-2,NC(CCCCNC=CC=O)C(=O)O,mutagenic
+104-67-6,CCCCCCCC1CCC(=O)O1,non-mutagenic
+140-29-4,N#CCc1ccccc1,non-mutagenic
+90594-13-1,Nc1cnc2c(c1)nc3ccccn23,mutagenic
+17564-64-6,ClCN1C(=O)c2ccccc2C1=O,mutagenic
+843-23-2,CC(=O)N(O)c1ccc(\C=C\c2ccccc2)cc1,mutagenic
+38914-97-5,CCN(CCCl)CCCNc1c2ccccc2nc3ccccc13,mutagenic
+35281-32-4,C1Cc2cc3cccc4ccc5cc6cccc1c6c2c5c34,mutagenic
+33757-42-5,CC(=O)Nc1cccc2cccnc12,mutagenic
+106532-71-2,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccccc3)\c2c1)C(=O)c4ccccc4,mutagenic
+612-25-9,OCc1ccccc1[N+](=O)[O-],non-mutagenic
+146683-80-9,Cc1cccc2C3OC3c4cc5ccccc5cc4c12,mutagenic
+NOCAS_M58,COC(=O)[C@]12O[C@@]1(C)[C@@H](OC2=O)C(C)C,mutagenic
+62641-69-4,Cc1c2ccccc2cc3c4[C@H](O)[C@H](O)C=Cc4ccc13,mutagenic
+146795-30-4,Cc1cccc(NC(=O)c2csc(c2)[N+](=O)[O-])c1,mutagenic
+NOCAS_M161,Cc1ccccc1OC[C@H]2CO2,mutagenic
+114-26-1,CNC(=O)Oc1ccccc1OC(C)C,mutagenic
+96196-27-9,Cc1cc(N)ccc1c2ccc(N)cc2C,mutagenic
+134-09-8,CC(C)C1CCC(C)CC1OC(=O)c2ccccc2N,non-mutagenic
+668-17-7,CCC1(O)CC(OC2CC(C(O)C(C)O2)N(C)C)c3c(O)c4C(=O)c5c(O)ccc(O)c5C(=O)c4cc3C1C(=O)OC,mutagenic
+78-79-5,CC(=C)C=C,non-mutagenic
+98911-07-0,CC(=O)N(O)c1ccc(Oc2ccc(Cl)cc2)cc1,mutagenic
+51481-10-8,CC1=CC2OC3C(O)CC(C)(C34CO4)C2(CO)C(O)C1=O,non-mutagenic
+497-19-8,OC(=O)O,non-mutagenic
+3811-49-2,COP1(=S)OCc2ccccc2O1,mutagenic
+NOCAS_M325,C[C@@]12CC[C@H](C[C@@H]1O2)C=C,non-mutagenic
+NOCAS_M352,C[C@H](CCl)OP(=O)(O[C@H](C)CCl)O[C@H](C)CCl,non-mutagenic
+11041-12-6,CCC(C)c1cccc(c1)C(C)CC(CC)c2ccc(C[N+](C)(C)C)cc2,non-mutagenic
+1874-23-3,COC(=O)c1oc(cc1)[N+](=O)[O-],mutagenic
+133831-61-5,[O-][N+](=O)c1ccccc1SSC(=C(Cl)Cl)F,mutagenic
+96-50-4,Nc1nccs1,mutagenic
+84174-21-0,CN(Cc1ccc(F)cc1)N=O,mutagenic
+87-61-6,Clc1cccc(Cl)c1Cl,non-mutagenic
+1689-89-0,Oc1c(I)cc(cc1[N+](=O)[O-])C#N,non-mutagenic
+122-99-6,OCCOc1ccccc1,non-mutagenic
+94-11-1,CC(C)OC(=O)COc1ccc(Cl)cc1Cl,non-mutagenic
+6789-88-4,CCCCCCOC(=O)c1ccccc1,non-mutagenic
+42576-02-3,COC(=O)c1cc(Oc2ccc(Cl)cc2Cl)ccc1[N+](=O)[O-],mutagenic
+609-20-1,Nc1cc(Cl)c(N)c(Cl)c1,mutagenic
+6923-22-4,CNC(=O)\C=C(/C)\OP(=O)(OC)OC,mutagenic
+NOCAS_M446,COC(=C1[C@H](C(=C(C)N=C1C)C(=O)OC\C=C\c2ccccc2)c3cccc(c3)[N+](=O)[O-])O,non-mutagenic
+99520-59-9,Oc1ccc2c(c1)c3ccc4ccc5cccc6cc2c3c4c56,mutagenic
+481-42-5,CC1=CC(=O)c2c(O)cccc2C1=O,mutagenic
+638-07-3,CCOC(=O)CC(=O)CCl,non-mutagenic
+67-72-1,ClC(Cl)(Cl)C(Cl)(Cl)Cl,non-mutagenic
+13301-61-6,CCN(CCC#N)c1ccc(cc1)N=Nc2c(Cl)cc(cc2Cl)[N+](=O)[O-],mutagenic
+3048-64-4,C=CC1CC2CC1C=C2,non-mutagenic
+135-20-6,ON(N=O)c1ccccc1,mutagenic
+107-68-6,CNCCS(=O)(=O)O,non-mutagenic
+156-43-4,CCOc1ccc(N)cc1,mutagenic
+NOCAS_M43,C(Oc1ccc2sncc2c1)[C@H]3CO3,mutagenic
+NOCAS_M29,CCN(CC)CCC[C@@H](C)Nc1ccnc2cc(Cl)ccc12,mutagenic
+73819-63-3,NC(=N)c1ccc2cc([nH]c2c1)C(=N)N,non-mutagenic
+NOCAS_M421,C[C@@H](O)c1ccccc1,non-mutagenic
+NOCAS_M258,CCc1cc(O)cc2c3CCO[C@@](CC)(CC(=O)O)c3[nH]c12,mutagenic
+9000-30-0,CCC1OC(CO)C(COCC2OC(COC3OC(CO)C(O)C(O)C3O)C(OC)C(O)C2O)C(O)C1O,non-mutagenic
+530-62-1,O=C(n1ccnc1)n2ccnc2,non-mutagenic
+557-30-2,O\N=C\C=N\O,non-mutagenic
+5418-93-9,Nc1nc2cc(Cl)ccc2[nH]1,non-mutagenic
+7226-23-5,CN1CCCN(C)C1=O,non-mutagenic
+135325-62-1,BrCc1ccc2cccc3c4ccccc4c1c23,mutagenic
+106532-74-5,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccc(Cl)cc3)\c2c1)C(=O)c4ccc(Cl)cc4,mutagenic
+51856-71-4,Cc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])N=[N+]([O-])c2cc(c(C)c(c2)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+86334-96-5,CC(N(CC1(O)CCC(O)C(O)C1O)N=O)C(=O)O,non-mutagenic
+111-90-0,CCOCCOCCO,non-mutagenic
+156-10-5,O=Nc1ccc(Nc2ccccc2)cc1,mutagenic
+1466-88-2,[O-][N+](=O)c1ccccc1\C=C\C=O,mutagenic
+42583-46-0,COc1cc2OC3OC4OC4C3c2c5OC(=O)C6=C(CCC6=O)c15,mutagenic
+3328-25-4,CC(C)CCCC(C)C1CCC2C3C=CC4(CC(O)CCC4(C)C3CCC12C)OO,mutagenic
+5464-79-9,COc1cccc2sc(N)nc12,mutagenic
+2402-78-0,Clc1cccc(Cl)n1,non-mutagenic
+78-81-9,CC(C)CN,non-mutagenic
+63041-77-0,Cc1cccc2c1cc3ccc4cccc5ccc2c3c45,mutagenic
+5306-96-7,Cc1c(C)c(N)ccc1N,non-mutagenic
+80440-44-4,O=C1c2cccc3cccc(c4ccc5ccccc5c14)c23,non-mutagenic
+633-65-8,COc1ccc2cc3c4cc5OCOc5cc4CC[n+]3cc2c1OC,non-mutagenic
+1147-55-3,CC(=O)Nc1ccc2c(Cc3cccc(O)c23)c1,mutagenic
+94-74-6,Cc1cc(Cl)ccc1OCC(=O)O,non-mutagenic
+17024-17-8,[O-][N+](=O)c1cccc2c1ccc3ccccc23,mutagenic
+96-18-4,ClCC(Cl)CCl,mutagenic
+148021-80-1,OC1C=Cc2c(ccc3c4CCC(=O)c4ccc23)C1O,mutagenic
+4651-67-6,CC(CCC(=O)O)C1CCC2C3C(CCC12C)C4(C)CCC(O)CC4CC3=O,non-mutagenic
+2243-78-9,Nc1ccc(cc1)c2ccc(N)cc2[N+](=O)[O-],mutagenic
+142762-84-3,COC(=O)C1CSC2N1C(=O)C(=C2Cl)Cl,mutagenic
+58957-92-9,CC1OC(CC(N)C1O)OC2CC(O)(Cc3c(O)c4C(=O)c5ccccc5C(=O)c4c(O)c23)C(=O)C,mutagenic
+448-19-1,COc1cc(F)ccc1[N+](=O)[O-],mutagenic
+29700-20-7,OCc1oc(cc1)c2[nH]ccc3c4ccccc4nc23,mutagenic
+131119-02-3,Cn1c2ccccc2c3nn[n+]([O-])c(C(=O)OCCCl)c13,mutagenic
+179073-71-3,Cc1ccc2cc3c(ccc4ccccc34)c5C(Cc1c25)OS(=O)(=O)O,mutagenic
+174794-16-2,CCC(=O)OCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+578-68-7,Nc1ccnc2ccccc12,non-mutagenic
+13394-86-0,Cc1ccccc1c2ccc(N)c(C)c2,mutagenic
+64-02-8,OC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O,non-mutagenic
+89873-24-5,N#N=Nc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,mutagenic
+39081-15-7,Oc1cccc2cc3c4ccccc4c5ccccc5c3cc12,mutagenic
+915-67-3,Oc1c(N=Nc2ccc(c3ccccc23)S(=O)(=O)O)c4ccc(cc4cc1S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+131-53-3,COc1ccc(C(=O)c2ccccc2O)c(O)c1,mutagenic
+4130-42-1,CCc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C,non-mutagenic
+157730-35-3,Cn1c(N)nc2nc3cnccc3cc12,mutagenic
+16533-72-5,OC(=O)C1OC1C(=O)O,non-mutagenic
+96-45-7,S=C1NCCN1,mutagenic
+3096-62-6,Cc1cccc(NO)c1C,mutagenic
+95-95-4,Oc1cc(Cl)c(Cl)cc1Cl,non-mutagenic
+58917-91-2,OC1=c2c(O)cc3cccc4ccc(c2c34)C56CCCCC15O6,mutagenic
+112575-92-5,O[C@H]1C=C2c3cc4ccccc4cc3c5cccc([C@@H]1O)c25,mutagenic
+521-61-9,COc1cc(O)c2C(=O)c3c(O)cc(C)cc3C(=O)c2c1,mutagenic
+482-44-0,CC(=CCOc1c2OC(=O)C=Cc2cc3ccoc13)C,mutagenic
+88-17-5,Nc1ccccc1C(F)(F)F,non-mutagenic
+115664-58-9,Oc1ccc2c(c1)c3cccc4c(ccc2c34)[N+](=O)[O-],mutagenic
+99520-66-8,Oc1cc2ccc3c4ccccc4c5cc6cccc1c6c2c35,non-mutagenic
+69527-46-4,[O-][N+](=O)c1oc(C=C(C#N)C#N)cc1,mutagenic
+313-67-7,COc1cccc2c1cc(c3c(cc4OCOc4c23)C(=O)O)[N+](=O)[O-],mutagenic
+148174-23-6,ClCCC(=O)\N=C\1/SN(C(=O)CCCl)c2ccccc12,non-mutagenic
+5329-15-7,COc1cc(N)ccc1NC(=O)C,mutagenic
+6309-46-2,CC(=O)Oc1ccc(CO)cc1,non-mutagenic
+NOCAS_M66,OC[C@@H](O)CN=[N+]=[N-],mutagenic
+28434-86-8,Nc1ccc(Oc2ccc(N)c(Cl)c2)cc1Cl,mutagenic
+17796-82-6,O=C1N(SC2CCCCC2)C(=O)c3ccccc13,non-mutagenic
+62826-28-2,COc1ccccc1CC2CO2,mutagenic
+146177-64-2,Cc1cc2c(nc(N)n2C)c3nc(cnc13)c4ccccc4,mutagenic
+101-70-2,COc1ccc(Nc2ccc(OC)cc2)cc1,non-mutagenic
+55621-29-9,CCCCN(C[C@H](O)CC)N=O,mutagenic
+18409-46-6,O=C\C=C\C=C\C=O,mutagenic
+160543-15-7,Cc1ccc2nc3c4C=CC(O)C(O)c4ccc3c(CO)c2c1,mutagenic
+108-99-6,Cc1cccnc1,non-mutagenic
+100-37-8,CCN(CC)CCO,non-mutagenic
+100593-23-5,[O-][N+](=O)c1ccc2ccc3ccc(N=O)c4ccc1c2c34,mutagenic
+14090-00-7,COc1c(C)c(N)c(C)cc1N,non-mutagenic
+NOCAS_M208,OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@H]1SCCN1N=O,mutagenic
+143603-79-6,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3ccc(NC(=O)C)cc3,mutagenic
+106532-78-9,[O-][N+](=O)c1ccc(cc1)C(=O)\N=C\2/SN(C(=O)c3ccc(cc3)[N+](=O)[O-])c4ccc(cc24)[N+](=O)[O-],mutagenic
+500-66-3,CCCCCc1cc(O)cc(O)c1,non-mutagenic
+10161-33-8,CC12C=CC3=C4CCC(=O)C=C4CCC3C1CCC2O,non-mutagenic
+24225-71-6,CC(=O)N(Nc1ccc2c(Cc3ccccc23)c1)c4ccc5c(Cc6ccccc56)c4,mutagenic
+389104-55-6,CC(C)(C)c1c(N)ccc2ccccc12,non-mutagenic
+75776-00-0,CNc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,mutagenic
+1629-58-9,CCC(=O)C=C,mutagenic
+97509-27-8,O[C@@H]1C=Cc2c(cc3ccccc3c2[N+](=O)[O-])[C@H]1O,mutagenic
+1679-02-3,Cc1ccc2ccc3c4ccc5c(C)cccc5c4ccc3c2c1,non-mutagenic
+372-47-4,Fc1cccnc1,non-mutagenic
+144651-75-2,OC(=O)C1Cc2c([nH]c3ccccc23)C(Cc4ccccc4O)N1,non-mutagenic
+593-56-6,CON,non-mutagenic
+104-87-0,Cc1ccc(C=O)cc1,non-mutagenic
+132059-52-0,OC1OC(=O)C(=C1C(Br)Br)Cl,mutagenic
+456-27-9,[O-][N+](=O)c1ccc(cc1)[N+]#N,mutagenic
+7470-44-2,C([C@@H]1CO1)c2ccc3OCOc3c2,mutagenic
+518-83-2,Oc1cc(O)c2C(=O)c3ccccc3C(=O)c2c1,mutagenic
+1122-54-9,CC(=O)c1ccncc1,non-mutagenic
+81924-79-0,CCN(CC)c1cc(NC(=O)C)c(cc1OC)N=Nc2ccc(cc2)[N+](=O)[O-],mutagenic
+35282-72-5,CN(C)c1ccc(cc1)N=Nc2cccc(CCl)c2,mutagenic
+80984-66-3,N1C2C1c3cccc4C5NC5c6cccc2c6c34,mutagenic
+17413-38-6,COc1cc(O)cc2c1cc(c3c(cc4OCOc4c23)C(=O)O)[N+](=O)[O-],non-mutagenic
+39115-11-2,OC[C@H]1O[C@@H](Oc2ccc(O)c3C(=O)c4ccccc4C(=O)c23)[C@H](O)[C@@H](O)[C@@H]1O,mutagenic
+75-38-7,FC(=C)F,mutagenic
+67-20-9,[O-][N+](=O)c1oc(\C=N\N2CC(=O)NC2=O)cc1,mutagenic
+114-83-0,CC(=O)NNc1ccccc1,mutagenic
+2876-22-4,Nc1cccc2nc3ccccc3nc12,mutagenic
+749-49-5,COc1ccc2nccc(C(OC(=O)C(C)O)C3CC4CCN3CC4C=C)c2c1,non-mutagenic
+142438-64-0,CCC1=C(C(=O)OC)C(=O)OC1C,mutagenic
+635-27-8,Clc1cccc2ncccc12,mutagenic
+NOCAS_M230,C[C@@H](O)CN(CC(=O)C)N=O,mutagenic
+362-74-3,CCCC(=O)Nc1ncnc2c1ncn2C3OC4COP(=O)(O)OC4C3OC(=O)CCC,non-mutagenic
+3074-00-8,O=C1c2cccc3ccc4ccc5cccc1c5c4c23,non-mutagenic
+108-44-1,Cc1cccc(N)c1,non-mutagenic
+60129-67-1,OCCN(CCO)c1ccc(cc1)N=Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-],mutagenic
+16813-36-8,O=NN1CCC(=O)NC1=O,mutagenic
+86853-93-2,O=C1c2ccccc2c3c1ccc4ccc5ccccc5c34,non-mutagenic
+423-39-2,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)I,non-mutagenic
+40911-07-7,CCCCN(CC[C@@H](C)O)N=O,mutagenic
+613-12-7,Cc1ccc2cc3ccccc3cc2c1,mutagenic
+112965-21-6,CC(\C=C\C(O)C1CC1)C2CCC3\C(=C\C=C\4/CC(O)CC(O)C4=C)\CCCC23C,non-mutagenic
+121-89-1,CC(=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+124-70-9,C[Si](Cl)(Cl)C=C,mutagenic
+546-80-5,CC(C)[C@@]12C[C@@H]1[C@H](C)C(=O)C2,non-mutagenic
+71339-55-4,Cc1c2ccccc2c(CO)c3ccccc13,mutagenic
+36504-68-4,C1Cc2cc3ccc4cccc5ccc(c2[C@@H]6O[C@H]16)c3c45,mutagenic
+610-48-0,Cc1cccc2cc3ccccc3cc12,non-mutagenic
+3958-60-9,[O-][N+](=O)c1ccccc1CBr,non-mutagenic
+116911-14-9,OCC(O)C(N=N#N)c1ccccc1,mutagenic
+60-29-7,CCOCC,non-mutagenic
+614-48-2,[O-][N+](=O)c1cccc(\C=C\C(=O)c2ccccc2)c1,non-mutagenic
+4261-16-9,Nc1c2ncn(Cc3ccccc3)c2nc[n+]1[O-],mutagenic
+933-88-0,Cc1ccccc1C(=O)Cl,mutagenic
+64811-02-5,OS(=O)(=O)Oc1c2ccccc2c3ccc4cccc5ccc1c3c45,non-mutagenic
+NOCAS_M10,CCOc1ccc2nc3cc(N)ccc3c(N)c2c1,mutagenic
+244775-76-6,CCCON(OC(=O)C)C(=O)c1ccccc1,mutagenic
+1034-41-9,OC1C2(Cl)C3(Cl)C4(Cl)C(Cl)(Cl)C5(Cl)C(Cl)(C1(Cl)C35Cl)C24Cl,non-mutagenic
+98-86-2,CC(=O)c1ccccc1,non-mutagenic
+52171-93-4,CC1=CCCc2c1cc(C)c3c2ccc4ccccc34,mutagenic
+116355-83-0,CCCCC(C)C(OC(=O)CC(CC(=O)O)C(=O)O)C(CC(C)CC(O)CCCCC(O)CC(O)C(C)N)OC(=O)CC(CC(=O)O)C(=O)O,non-mutagenic
+336629-39-1,CCCOc1cc(c(OC)cc1N\N=C(/C(=O)C)\C(=O)Nc2ccc(cc2)[N+](=O)[O-])c3cc(OCCC)c(N\N=C(/C(=O)C)\C(=O)Nc4ccc(cc4)[N+](=O)[O-])cc3OC,mutagenic
+56438-59-6,COc1ccc(CCC2CO2)cc1,mutagenic
+4337-51-3,[O-][N+](=O)c1ccc2C(=O)NSc2c1,mutagenic
+59-92-7,N[C@H](Cc1ccc(O)c(O)c1)C(=O)O,mutagenic
+2634-33-5,Oc1nsc2ccccc12,non-mutagenic
+523-50-2,O=C1Oc2c(C=C1)ccc3occc23,non-mutagenic
+491-80-5,COc1ccc(cc1)C2=COc3cc(O)cc(O)c3C2=O,non-mutagenic
+1503-91-9,CC(=O)N(O)c1ccc(Cl)cc1,non-mutagenic
+17177-50-3,OCC(O)C1CO1,mutagenic
+123-31-9,Oc1ccc(O)cc1,non-mutagenic
+98114-60-4,CCN=NO,mutagenic
+63358-49-6,CNC(=O)CC(N)C(=O)NC(C(=O)NC1C2SC(C)(C)C(N2C1=O)C(=O)O)c3ccc(O)cc3,non-mutagenic
+55022-75-8,O1C2C1C3N=NC2C4OC34,non-mutagenic
+26541-56-0,CC(=O)ON(C(=O)C)c1ccc(cc1)c2ccccc2,mutagenic
+27729-98-2,Fc1ccc(cc1)C2OC2C(=O)c3ccccc3,non-mutagenic
+103-84-4,CC(=O)Nc1ccccc1,non-mutagenic
+102-81-8,CCCCN(CCO)CCCC,non-mutagenic
+99523-86-1,Cc1ccc2nsc(N)c2c1,mutagenic
+102408-25-3,Cn1c(N)nc2ccc3ncccc3c12,mutagenic
+520-18-3,OC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)cc3,mutagenic
+NOCAS_M401,Oc1cccc2OC(=O)C(=Cc12)[C@@H]3CCc4ccccc4C3,non-mutagenic
+484-20-8,COc1c2C=CC(=O)Oc2cc3occc13,mutagenic
+13345-26-1,Oc1ccc2c(c1)cc3ccc4cccc5ccc2c3c45,mutagenic
+66452-61-7,CC(C)Sc1cc(Cc2ccc(N)c(SC(C)C)c2)ccc1N,mutagenic
+75-25-2,BrC(Br)Br,mutagenic
+54-21-7,OC(=O)c1ccccc1O,non-mutagenic
+13256-32-1,CNC(=O)N(C)N=O,mutagenic
+90098-04-7,OC(=O)C(Cc1cc(O)nc2ccccc12)NC(=O)c3ccc(Cl)cc3,non-mutagenic
+71807-56-2,Cc1[nH]cnc1CSCCN=C(NCC#C)NC#N,non-mutagenic
+NOCAS_M152,CC(C)(COC[C@H]1CO1)COC[C@H]2CO2,mutagenic
+102-06-7,N=C(Nc1ccccc1)Nc2ccccc2,mutagenic
+5405-41-4,CCOC(=O)CC(C)O,non-mutagenic
+38915-40-1,CCCCOc1ccc2nc3cc(Cl)ccc3c(NCCCN(CC)CCCl)c2n1,mutagenic
+135626-95-8,CC1(CC(O)C2(C)C(CCC3C4(C)CCCC23OC4=O)C1)C=C,non-mutagenic
+129018-59-3,Cn1c(nc2ncc(cc12)c3ccccc3)[N+](=O)[O-],mutagenic
+475-38-7,Oc1ccc(O)c2C(=O)C=CC(=O)c12,mutagenic
+106532-67-6,CC(C)CC(=O)\N=C\1/SN(C(=O)CC(C)C)c2ccc(cc12)[N+](=O)[O-],mutagenic
+19202-92-7,C[C@@H]1C[C@H]2OC(=O)[C@]3(C)[C@H]2[C@@H](O[C@]3(C)O)[C@]4(C)[C@H]1C=CC4=O,non-mutagenic
+13379-35-6,COc1ccc2Oc3cc(OC)cc(O)c3C(=O)c2c1,mutagenic
+94764-55-3,[O-][N+](=O)c1ccc2c(c1)sc3ccccc23,mutagenic
+298-18-0,C1O[C@H]1[C@H]2CO2,mutagenic
+33424-05-4,C1O[C@@H]1c2cc3ccccc3c4ccccc24,mutagenic
+67450-45-7,CCC(=O)N(C1CCCC1N(C)C)c2ccc(Cl)c(Cl)c2,non-mutagenic
+149396-90-7,Cc1cc(C(O)c2ncc([N+](=O)[O-])n2C)c(O)c(c1)C(C)(C)C,non-mutagenic
+437-50-3,COc1cc(O)c2C(=O)c3cc(O)ccc3Oc2c1,mutagenic
+112-80-1,CCCCCCCC\C=C\CCCCCCCC(=O)O,non-mutagenic
+34041-03-7,CN(C)C(=S)SNCCNSC(=S)N(C)C,mutagenic
+97-41-6,CCOC(=O)C1C(C=C(C)C)C1(C)C,non-mutagenic
+41830-80-2,Nc1ccc2N=C3C(=CC(=N)c4ccccc34)Oc2c1,mutagenic
+129129-64-2,CN1C=CN(CCC[n+]2ccc(cc2)C(=O)N)C1\C=N\O,non-mutagenic
+148193-37-7,Nc1ccc2C(=O)NSc2c1,non-mutagenic
+104775-36-2,CNC(=O)c1cccc(NCC(=O)NCCc2ccc(OC)c(OC)c2)c1,non-mutagenic
+107-16-4,OCC#N,non-mutagenic
+6264-66-0,Nc1ccc(Oc2ccc(N)c(N)c2)cc1,mutagenic
+34592-47-7,OC(=O)[C@@H]1CSCN1,non-mutagenic
+7251-61-8,Cc1cnc2ccccc2n1,non-mutagenic
+2068-78-2,CCC1(O)CC2CN(CCc3c([nH]c4ccccc34)C(C2)(C(=O)OC)c5cc6c(cc5OC)N(C=O)C7C(O)(C(OC(=O)C)C8(CC)C=CCN9CCC67C89)C(=O)OC)C1,non-mutagenic
+160543-06-6,Cc1ccc2c(CO)c3ccc4ccccc4c3nc2c1,non-mutagenic
+90-19-7,COc1cc(O)c2C(=O)C(=C(Oc2c1)c3ccc(O)c(O)c3)O,mutagenic
+88193-04-8,Cc1cc2[nH]c3cc(C)c4ccccc4c3c2c5ccccc15,mutagenic
+10353-53-4,C=CCCC1CO1,mutagenic
+5836-85-1,COc1cc2C(=O)CCc2c3ccc4ccccc4c13,mutagenic
+97-99-4,OCC1CCCO1,non-mutagenic
+210245-96-8,CN(C)c1ccc(cc1)N=Nc2ccc(OC3OC(CO)C(O)C(O)C3O)cc2,non-mutagenic
+92382-74-6,CCN(CC)[N+](=NO)[O-],mutagenic
+98096-09-4,Cc1ccc2C(=O)c3cccc4ccc1c2c34,mutagenic
+146818-20-4,CCc1ccc(NC(=O)c2csc(c2)[N+](=O)[O-])cc1,mutagenic
+31120-85-1,CCOP(=O)(NC(C)C)Oc1ccccc1C(=O)OC(C)C,mutagenic
+642-83-1,CC(=O)OC1C2OC(=O)C(OC(=O)C)C2OC1=O,non-mutagenic
+128753-93-5,CC12OOC1(CO)Oc3ccccc23,non-mutagenic
+1193-54-0,ClC1=C(Cl)C(=O)NC1=O,mutagenic
+501-92-8,Oc1ccc(CC=C)cc1,non-mutagenic
+140-88-5,CCOC(=O)C=C,non-mutagenic
+NOCAS_M9,ClC[C@H](Br)CBr,mutagenic
+2431-96-1,CCN(CC)C(=O)Cc1ccccc1,non-mutagenic
+88-96-0,NC(=O)c1ccccc1C(=O)N,non-mutagenic
+107-21-1,OCCO,non-mutagenic
+106636-46-8,Cc1cn2c(N=O)c(nc2s1)c3ccc(cc3)[N+](=O)[O-],mutagenic
+158366-46-2,CC(=O)c1c(cc([N+](=O)[O-])n1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+145241-76-5,Fc1ccc2cccnc2c1F,mutagenic
+51357-79-0,Nc1snc2ccc(Cl)cc12,mutagenic
+113058-39-2,Oc1cccc2c3cc4ccccc4cc3c5ccccc5c12,mutagenic
+71-33-0,O=C1NC=NC(=O)N1,non-mutagenic
+125369-84-8,[O-][N+](=O)c1ccccc1\C=C\C=C(/C#N)\c2ccc(Br)cc2,mutagenic
+99-04-7,Cc1cccc(c1)C(=O)O,non-mutagenic
+2883-98-9,COc1cc(OC)c(\C=C\C)cc1OC,mutagenic
+1875-48-5,NN1C(=O)c2ccccc2C1=O,non-mutagenic
+655-86-7,Nc1cc2nc3ccccc3nc2cc1N,mutagenic
+149862-57-7,CC(C)CCNc1snc2ccccc12,non-mutagenic
+3416-21-5,Cc1ccc2cc3c4ccccc4C5OC5c3c6CCc1c26,mutagenic
+2458-12-0,Cc1ccc(cc1N)C(=O)O,mutagenic
+15562-42-2,COc1ccc2C(=O)c3nccc4cc(OC)c(OC)c(c2c1)c34,non-mutagenic
+62018-91-1,CCCCN(C[C@H](O)CCO)N=O,mutagenic
+143922-96-7,Cc1c(N)cccc1N=[N+]([O-])c2cccc(N)c2C,mutagenic
+114838-69-6,CC(=O)O[C@@H]1[C@]2(C)C[C@]2(C=O)C(=C3CC(C)(C)C[C@]13O)C=O,mutagenic
+24903-48-8,c1ccc2c(c1)ccc3cc4c(ccc5ccncc45)cc23,mutagenic
+102-50-1,COc1ccc(N)c(C)c1,mutagenic
+6313-44-6,[O-][N+](=O)C1c2ccccc2C(=O)c3ccccc13,non-mutagenic
+58917-67-2,OC1C2OC2c3c(cc4ccc5cccc6ccc3c4c56)C1O,mutagenic
+693-98-1,Cc1ncc[nH]1,non-mutagenic
+76150-91-9,Clc1cnc(Oc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c(Cl)c1,non-mutagenic
+13256-06-9,CCCCCN(CCCCC)N=O,mutagenic
+42397-64-8,[O-][N+](=O)c1ccc2ccc3c(ccc4ccc1c2c34)[N+](=O)[O-],mutagenic
+21259-20-1,CC(C)CC(=O)OC1CC2(COC(=O)C)C(OC3C(O)C(OC(=O)C)C2(C)C34CO4)C=C1C,mutagenic
+112-52-7,CCCCCCCCCCCCCl,non-mutagenic
+131119-01-2,Cn1c(CC(=O)OCCCl)c(C(=O)O)c2ccccc12,mutagenic
+1028-11-1,[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Nc2ccccn2,non-mutagenic
+32692-19-6,[O-][N+](=O)c1ccc2NCCc2c1,mutagenic
+81-55-0,Oc1ccc(c2C(=O)c3c(C(=O)c12)c(O)ccc3[N+](=O)[O-])[N+](=O)[O-],mutagenic
+482-89-3,Oc1c([nH]c2ccccc12)C3=Nc4ccccc4C3=O,mutagenic
+59283-76-0,Cc1c(NO)cc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+930-68-7,O=C1CCCC=C1,non-mutagenic
+67028-20-0,Cc1cccc2cc3ccc4ccccc4c3nc12,non-mutagenic
+555-84-0,[O-][N+](=O)c1oc(\C=N\N2CCNC2=O)cc1,mutagenic
+13909-09-6,CC1CCC(CC1)NC(=O)N(CCCl)N=O,mutagenic
+147151-64-2,CC12CCC3C(CCC4=CC(=O)NCCC34C)C1CCC2OC(=O)\C=C\c5cccc(c5)N(CCCl)CCCl,non-mutagenic
+159416-83-8,COc1cc(C)cc2c(O)c(cc(O)c12)c3c(C)cc4c(O)ccc(O)c4c3OC,non-mutagenic
+90597-22-1,NC1=NC(=O)N(C=C1)C2C=C(CO)C(O)C2O,non-mutagenic
+21313-86-0,Nc1[nH]cnc2nc(nc12)c3ccc(cc3)[N+](=O)[O-],mutagenic
+86334-97-6,OC1CCC(O)(CN(N=O)C(Cc2ccccc2)C(=O)O)C(O)C1O,non-mutagenic
+58139-46-1,[O-][N+](=O)c1ccc(s1)c2csc(NC=O)n2,mutagenic
+6344-63-4,Nc1cccc2c1Cc3ccccc23,mutagenic
+106232-36-4,O=Nc1[nH]cnc1c2ccccc2,mutagenic
+18883-66-4,CN(N=O)C(=O)NC1C(O)OC(CO)C(O)C1O,mutagenic
+96563-07-4,CC1c2ccccc2c3cc(C)ccc13,mutagenic
+597-25-1,COP(=O)(OC)N1CCOCC1,non-mutagenic
+491-59-8,Cc1cc(O)c2c(O)c3c(O)cccc3cc2c1,mutagenic
+105-87-3,CC(=CCC\C(=C/COC(=O)C)\C)C,non-mutagenic
+136950-74-8,CC(=O)c1ccc2[nH]c3c(C)cc(c(C)c3c2c1)[N+](=O)[O-],mutagenic
+91085-62-0,Cl\C=C(\Cl)/SCc1ccccc1,mutagenic
+116-54-1,COC(=O)C(Cl)Cl,mutagenic
+58683-84-4,COc1cc(ccc1[N+](=O)[O-])N=Nc2ccccc2,mutagenic
+17804-35-2,CCCCNC(=O)n1c(NC(=O)OC)nc2ccccc12,non-mutagenic
+1747-60-0,COc1ccc2nc(N)sc2c1,mutagenic
+13743-07-2,NC(=O)N(CCO)N=O,mutagenic
+129812-24-4,CC1=CC(=O)Oc2cc3OC4(C)OOC4(C)c3cc12,mutagenic
+159092-73-6,[O-][N+](=O)c1ccc2c(cc3ccccc3c2c1)[N+](=O)[O-],mutagenic
+476-71-1,COc1cc2CCN(C)C3Cc4cc5OCOc5cc4c(c1O)c23,non-mutagenic
+67019-26-5,CCCCCCCC(=O)Nc1snc2ccccc12,non-mutagenic
+101489-25-2,COc1ccc(O)c2C(=O)c3c(OC)cc4OC5OCCC5c4c3Oc12,non-mutagenic
+106532-72-3,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccccc3Cl)\c2c1)C(=O)c4ccccc4Cl,mutagenic
+75-91-2,CC(C)(C)OO,mutagenic
+112654-68-9,ClC(=C1OC(=O)C(=C1)Cl)Cl,mutagenic
+13109-99-4,[O-][N+](=O)c1cnc(s1)N2CCCC2=O,mutagenic
+124489-20-9,Cn1c(NO)nc2ncc(cc12)c3ccccc3,mutagenic
+63449-41-2,CCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,non-mutagenic
+21884-44-6,Cc1cc(O)c2C(=C3C(=O)C4C(O)C5C6C(O)C(C(=O)C7=C(O)c8c(O)cc(C)c(O)c8C(=O)C467)C35C(=O)c2c1O)O,non-mutagenic
+65267-04-1,NC(=O)CNC(=O)N(CCCl)N=O,mutagenic
+279242-11-4,CC(C)(C)c1ccc(cc1)c2ccc(cc2)[N+](=O)[O-],non-mutagenic
+3244-90-4,CCCOP(=S)(OCCC)OP(=S)(OCCC)OCCC,non-mutagenic
+111249-52-6,Cc1cc(N)c(C)c2c3ccccc3[nH]c12,mutagenic
+4196-87-6,CC(COC(=O)c1ccccc1)(COC(=O)c2ccccc2)COC(=O)c3ccccc3,non-mutagenic
+129812-30-2,CC12OOC1(C)c3ccc4cccnc4c3O2,non-mutagenic
+123-92-2,CC(C)CCOC(=O)C,non-mutagenic
+NOCAS_M291,CCCCCCCCCCCCCCCCCC(=O)OCC1=CC=C2C(=CC[C@H](C=C12)C(=C)C)C,mutagenic
+28342-33-8,COc1ccc2c3ccc4cc5OCOc5cc4c3N(C)C(=O)c2c1OC,mutagenic
+220168-43-4,Cc1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,mutagenic
+1516-74-1,N#N=Nc1nc2ccccc2[nH]1,mutagenic
+146-68-9,[O-][N+](=O)c1ccc(cc1)n2nc(n[n+]2c3ccc(I)cc3)c4ccccc4,non-mutagenic
+873-76-7,OCc1ccc(Cl)cc1,non-mutagenic
+127-47-9,CC(=O)OC\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C,non-mutagenic
+70222-95-6,COc1cccc2C(=O)c3c(O)c4C(CC(O)(Cc4c(O)c3C(=O)c12)C(=O)CO)OC5CC(C(O)C(C)O5)N(C)C,mutagenic
+107210-39-9,CN(C)CCCNc1c2ccccc2nc3c(ccc(c13)[N+](=O)[O-])N(CCOC(=O)C)CCOC(=O)C,mutagenic
+6810-26-0,ONc1ccc(cc1)c2ccccc2,mutagenic
+98-11-3,OS(=O)(=O)c1ccccc1,non-mutagenic
+159092-80-5,[O-][N+](=O)c1ccc2c(c1)c(cc3cccc(c23)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+125369-76-8,Cc1ccc(cc1)\C(=C\C=C\c2ccccc2[N+](=O)[O-])\C#N,mutagenic
+72492-12-7,CC(=O)c1ccc2OC3(CC3)C(=O)c2c1,non-mutagenic
+97-42-7,CC(=O)O[C@H]1C[C@H](CC=C1C)C(=C)C,non-mutagenic
+33175-34-7,ONc1ccc(Cl)c(Cl)c1,non-mutagenic
+110-21-4,NC(=O)NNC(=O)N,non-mutagenic
+55556-93-9,OC1CCN(CC1)N=O,mutagenic
+83287-02-9,COc1ccc2c(c1)C(=O)c3c(OC)c(OC)cc4ccnc2c34,mutagenic
+19622-55-0,Cn1c(ncc1[N+](=O)[O-])c2nnc(N)s2,mutagenic
+67508-86-5,CN[C@H]1C[C@@H](O[C@H]2C[C@](O)(Cc3c(O)c4C(=O)c5cccc(OC)c5C(=O)c4c(O)c23)C(=O)C)O[C@@H](C)[C@@H]1O,mutagenic
+7422-80-2,CCCCN(N)CCCC,non-mutagenic
+3333-66-2,Cc1c(C)c2c(Cl)c3ccccc3nc2c4ccccc14,mutagenic
+128-95-0,Nc1ccc(N)c2C(=O)c3ccccc3C(=O)c12,mutagenic
+55965-84-9,CN1SC(=CC1=O)Cl,mutagenic
+108-37-2,Clc1cccc(Br)c1,non-mutagenic
+98-82-8,CC(C)c1ccccc1,non-mutagenic
+79-06-1,NC(=O)C=C,non-mutagenic
+121-17-5,[O-][N+](=O)c1cc(ccc1Cl)C(F)(F)F,non-mutagenic
+5470-37-1,CC1NC(Cc2c1[nH]c3ccccc23)C(=O)O,non-mutagenic
+120-75-2,Cc1nc2ccccc2s1,non-mutagenic
+73870-33-4,O=NN1CCSC1,mutagenic
+121625-60-3,CC12OC1C3CCCCC3c4ccccc24,non-mutagenic
+83053-60-5,CCCCOc1cc2C(=O)CCc2c3ccc4ccccc4c13,non-mutagenic
+111955-14-7,OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N(N=O)c2ccc(cc2)[N+](=O)[O-],mutagenic
+7763-77-1,Cl[C@@H]1CO1,mutagenic
+621-96-5,Nc1ccc(\C=C\c2ccc(N)cc2)cc1,mutagenic
+6190-65-4,CC(C)Nc1nc(N)nc(Cl)n1,non-mutagenic
+NOCAS_M182,CC[C@@H](C)COC(=O)\C=C\c1ccc(cc1)\N=C\c2ccc(OC)cc2,mutagenic
+607-35-2,[O-][N+](=O)c1cccc2cccnc12,mutagenic
+130536-38-8,OC1C=Cc2ncccc2C1O,non-mutagenic
+91-62-3,Cc1ccc2ncccc2c1,mutagenic
+185-70-6,C1CCC2(CC1)CO2,non-mutagenic
+NOCAS_M224,C1CC[C@H]2O[C@H]2C1,mutagenic
+108-67-8,Cc1cc(C)cc(C)c1,non-mutagenic
+88-73-3,[O-][N+](=O)c1ccccc1Cl,mutagenic
+2381-39-7,Cc1c2ccccc2c3ccc4cccc5ccc1c3c45,mutagenic
+86-50-0,COP(=S)(OC)SCN1N=Nc2ccccc2C1=O,mutagenic
+25081-31-6,OC(=O)CN(CC(=O)O)N=O,mutagenic
+117929-15-4,[O-][N+](=O)c1cc2ccc3cc(cc4ccc(c1)c2c34)[N+](=O)[O-],mutagenic
+72999-11-2,COC(=O)\C(=C\c1occc1)\[N+](=O)[O-],non-mutagenic
+17433-31-7,CC(=O)NNC(=O)c1ccccn1,non-mutagenic
+170660-63-6,ClC1C(=O)NC(=O)C1=C(Cl)Cl,mutagenic
+77500-04-0,Cc1cnc2ccc3c(nc(N)n3C)c2n1,mutagenic
+163275-67-0,Fc1cccc2ccc3ncccc3c12,mutagenic
+52744-22-6,CC(=O)C1(O)CC(O)c2c(O)c3C(=O)c4c(O)cccc4C(=O)c3c(O)c2C1,mutagenic
+1069-55-2,CC(C)COC(=O)C(=C)C#N,non-mutagenic
+619-90-9,CC(=O)OCc1ccc(cc1)[N+](=O)[O-],mutagenic
+NOCAS_M338,CC(=O)O[C@H]1[C@H](O)[C@@H]2O[C@H]3C=C(C)C(=O)[C@H](O)[C@@]3(CO)[C@@]1(C)[C@@]24CO4,non-mutagenic
+105427-03-0,O=C(Nc1ccccc1)C2CO2,mutagenic
+523-47-7,CC1=CC[C@H]2[C@H](C1)[C@H](CC=C2C)C(C)(C)C,non-mutagenic
+NOCAS_M126,COC(=O)[C@]12O[C@@]1(C)[C@@](C)(O)NC2=O,mutagenic
+20589-63-3,[O-][N+](=O)c1ccc2c3cccc4cccc(c5cccc1c25)c34,mutagenic
+446-86-6,Cn1cnc(c1Sc2[nH]cnc3ncnc23)[N+](=O)[O-],mutagenic
+16665-89-7,CCc1cccc(CC)c1NC(=O)C,non-mutagenic
+NOCAS_M372,NC1=NC(=O)N(C=C1)[C@H]2O[C@@H](COP(=O)(O)O)[C@H](O)[C@H]2O,non-mutagenic
+14953-62-9,[O-][N+](=O)c1[nH]cnc1c2ccccc2,mutagenic
+106-27-4,CCCC(=O)OCCC(C)C,non-mutagenic
+493-52-7,CN(C)c1ccc(cc1)N=Nc2ccccc2C(=O)O,mutagenic
+885-62-1,OS(=O)(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+110690-43-2,CCOCN1C=C(F)C(=O)N(C(=O)c2cccc(c2)C(=O)Oc3nc(OC(=O)c4ccccc4)ccc3C#N)C1=O,non-mutagenic
+3787-28-8,ClC(=C(Cl)C=O)Cl,mutagenic
+928-73-4,NC(=O)N\N=C\C(=O)O,non-mutagenic
+163275-65-8,Fc1cnc2ccc3ccccc3c2c1,mutagenic
+50-84-0,OC(=O)c1ccc(Cl)cc1Cl,non-mutagenic
+304-28-9,CC(=O)Nc1ccc2c(Cc3cc(NC(=O)C)ccc23)c1,mutagenic
+97747-88-1,CN(C)c1ccc(cc1)C2CC3(C)C(CCC3(O)\C=C\CO)C4CCC5=CC(=O)CCC5=C24,non-mutagenic
+95896-78-9,Cc1cnc2cc(C)c3c(nc(N)n3C)c2n1,mutagenic
+2752-54-7,CC(C)CC(NC(=O)COc1ccc(Cl)cc1Cl)C(=O)O,non-mutagenic
+95-84-1,Cc1ccc(O)c(N)c1,mutagenic
+125973-99-1,ClCC1=CC(=O)OC1,mutagenic
+63390-11-4,Nc1ccc(cc1)c2cc(Cl)c(N)c(Cl)c2,mutagenic
+54522-53-1,COC1(CCC(C)COC2OC(CO)C(O)C(O)C2O)OC3CC4C5CC=C6CC(CCC6(C)C5CCC4(C)C3C1C)OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7OC9OC(C)C(O)C(O)C9O,non-mutagenic
+2945-96-2,COc1cc(N=Nc2ccc(N)cc2)c(C)cc1N=Nc3c(O)c4cc(N)ccc4cc3S(=O)(=O)O,mutagenic
+62681-13-4,CCOC(=O)N(CCOC(=O)C)N=O,mutagenic
+3531-19-9,Nc1c(Cl)cc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+16757-83-8,Cc1cc2cc3ccccc3c4ccc5cccc1c5c24,mutagenic
+94-70-2,CCOc1ccccc1N,non-mutagenic
+33399-00-7,CCOP(=O)(OCC)O\C(=C/Br)\c1ccc(Cl)cc1Cl,non-mutagenic
+10227-50-6,O=C1NCCN1c2nccs2,mutagenic
+19083-00-2,CC1CCC2(OC1)OC3CC4C5CC=C6CC(CCC6(C)C5CCC4(C)C3C2C)OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7OC9OC(C)C(O)C(O)C9O,non-mutagenic
+134109-01-6,OC1C(O)c2c(Cl)c3ccccc3cc2c4ccccc14,non-mutagenic
+91254-92-1,Oc1cc2cccc3ccc4ccc(c1c4c23)[N+](=O)[O-],mutagenic
+60877-85-2,[O-][N+](=O)c1ccc(\C=N\c2snc3c(Cl)cc(Cl)cc23)cc1,mutagenic
+96839-34-8,OCc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+670-54-2,N#CC(=C(C#N)C#N)C#N,non-mutagenic
+98079-51-7,CCN1C=C(C(=O)O)C(=O)c2cc(F)c(N3CCNC(C)C3)c(F)c12,mutagenic
+87-44-5,C\C\1=C\CCC(=C)[C@@H]2CC(C)(C)[C@@H]2CC1,non-mutagenic
+64283-13-2,OC1C(O)c2c3ccccc3cc4ccc5cccc1c5c24,mutagenic
+8065-48-3,CCOP(=S)(OCC)OCCSCC,mutagenic
+10114-58-6,Nc1ccc(N=Nc2cccc(c2)N=Nc3ccc(N)cc3N)c(N)c1,mutagenic
+918-00-3,CC(=O)C(Cl)(Cl)Cl,mutagenic
+96-69-5,Cc1cc(O)c(cc1Sc2cc(c(O)cc2C)C(C)(C)C)C(C)(C)C,non-mutagenic
+525-03-1,NC1c2ccccc2c3ccccc13,non-mutagenic
+822-36-6,Cc1c[nH]cn1,non-mutagenic
+NOCAS_M398,CCCC[C@@H](CC)CN,non-mutagenic
+NOCAS_M95,C([C@H]1CO1)c2ccc(Cc3ccccc3)cc2,mutagenic
+58-94-6,NS(=O)(=O)c1cc2c(NC=NS2(=O)=O)cc1Cl,non-mutagenic
+NOCAS_M255,O1[C@@H]2[C@H]1c3c(c4ccccc24)c5ccccc5c6ccccc36,mutagenic
+79-92-5,CC1(C)[C@@H]2CC[C@@H](C2)C1=C,non-mutagenic
+NOCAS_M289,CC(C)[C@@H]1CC[C@@H](C)CC1=O,mutagenic
+36164-42-8,CC(=O)Nc1ccc2cccnc2c1,mutagenic
+NOCAS_M92,O[C@@H]1Cc2cc3cccc4ccc5ccc1c2c5c34,mutagenic
+NOCAS_M374,CC(C)CC[C@@H](C)Nc1ccc(N[C@H](C)CCC(C)C)cc1,non-mutagenic
+91991-18-3,CC(=O)Nc1snc2ccc(Cl)cc12,mutagenic
+51-36-5,OC(=O)c1cc(Cl)cc(Cl)c1,non-mutagenic
+126-99-8,ClC(=C)C=C,non-mutagenic
+70987-78-9,Cc1ccc(cc1)S(=O)(=O)OCC2CO2,mutagenic
+514-78-3,C\C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C(=O)CCC1(C)C)\C=C\C=C(/C)\C=C\C2=C(C)C(=O)CCC2(C)C,non-mutagenic
+5679-89-0,Cc1ccc(cc1[N+](=O)[O-])N=[N+]([O-])c2ccc(C)c(c2)[N+](=O)[O-],non-mutagenic
+53693-67-7,Nc1ccc(cc1)c2ccc(cc2)c3ccc(cc3)c4ccc(N)cc4,non-mutagenic
+32784-82-0,CS(=O)(=O)OCCCNCCCOS(=O)(=O)C,mutagenic
+64099-26-9,COc1nsc2ccc(cc12)[N+](=O)[O-],mutagenic
+106-99-0,C=CC=C,mutagenic
+610-39-9,Cc1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+2873-97-4,CC(=O)CC(C)(C)NC(=O)C=C,non-mutagenic
+2310-17-0,CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12,non-mutagenic
+50782-69-9,CCOP(=O)(C)SCCN(C(C)C)C(C)C,non-mutagenic
+142713-64-2,COc1cc(CNC(=O)C(C)Br)ccc1O,mutagenic
+533-74-4,CN1CSC(=S)N(C)C1,mutagenic
+5806-00-8,Cc1c(cccc1[N+](=O)[O-])N=[N+]([O-])c2cccc(c2C)[N+](=O)[O-],non-mutagenic
+115-32-2,OC(c1ccc(Cl)cc1)(c2ccc(Cl)cc2)C(Cl)(Cl)Cl,non-mutagenic
+16338-97-9,C=CCN(CC=C)N=O,mutagenic
+459-56-3,OCc1ccc(F)cc1,non-mutagenic
+2675-77-6,COc1cc(Cl)c(OC)cc1Cl,mutagenic
+110-18-9,CN(C)CCN(C)C,non-mutagenic
+4430-25-5,Oc1c(Br)cc(cc1Br)C2(OS(=O)(=O)c3c(Br)c(Br)c(Br)c(Br)c23)c4cc(Br)c(O)c(Br)c4,non-mutagenic
+4801-39-2,NCC(=O)Nc1ccccc1,mutagenic
+93673-37-1,O[C@H]1C=Cc2c(ccc3c4C=Cc5cccc(cc23)c45)[C@@H]1O,mutagenic
+626-17-5,N#Cc1cccc(c1)C#N,non-mutagenic
+101-84-8,O(c1ccccc1)c2ccccc2,non-mutagenic
+6146-52-7,[O-][N+](=O)c1ccc2[nH]ccc2c1,mutagenic
+66789-78-4,CC(C)CC(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C(=O)O,non-mutagenic
+61841-39-2,Nc1ccc(cc1)c2ccc(N)c(c2)[N+](=O)[O-],mutagenic
+91-08-7,Cc1c(cccc1N=C=O)N=C=O,mutagenic
+24463-15-8,OCc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+86803-19-2,ClCc1cccc2cc3ccc4cccc5ccc(c12)c3c45,mutagenic
+56-55-3,c1ccc2cc3c(ccc4ccccc34)cc2c1,mutagenic
+159092-75-8,[O-][N+](=O)c1cccc2c(cc3ccccc3c12)[N+](=O)[O-],mutagenic
+120404-27-5,OCCNc1ccc(cc1)N=Nc2ccc(cc2)N(CCO)CCO,non-mutagenic
+1197-01-9,Cc1ccc(cc1)C(C)(C)O,non-mutagenic
+7269-58-1,Nc1nc(NO)c2ncn(C3OC(CO)C(O)C3O)c2n1,mutagenic
+138-42-1,OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-],non-mutagenic
+41372-08-1,CC(N)(Cc1ccc(O)c(O)c1)C(=O)O,non-mutagenic
+6959-47-3,ClCc1ccccn1,mutagenic
+93673-33-7,O1C2C1c3c4c2cccc4cc5ccc6ccccc6c35,mutagenic
+122-57-6,CC(=O)\C=C/c1ccccc1,mutagenic
+146795-33-7,CCc1ccccc1NC(=O)c2csc(c2)[N+](=O)[O-],mutagenic
+1929-82-4,Clc1cccc(n1)C(Cl)(Cl)Cl,mutagenic
+461-58-5,NC(=N)NC#N,mutagenic
+108-01-0,CN(C)CCO,non-mutagenic
+100690-33-3,CCCCCOc1ccc(cc1)N=O,mutagenic
+39179-91-4,Cc1ccc(NCCCl)cc1,mutagenic
+95-48-7,Cc1ccccc1O,non-mutagenic
+111712-49-3,BrCC(Br)CCOP(=O)(OCCC(Br)CBr)OCCC(Br)CBr,non-mutagenic
+132297-89-3,COc1ccc2nc3c(cc2c1)c4cccc5cccc3c45,mutagenic
+545-06-2,ClC(Cl)(Cl)C#N,mutagenic
+481-39-0,Oc1cccc2C(=O)C=CC(=O)c12,mutagenic
+6623-66-1,[O-][N+](=O)c1ccc2OC(=O)c3ccccc3c2c1,mutagenic
+150445-98-0,[O-][N+](=O)c1ccc2c(c1)nc(\C=N\OCc3ccccc3[N+](=O)[O-])n2Cc4ccc(Cl)cc4Cl,mutagenic
+21490-63-1,C[C@@H]1O[C@@H]1C,mutagenic
+148-82-3,N[C@H](Cc1ccc(cc1)N(CCCl)CCCl)C(=O)O,mutagenic
+NOCAS_M190,C[C@@H](O)c1ccc2ccc3cccc4ccc1c2c34,mutagenic
+51-21-8,Oc1ncc(F)c(O)n1,non-mutagenic
+3343-64-4,CCCCSCCC(N)C(=O)O,non-mutagenic
+82-28-0,Cc1ccc2C(=O)c3ccccc3C(=O)c2c1N,mutagenic
+483-84-1,Oc1c(cc(c2ccc(cc12)S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+59804-37-4,CN1C(=C(O)c2sccc2S1(=O)=O)C(=O)Nc3ccccn3,non-mutagenic
+3520-42-1,CCN(CC)c1ccc2C(=C3C=CC(=[N+](CC)CC)C=C3Oc2c1)c4ccc(cc4S(=O)(=O)O)S(=O)(=O)O,mutagenic
+142438-72-0,CCC1(OC1(C(=O)N)C(=O)OC)C(C)O,non-mutagenic
+80-08-0,Nc1ccc(cc1)S(=O)(=O)c2ccc(N)cc2,non-mutagenic
+6633-40-5,Oc1ccc2c(Cc3cc(ccc23)[N+](=O)[O-])c1,mutagenic
+6428-31-5,Nc1ccc(N=Nc2ccc(cc2)N=Nc3c(N)c4c(O)c(N=Nc5ccc(cc5)N=Nc6ccc(N)cc6N)c(cc4cc3S(=O)(=O)O)S(=O)(=O)O)c(N)c1,mutagenic
+86674-50-2,OC1C(O)c2ccc(c3ccc4cccc1c4c23)[N+](=O)[O-],mutagenic
+98033-26-2,Cc1nc2c(ccc3ccc4ccc(O)cc4c23)[nH]1,mutagenic
+833-50-1,o1c(nc2ccccc12)c3ccccc3,non-mutagenic
+139259-64-6,CC(C)ON(OC(=O)C)C(=O)c1ccccc1,mutagenic
+127502-69-6,CC(C)c1cc(ccc1N)c2ccccc2,mutagenic
+94500-54-6,ClCc1cc2cccc3ccc4cc5ccccc5c1c4c23,mutagenic
+113698-22-9,COC1=CC(=O)c2c(nc(C)c3c4ccccc4[nH]c23)C1=O,mutagenic
+86439-49-8,Nc1cc2[nH]c3ccccc3c2cc1[N+](=O)[O-],mutagenic
+75-08-1,CCS,non-mutagenic
+353-59-3,FC(F)(Cl)Br,non-mutagenic
+622-79-7,N#N=NCc1ccccc1,mutagenic
+1484-12-4,Cn1c2ccccc2c3ccccc13,mutagenic
+13284-42-9,CC\C=C/C#N,non-mutagenic
+134998-76-8,O=Nc1ccc2ccc3c4CCCCc4cc5ccc1c2c35,mutagenic
+83-79-4,COc1cc2OC[C@@H]3Oc4c5C[C@H](Oc5ccc4C(=O)[C@H]3c2cc1OC)C(=C)C,non-mutagenic
+135295-00-0,OCc1ccc2c3cccc4cccc(c2c1)c34,mutagenic
+1119-40-0,COC(=O)CCCC(=O)OC,non-mutagenic
+618-39-3,NC(=N)c1ccccc1,non-mutagenic
+3546-41-6,CN(C)c1ccc2c(ccc(\C=C\c3cc(C)n(c3C)c4ccccc4)[n+]2C)c1,mutagenic
+128-08-5,BrN1C(=O)CCC1=O,mutagenic
+184582-67-0,CN1c2ccc3OCCOCCOCCOCCOCCOCCOc4ccc1c(c4)C(=S)c2c3,non-mutagenic
+7433-46-7,CNC(=O)NO,non-mutagenic
+3113-72-2,Cc1ccc(c(c1)C(=O)O)[N+](=O)[O-],mutagenic
+NOCAS_M114,[O-][N+](=O)c1ccc(O[C@H]2CO2)cc1,mutagenic
+107-35-7,NCCS(=O)(=O)O,non-mutagenic
+88-21-1,Nc1ccccc1S(=O)(=O)O,mutagenic
+19866-62-7,[O-][n+]1cc2ncccc2cn1,non-mutagenic
+15299-08-8,Cc1ccc2c(c1)c3cc4ccccc4c5cc6ccccc6c2c35,mutagenic
+2498-75-1,Cc1ccc2c(ccc3cc4ccccc4cc23)c1,mutagenic
+57-14-7,CN(C)N,mutagenic
+192-87-0,C1c2ccccc2c3c1ccc4ccc5ccccc5c34,non-mutagenic
+119-65-3,c1ccc2cnccc2c1,non-mutagenic
+22994-85-0,[O-][N+](=O)c1nccn1CC(=O)NCc2ccccc2,mutagenic
+141-38-8,CCCCCCCCC1OC1CCCCCCCC(=O)OCC(CC)CCCC,non-mutagenic
+121-47-1,Nc1cccc(c1)S(=O)(=O)O,non-mutagenic
+75476-80-1,[O-][N+](=O)c1ccc2C=CCc2c1,mutagenic
+18523-47-2,OC(=O)CCN=N#N,mutagenic
+10169-02-5,Oc1ccc2ccccc2c1N=Nc3ccc(c4ccc(cc4S(=O)(=O)O)N=Nc5c(O)ccc6ccccc56)c(c3)S(=O)(=O)O,non-mutagenic
+70951-83-6,OC1C(O)c2c(ccc3c2ccc4ccccc34)C5OC15,mutagenic
+81542-82-7,CC(C)(C)NCC(O)COc1ccc(O)cc1C2CCCC2,non-mutagenic
+25103-58-6,CCCCC(S)(CCC)CCCC,non-mutagenic
+98-08-8,FC(F)(F)c1ccccc1,non-mutagenic
+7779-16-0,Nc1ccccc1C(=O)OC2CCCCC2,non-mutagenic
+95389-75-6,Cn1c(N=N#N)nc2ccc3ccccc3c12,mutagenic
+14691-88-4,CC1(C)CC(N)CC(C)(C)N1O,mutagenic
+6066-82-6,ON1C(=O)CCC1=O,non-mutagenic
+141-97-9,CCOC(=O)CC(=O)C,non-mutagenic
+124617-86-3,CC(=O)ON(OCc1ccccc1)C(=O)c2ccccc2,mutagenic
+61691-83-6,COc1ccc([C@H](OC(=O)C)C=C)c2ccccc12,mutagenic
+183249-37-8,C1C=Cc2c1ccc3ccc4ccccc4c23,mutagenic
+97851-13-3,Oc1ccc(cc1[N+](=O)[O-])c2cccc(c2O)[N+](=O)[O-],non-mutagenic
+92-67-1,Nc1ccc(cc1)c2ccccc2,mutagenic
+159714-85-9,CCc1c2C3OC3c4ccccc4c2cc5ccccc15,mutagenic
+124817-06-7,OC(CN=N#N)c1ccccc1,mutagenic
+75-26-3,CC(C)Br,mutagenic
+1594-56-5,[O-][N+](=O)c1ccc(SC#N)c(c1)[N+](=O)[O-],mutagenic
+443-48-1,Cc1ncc([N+](=O)[O-])n1CCO,mutagenic
+57564-91-7,NC(CCC(=O)N(CC(=O)O)C(=O)C(N)CSN=O)C(=O)O,mutagenic
+603-54-3,NC(=O)N(c1ccccc1)c2ccccc2,non-mutagenic
+607-30-7,ONc1cccc2ccccc12,mutagenic
+105467-73-0,OC1C2OC2c3c(ccc4nc5ccc6ccccc6c5cc34)C1O,mutagenic
+NOCAS_M199,C=CC(=O)OC[C@H]1CO1,mutagenic
+114882-46-1,O=Nc1ccc2ccc3cc4ccccc4c5ccc1c2c35,mutagenic
+41122-70-7,CCCCCCc1ccc(cc1)c2ccc(cc2)C#N,non-mutagenic
+80830-42-8,OC(=O)C1CSC(N1C(=O)CCS)c2ccccc2O,non-mutagenic
+147-47-7,CC1=CC(C)(C)Nc2ccccc12,non-mutagenic
+544-63-8,CCCCCCCCCCCCCC(=O)O,non-mutagenic
+NOCAS_M465,C[C@@H]1OCCc2cc3c(cc12)C(C)(C)[C@@H](C)C3(C)C,non-mutagenic
+63412-06-6,CN(N=O)C(=O)c1ccccc1,mutagenic
+67508-85-4,CC[C@]1(O)C[C@H](O[C@@H]2C[C@H](N)[C@@H](O)[C@H](C)O2)c3c(O)c4C(=O)c5c(O)ccc(O)c5C(=O)c4cc3[C@H]1C(=O)OC,mutagenic
+103978-08-1,CCN1C=C(C(=O)O)C(=O)c2cc(F)c(c(F)c12)c3ccc(O)cc3,mutagenic
+123016-76-2,NC(=O)N(c1ccccc1)c2ccc(cc2)C(=O)O,mutagenic
+23355-64-8,OCCN(CCO)c1ccc(N=Nc2c(Cl)cc(cc2Cl)[N+](=O)[O-])c(Cl)c1,mutagenic
+88741-68-8,COc1ccc2C(=O)c3c(OC)c(OC)cc4ccnc(c2c1)c34,mutagenic
+3351-28-8,Cc1cccc2c1ccc3c4ccccc4ccc23,mutagenic
+115609-71-7,Cc1cnc2c(n1)c(C)cc3c2nc(N)n3C,mutagenic
+578-67-6,Oc1cccc2ncccc12,mutagenic
+24027-84-7,Oc1cc2cccc3ccc4c5ccccc5cc1c4c23,mutagenic
+131862-22-1,CN(C)CCNC(=O)c1cccc2cc(oc12)c3ccccc3,mutagenic
+102791-33-3,[O-][N+](=O)c1ccc2OC(=O)c3cccc4ccc1c2c34,mutagenic
+113393-59-2,CC(=C)c1ccc(C)c2ccc(CO)c2c1,mutagenic
+NOCAS_M550,CC(C)[C@@H]1CC[C@@H](C)CC1,non-mutagenic
+84-11-7,O=C1C(=O)c2ccccc2c3ccccc13,non-mutagenic
+180913-77-3,CC(=O)Nc1ccc2C(=O)C(=O)c3cccc4ccc1c2c34,mutagenic
+345667-01-8,CC(C)(C)c1cc(ccc1NO)c2ccccc2,mutagenic
+873-69-8,O\N=C\c1ccccn1,non-mutagenic
+312304-89-5,CC(=O)OCN(CCCCCl)N=O,mutagenic
+55446-27-0,COc1cc2O[C@H]3OC=C[C@H]3c2c4OC(=O)C5=C([C@@H](O)C[C@@H]5O)c14,mutagenic
+63-25-2,CNC(=O)Oc1cccc2ccccc12,mutagenic
+155379-82-1,Cc1cc(N)cc(c1N)[N+](=O)[O-],mutagenic
+100757-60-6,ClCc1ccc2ccc3cc4ccccc4c5ccc1c2c35,non-mutagenic
+51325-35-0,CC(=O)Nc1nc(NC(=O)C)nc(n1)c2oc(cc2)[N+](=O)[O-],mutagenic
+79-27-6,BrC(Br)C(Br)Br,non-mutagenic
+4176-53-8,Nc1cccc2c1ccc3ccccc23,mutagenic
+139495-76-4,CN1CCN(CC1)c2cc3N(C4CC4)C5=CC(=O)NC(=O)N5c3cc2F,mutagenic
+108-88-3,Cc1ccccc1,non-mutagenic
+56525-92-9,COc1nncc2ncccc12,non-mutagenic
+2757-90-6,N[C@@H](CCC(=O)NNc1ccc(CO)cc1)C(=O)O,mutagenic
+132742-02-0,[O-][N+](=O)c1c2C=CCCc2c3ccc4cccc5ccc1c3c45,mutagenic
+6983-79-5,COC(=O)\C=C\C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C(=O)OC)/C)\C,mutagenic
+111380-08-6,Cn1cnc(c2ccccc2)c1N=O,mutagenic
+218-08-6,c1ccc2c(c1)ccc3c4cccnc4ccc23,mutagenic
+74006-72-7,O=C1CC2SCC=CN12,non-mutagenic
+3268-49-3,CSCCC=O,non-mutagenic
+92339-11-2,CC(=O)N(CC(O)CN(C(=O)C)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c2c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c2I,non-mutagenic
+153654-33-2,Oc1cc2[nH]c3ccccc3c2cc1[N+](=O)[O-],mutagenic
+97461-43-3,COC(=O)\C(=C\c1oc(cc1)[N+](=O)[O-])\C,mutagenic
+82-39-3,COc1cccc2C(=O)c3ccccc3C(=O)c12,mutagenic
+129-73-7,CN(C)c1ccc(cc1)C(c2ccccc2)c3ccc(cc3)N(C)C,non-mutagenic
+143-16-8,CCCCCCNCCCCCC,non-mutagenic
+1195-79-5,C[C@]12CC[C@H](C1)C(C)(C)C2=O,non-mutagenic
+683-51-2,ClC(=C)C=O,mutagenic
+602-60-8,[O-][N+](=O)c1c2ccccc2cc3ccccc13,mutagenic
+25168-15-4,CC(C)CCCCCOC(=O)Cc1cc(Cl)c(Cl)cc1Cl,non-mutagenic
+24519-27-5,N#CC1=C(SCCS1)C#N,non-mutagenic
+5221-17-0,BrCC(Br)C=O,mutagenic
+121-88-0,Nc1ccc(cc1O)[N+](=O)[O-],mutagenic
+620-02-0,Cc1oc(C=O)cc1,non-mutagenic
+67809-14-7,CN(C=O)N=O,mutagenic
+149-32-6,OCC(O)C(O)CO,non-mutagenic
+136-35-6,N(N=Nc1ccccc1)c2ccccc2,mutagenic
+16110-09-1,Clc1ccc(Cl)nc1,non-mutagenic
+2154-67-8,CC1(C)C=C(C(=O)O)C(C)(C)N1O,non-mutagenic
+16596-38-6,CC(C)CN(N)CC(C)C,mutagenic
+122349-91-1,Cc1cc(C)c2cc(C)c(N)cc2n1,mutagenic
+579527-03-0,Clc1cc(Cl)cc(c1)N2C(=O)N3C[C@H](C[C@@]3(Cc4ccc(cc4)C#N)C2=O)N=[N+]=[N-],mutagenic
+89-58-7,Cc1ccc(C)c(c1)[N+](=O)[O-],mutagenic
+363-03-1,O=C1C=CC(=O)C(=C1)c2ccccc2,non-mutagenic
+139259-93-1,CC(=O)ON(OCc1ccc(cc1)C(C)(C)C)C(=O)c2ccccc2,mutagenic
+58139-53-0,CC(=O)Nc1nc(cs1)c2cc(cs2)[N+](=O)[O-],mutagenic
+1582-09-8,CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-],mutagenic
+88-14-2,OC(=O)c1occc1,non-mutagenic
+2278-22-0,CC(=O)OO[N+](=O)[O-],mutagenic
+2646-17-5,Cc1ccccc1N=Nc2c(O)ccc3ccccc23,mutagenic
+982-57-0,O[C@H]([C@H](COC(=O)CCC(=O)O)NC(=O)C(Cl)Cl)c1ccc(cc1)[N+](=O)[O-],non-mutagenic
+108-64-5,CCOC(=O)CC(C)C,non-mutagenic
+64099-28-1,COc1nsc2ccc(N)cc12,mutagenic
+70-25-7,CN(N=O)C(=N)N[N+](=O)[O-],mutagenic
+NOCAS_M495,[O-][N+](=O)c1ccc(cc1)[C@@H]2O[C@H]2C(=O)c3ccccc3,non-mutagenic
+63038-82-4,O[C@H]1[C@H](O)c2cc3ccc4ccccc4c3cc2[C@@H]5O[C@H]15,mutagenic
+160543-18-0,Cc1c2C3OC3c4ccccc4c2nc5ccc(CO)cc15,non-mutagenic
+113600-17-2,Fc1cccc2cc3c(cc12)c4cccc5cccc3c45,mutagenic
+116208-67-4,Fc1ccc2c3cc4ccccc4cc3c5cccc1c25,mutagenic
+NOCAS_M200,BrC[C@@H](Br)COC(=O)C=C,mutagenic
+1591-56-6,CN(C)c1ccc(cc1)N=Nc2ccc(NC(=O)C)cc2,mutagenic
+95-57-8,Oc1ccccc1Cl,non-mutagenic
+947-73-9,Nc1cc2ccccc2c3ccccc13,mutagenic
+159092-77-0,[O-][N+](=O)c1cccc2c1c(cc3cccc(c23)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+1116-54-7,OCCN(CCO)N=O,mutagenic
+146795-44-0,[O-][N+](=O)c1ccc(NC(=O)c2csc(c2)[N+](=O)[O-])cc1,mutagenic
+2439-35-2,CN(C)CCOC(=O)C=C,non-mutagenic
+334-22-5,ClCCNCCCl,mutagenic
+112368-26-0,OC(=O)CCC(=O)Nc1cc(Cl)c(Cl)c(Cl)c1,non-mutagenic
+70403-80-4,COc1ccc2cc3N(C)CCc4cc(OC)c(OC)c(c2c1)c34,non-mutagenic
+163275-68-1,Fc1ccc(F)c2c1ccc3ncccc23,mutagenic
+1728-95-6,COc1ccc(cc1)c2nc(c3ccccc3)c([nH]2)c4ccccc4,mutagenic
+158729-24-9,Clc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1,non-mutagenic
+646-06-0,C1COCO1,non-mutagenic
+8004-87-3,CNc1ccc(cc1)C(=C2C=CC(=[N+](C)C)C=C2)c3ccc(cc3)N(C)C,mutagenic
+134170-56-2,COC(=O)c1oc(N(OC(=O)C)C(=O)C)c(c2ccccc2)c1c3ccccc3,non-mutagenic
+96-11-7,BrCC(Br)CBr,mutagenic
+3096-52-4,[O-][N+](=O)c1ccc2c3ccccc3C(=O)c2c1,mutagenic
+463-40-1,CC\C=C\C\C=C\C\C=C\CCCCCCCC(=O)O,non-mutagenic
+531-82-8,CC(=O)Nc1nc(cs1)c2oc(cc2)[N+](=O)[O-],mutagenic
+32433-28-6,CC(=O)Nc1ccnc2ccccc12,non-mutagenic
+13687-09-7,CNP(=S)(N1CC1)N2CC2,mutagenic
+105708-74-5,BrCc1c2cccc3ccc4cc5cccc6ccc1c(c56)c4c23,mutagenic
+305-03-3,OC(=O)CCCc1ccc(cc1)N(CCCl)CCCl,mutagenic
+28124-29-0,Nc1ccc2nc3c(N)cccc3nc2c1,mutagenic
+147318-81-8,CSCC(NC(=O)COc1cccc2cnccc12)C(=O)NC(Cc3ccccc3)C(O)C(=O)N4CSCC4C(=O)NC(C)(C)C,non-mutagenic
+51938-13-7,CCCCN(CCCO)N=O,mutagenic
+96-91-3,Nc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+557-91-5,CC(Br)Br,non-mutagenic
+4823-47-6,BrCCOC(=O)C=C,mutagenic
+133831-62-6,[O-][N+](=O)c1ccccc1SS\C(=C(/Cl)\C(F)(F)F)\Cl,mutagenic
+110-63-4,OCCCCO,non-mutagenic
+146177-58-4,Cc1cc2c(nc(N)n2C)c3nc(C)c(C)nc13,mutagenic
+2524-03-0,COP(=S)(Cl)OC,non-mutagenic
+103369-09-1,CC(=O)OCNC(=O)c1ccc(Cl)cc1,non-mutagenic
+106636-48-0,[O-][N+](=O)c1ccc(cc1)c2nc3SCCn3c2[N+](=O)[O-],mutagenic
+148-53-8,COc1cccc(C=O)c1O,non-mutagenic
+6639-36-7,[O-][N+](=O)c1ccc2sc3ccccc3c2c1,mutagenic
+41340-36-7,CCc1cccc2c(CCO)c[nH]c12,non-mutagenic
+33973-15-8,CC12OOC1(C)c3ccccc3O2,mutagenic
+134-20-3,COC(=O)c1ccccc1N,non-mutagenic
+81340-58-1,[O-][N+](=O)c1ccc2c3ccccc3c4cccc5ccc1c2c45,mutagenic
+555-16-8,[O-][N+](=O)c1ccc(C=O)cc1,mutagenic
+80-30-8,Cc1ccc(cc1)S(=O)(=O)NC2CCCCC2,non-mutagenic
+75-11-6,ICI,non-mutagenic
+139495-80-0,CN1CCN(CC1)c2cc3N(C4CC4)C5=CC(=O)N(O)C(=O)N5c3cc2F,mutagenic
+108283-49-4,CC(C)(C)OC(=O)NC(CN=N#N)C(=O)O,mutagenic
+NOCAS_M383,ClC(Cl)[C@H](c1ccc(Cl)cc1)c2ccccc2Cl,non-mutagenic
+132059-53-1,OC1OC(=O)C(=C1C(Br)Br)Br,mutagenic
+5623-11-0,CC(=O)Nc1cccc(N)c1C(=O)O,mutagenic
+23696-28-8,Cc1c(C(=O)NCCO)[n+]([O-])c2ccccc2[n+]1[O-],mutagenic
+84-24-2,CCCCCC(=O)Cc1cc(O)cc2Oc3c(CCCCC)c(C(=O)O)c(O)cc3OC(=O)c12,non-mutagenic
+4170-30-3,C\C=C/C=O,mutagenic
+99520-57-7,OC1C(O)c2ccc3cccc4cc5c6ccccc6C1=c5c2c34,non-mutagenic
+331-39-5,OC(=O)\C=C\c1ccc(O)c(O)c1,non-mutagenic
+191861-15-1,Fc1cnc2cccc(F)c2c1,non-mutagenic
+142382-12-5,OC(=O)c1ccc(CCC(=O)CCC#N)cc1,mutagenic
+109-69-3,CCCCCl,non-mutagenic
+109-84-2,NNCCO,mutagenic
+2478-38-8,COc1cc(cc(OC)c1O)C(=O)C,non-mutagenic
+159394-72-6,[O-][N+](=O)c1ccc(\C=C\c2cccc(c2)C#N)cc1,mutagenic
+NOCAS_M131,ClC(Cl)(Cl)C[C@H]1CO1,mutagenic
+108-05-4,CC(=O)OC=C,non-mutagenic
+585-86-4,OC[C@@H](O)[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)CO,non-mutagenic
+16310-69-3,C1CCc2c(C1)ccc3cc4CCc5ccccc5c4cc23,mutagenic
+570-24-1,Cc1cccc(c1N)[N+](=O)[O-],mutagenic
+51775-36-1,ClCC1(CCl)C2CC(Cl)(Cl)C1(CCl)C(Cl)C2Cl,non-mutagenic
+107-51-7,C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C,non-mutagenic
+56316-37-1,CCCN(CCCC(=O)O)N=O,mutagenic
+98600-98-7,Cc1cc2C(O)C(O)C=Cc2c3cc4ccccc4cc13,mutagenic
+71-36-3,CCCCO,non-mutagenic
+17376-04-4,ICCc1ccccc1,non-mutagenic
+57117-24-5,CS\C(=N/OC(=O)N(C)N=O)\C,mutagenic
+106532-75-6,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccc(Cl)c(Cl)c3)\c2c1)C(=O)c4ccc(Cl)c(Cl)c4,mutagenic
+29082-74-4,ClC(=C(Cl)c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl)Cl,non-mutagenic
+68279-00-5,CCCCCCCCSCN1CN(C)C=C1,non-mutagenic
+55400-88-9,O1C2C1c3cccc4C5OC5c6cccc2c6c34,mutagenic
+77-79-2,O=S1(=O)CC=CC1,non-mutagenic
+111-66-0,CCCCCCC=C,non-mutagenic
+1436-34-6,CCCCC1CO1,non-mutagenic
+52-24-4,S=P(N1CC1)(N2CC2)N3CC3,mutagenic
+344-07-0,Fc1c(F)c(F)c(Cl)c(F)c1F,non-mutagenic
+10159-46-3,CNP(=O)(N(C)C)N(C)C,mutagenic
+36355-01-8,Brc1cc(Br)c(c(Br)c1)c2c(Br)cc(Br)cc2Br,non-mutagenic
+64724-48-7,CC(=O)Nc1ccc2c(Cc3ccccc23)c1OC(=O)C,non-mutagenic
+144280-50-2,[O-][N+](=O)c1ccc2oc3ccc(cc3c2c1)[N+](=O)[O-],mutagenic
+107-14-2,ClCC#N,non-mutagenic
+135-23-9,CN(C)CCN(Cc1cccs1)c2ccccn2,non-mutagenic
+117-80-6,ClC1=C(Cl)C(=O)c2ccccc2C1=O,mutagenic
+954-46-1,[O-][N+](=O)c1cc2ccccc2c3ccccc13,mutagenic
+476-60-8,Oc1ccc(O)c2c(O)c3ccccc3c(O)c12,mutagenic
+66-81-9,C[C@H]1C[C@@H](C)C(=O)[C@H](C1)[C@@H](O)CC2CC(=O)NC(=O)C2,non-mutagenic
+121-92-6,OC(=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+121-50-6,Nc1cc(ccc1Cl)C(F)(F)F,non-mutagenic
+130536-45-7,C1Cc2ncccc2C3OC13,non-mutagenic
+105-76-0,CCCCOC(=O)\C=C/C(=O)OCCCC,non-mutagenic
+38252-74-3,CCCCN(CCCC(=O)O)N=O,mutagenic
+115084-48-5,Nc1ccc(Cc2cc(O)c(N)c(Cl)c2)cc1Cl,non-mutagenic
+185-75-1,C1COCC2(C1)CO2,mutagenic
+62641-70-7,Cc1c2ccccc2cc3c4C=C[C@@H](O)[C@H](O)c4ccc13,mutagenic
+70883-13-5,CCSc1cc(Cc2ccc(N)c(SCC)c2)ccc1N,mutagenic
+594-70-7,CC(C)(C)[N+](=O)[O-],non-mutagenic
+821-95-4,CCCCCCCCCC=C,non-mutagenic
+NOCAS_M408,CCC[C@@H](C)C[C@H](OC(=O)C[C@@H](CC(=O)O)C(=O)O)[C@H](C[C@H](C)C[C@H](O)CCCC[C@H](O)C[C@H](O)[C@H](C)N)OC(=O)C[C@@H](CC(=O)O)C(=O)O,non-mutagenic
+606-37-1,[O-][N+](=O)c1cc(c2ccccc2c1)[N+](=O)[O-],mutagenic
+29761-21-5,CC(C)CCCCCCCOP(=O)(Oc1ccccc1)Oc2ccccc2,non-mutagenic
+1522-92-5,OCC(CBr)(CBr)CBr,mutagenic
+519-23-3,Cc1c2ccncc2c(C)c3c4ccccc4[nH]c13,mutagenic
+162022-85-7,[O-][n+]1cc2ccncc2cn1,non-mutagenic
+1516-21-8,COc1ccc(cc1)N=O,mutagenic
+333-41-5,CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C,non-mutagenic
+111-69-3,N#CCCCCC#N,non-mutagenic
+1825-21-4,COc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,mutagenic
+115084-47-4,Nc1ccc(Cc2ccc(NO)c(Cl)c2)cc1Cl,mutagenic
+119-27-7,COc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+105052-39-9,COc1ccc2C=C(Oc3cccc1c23)[N+](=O)[O-],mutagenic
+56-57-5,[O-][N+](=O)c1cc[n+]([O-])c2ccccc12,mutagenic
+39515-41-8,CC1(C)C(C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2)C1(C)C,non-mutagenic
+NOCAS_M155,CC(C)OC[C@H]1CO1,mutagenic
+95-49-8,Cc1ccccc1Cl,non-mutagenic
+NOCAS_M510,O[C@@H]1OCC=C2OC(=O)C=C12,non-mutagenic
+104-49-4,O=C=Nc1ccc(cc1)N=C=O,non-mutagenic
+732-11-6,COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O,mutagenic
+112-73-2,CCCCOCCOCCOCCCC,non-mutagenic
+100-69-6,C=Cc1ccccn1,non-mutagenic
+2867-47-2,CN(C)CCOC(=O)C(=C)C,mutagenic
+106532-65-4,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)CCCCl)\c2c1)C(=O)CCCCl,mutagenic
+128753-87-7,COc1cccc2OC3(C)OOC3(C)c12,mutagenic
+156243-39-9,Cc1cnc2cc3nc(N)n(C)c3c(C)c2n1,mutagenic
+98090-89-2,Cc1ccc2Cc3cccc4ccc1c2c34,mutagenic
+146177-60-8,Cc1cnc2c(C)c(C)c3c(nc(N)n3C)c2n1,mutagenic
+63041-76-9,Cc1ccc2c(c1)cc3ccc4cccc5ccc2c3c45,mutagenic
+131862-15-2,CN(C)CCNC(=O)c1cccc2c3ccccc3cnc12,mutagenic
+135577-57-0,Cn1c(N=N#N)nc2ncc(cc12)c3ccccc3,mutagenic
+146795-36-0,[O-][N+](=O)c1cc(cs1)C(=O)Nc2cccc(F)c2,mutagenic
+7166-19-0,[O-][N+](=O)\C(=C\c1ccccc1)\Br,mutagenic
+75-29-6,CC(C)Cl,mutagenic
+64-17-5,CCO,non-mutagenic
+6628-97-3,O=C1C=C(Nc2ccccc2)C(=O)c3ccccc13,mutagenic
+NOCAS_M420,C[C@@H](CC(=O)O)C(=O)O,non-mutagenic
+NOCAS_M278,OC[C@@H]1SCCN1N=O,mutagenic
+5422-34-4,CC(O)C(=O)NCCO,mutagenic
+1705-85-7,Cc1cc2c3ccccc3ccc2c4ccccc14,mutagenic
+66789-82-0,OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)COc3cc(Cl)c(Cl)cc3Cl,non-mutagenic
+99346-47-1,OC1C=Cc2c(cc3ccc4c(O)ccc5ccc2c3c45)C1O,mutagenic
+146177-59-5,Cc1c(C)c2c(nc(N)n2C)c3nccnc13,mutagenic
+111-21-7,CC(=O)OCCOCCOCCOC(=O)C,mutagenic
+78-63-7,CC(C)(C)OOC(C)(C)CCC(C)(C)OOC(C)(C)C,non-mutagenic
+98-29-3,CC(C)(C)c1ccc(O)c(O)c1,non-mutagenic
+91-58-7,Clc1ccc2ccccc2c1,non-mutagenic
+123-66-0,CCCCCC(=O)OCC,non-mutagenic
+78-83-1,CC(C)CO,non-mutagenic
+23815-63-6,NC(CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O,mutagenic
+7151-65-7,CC(=O)N(Cl)c1ccc2c(Cc3ccccc23)c1,mutagenic
+90147-19-6,CCCCOC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+119260-67-2,Nc1ccc(Cc2ccc(N=O)c(Cl)c2)cc1Cl,non-mutagenic
+192-65-4,c1ccc2c(c1)cc3c4ccccc4c5cccc6ccc2c3c56,mutagenic
+333-27-7,COS(=O)(=O)C(F)(F)F,mutagenic
+54-85-3,NNC(=O)c1ccncc1,mutagenic
+83053-57-0,CCOc1cc2C(=O)CCc2c3ccc4ccccc4c13,non-mutagenic
+55256-58-1,COc1c(Cl)ccc2Oc3cc4OC5OC=CC5c4c(OC)c3C(=O)c12,mutagenic
+218-21-3,c1cnc2c(c1)ccc3c4cccnc4ccc23,mutagenic
+2519-30-4,CC(=O)Nc1ccc(c2cc(c(N=Nc3ccc(N=Nc4ccc(cc4)S(=O)(=O)O)c5ccc(cc35)S(=O)(=O)O)c(O)c12)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+NOCAS_M575,C[C@@H](S)C(=O)NCC(=O)O,non-mutagenic
+161221-84-7,COc1cc(C)cc2c(OC(=O)C)c(cc(OC(=O)C)c12)c3c(C)cc4c(OC(=O)C)ccc(OC(=O)C)c4c3OC,non-mutagenic
+3740-52-1,OC(=O)Cc1ccccc1[N+](=O)[O-],mutagenic
+126-27-2,CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc2ccccc2,non-mutagenic
+NOCAS_M11,CCN(CC)CCC[C@@H](C)Nc1c2ccc(Cl)cc2nc3ccc(OC)cc13,mutagenic
+66-27-3,COS(=O)(=O)C,mutagenic
+2429-82-5,Nc1ccc2cc(c(N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5ccc(O)c(c5)C(=O)O)c(O)c2c1)S(=O)(=O)O,mutagenic
+20268-51-3,[O-][N+](=O)c1c2ccccc2cc3c1ccc4ccccc34,non-mutagenic
+16090-02-1,OS(=O)(=O)c1cc(Nc2nc(Nc3ccccc3)nc(n2)N4CCOCC4)ccc1\C=C\c5ccc(Nc6nc(Nc7ccccc7)nc(n6)N8CCOCC8)cc5S(=O)(=O)O,non-mutagenic
+2837-89-0,FC(Cl)C(F)(F)F,non-mutagenic
+139-96-8,CCCCCCCCCCCCOS(=O)(=O)O,non-mutagenic
+89-82-7,C[C@@H]1CCC(=C(C)C)C(=O)C1,non-mutagenic
+128753-86-6,CC(=O)c1cccc2c1OC3(C)OOC23C,mutagenic
+78533-30-9,BrCc1c2ccccc2cc3ccc4ccccc4c13,mutagenic
+107-20-0,ClCC=O,mutagenic
+2589-58-4,CCC(C)Nc1snc2ccccc12,non-mutagenic
+153954-29-1,Cc1cnc2cc(CO)c3c(nc(N)n3C)c2n1,mutagenic
+622-51-5,Cc1ccc(NC(=O)N)cc1,non-mutagenic
+60197-68-4,CC(=O)OC[C@H]1O[C@@H](Oc2cccc3C(=O)c4cccc(O)c4C(=O)c23)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C,mutagenic
+68267-99-2,CN(C(=O)CCCl)c1snc2ccccc12,mutagenic
+2275-23-2,CNC(=O)[C@@H](C)SCCSP(=O)(OC)OC,mutagenic
+32451-61-9,NC(=O)Nc1cccc2cccnc12,non-mutagenic
+189-55-9,c1ccc2c(c1)cc3ccc4cc5ccccc5c6ccc2c3c46,mutagenic
+130933-91-4,OC1C2OC2c3c(ccc4c5C=Cc6cccc(cc34)c56)C1O,mutagenic
+96-47-9,CC1CCCO1,non-mutagenic
+99523-59-8,Cc1ccc2nsc(NC(=O)C(Cl)(Cl)Cl)c2c1,mutagenic
+57-13-6,NC(=O)N,non-mutagenic
+100-02-7,Oc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+NOCAS_M183,C[C@H]1CC(=O)O1,mutagenic
+59-51-8,CSCCC(N)C(=O)O,non-mutagenic
+102791-32-2,[O-][N+](=O)c1ccc2ccc3cccc4C(=O)C(=O)c1c2c34,mutagenic
+115044-41-2,Cc1cnc2ccc3c(nc(NO)n3C)c2n1,mutagenic
+112309-62-3,OC(=O)C=C(C(Cl)Cl)C(Cl)Cl,mutagenic
+24096-53-5,Clc1cc(Cl)cc(c1)N2C(=O)CCC2=O,non-mutagenic
+6931-54-0,CC1(C)C2CCC3(CO3)C1C2,non-mutagenic
+6548-29-4,Nc1c(N=Nc2ccc(cc2Cl)c3ccc(N=Nc4c(N)c(cc5cc(ccc45)S(=O)(=O)O)S(=O)(=O)O)c(Cl)c3)c6ccc(cc6cc1S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+194479-79-3,Nc1c2ccccc2nc3ccc(I)cc13,mutagenic
+60391-92-6,NC(=O)N(CC(=O)O)N=O,non-mutagenic
+57074-51-8,C[C@H]1C[C@H]2OC(=O)C(=C)[C@H]2C[C@@]3(C)[C@H](O)O[C@H](O)C[C@H]13,mutagenic
+646-14-0,CCCCCC[N+](=O)[O-],non-mutagenic
+615-53-2,CCOC(=O)N(C)N=O,mutagenic
+220168-39-8,O=C(ON(OCc1ccccc1)C(=O)c2ccccc2)c3ccccc3,mutagenic
+55936-76-0,COC(=O)c1ccc(cc1)N=Nc2ccc(cc2)N(C)OC(=O)C,mutagenic
+128753-96-8,CC(=O)OCC12OOC1(C)c3ccccc3O2,mutagenic
+88321-09-9,CCOC(=O)C1OC1C(=O)NC(CC(C)C)C(=O)NCCC(C)C,non-mutagenic
+1671-82-5,Cn1ccnc1[N+](=O)[O-],mutagenic
+364-74-9,[O-][N+](=O)c1cc(F)ccc1F,mutagenic
+149127-58-2,CCCN=NC(C)(C)OO,mutagenic
+396-32-7,Fc1ccc2cccnc2c1,mutagenic
+593-60-2,BrC=C,mutagenic
+53198-46-2,CN(N=O)[C@H](OC(=O)C)c1ccccc1,mutagenic
+623-30-3,O=C\C=C/c1occc1,non-mutagenic
+NOCAS_M249,N[C@@H](CCC(=O)NNc1ccccc1)C(=O)O,mutagenic
+97-56-3,Cc1ccccc1N=Nc2ccc(N)c(C)c2,mutagenic
+NOCAS_M497,CCOC(=O)[C@H](SP(=S)(OC)OC)c1ccccc1,non-mutagenic
+5776-39-6,C[n+]1c2ccccc2cc3ccccc13,mutagenic
+25376-45-8,Cc1cc(N)cc(N)c1,non-mutagenic
+3333-52-6,CC(C)(C#N)C(C)(C)C#N,non-mutagenic
+89-87-2,Cc1ccc(c(C)c1)[N+](=O)[O-],mutagenic
+547-58-0,CN(C)c1ccc(cc1)N=Nc2ccc(cc2)S(=O)(=O)O,non-mutagenic
+499-75-2,CC(C)c1ccc(C)c(O)c1,non-mutagenic
+129-43-1,Oc1cccc2C(=O)c3ccccc3C(=O)c12,mutagenic
+1465-25-4,NCCNc1cccc2ccccc12,mutagenic
+NOCAS_M537,C[C@H](CS)[C@@H]1CC[C@@H](C)[C@H](S)C1,non-mutagenic
+4584-49-0,C[C@H](Cl)CN(C)C,mutagenic
+555-03-3,COc1cccc(c1)[N+](=O)[O-],non-mutagenic
+29706-59-0,OCc1c(O)c2C(=O)c3ccccc3C(=O)c2cc1OC4OC(COC5OCC(O)C(O)C5O)C(O)C(O)C4O,mutagenic
+22071-15-4,CC(C(=O)O)c1cccc(c1)C(=O)c2ccccc2,non-mutagenic
+NOCAS_M438,CCOC(=O)C[C@H](S[P@@](=O)(OC)SC)C(=O)OCC,non-mutagenic
+NOCAS_M100,Cc1ccc(cc1C)[C@@](OC(=O)NC2CCCCC2)(C#C)c3ccccc3,mutagenic
+4196-86-5,COCC(COC(=O)c1ccccc1)(COC(=O)c2ccccc2)COC(=O)c3ccccc3,non-mutagenic
+6967-29-9,CCc1cccc(CC)c1NC(=O)CCl,mutagenic
+4359-61-9,CC(=O)N(N)C(=O)C,non-mutagenic
+67730-10-3,Nc1ccc2nc3ccccn3c2n1,mutagenic
+15791-78-3,OCCc1ccc(Nc2ccc(O)c3C(=O)c4c(O)ccc(c4C(=O)c23)[N+](=O)[O-])cc1,mutagenic
+6270-13-9,OCCN(CCO)c1ccc2ccccc2c1,mutagenic
+119-61-9,O=C(c1ccccc1)c2ccccc2,non-mutagenic
+53-03-2,CC12CC(=O)C3C(CCC4=CC(=O)C=CC34C)C1CCC2(O)C(=O)CO,mutagenic
+105801-28-3,ON(C=O)c1ccc(Oc2ccc(Cl)cc2)cc1,mutagenic
+79-21-0,CC(=O)OO,non-mutagenic
+111-96-6,COCCOCCOC,non-mutagenic
+26148-68-5,Nc1ccc2c3ccccc3[nH]c2n1,mutagenic
+1077-28-7,OC(=O)CCCC[C@@H]1CCSS1,non-mutagenic
+31969-03-6,Cc1cccc(N=Nc2c(O)ccc3ccccc23)c1C,non-mutagenic
+35250-53-4,SCCc1cnccn1,non-mutagenic
+720-69-4,Nc1nc(N)nc(n1)c2oc(cc2)[N+](=O)[O-],mutagenic
+4316-73-8,CNCC(=O)O,non-mutagenic
+14448-67-0,CN1\C(=N\N)\Sc2ccccc12,mutagenic
+63019-38-5,Oc1cccc2c1ccc3c4ccccc4ccc23,mutagenic
+859-97-2,CC(CCC(=O)O)C1CCC2C3C(CCC12C)C4(C)CCC(=O)CC4CC3=O,non-mutagenic
+5581-32-8,CC(C)(c1ccc(OCC(O)CO)cc1)c2ccc(OCC(O)CO)cc2,non-mutagenic
+1794-45-2,Clc1ccccc1\C=C\C=O,mutagenic
+1253-84-5,CC(C)CCCC(C)C1CCC2C3CC(O)C4(O)CC(O)CCC4(C)C3CCC12C,mutagenic
+3385-21-5,NC1CCCC(N)C1,non-mutagenic
+113779-16-1,C1=Cc2cc3cccc4c5ccccc5c6ccc1c2c6c34,mutagenic
+75464-11-8,CCCC(=O)C1c2cccc(O)c2C(=O)c3c(O)cccc13,mutagenic
+NOCAS_M520,CC(=C)[C@@H]1CC=C(C)[C@@H](O)C1,non-mutagenic
+2835-39-4,CC(C)CC(=O)OCC=C,non-mutagenic
+43210-67-9,COC(=O)Nc1nc2cc(Sc3ccccc3)ccc2[nH]1,non-mutagenic
+100-11-8,[O-][N+](=O)c1ccc(CBr)cc1,mutagenic
+109380-46-3,CCOC(=O)C(C#N)c1snc2ccc(cc12)[N+](=O)[O-],mutagenic
+1608-51-1,Fc1ccc(\C=C\C(=O)c2ccccc2)cc1,non-mutagenic
+830-96-6,OC(=O)CCc1c[nH]c2ccccc12,non-mutagenic
+6281-32-9,OCc1ccnc2ccccc12,non-mutagenic
+3475-63-6,CN(C)C(=O)N(C)C=O,mutagenic
+7269-60-5,Cn1cnc2c(NO)ncnc12,mutagenic
+85-44-9,O=C1OC(=O)c2ccccc12,non-mutagenic
+74518-94-8,[O-][N+](=O)c1ccc(\C=C\c2ccc(cc2)C#N)cc1,mutagenic
+133550-91-1,OCc1ccc2cccc3c4ccccc4c1c23,non-mutagenic
+87638-04-8,NC(=O)OCC1C(NC(=O)\C(=N/OCC(=O)O)\c2csc(N)n2)C(=O)N1S(=O)(=O)O,non-mutagenic
+133591-35-2,Cc1cc(c(C)c2c3cc(ccc3[nH]c12)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+53330-03-3,NC(CSC(=O)NCCCl)C(=O)O,mutagenic
+3586-69-4,[O-][N+](=O)c1ccc2cc3ccccc3cc2c1,mutagenic
+112-56-1,CCCCOCCOCCSC#N,non-mutagenic
+194-59-2,c1ccc2c(c1)ccc3[nH]c4ccc5ccccc5c4c23,mutagenic
+109-73-9,CCCCN,non-mutagenic
+33611-88-0,[O-][N+](=O)c1cc2cccc3c4ccccc4c(c1[N+](=O)[O-])c23,mutagenic
+16495-13-9,C(OCc1ccccc1)C2CO2,mutagenic
+30235-27-9,Nc1nc(cs1)c2cccnc2,non-mutagenic
+102-16-9,O=C(Cc1ccccc1)OCc2ccccc2,non-mutagenic
+64521-09-1,CN(N=O)C(=O)Oc1ccc(C)c(C)c1C,mutagenic
+93793-83-0,CC(=O)OCC(=O)NCCCOc1cccc(CN2CCCCC2)c1,non-mutagenic
+10353-99-8,[O-][N+](=O)c1ccc2C=Cc3cccc1c23,mutagenic
+6959-48-4,ClCc1cccnc1,mutagenic
+155-09-9,N[C@@H]1C[C@H]1c2ccccc2,non-mutagenic
+316-49-4,Cc1cccc2c1ccc3cc4ccccc4cc23,mutagenic
+100-44-7,ClCc1ccccc1,mutagenic
+126370-97-6,FC(F)(F)c1cccc(CN2C3C2c4ccccc4c5ccccc35)c1,mutagenic
+84736-60-7,ON(C=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+77287-29-7,COC(=O)C(C)Cl,mutagenic
+1668-19-5,CN(C)CC\C=C\1/c2ccccc2COc3ccccc13,non-mutagenic
+NOCAS_M346,C[C@H](CCc1ccccc1)NC[C@@H](O)c2ccc(O)c(c2)C(=O)N,non-mutagenic
+54897-63-1,CCN(CCCC(=O)O)N=O,mutagenic
+21388-97-6,CC(=O)OCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+100-27-6,OCCc1ccc(cc1)[N+](=O)[O-],mutagenic
+107-11-9,NCC=C,non-mutagenic
+42028-27-3,CCc1cc2C(=O)CCc2c3ccc4ccccc4c13,mutagenic
+517-66-8,COc1cc2CC3N(C)CCc4cc5OCOc5c(c34)c2cc1OC,mutagenic
+97467-07-7,C[N+]1=CC=C(CC1)c2ccccc2,mutagenic
+134-31-6,Oc1cccc2cccnc12,mutagenic
+7417-67-6,CN(N=O)C(=O)C,mutagenic
+196-77-0,C1=Cc2c3ccc4cccc5ccc(c6cccc1c26)c3c45,mutagenic
+34244-14-9,Clc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+40321-98-0,CCC(CCC(=O)C)COC(=O)c1ccccc1C(=O)O,non-mutagenic
+134-62-3,CCN(CC)C(=O)c1cccc(C)c1,non-mutagenic
+2379-74-0,Cc1cc(Cl)cc2S\C(=C\3/Sc4cc(Cl)cc(C)c4C3=O)\C(=O)c12,non-mutagenic
+122033-85-6,Cc1ccc(C)c2c3C4OC4C(O)C(O)c3ccc12,mutagenic
+2381-16-0,Cc1ccc2cc3c(ccc4ccccc34)cc2c1,mutagenic
+99-54-7,[O-][N+](=O)c1ccc(Cl)c(Cl)c1,mutagenic
+68941-03-7,Nc1ccc(cc1)N(c2ccc3ccccc3c2)c4ccc5ccccc5c4,non-mutagenic
+118499-61-9,OC1C(O)c2cc3ccc4cccc5ccc(c2C(O)C1S(=O)(=O)O)c3c45,non-mutagenic
+109143-16-0,[O-][N+](=O)c1oc2ccc(cc2c1)N(CCCl)CCCl,mutagenic
+124617-84-1,CCCCON(OC(=O)C)C(=O)c1ccccc1,mutagenic
+224-53-3,c1ccc2c(c1)ccc3cc4ccc5ccccc5c4nc23,mutagenic
+4691-65-0,OC1C(O)C(OC1COP(=O)(O)O)n2cnc3c(O)ncnc23,non-mutagenic
+107-44-8,CC(C)OP(=O)(C)F,non-mutagenic
+1794-84-9,[O-][N+](=O)CCl,mutagenic
+156215-58-6,Cn1c(N)nc2nc3ccccc3cc12,mutagenic
+136-77-6,CCCCCCc1ccc(O)cc1O,non-mutagenic
+102029-81-2,CC(N)C(=O)O,non-mutagenic
+2541-69-7,Cc1c2ccccc2cc3c1ccc4ccccc34,mutagenic
+589-17-3,ClCc1ccc(Br)cc1,non-mutagenic
+106-93-4,BrCCBr,mutagenic
+98-88-4,ClC(=O)c1ccccc1,mutagenic
+94-25-7,CCCCOC(=O)c1ccc(N)cc1,non-mutagenic
+87259-00-5,OC1C=Cc2cc3c(ccc4ccccc34)c(c2C1O)[N+](=O)[O-],mutagenic
+89-69-0,[O-][N+](=O)c1cc(Cl)c(Cl)cc1Cl,mutagenic
+3018-12-0,ClC(Cl)C#N,mutagenic
+574-06-1,CC(=O)OC(C(=O)c1ccccc1)c2ccccc2,non-mutagenic
+56-75-7,OCC(NC(=O)C(Cl)Cl)C(O)c1ccc(cc1)[N+](=O)[O-],non-mutagenic
+528-53-0,Oc1cc(O)c2cc(O)c([o+]c2c1)c3cc(O)c(O)c(O)c3,non-mutagenic
+202345-21-9,Cc1cc2c3ccccc3[nH]c2nc1NO,mutagenic
+NOCAS_M162,O=C(OC[C@H]1CO1)c2cccc(c2)C(=O)OC[C@H]3CO3,mutagenic
+68268-00-8,CN(C(=O)CCCCl)c1snc2ccccc12,non-mutagenic
+63785-42-2,OS(=O)(=O)Oc1cccc2c3ccc4cccc5ccc(cc12)c3c45,non-mutagenic
+49562-28-9,CC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c2ccc(Cl)cc2,non-mutagenic
+634-66-2,Clc1ccc(Cl)c(Cl)c1Cl,non-mutagenic
+98105-99-8,OC(=O)C1=CN(c2ccc(F)cc2)c3cc(N4CCNCC4)c(F)cc3C1=O,non-mutagenic
+298-02-2,CCOP(=S)(OCC)SCSCC,non-mutagenic
+107-70-0,COC(C)(C)CC(=O)C,non-mutagenic
+128350-00-5,CC(\C=C(/C#N)\c1ccc(Cl)c(Cl)c1)C(C(C#N)c2ccc(Cl)c(Cl)c2)c3ccccc3,mutagenic
+84-15-1,c1ccc(cc1)c2ccccc2c3ccccc3,non-mutagenic
+50-45-3,OC(=O)c1cccc(Cl)c1Cl,non-mutagenic
+140-53-4,Clc1ccc(CC#N)cc1,non-mutagenic
+548-62-9,CN(C)c1ccc(cc1)C(=C2C=CC(=[N+](C)C)C=C2)c3ccc(cc3)N(C)C,non-mutagenic
+5802-60-8,NN(Cc1ccccc1)Cc2ccccc2,non-mutagenic
+106532-64-3,CC(C)C(=O)\N=C\1/SN(C(=O)C(C)C)c2ccc(cc12)[N+](=O)[O-],mutagenic
+611-09-6,[O-][N+](=O)c1ccc2NC(=O)C(=O)c2c1,mutagenic
+59-49-4,Oc1oc2ccccc2n1,non-mutagenic
+2358-84-1,CC(=C)C(=O)OCCOCCOC(=O)C(=C)C,non-mutagenic
+98025-31-1,NC(CSC(=C(Cl)Cl)Cl)C(=O)O,mutagenic
+120812-51-3,[O-][N+](=O)c1ccc2c3CCCCc3c4c(ccc5ccc1c2c45)[N+](=O)[O-],mutagenic
+86-88-4,NC(=S)Nc1cccc2ccccc12,mutagenic
+20562-02-1,C[C@H]1CC[C@@H]2[C@@H](C)[C@H]3[C@@H](C[C@H]4[C@@H]5CC=C6C[C@H](CC[C@]6(C)[C@H]5CC[C@]34C)O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O[C@@H]8O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]8O)[C@@H]7O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)N2C1,non-mutagenic
+26049-69-4,CN(C)Nc1nc(cs1)c2oc(cc2)[N+](=O)[O-],mutagenic
+872-05-9,CCCCCCCCC=C,non-mutagenic
+58658-11-0,Nc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,mutagenic
+74-11-3,OC(=O)c1ccc(Cl)cc1,non-mutagenic
+84174-20-9,COc1ccc(CN(C)N=O)cc1,non-mutagenic
+536-33-4,CCc1cc(ccn1)C(=S)N,non-mutagenic
+1528-74-1,[O-][N+](=O)c1ccc(cc1)c2ccc(cc2)[N+](=O)[O-],mutagenic
+508-71-4,CC1(CCC2(C)C(C1)C(=O)CC3C4(C)CCCC23OC4=O)C=C,non-mutagenic
+NOCAS_M261,Cl[C@@H](Br)C#N,mutagenic
+97055-37-3,OC(=O)C(=C(C(Cl)Cl)C(Cl)Cl)Cl,mutagenic
+78967-07-4,COc1ccc(cc1)c2noc(CC(=O)O)c2c3ccc(OC)cc3,non-mutagenic
+NOCAS_M195,[O-][N+](=O)c1ccc2[C@H]3O[C@H]3c4cccc5ccc1c2c45,mutagenic
+58071-32-2,C[C@H](O)[C@H](NC(=O)[C@@H](C)[C@H](O)[C@@H](C)NC(=O)[C@@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@H](N)C(=O)N)[C@@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCNCCCNC(=N)CC7CCC(Cl)CC7,mutagenic
+NOCAS_M143,Cc1c2[C@H]3N[C@H]3c4ccccc4c2cc5ccccc15,mutagenic
+1072-52-2,OCCN1CC1,mutagenic
+5307-14-2,Nc1ccc(N)c(c1)[N+](=O)[O-],mutagenic
+75-69-4,FC(Cl)(Cl)Cl,non-mutagenic
+7661-55-4,Cc1cccc2ncccc12,mutagenic
+145569-98-8,COC(=O)\C(=C/CO)\C=C(/C)\C=C(/C)\C=C\C=C(/C)\C(=O)C12OC1C(O)(CCO)NC2=O,mutagenic
+NOCAS_M241,C(Oc1ccccc1)[C@H]2CO2,mutagenic
+72917-35-2,Cc1cc(c(C)c2c3cc(O)ccc3[nH]c12)[N+](=O)[O-],mutagenic
+100-74-3,CCN1CCOCC1,mutagenic
+126983-61-7,COC1=CC(=O)c2c(nc(C)c3c4c[nH]ccc4nc23)C1=O,mutagenic
+85-41-6,O=C1NC(=O)c2ccccc12,non-mutagenic
+13855-74-8,OCNC(=O)c1ccc(Cl)cc1,non-mutagenic
+145627-69-6,Cc1cc2CCCc2c3ccc4C(O)C(O)C=Cc4c13,mutagenic
+NOCAS_M12,C[C@H](COc1ccccc1)N(CCCl)Cc2ccccc2,mutagenic
+69231-25-0,COC(=O)C1=C(C(C)OC1=O)c2ccccc2,non-mutagenic
+75-88-7,FC(F)(F)CCl,non-mutagenic
+135-68-2,Nc1ccc(cc1)c2ccc(Cl)cc2,mutagenic
+42978-43-8,CC(=O)OCc1c2ccccc2c3ccc4cccc5ccc1c3c45,mutagenic
+80-70-6,CN(C)C(=N)N(C)C,non-mutagenic
+3682-19-7,[O-][N+](=O)c1ccc2C(=O)NNC(=O)c2c1,mutagenic
+129-09-9,O=C1c2ccc3nc(sc3c2C(=O)c4ccc5nc(sc5c14)c6ccccc6)c7ccccc7,non-mutagenic
+37841-91-1,CC1(C)CC2C=C(C=O)C3(CC3(C)C2C1)C=O,mutagenic
+85-86-9,Oc1ccc2ccccc2c1N=Nc3ccc(cc3)N=Nc4ccccc4,mutagenic
+951-78-0,OCC1OC(CC1O)N2C=CC(=O)NC2=O,non-mutagenic
+104535-30-0,Nc1cc(CCO)c(N)c(c1)[N+](=O)[O-],mutagenic
+527-85-5,Cc1ccccc1C(=O)N,non-mutagenic
+17987-99-4,OC(=O)c1c[n+]([O-])c2ccccc2[n+]1[O-],mutagenic
+142438-65-1,COC(=O)C1=C(C)C(OC1=O)C(C)C,mutagenic
+123-42-2,CC(=O)CC(C)(C)O,non-mutagenic
+3577-63-7,Nc1ccc(cc1C(=O)O)S(=O)(=O)O,non-mutagenic
+95741-56-3,Cc1c2c3cccc4cccc(c2c(C)c5ccccc15)c34,mutagenic
+1397-89-3,C[C@@H]1OC(=O)C[C@H](O)C[C@H](O)CC[C@@H](O)[C@H](O)C[C@H](O)C[C@]2(O)C[C@H](O)[C@@H]([C@@H](C[C@@H](O[C@H]3O[C@H](C)[C@H](O)[C@H](N)[C@@H]3O)\C=C\C=C\C=C\C=C\C=C\C=C\C=C\[C@H](C)[C@@H](O)[C@H]1C)O2)C(=O)O,non-mutagenic
+952-97-6,[O-][N+](=O)c1ccc(Sc2ccccc2)cc1,mutagenic
+35572-78-2,Cc1c(N)cc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+2431-50-7,ClCC(Cl)C(=C)Cl,mutagenic
+614-95-9,CCOC(=O)N(CC)N=O,mutagenic
+55706-57-5,Cc1cc(C(=O)O)c2ncccc2c1,non-mutagenic
+2598-99-4,CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC,non-mutagenic
+102-71-6,OCCN(CCO)CCO,non-mutagenic
+1330-78-5,Cc1ccc(O)cc1O[P@](=O)(Oc2ccc(O)cc2C)Oc3c(C)cccc3O,non-mutagenic
+79-15-2,NC(=O)CBr,non-mutagenic
+130040-14-1,CC(=O)N(O)c1ccc(Sc2ccccc2)cc1,mutagenic
+118-52-5,CC1(C)N(Cl)C(=O)N(Cl)C1=O,non-mutagenic
+69655-05-6,OC[C@H]1CC[C@H](O1)n2cnc3c(O)ncnc23,mutagenic
+142382-11-4,OC(=O)c1ccc(\C=C\C(=O)CCC#N)cc1,non-mutagenic
+30835-65-5,Cc1cc2ccccc2c3ccc4C(=O)CCc4c13,mutagenic
+618-46-2,ClC(=O)c1cccc(Cl)c1,mutagenic
+127045-41-4,CC1COc2c3N1C=C(C(=O)O)C(=O)c3cc(F)c2C4(N)CC4,non-mutagenic
+4655-34-9,CC(C)OC(=O)C(=C)C,non-mutagenic
+89-86-1,OC(=O)c1ccc(O)cc1O,non-mutagenic
+371-40-4,Nc1ccc(F)cc1,mutagenic
+111-15-9,CCOCCOC(=O)C,mutagenic
+2322-45-4,CC(C)(Br)C(=O)Nc1ccccc1,non-mutagenic
+79642-25-4,Nn1c2ccccc2c3cnccc13,mutagenic
+185-72-8,C1CC2(CCO1)CO2,mutagenic
+52253-69-7,Nc1nc(cs1)c2ccccc2,mutagenic
+111712-50-6,CC(Br)C(Br)CCl,mutagenic
+6452-71-7,CC(C)NCC(O)COc1ccccc1OCC=C,non-mutagenic
+486-66-8,Oc1ccc(cc1)C2=COc3cc(O)ccc3C2=O,non-mutagenic
+79-34-5,ClC(Cl)C(Cl)Cl,non-mutagenic
+37878-54-9,CCCOc1ccc(N)cc1N,mutagenic
+88-72-2,Cc1ccccc1[N+](=O)[O-],non-mutagenic
+106-47-8,Nc1ccc(Cl)cc1,mutagenic
+91-84-9,COc1ccc(CN(CCN(C)C)c2ccccn2)cc1,non-mutagenic
+98601-01-5,Cc1cc2ccccc2c3cc4C(O)C(O)C=Cc4cc13,mutagenic
+546-88-3,CC(=O)NO,mutagenic
+5447-11-0,CSCCC(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C(=O)O,non-mutagenic
+27208-37-3,C1=Cc2cc3cccc4ccc5ccc1c2c5c34,mutagenic
+20643-71-4,COc1c2ccoc2nc3cc(O)ccc13,non-mutagenic
+7297-53-2,[O-][N+](=O)c1ccc(\C=C\c2cccc(Cl)c2)cc1,mutagenic
+2373-51-5,CSCCl,mutagenic
+3717-88-2,CC1=C(Oc2c(cccc2C1=O)C(=O)OCCN3CCCCC3)c4ccccc4,non-mutagenic
+61702-44-1,Nc1ccc(NOS(=O)(=O)O)cc1Cl,mutagenic
+43192-07-0,Cc1ccc(NO)cc1C,mutagenic
+16664-45-2,Cc1cc(C)c2ccc3ccccc3c2c1,mutagenic
+149573-80-8,ONC(=O)Cc1cn(cn1)N=O,mutagenic
+1187-42-4,N\C(=C(\N)/C#N)\C#N,non-mutagenic
+299-75-2,CS(=O)(=O)OC[C@@H](O)[C@H](O)COS(=O)(=O)C,mutagenic
+104-98-3,OC(=O)\C=C\c1c[nH]cn1,non-mutagenic
+59-14-3,OCC1OC(CC1O)N2C=C(Br)C(=O)NC2=O,non-mutagenic
+134514-27-5,Nc1cc(c(N)cc1F)[N+](=O)[O-],mutagenic
+82389-38-6,CC(=O)Nc1ccc(cc1)C(=O)[C@@H]2O[C@H]2c3ccccc3,mutagenic
+91-17-8,C1CC[C@@H]2CCCC[C@H]2C1,non-mutagenic
+3351-32-4,Cc1ccc2c(ccc3c4ccccc4ccc23)c1,mutagenic
+150446-01-8,Cc1c(\C=N\OCc2ccc(Cl)cc2Cl)c3cc(ccc3n1Cc4ccc(Cl)cc4)[N+](=O)[O-],non-mutagenic
+215245-16-2,CCN(CCC#N)c1cc(NC(=O)C)c(cc1OC)n2nc3c(Br)cc(N)c(Cl)c3n2,mutagenic
+97483-08-4,COP(=O)(OC)Oc1c(Cl)cc(C)cc1Cl,non-mutagenic
+527-62-8,Nc1cc(Cl)cc(Cl)c1O,non-mutagenic
+96383-86-7,O[C@@H]1C=Cc2c(ccc3c2ccc4ccc(O)cc34)[C@H]1O,mutagenic
+22603-58-3,Cc1c(cc(c(N)c1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+86334-95-4,OC1CCC(O)(CN(CC(=O)O)N=O)C(O)C1O,non-mutagenic
+162022-92-6,Clc1nncc2cnccc12,non-mutagenic
+52101-39-0,COC(=O)c1oc(c(c2ccccc2)c1c3ccccc3)[N+](=O)[O-],mutagenic
+610-49-1,Nc1cccc2cc3ccccc3cc12,mutagenic
+1187-84-4,CSCC(N)C(=O)O,non-mutagenic
+5522-43-0,[O-][N+](=O)c1ccc2ccc3cccc4ccc1c2c34,mutagenic
+NOCAS_M428,C[C@@H](O)C(=O)C,non-mutagenic
+512-04-9,CC1CCC2(OC1)OC3CC4C5CC=C6CC(O)CCC6(C)C5CCC4(C)C3C2C,non-mutagenic
+121-91-5,OC(=O)c1cccc(c1)C(=O)O,non-mutagenic
+68140-48-7,CC(C)C1C(C)C(C)(C)c2cc(C)c(cc12)C(=O)C,non-mutagenic
+74-31-7,N(c1ccccc1)c2ccc(Nc3ccccc3)cc2,mutagenic
+524-89-0,COc1c2ccoc2nc3cc4OCOc4cc13,mutagenic
+202-03-9,C1=Cc2c3ccccc3cc4cccc1c24,mutagenic
+155164-65-1,CCCCC(=O)N1N=CC(=C(Cl)C1=O)Cl,non-mutagenic
+830-07-9,[O-][N+](=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+106532-66-5,CCCCC(=O)\N=C\1/SN(C(=O)CCCC)c2ccc(cc12)[N+](=O)[O-],mutagenic
+5307-00-6,COc1cc(N)c(C)cc1N,non-mutagenic
+36791-04-5,NC(=O)c1ncn(n1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O,non-mutagenic
+537-92-8,CC(=O)Nc1cccc(C)c1,non-mutagenic
+162022-90-4,COc1nncc2cnccc12,non-mutagenic
+700-00-5,Cn1cnc2c(N)ncnc12,mutagenic
+161697-04-7,CN(C)c1ccc2nc(C)c(C)nc2c1C,mutagenic
+76113-31-0,[O-][N+](=O)c1cc2c3ccccc3sc2c4ccccc14,mutagenic
+119613-69-3,CCCc1cc2ccccc2c3ccc4C(O)C(O)C5OC5c4c13,non-mutagenic
+15121-84-3,OCCc1ccccc1[N+](=O)[O-],mutagenic
+6138-79-0,Cc1ccc(cc1)\C(=C/CN2CCCC2)\c3ccccn3,non-mutagenic
+98447-35-9,CC(C)C(=O)Nc1snc2cc(Cl)ccc12,non-mutagenic
+NOCAS_M118,C[C@H]1CN1,mutagenic
+611-36-9,Oc1ccnc2ccccc12,non-mutagenic
+92072-10-1,[O-][N+](=O)c1ccc2c3c1cccc3c4cccc5ccc(c2c45)[N+](=O)[O-],mutagenic
+89021-88-5,N[C@@H](CCC(=O)N[C@@H](CS\C(=C(\Cl)/C(=C(Cl)Cl)Cl)\Cl)C(=O)NCC(=O)O)C(=O)O,mutagenic
+121-61-9,CC(=O)Nc1ccc(cc1)S(=O)(=O)N,non-mutagenic
+67019-32-3,CC(=O)Nc1snc2c(Cl)cc(Cl)cc12,non-mutagenic
+110408-52-1,Oc1cccc2ccc3[nH]c4ccc5ccccc5c4c3c12,non-mutagenic
+67-97-0,CC(C)CCC[C@@H](C)[C@@H]1CC[C@@H]2\C(=C/C=C/3\C(CC[C@@H](C3)O)=C)\CCC[C@@]12C,non-mutagenic
+629-14-1,CCOCCOCC,mutagenic
+37962-27-9,[O-][N+](=O)c1oc(\C=C\C(=O)N\N=C\c2oc(cc2)[N+](=O)[O-])cc1,mutagenic
+128946-65-6,CCCCCC(O)\C=C\C=O,non-mutagenic
+2784-94-3,CNc1ccc(cc1[N+](=O)[O-])N(CCO)CCO,mutagenic
+38246-95-6,CCOc1ccc(NO)cc1,mutagenic
+129927-33-9,CCN(CC)CC#CC(C)(C)OC(=O)C(O)(C1CCCCC1)c2ccccc2,non-mutagenic
+464-49-3,CC1(C)[C@H]2CC[C@]1(C)C(=O)C2,non-mutagenic
+NOCAS_M124,O=C(OC[C@H]1CO1)[C@H]2CCCC[C@@H]2C(=O)OC[C@H]3CO3,mutagenic
+82-86-0,O=C1C(=O)c2cccc3cccc1c23,mutagenic
+487-99-0,CC(C)C(O)(C(C)O)C(=O)OCC1CCN2CCCC12,non-mutagenic
+260-94-6,c1ccc2nc3ccccc3cc2c1,mutagenic
+56183-24-5,OC1C(O)c2c(ccc3ccccc23)c4ccccc14,non-mutagenic
+106532-62-1,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)CCCl)\c2c1)C(=O)CCCl,mutagenic
+21802-46-0,Nc1ncnc2c1ncn2C(c3ccccc3)(c4ccccc4)c5ccccc5,mutagenic
+1214-32-0,Nc1ccc2c(Cc3cc(ccc23)[N+](=O)[O-])c1,mutagenic
+98897-14-4,OCNc1ncnc2c1ncn2C3OC(CO)C(O)C3O,mutagenic
+61-76-7,CNC[C@@H](O)c1cccc(O)c1,non-mutagenic
+124076-67-1,NC(CSC(F)(F)C(Cl)Cl)C(=O)O,non-mutagenic
+82-68-8,[O-][N+](=O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,non-mutagenic
+6232-91-3,COc1ccc2[nH]c(N)nc2c1,non-mutagenic
+133830-97-4,CCC1C(=C(C)c2cc(O)ccc12)c3ccc(O)cc3,non-mutagenic
+92-93-3,[O-][N+](=O)c1ccc(cc1)c2ccccc2,mutagenic
+23445-00-3,COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c3C(=O)c4c(O)ccc(O)c4Oc3c1,mutagenic
+1146-04-9,CC1=C2C(O)C(C)(C)C=C2C(=O)C(C)(O)C13CC3,mutagenic
+106400-44-6,NC(CCS\C(=C\Cl)\Cl)C(=O)O,mutagenic
+75584-89-3,CCOC(=O)C[n+]1csc2ccccc12,non-mutagenic
+1163-05-9,[O-][n+]1c2ccc3ccccc3c2cc4c5ccccc5ccc14,non-mutagenic
+105-58-8,CCOC(=O)OCC,non-mutagenic
+153-98-0,NCCc1c[nH]c2ccc(O)cc12,non-mutagenic
+6533-68-2,CN1[C@@H]2C[C@@H](C[C@H]1[C@H]3O[C@@H]23)OC(=O)[C@@H](CO)c4ccccc4,non-mutagenic
+126222-34-2,CC(C)(C)S(=O)(=O)CC(Cc1ccccc1)C(=O)NC(Cc2c[nH]cn2)C(=O)NC(CC3CCCCC3)C(O)C(O)C4CC4,non-mutagenic
+55557-00-1,O=NN1CCCN(CC1)N=O,mutagenic
+95050-14-9,[O-][N+](=O)c1cccc2c3cc4cccc5ccc6ccc(c12)c3c6c45,mutagenic
+4584-57-0,CN(C)c1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+114607-46-4,OC(=O)C(=O)Nc1cccc(c1)c2nn[nH]n2,non-mutagenic
+30517-66-9,Oc1cccc2Oc3c4C5CCOC5Oc4cc(O)c3C(=O)c12,non-mutagenic
+146795-28-0,COc1ccccc1NC(=O)c2csc(c2)[N+](=O)[O-],mutagenic
+202-33-5,C1=Cc2c3ccc4ccccc4c3cc5cccc1c25,mutagenic
+645-12-5,OC(=O)c1oc(cc1)[N+](=O)[O-],mutagenic
+NOCAS_M286,C1O[C@H]1c2ccccc2,mutagenic
+13365-37-2,CN(C)CCCNc1c2ccccc2nc3ccccc13,mutagenic
+1456-28-6,CC1CN(CC(C)O1)N=O,mutagenic
+29128-23-2,[O-][N+](=O)c1cc(c(c2ccccc2)c(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+1613-37-2,[O-][n+]1cccc2ccccc12,non-mutagenic
+19770-52-6,C1=Cc2c3ccccc3cc4cc5ccccc5c1c24,mutagenic
+76-14-2,FC(F)(Cl)C(F)(F)Cl,non-mutagenic
+13849-08-6,CC(C)(O)C1Cc2cc3C=CC(=O)Oc3cc2O1,mutagenic
+24245-99-6,[O-][N+](=O)c1ccc2nscc2c1,mutagenic
+120-40-1,CCCCCCCCCCCC(=O)N(CCO)CCO,non-mutagenic
+145241-75-4,Fc1cc(F)c2ncccc2c1,mutagenic
+101821-44-7,NC(=N)c1cc2ccc(Br)cc2[nH]1,non-mutagenic
+621-31-8,CCNc1cccc(O)c1,mutagenic
+5831-16-3,C[C@@H]1CCc2c1cc(C)c3c2ccc4ccccc34,mutagenic
+128753-88-8,COc1cccc2c1OC3(C)OOC23C,mutagenic
+6691-68-5,CN(C)CCCNc1c2ccccc2nc3c(cccc13)[N+](=O)[O-],mutagenic
+NOCAS_M99,CC[C@@]12O[C@]1(C(=O)OC)C(=O)N[C@]2(C)O,mutagenic
+77314-23-9,Cn1c(NO)nc2c3cccnc3ccc12,mutagenic
+59-31-4,Oc1ccc2ccccc2n1,non-mutagenic
+67199-66-0,Nc1ccc2N=C3N(Cc2c1)C(=O)c4ccccc34,mutagenic
+2835-98-5,Cc1ccc(N)c(O)c1,mutagenic
+73-24-5,Nc1[nH]cnc2ncnc12,mutagenic
+496-72-0,Cc1ccc(N)c(N)c1,mutagenic
+NOCAS_M234,O1[C@@H]2[C@H]1c3cc4c(ccc5ccccc45)cc3c6ccccc26,mutagenic
+1070-70-8,C=CC(=O)OCCCCOC(=O)C=C,non-mutagenic
+13154-57-9,CC(C)(C)OOC1(C)C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C,non-mutagenic
+5208-87-7,O[C@H](C=C)c1ccc2OCOc2c1,non-mutagenic
+39013-93-9,CCN(CCCl)CCCNc1c2ccccc2nc3c1ccc4cccnc34,mutagenic
+112077-92-6,CC(=O)ON(C(=O)C)c1ccccc1C,non-mutagenic
+124-64-1,OCP(CO)(CO)CO,non-mutagenic
+20562-03-2,CC1CCC2C(C)C3C(CC4C5CC=C6CC(CCC6(C)C5CCC34C)OC7OC(CO)C(OC8OC(C)C(O)C(O)C8O)C(O)C7OC9OC(C)C(O)C(O)C9O)N2C1,non-mutagenic
+481-49-2,COc1ccc2C[C@H]3N(C)CCc4cc(OC)c(Oc5c6OCOc6cc7CCN(C)[C@@H](Cc8ccc(Oc1c2)cc8)c57)cc34,mutagenic
+462-60-2,NC(=O)NCC(=O)O,non-mutagenic
+109-83-1,CNCCO,non-mutagenic
+1709-39-3,CCN(CC)S(=O)(=O)c1ccc(N)cc1,non-mutagenic
+54484-91-2,CC[N+]([O-])(CC)CCn1nc2c3ccc(Cl)cc3Sc4c(CO)ccc1c24,mutagenic
+97-54-1,COc1cc(\C=C/C)ccc1O,non-mutagenic
+616-40-0,CCN(N)CC,non-mutagenic
+60262-87-5,OC1C(Oc2ccc3cc4ccc5cccc6ccc(c3c2)c4c56)OC(C(O)C1O)C(=O)O,non-mutagenic
+1633-83-6,O=S1(=O)CCCCO1,mutagenic
+57309-38-3,CC1(N(O)c2ccccc2/C/1=N\c3ccccc3)c4ccccc4,non-mutagenic
+112653-29-9,OCC(CO)N[C@@H]1C[C@](O)(CO)[C@H](O)[C@@H](O)[C@@H]1O,non-mutagenic
+120-78-5,S(Sc1nc2ccccc2s1)c3nc4ccccc4s3,mutagenic
+NOCAS_M120,C[C@H]1C[C@H](OC(=O)C)O[C@H](C)O1,mutagenic
+13088-34-1,ClC(=C1OC(=O)C=C1)Cl,mutagenic
+51-30-9,CC(C)NCC(O)c1ccc(O)c(O)c1,non-mutagenic
+17700-09-3,[O-][N+](=O)c1ccc(Cl)c(Cl)c1Cl,mutagenic
+29082-75-5,ClC(=Cc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl)Cl,non-mutagenic
+67-21-0,CCSCC[C@H](N)C(=O)O,non-mutagenic
+36504-67-3,C1Cc2c(cc3ccc4cccc5ccc2c3c45)[C@@H]6O[C@H]16,mutagenic
+97055-38-4,COC1OC(=O)C(=C1C(Cl)Cl)Cl,mutagenic
+65445-61-6,ClC1CCN(CC1)N=O,mutagenic
+118-96-7,Cc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+5667-20-9,ONc1[nH]cnc2ncnc12,mutagenic
+84-66-2,CCOC(=O)c1ccccc1C(=O)OCC,non-mutagenic
+116374-65-3,CN(C)CCCNc1c2ccccc2nc3c(Cl)ccc(c13)[N+](=O)[O-],mutagenic
+24496-65-9,c1ccc2c(c1)cc3ccc4cccc5ncc2c3c45,mutagenic
+3397-62-4,Nc1nc(N)nc(Cl)n1,non-mutagenic
+134-32-7,Nc1cccc2ccccc12,mutagenic
+15110-74-4,[O-][N+](=O)c1ccc2c(Cc3cccc(c23)[N+](=O)[O-])c1,mutagenic
+501-53-1,ClC(=O)OCc1ccccc1,non-mutagenic
+605-94-7,COC1=C(OC)C(=O)C(=CC1=O)C,non-mutagenic
+157996-59-3,Nc1c2ccccc2nc3ccc(Br)cc13,mutagenic
+72-33-3,COc1ccc2C3CCC4(C)C(CCC4(O)C#C)C3CCc2c1,non-mutagenic
+13177-29-2,[O-][N+](=O)c1cc2c3ccccc3c4cccc(c1)c24,mutagenic
+29916-56-1,[O-][N+](=O)C1CCCC1,mutagenic
+483-65-8,CC(C)c1ccc2c(ccc3c(C)cccc23)c1,non-mutagenic
+81424-67-1,CNC(=O)ON(C(=O)C)C(=O)NC,mutagenic
+434-13-9,C[C@@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,non-mutagenic
+66-75-1,Oc1ncc(N(CCCl)CCCl)c(O)n1,mutagenic
+112-70-9,CCCCCCCCCCCCCO,non-mutagenic
+162022-89-1,NNc1nncc2ccncc12,mutagenic
+102-13-6,CC(C)COC(=O)Cc1ccccc1,non-mutagenic
+108171-26-2,CCCCCCCCCCCl,non-mutagenic
+14191-22-1,[O-][N+](=O)c1ccc2c(c1)[nH]c3ccccc23,mutagenic
+26741-53-7,CC(C)(C)c1ccc(OP2OCC3(COP(Oc4ccc(cc4C(C)(C)C)C(C)(C)C)OC3)CO2)c(c1)C(C)(C)C,non-mutagenic
+15386-58-0,Clc1ccc(cc1Cl)N2C(=O)CCC2=O,non-mutagenic
+75-36-5,CC(=O)Cl,non-mutagenic
+2402-77-9,Clc1cccnc1Cl,mutagenic
+33229-34-4,OCCNc1ccc(cc1[N+](=O)[O-])N(CCO)CCO,mutagenic
+518-82-1,Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1,mutagenic
+523-66-0,COc1ccc2c(OC)c3ccoc3nc2c1,mutagenic
+22608-53-3,COP(=O)(SC)SC,non-mutagenic
+111-77-3,COCCOCCO,non-mutagenic
+771-97-1,Nc1cc2ccccc2cc1N,mutagenic
+56257-59-1,Oc1ccc2c3C(C4OC4C(=O)c13)C5(O)CCC(=O)c6c(O)ccc2c56,mutagenic
+77-81-6,CCOP(=O)(C#N)N(C)C,non-mutagenic
+345667-02-9,CC(C)(C)c1ccc(cc1)c2ccc(NO)cc2,mutagenic
+115-86-6,O=P(Oc1ccccc1)(Oc2ccccc2)Oc3ccccc3,non-mutagenic
+NOCAS_M201,OC[C@H]1CO1,mutagenic
+610-15-1,NC(=O)c1ccccc1[N+](=O)[O-],mutagenic
+57011-48-0,OC(CN=N#N)CN=N#N,mutagenic
+194590-84-6,COCCN(CCOC)c1cc(NC(=O)C)c(cc1OC)n2nc3c(Br)cc(N)c(Cl)c3n2,mutagenic
+159092-84-9,[O-][N+](=O)c1ccc2cc(c3ccc(cc3c2c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+939-99-1,FC(F)(F)c1ccc(CCl)cc1,non-mutagenic
+70-30-4,Oc1c(Cl)cc(Cl)c(Cl)c1Cc2c(O)c(Cl)cc(Cl)c2Cl,non-mutagenic
+28622-66-4,OC1C=Cc2c(ccc3ccccc23)C1O,mutagenic
+20268-52-4,Clc1c2ccccc2cc3c1ccc4ccccc34,mutagenic
+14064-58-5,COc1cccc(\C=C\c2ccc(cc2)[N+](=O)[O-])c1,mutagenic
+128349-98-4,CC(\C=C(\C#N)/c1ccc(Br)cc1)C(C(C#N)c2ccc(Br)cc2)c3ccccc3,non-mutagenic
+5709-68-2,Cn1c(nc2ccccc12)[N+](=O)[O-],mutagenic
+NOCAS_M283,BrC[C@H]1CO1,mutagenic
+68268-12-2,CCN(C(=O)CCCCl)c1snc2ccccc12,non-mutagenic
+98499-59-3,CSCNc1ccccc1,mutagenic
+134998-77-9,[O-][N+](=O)c1cc2cccc3c4ccccc4c5cccc1c5c23,mutagenic
+627-11-2,ClCCOC(=O)Cl,non-mutagenic
+67019-22-1,CC(C)C(=O)Nc1snc2ccccc12,non-mutagenic
+77376-01-3,CC(=O)OCc1ccccc1[N+](=O)[O-],non-mutagenic
+7227-91-0,CN(C)N=Nc1ccccc1,mutagenic
+2578-75-8,CC(=O)Nc1nnc(s1)c2oc(cc2)[N+](=O)[O-],mutagenic
+82389-34-2,O=C(C1OC1c2ccc(cc2)c3ccccc3)c4ccccc4,non-mutagenic
+6428-94-0,Oc1ccc(N=Nc2ccc(cc2)[N+](=O)[O-])c(O)c1,non-mutagenic
+38848-76-9,CCCCCCCCCCCCCC(=O)[N-][N+](C)(C)CC(C)O,non-mutagenic
+115664-51-2,Oc1ccc2ccc3ccc(c4c5ccccc5c1c2c34)[N+](=O)[O-],mutagenic
+55520-40-6,NC(Cc1ccc(O)cc1)C(=O)O,non-mutagenic
+77109-49-0,COC(=O)C(CSCCBr)NC(=O)C,mutagenic
+135-73-9,BrCC(=O)c1ccc(cc1)c2ccccc2,mutagenic
+19213-10-6,CC(=O)CC(=O)Nc1ccc(O)cc1,non-mutagenic
+86854-03-7,O=C1c2ccccc2c3ccc4ccc5ccccc5c4c13,non-mutagenic
+79748-81-5,COC(=O)\C(=C\C)\C=C(/C)\C=C(/C)\C=C\C=C(/C)\C(=O)[C@@]12O[C@@H]1[C@](O)(CCO)NC2=O,mutagenic
+123098-37-3,CC(=O)N1CNC(=O)N(C(=O)C)C1=O,non-mutagenic
+61477-94-9,CC1CCCC(C)N1CCCC(O)(c2ccccc2)c3ccccn3,non-mutagenic
+54567-09-8,OCCN(CCO)c1ccc(cc1)N=Nc2ccc(cc2C#N)[N+](=O)[O-],mutagenic
+1088-11-5,Clc1ccc2NC(=O)CN=C(c3ccccc3)c2c1,non-mutagenic
+13360-61-7,CCCCCCCCCCCCCC=C,non-mutagenic
+90745-27-0,Cc1cccc2cccc(c12)[N+](=O)[O-],mutagenic
+142-46-1,NC(=S)NNC(=S)N,non-mutagenic
+6530-27-4,ONc1ccc(cc1)N=Nc2ccccc2,mutagenic
+NOCAS_M259,CC(C)(C)CCCCCC(=O)OC[C@H]1CO1,mutagenic
+134-58-7,Nc1nc(O)c2[nH]nnc2n1,non-mutagenic
+59405-72-0,CCCCOc1ccc(cn1)N=Nc2ccc(cc2)N(CC)CC,mutagenic
+98447-34-8,CCCC(=O)Nc1snc2cc(Cl)ccc12,non-mutagenic
+115314-17-5,[O-][N+](=O)c1cccc(c1)S(=O)(=O)OC[C@H]2CO2,mutagenic
+7300-59-6,NC(CCC(=O)Nc1ccc(cc1)[N+](=O)[O-])C(=O)O,non-mutagenic
+478-43-3,OC(=O)c1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1,mutagenic
+110-54-3,CCCCCC,non-mutagenic
+58718-48-2,[O-][N+](=O)c1cccc2nc3cccc(c3nc12)[N+](=O)[O-],mutagenic
+103393-72-2,ClCc1ccc2c3cccc4cccc(c2c1)c34,mutagenic
+598-38-9,OCC(Cl)Cl,mutagenic
+159714-86-0,CCc1c2C3NC3c4ccccc4c2cc5ccccc15,mutagenic
+92-31-9,CN(C)c1ccc2nc3cc(C)c(N)cc3[s+]c2c1,mutagenic
+108529-37-9,CC(=O)Nc1nc2c3cccnc3ccc2n1C,mutagenic
+78-59-1,CC1=CC(=O)CC(C)(C)C1,non-mutagenic
+6382-01-0,N[C@@H](CCC(=O)O)C(=O)O,non-mutagenic
+22089-22-1,ClCCN(CCCl)P1(=O)OCCCN1CCCl,mutagenic
+18234-46-3,CC(=O)OCc1cocc2c(C=O)ccc12,mutagenic
+111712-51-7,CC(C)(Br)C(Br)CCl,non-mutagenic
+32959-60-7,Cc1ccccc1c2oc3ccccc3n2,non-mutagenic
+52-28-8,COc1ccc2C[C@@H]3[C@@H]4C=C[C@H](O)[C@H]5Oc1c2[C@]45CCN3C,non-mutagenic
+937-40-6,CN(Cc1ccccc1)N=O,mutagenic
+NOCAS_M173,[O-][N+](=O)c1ccc2ccc3cccc4[C@H]5O[C@H]5c1c2c34,mutagenic
+42794-87-6,Nc1c(F)cc(cc1F)c2cc(F)c(N)c(F)c2,mutagenic
+85-82-5,Cc1cc(C)cc(c1)N=Nc2c(O)ccc3ccccc23,non-mutagenic
+77191-36-7,Cc1cccc(C)c1NC(=O)CN2CCCC2=O,non-mutagenic
+NOCAS_M381,CC(=CCC[C@@](C)(O)C=C)C,non-mutagenic
+91575-28-9,CC(=O)Nc1ccc(Cc2ccc(N)c(Cl)c2)cc1Cl,mutagenic
+2221-41-2,COc1ccc2nc3occc3c(OC)c2c1,mutagenic
+22008-60-2,CSCCC(NC=O)C(=O)NC(Cc1ccccc1)C(=O)O,non-mutagenic
+53-70-3,c1ccc2c(c1)ccc3cc4c(ccc5ccccc45)cc23,mutagenic
+105708-79-0,CC(=O)OCc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+113163-23-8,C1Cc2c(ccc3cccnc23)C4OC14,non-mutagenic
+151-50-8,[C-]#N,non-mutagenic
+83-66-9,COc1c(c(C)c(cc1C(C)(C)C)[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+6473-13-8,Nc1ccc(N=Nc2ccc3cc(c(N=Nc4ccc(Nc5ccc(cc5S(=O)(=O)O)N=Nc6c(O)c7cc(ccc7cc6S(=O)(=O)O)N=Nc8ccc(N)cc8N)cc4)c(O)c3c2)S(=O)(=O)O)c(N)c1,mutagenic
+101126-65-2,[O-][N+](=O)c1c(Cl)c(Cl)c2Oc3c(Cl)c(Cl)ccc3Oc2c1Cl,mutagenic
+32534-81-9,Brc1ccc(Oc2cc(Br)c(Br)cc2Br)c(Br)c1,non-mutagenic
+612-22-6,CCc1ccccc1[N+](=O)[O-],non-mutagenic
+2912-62-1,ClC(C(=O)Cl)c1ccccc1,mutagenic
+1197-55-3,Nc1ccc(CC(=O)O)cc1,mutagenic
+13889-92-4,CCCSC(=O)Cl,mutagenic
+4245-76-5,CNC(=N)N[N+](=O)[O-],mutagenic
+1934-20-9,Oc1ccc2cc(ccc2c1N=Nc3ccccc3)S(=O)(=O)O,non-mutagenic
+24279-91-2,COC(COC(=O)N)C1=C(N2CC2)C(=O)C(=C(N3CC3)C1=O)C,mutagenic
+128753-95-7,COCC12OOC1(C)c3ccccc3O2,mutagenic
+126420-93-7,Brc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,mutagenic
+110-88-3,C1OCOCO1,non-mutagenic
+7085-55-4,CC1OC(OCC2OC(OC3=C(Oc4cc(OCCO)cc(O)c4C3=O)c5ccc(OCCO)c(OCCO)c5)C(O)C(O)C2O)C(O)C(O)C1O,non-mutagenic
+63018-94-0,Cc1ccc2c(C)c3ccccc3c(C)c2c1,mutagenic
+14346-19-1,Nc1snc2ccc(cc12)[N+](=O)[O-],mutagenic
+81407-76-3,C\C=C\C1=CC(=O)C23CC2C(C)(C)OC3(O)C1=O,mutagenic
+NOCAS_M470,FC(F)(F)[C@H](Cl)Br,non-mutagenic
+112-24-3,NCCNCCNCCN,mutagenic
+60-11-7,CN(C)c1ccc(cc1)N=Nc2ccccc2,mutagenic
+5786-21-0,CN1CCN(CC1)C2=Nc3cc(Cl)ccc3Nc4ccccc24,non-mutagenic
+NOCAS_M288,C=CCCCC[C@H]1CO1,mutagenic
+109-76-2,NCCCN,non-mutagenic
+62690-96-4,C1CC=C2C(C1)CCc3ccccc23,mutagenic
+616-72-8,Cc1cc(C)c(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+612-12-4,ClCc1ccccc1CCl,non-mutagenic
+111380-10-0,Cn1cnc(c1c2ccccc2)[N+](=O)[O-],non-mutagenic
+4612-63-9,Cc1cc2Cc3ccccc3c2cc1C,non-mutagenic
+2508-20-5,O=Nc1ccc2c(Cc3ccccc23)c1,mutagenic
+4947-27-7,Cc1ccc2C(=O)c3ccccc3C(=O)c2c1Nc4ccccc4,mutagenic
+101-80-4,Nc1ccc(Oc2ccc(N)cc2)cc1,mutagenic
+81-25-4,CC(CCC(=O)O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C,mutagenic
+13107-39-6,Cc1ccc(cc1)[C@@H]2CO2,mutagenic
+81-63-0,Oc1c2C(=N)CCC(=N)c2c(O)c3ccccc13,mutagenic
+6385-62-2,C1C[n+]2ccccc2c3cccc[n+]13,non-mutagenic
+59-67-6,OC(=O)c1cccnc1,non-mutagenic
+2303-16-4,CC(C)N(C(C)C)C(=O)SC\C(=C\Cl)\Cl,mutagenic
+37571-88-3,OC1C(O)c2cc3ccccc3c4ccc5cccc1c5c24,mutagenic
+115453-71-9,NC(CS\C=C\Cl)C(=O)O,mutagenic
+37574-48-4,Oc1cc2cc3ccccc3c4ccc5cccc1c5c24,mutagenic
+1445-69-8,O=C1NNC(=O)c2ccccc12,non-mutagenic
+17024-18-9,[O-][N+](=O)c1ccc2c(ccc3ccccc23)c1,mutagenic
+548-42-5,CN1CC(=C[C@@H]2[C@H]1Cc3c[nH]c4cccc2c34)C,mutagenic
+99520-58-8,Oc1ccc2c3ccc4ccc5cccc6cc(c2c1)c3c4c56,mutagenic
+51868-46-3,COc1cc(N=Nc2c(Br)cc(cc2[N+](=O)[O-])[N+](=O)[O-])c(NC(=O)C)cc1N(CC=C)CC=C,mutagenic
+92-84-2,N1c2ccccc2Sc3ccccc13,non-mutagenic
+193-54-4,C1=Cc2ccc3c4ccccc4c5ccc1c2c35,mutagenic
+53693-66-6,CCN(CC)c1ccc(cc1)c2ccc(cc2)c3ccc(cc3)N(CC)CC,mutagenic
+224-42-0,c1ccc2c(c1)ccc3nc4ccc5ccccc5c4cc23,mutagenic
+586-78-7,[O-][N+](=O)c1ccc(Br)cc1,mutagenic
+107-06-2,ClCCCl,mutagenic
+17070-45-0,COc1ccc2nc3cc(Cl)ccc3c(NCCCNCCCl)c2c1,mutagenic
+43218-55-9,CCN(CC)CCn1nc2ccc(C)c3c4ccc(Cl)cc4Sc1c23,mutagenic
+86640-16-6,COc1cc2nc3ccccc3c(O)c2cc1OC,mutagenic
+215226-71-4,C\C(=C(\Cl)/C(=O)O)\C=O,mutagenic
+103-76-4,OCCN1CCNCC1,non-mutagenic
+316-14-3,Cc1cc2ccccc2c3cc4ccccc4cc13,mutagenic
+52748-34-2,O=CC1C=COC=C1,non-mutagenic
+758-17-8,CN(N)C=O,non-mutagenic
+619-80-7,NC(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+107-92-6,CCCC(=O)O,non-mutagenic
+68-26-8,C\C(=C\CO)\C=C/C=C(/C)\C=C/C1=C(C)CCCC1(C)C,mutagenic
+2611-82-7,Oc1ccc2cc(cc(c2c1N=Nc3ccc(c4ccccc34)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+61166-04-9,Cn1c2ccccc2c3cc(N)ccc13,mutagenic
+123-77-3,NC(=O)N=NC(=O)N,mutagenic
+594-72-9,CC(Cl)(Cl)[N+](=O)[O-],mutagenic
+1955-45-9,CC1(C)COC1=O,mutagenic
+59-30-3,Nc1nc(O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)cnc2n1,non-mutagenic
+97-02-9,Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+112-57-2,NCCNCCNCCNCCN,mutagenic
+97284-34-9,Oc1ncc2ccc3cccc4ccc1c2c34,non-mutagenic
+4648-33-3,COc1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+131862-21-0,CN(C)CCNC(=O)c1cccn2cc(nc12)c3ccccc3,mutagenic
+72273-04-2,C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](CC[C@]34C)OC(=O)COc5ccc(cc5)N(CCCl)CCCl)[C@@H]1CCC(=O)N2,mutagenic
+81-07-2,O=C1NS(=O)(=O)c2ccccc12,non-mutagenic
+4426-50-0,C[C@H]1CCOS(=O)(=O)O1,mutagenic
+146795-38-2,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccc(Cl)cc2,mutagenic
+NOCAS_M491,CCCC[C@@H](CC)COC(=O)CCCCC(=O)OC[C@H](CC)CCCC,non-mutagenic
+51576-10-4,CC(=O)OC12CCC3[C@](CCC4[C@@]3(C)CCC[C@@]4(C)C(=O)O)(CC1=C)C2,non-mutagenic
+613-65-0,CN(C)c1ccc(cc1)N=Nc2ccc3ccccc3c2,mutagenic
+3031-73-0,COO,mutagenic
+NOCAS_M317,N[C@@H](CSCc1ccccc1)C(=O)O,non-mutagenic
+9006-42-2,SC(=N\C=C\N=C(S)S)S,non-mutagenic
+88266-67-5,C[C@@H](O)[C@H](NC(=O)[C@@H](C)[C@H](O)[C@H](C)NC(=O)[C@@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(=O)N)NC[C@H](N)C(=O)N)[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@@H]3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCN(C)CCC(N(C)c7ccc(OCc8ccccc8)c(OCc9ccccc9)c7)N(C)c%10ccc(OCc%11ccccc%11)c(OCc%12ccccc%12)c%10,mutagenic
+24325-70-0,Cc1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+59820-43-8,OCCN(CCO)c1ccc(cc1O)[N+](=O)[O-],mutagenic
+69657-88-1,CN(C)c1ccc(N(C)C)c2C(=O)c3c(O)ccc(O)c3C(=O)c12,mutagenic
+138805-31-9,CC(=O)Nc1cc(ccc1C)N=Nc2ccc(C)c(NC(=O)C)c2,non-mutagenic
+115781-41-4,Cn1c(NS(=O)(=O)O)nc2c3nc(CO)cnc3ccc12,non-mutagenic
+16423-19-1,CC1CCCC2(C)CCCCC12O,non-mutagenic
+6041-94-7,Oc1c(cc2ccccc2c1N=Nc3cc(Cl)ccc3Cl)C(=O)Nc4ccccc4,mutagenic
+23045-12-7,Cc1ccc2nc3ccccc3c(N)c2c1,mutagenic
+146177-63-1,Cn1c(N)nc2c1ccc3nc(c4ccccc4)c(nc23)c5ccccc5,non-mutagenic
+76-38-0,COC(F)(F)C(Cl)Cl,non-mutagenic
+97931-39-0,[O-][N+](=O)c1c2CCc3cccc4ccc(c5ccccc15)c2c34,mutagenic
+298-12-4,OC(=O)C=O,mutagenic
+14861-17-7,Nc1ccc(Oc2ccc(Cl)cc2Cl)cc1,mutagenic
+1338-23-4,CC(=O)CCOOCCC(=O)C,non-mutagenic
+519-73-3,c1ccc(cc1)C(c2ccccc2)c3ccccc3,non-mutagenic
+4097-22-7,Nc1ncnc2c1ncn2[C@@H]3CC[C@H](CO)O3,mutagenic
+72782-13-9,CN(Cc1ccc(cc1)C(=O)O)N=O,non-mutagenic
+18810-04-3,NC(CCCCNCC(N)C(=O)O)C(=O)O,non-mutagenic
+96910-71-3,CC1(C)CC2C3(C)CC3(C=O)C(=CC2(O)C1)C=O,mutagenic
+90-13-1,Clc1cccc2ccccc12,mutagenic
+366-70-1,CNNCc1ccc(cc1)C(=O)NC(C)C,non-mutagenic
+59702-31-7,CCN1CCNC(=O)C1=O,non-mutagenic
+86-57-7,[O-][N+](=O)c1cccc2ccccc12,mutagenic
+555-68-0,OC(=O)\C=C\c1cccc(c1)[N+](=O)[O-],mutagenic
+87812-99-5,[O-][N+](=O)c1cccc2oc3ccccc3c12,mutagenic
+58-55-9,CN1C(=O)N(C)c2[nH]cnc2C1=O,non-mutagenic
+33685-60-8,[O-][N+](=O)c1c2ccccc2c(c3ccccc13)[N+](=O)[O-],non-mutagenic
+571-60-8,Oc1ccc(O)c2ccccc12,mutagenic
+62-73-7,COP(=O)(OC)OC=C(Cl)Cl,mutagenic
+121-54-0,CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1,non-mutagenic
+191-26-4,c1cc2ccc3cc4cccc5ccc6cc(c1)c2c3c6c45,mutagenic
+142184-78-9,O1C2C3OC3c4ncccc4C12,non-mutagenic
+94-13-3,CCCOC(=O)c1ccc(O)cc1,non-mutagenic
+50700-49-7,CC(=O)N=C1C=CC(=O)C=C1,non-mutagenic
+811-97-2,FCC(F)(F)F,non-mutagenic
+116-71-2,O=C1c2ccccc2c3ccc4c5ccc6c7ccccc7C(=O)c8ccc(c9ccc1c3c49)c5c68,mutagenic
+626-43-7,Nc1cc(Cl)cc(Cl)c1,non-mutagenic
+14098-44-3,C1COCCOc2ccccc2OCCOCCO1,non-mutagenic
+59282-34-7,COc1cc(c(O)c(c1)C(C)(C)C)[N+](=O)[O-],non-mutagenic
+31430-15-6,COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3ccc(F)cc3,non-mutagenic
+29752-43-0,COc1cc(O)c2C(=O)OC3(C)CC(O)C(O)C=C3c2c1,non-mutagenic
+117661-13-9,[O-][N+]1=C2C=CC(=O)C=C2\C(=N/c3ccccc3)\C1(c4ccccc4)c5ccccc5,non-mutagenic
+125974-06-3,OC1OC(=O)C=C1CCl,mutagenic
+173216-43-8,CC(CCN=N#N)c1ccccc1,mutagenic
+19315-64-1,CCOc1ccc(cc1)N(O)C(=O)C,mutagenic
+56355-17-0,CC(C(=O)O)c1ccc(Oc2nccs2)cc1,non-mutagenic
+79-09-4,CCC(=O)O,non-mutagenic
+73747-10-1,CCOC(=O)c1ccc(cc1)N(O)C=O,non-mutagenic
+542-85-8,CCN=C=S,non-mutagenic
+233-88-5,c1cnc2c(c1)ccc3cc[nH]c23,non-mutagenic
+NOCAS_M277,OO[C@@H]1CCCc2ccccc12,mutagenic
+513-31-5,BrCC(=C)Br,mutagenic
+50-35-1,O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1,non-mutagenic
+552-16-9,OC(=O)c1ccccc1[N+](=O)[O-],mutagenic
+452-86-8,Cc1ccc(O)c(O)c1,non-mutagenic
+26761-40-0,CC(C)CCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC(C)C,non-mutagenic
+145-39-1,Cc1c(C)c(c(c(c1C)[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-],non-mutagenic
+108-42-9,Nc1cccc(Cl)c1,non-mutagenic
+139953-97-2,CC\C=C\C=C\C=C\C=C\C=C\OCC(C)O,mutagenic
+23246-96-0,C\C=C/1\CC(=C)[C@](O)(CO)C(=O)OCC2=CCN3CC[C@H](OC1=O)[C@@H]23,mutagenic
+116-83-6,COc1ccc(N)c2C(=O)c3ccccc3C(=O)c12,mutagenic
+101-59-7,Nc1ccc(Sc2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+21794-55-8,COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O)c4c(O)c3C(=O)c12)C(=O)C,mutagenic
+4648-54-8,C[Si](C)(C)N=N#N,mutagenic
+20930-10-3,CC#CC(OC(=O)NC1CCCCC1)(c2ccccc2)c3ccccc3,mutagenic
+603-35-0,c1ccc(cc1)P(c2ccccc2)c3ccccc3,non-mutagenic
+10335-79-2,ONC(=O)c1ccc2ccccc2c1,mutagenic
+63655-40-3,Nc1nc2cc(ccc2[nH]1)C#N,mutagenic
+128753-83-3,CC12OOC1Oc3ccccc23,mutagenic
+15950-66-0,Oc1ccc(Cl)c(Cl)c1Cl,non-mutagenic
+481-74-3,Cc1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1,mutagenic
+150445-97-9,[O-][N+](=O)c1cccc(CO\N=C\c2nc3cc(ccc3n2Cc4ccc(Cl)cc4)[N+](=O)[O-])c1,non-mutagenic
+112380-30-0,CCCCN(N=O)\C(=N\O)\C=O,mutagenic
+100-15-2,CNc1ccc(cc1)[N+](=O)[O-],mutagenic
+NOCAS_M17,C(CC[C@H]1CO1)C[C@H]2CO2,mutagenic
+590-86-3,CC(C)CC=O,non-mutagenic
+132832-27-0,OC1C2OC2c3c(ccc4c5ccccc5c6ccccc6c34)C1O,mutagenic
+60516-11-2,CC(=O)Nc1ccc(Nc2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+67-63-0,CC(C)O,non-mutagenic
+74-87-3,CCl,mutagenic
+461-72-3,O=C1CNC(=O)N1,non-mutagenic
+81-61-8,Oc1ccc2C(=O)c3c(O)ccc(O)c3C(=O)c2c1O,mutagenic
+NOCAS_M257,COC[C@H]1CO1,mutagenic
+98982-99-1,COc1ccc(CN(CC[N+](C)(C)[O-])c2ccccn2)cc1,non-mutagenic
+27758-60-7,Cc1ccc(cc1)N(N)c2ccc(C)cc2,mutagenic
+168010-55-7,Cc1cc(cc(C)n1)c2cc3N(C4CC4)C5=CC(=O)NC(=O)N5c3cc2F,mutagenic
+79-11-8,OC(=O)CCl,non-mutagenic
+51483-39-7,ClCC(Br)CCl,mutagenic
+117467-28-4,CO\N=C(/C(=O)NC1C2SCC(=C(N2C1=O)C(=O)OCOC(=O)C(C)(C)C)\C=C\c3scnc3C)\c4csc(N)n4,non-mutagenic
+145438-97-7,CN(N=O)C(=O)c1c(ncn1C)N(C)N=O,mutagenic
+203-33-8,c1ccc2c(c1)c3cccc4cc5ccccc5c2c34,mutagenic
+146795-31-5,Cc1ccccc1NC(=O)c2csc(c2)[N+](=O)[O-],mutagenic
+62-55-5,CC(=N)S,non-mutagenic
+148193-33-3,COc1nsc2cc(N)ccc12,mutagenic
+88-75-5,Oc1ccccc1[N+](=O)[O-],non-mutagenic
+103139-94-2,Cc1cnc2c(C)cc3c(nc(N)n3C)c2n1,mutagenic
+4309-66-4,Nc1ccc(\C=C\c2ccccc2)cc1,mutagenic
+24684-42-2,Cc1cc2CCC(=O)c2c3ccc4ccccc4c13,mutagenic
+120014-85-9,OC1CCCc2c1cc3ccc4ccc(c5ccc2c3c45)[N+](=O)[O-],mutagenic
+2984-50-1,CCCCCCC1CO1,non-mutagenic
+226-36-8,c1ccc2c(c1)ccc3nc4c(ccc5ccccc45)cc23,mutagenic
+563-41-7,NNC(=O)N,non-mutagenic
+129134-96-9,CC1CC2C(Cc3cn(C4CCCC4)c5cccc2c35)N(C)C1,mutagenic
+135086-97-4,Nn1nnc2c3ccccc3nc2c1O,mutagenic
+138245-74-6,OCC(O)C(O)C(O)C(O)CN=N#N,mutagenic
+59-87-0,NC(=O)N\N=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+139953-79-0,C1N(\N=C\c2ccc(Oc3ccccc3)cc2)N=Nc4c1[nH]c5ccccc45,non-mutagenic
+108618-28-6,Nc1ccc(\C=C\c2cccc(c2)C#N)cc1,mutagenic
+106063-42-7,COc1cc(O)ccc1Nc2c3ccccc3nc4ccccc24,mutagenic
+71382-46-2,Cc1c2C3NC3c4ccccc4c2c(C)c5ccccc15,mutagenic
+91-64-5,O=C1Oc2ccccc2C=C1,mutagenic
+23590-58-1,Clc1nncc2ncccc12,non-mutagenic
+50285-71-7,CCN(N=O)C(=O)N(C)C,mutagenic
+40580-89-0,O=NN1CCCCCCCCCCCC1,mutagenic
+97629-28-2,Cc1c(C)c(N)c(cc1N)[N+](=O)[O-],mutagenic
+62783-50-0,CN(Cc1ccc(C)cc1)N=O,non-mutagenic
+82414-02-6,Cc1ccc(cc1N=O)[N+](=O)[O-],mutagenic
+87-62-7,Cc1cccc(C)c1N,mutagenic
+99-52-5,Cc1cc(ccc1N)[N+](=O)[O-],mutagenic
+42017-89-0,CC(C)(Oc1ccc(cc1)C(=O)c2ccc(Cl)cc2)C(=O)O,non-mutagenic
+2687-41-4,CC(=O)Nc1ccc(Oc2ccc(N)cc2)cc1,mutagenic
+100-63-0,NNc1ccccc1,mutagenic
+1210-35-1,O=C1c2ccccc2CCc3ccccc13,non-mutagenic
+75-64-9,CC(C)(C)N,non-mutagenic
+108-31-6,O=C1OC(=O)C=C1,non-mutagenic
+96918-24-0,o1ccc2c1cc3ccc4cccc5ccc2c3c45,mutagenic
+611-32-5,Cc1cccc2cccnc12,mutagenic
+137-89-3,CCCC[C@H](CC)COC(=O)c1cccc(c1)C(=O)OC[C@@H](CC)CCCC,non-mutagenic
+79526-11-7,C1OC1Oc2ccccc2,mutagenic
+1948-33-0,CC(C)(C)c1cc(O)ccc1O,non-mutagenic
+7224-61-5,COc1cc2c(CC3c4c(CC[N+]3(C)C)cc(OC)c(O)c24)cc1O,non-mutagenic
+108670-78-6,CC\C=C\C=C\C=C\C=C\OCC(O)CO,mutagenic
+105361-86-2,O=Nc1cccc(c1)c2ccccc2,mutagenic
+68268-11-1,CCN(C(=O)CCCl)c1snc2ccccc12,mutagenic
+145679-85-2,Cc1cc2CCCc2c3ccc4C(O)C(O)C5OC5c4c13,mutagenic
+479-92-5,CC(C)C1=C(C)N(C)N(C1=O)c2ccccc2,non-mutagenic
+150-60-7,C(SSCc1ccccc1)c2ccccc2,mutagenic
+135-49-9,Cc1cc2cc3cc(C)c(N)cc3nc2cc1N,mutagenic
+88598-56-5,[O-][N+](=O)c1ccc2ccc3cc4CCCCc4c5ccc1c2c35,mutagenic
+60784-46-5,OCCNC(=O)N(CCCl)N=O,mutagenic
+18137-96-7,[CH2-][N+](=O)[O-],non-mutagenic
+5042-54-6,Cc1cc(N=Nc2ccccc2)c(N)cc1N,mutagenic
+125-31-5,Cc1cc(c(C)cc1O)C2(OS(=O)(=O)c3ccccc23)c4cc(C)c(O)cc4C,non-mutagenic
+2080-32-2,CCN(CC)S(=O)(=O)c1ccc(NC(=O)C)cc1,non-mutagenic
+65-61-2,CN(C)c1ccc2cc3ccc(cc3nc2c1)N(C)C,mutagenic
+117-05-5,Clc1cccc2C(=O)c3c(NC(=O)c4ccccc4)cccc3C(=O)c12,mutagenic
+69322-61-8,OC(=O)C1CC=C(OP2(NP(NP(N2)(Oc3ccc(cc3)C(=O)O)Oc4ccc(cc4)C(=O)O)(Oc5ccc(cc5)C(=O)O)Oc6ccc(cc6)C(=O)O)Oc7ccc(cc7)C(=O)O)C=C1,non-mutagenic
+9014-90-8,CCCCCCCCCc1ccccc1C(CO)OS(=O)(=O)O,non-mutagenic
+842-19-3,Oc1ccc2cc(cc(c2c1)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+75-47-8,IC(I)I,mutagenic
+74-97-5,ClCBr,mutagenic
+2784-27-2,Oc1ccc(cc1)C2(NC(=O)NC2=O)c3ccccc3,non-mutagenic
+91991-22-9,CCCCC(=O)Nc1snc2ccc(Cl)cc12,non-mutagenic
+36840-85-4,C=CC(=O)OCCCCCOC(=O)C=C,non-mutagenic
+316-42-7,CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@H]2C[C@H]1C[C@H]4NCCc5cc(OC)c(OC)cc45,non-mutagenic
+120-37-6,CCNc1cc(O)ccc1C,mutagenic
+70644-19-8,Cc1ccc2cc3ccc4cccc5ccc(c2c1)c3c45,mutagenic
+120-72-9,c1ccc2[nH]ccc2c1,non-mutagenic
+150-78-7,COc1ccc(OC)cc1,non-mutagenic
+NOCAS_M256,O=NN1CCC[C@@H]1c2cccnc2,mutagenic
+111-87-5,CCCCCCCCO,non-mutagenic
+3209-22-1,[O-][N+](=O)c1cccc(Cl)c1Cl,non-mutagenic
+3675-13-6,O=C\C=C\C=O,mutagenic
+95-54-5,Nc1ccccc1N,mutagenic
+52171-92-3,Cc1cccc2c1cc(C)c3c4ccccc4ccc23,mutagenic
+132742-05-3,[O-][N+](=O)c1c2CCC=Cc2c3ccc4cccc5ccc1c3c45,non-mutagenic
+21626-89-1,O=C1N2Cc3ccccc3C(=O)N2Cc4ccccc14,non-mutagenic
+38178-41-5,[O-][N+](=O)c1ccc2Oc3ccccc3Oc2c1,mutagenic
+1072-43-1,CC1CS1,non-mutagenic
+36050-09-6,NC(=O)c1csc(c1)[N+](=O)[O-],mutagenic
+66-71-7,c1cnc2c(c1)ccc3cccnc23,non-mutagenic
+16683-64-0,C1=Cc2c3cc4ccccc4cc3cc5cccc1c25,mutagenic
+107-01-7,C\C=C\C,non-mutagenic
+59901-91-6,O[C@H]([C@@H]1CO1)c2ccc3OCOc3c2,mutagenic
+93673-31-5,O1C2C1c3c4ccc5ccccc5c4cc6cccc2c36,mutagenic
+24367-94-0,CC(=O)Nc1ccc(Cc2ccc(N)cc2)cc1,non-mutagenic
+14088-71-2,OC(C1CC1)(c2ccc(Cl)cc2)c3ccc(Cl)cc3,non-mutagenic
+30747-87-6,[O-][N+](=O)c1ccc2snc(Cl)c2c1,mutagenic
+94223-88-8,[O-][N+](=O)c1ccc2nc3c(cc2c1)c4cccc5cccc3c45,mutagenic
+90-44-8,O=C1c2ccccc2Cc3ccccc13,mutagenic
+5131-60-2,Nc1ccc(Cl)c(N)c1,mutagenic
+372-48-5,Fc1ccccn1,mutagenic
+577-33-3,Oc1ccc2c(O)c3ccccc3cc2c1O,mutagenic
+3070-86-8,CC(=O)Nc1ccc(Oc2ccc(NC(=O)C)cc2)cc1,non-mutagenic
+137-05-3,COC(=O)C(=C)C#N,mutagenic
+52671-42-8,O=Nc1ccc(Oc2ccccc2)cc1,mutagenic
+98-95-3,[O-][N+](=O)c1ccccc1,non-mutagenic
+463-58-1,O=C=S,mutagenic
+142628-08-8,NC(CSC(F)(F)C(Cl)Br)C(=O)O,mutagenic
+NOCAS_M492,C[C@@H](O)CN(C[C@@H](C)O)C[C@@H](C)O,non-mutagenic
+2449-49-2,CC(N(C)C)c1ccccc1,non-mutagenic
+NOCAS_M192,COC[C@@H](O)Cn1cc(nc1Cl)[N+](=O)[O-],mutagenic
+159092-85-0,[O-][N+](=O)c1ccc2c(cc3cccc(c3c2c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+33804-48-7,CN(C)c1ccc(cc1)N=Nc2ccc(cc2)N(C)C(=O)C,mutagenic
+107673-67-6,[O-][N+](=O)C1=Cc2cccc3c4cc5ccccc5cc4cc1c23,mutagenic
+NOCAS_M479,CCCC[C@@H](CC)COC(=O)c1ccccc1C(=O)O,non-mutagenic
+26049-71-8,NNc1nc(cs1)c2ccc(N)cc2,mutagenic
+17683-09-9,Cc1ccc(NN=NCc2ccccc2)cc1,mutagenic
+78113-36-7,CCCCCCCCCCCCCCCCCC(=O)NCCCCC(NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)OC(C(O)C(O)CO)C(NC(=O)C)C=O)C(=O)N)C(=O)O,non-mutagenic
+NOCAS_M91,C[C@H]1CO1,mutagenic
+220042-15-9,OC1=C\C(=N/c2ccc(cc2)[N+](=O)[O-])\C(=O)C=C1c3nnc(NC(=O)c4ccccc4)s3,mutagenic
+606-20-2,Cc1c(cccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+13098-39-0,FC(F)(F)C(=O)C(F)(F)F,non-mutagenic
+2164-17-2,CN(C)C(=O)Nc1cccc(c1)C(F)(F)F,non-mutagenic
+37350-58-6,COCCc1ccc(OCC(O)CNC(C)C)cc1,non-mutagenic
+26651-23-0,OS(=O)(=O)c1ccc2ccc3cccc4ccc1c2c34,mutagenic
+64371-62-6,CC1(CO1)c2ccc(cc2)c3ccccc3,mutagenic
+87-56-9,OC(=O)\C(=C(/Cl)\C=O)\Cl,mutagenic
+142-62-1,CCCCCC(=O)O,non-mutagenic
+33857-26-0,Clc1ccc2Oc3cc(Cl)ccc3Oc2c1,non-mutagenic
+99-30-9,Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-],mutagenic
+50-34-0,CC(C)[N+](C)(CCOC(=O)C1c2ccccc2Oc3ccccc13)C(C)C,non-mutagenic
+84-54-8,Cc1ccc2C(=O)c3ccccc3C(=O)c2c1,non-mutagenic
+54818-87-0,CC(=O)Nc1ccc(Sc2ccccc2)cc1,mutagenic
+92887-88-2,CN(CCC#N)c1ccc(cc1)N=Nc2ccc3ncsc3c2,mutagenic
+72-55-9,ClC(=C(c1ccc(Cl)cc1)c2ccc(Cl)cc2)Cl,non-mutagenic
+55792-21-7,CCCCCCCOc1ccccc1NC(=O)OCCN2CCCCC2,non-mutagenic
+2923-68-4,OC(=O)C(F)(F)C(F)(Cl)C(F)(F)C(F)(Cl)C(F)(F)C(F)(Cl)C(F)(F)Cl,non-mutagenic
+1229-55-6,COc1ccccc1N=Nc2c(O)ccc3ccccc23,mutagenic
+1707-31-9,ON(C=O)c1ccc2ccccc2c1,mutagenic
+1192-62-7,CC(=O)c1occc1,mutagenic
+13360-63-9,CCCCNCC,non-mutagenic
+13177-28-1,[O-][N+](=O)c1ccc2cccc3c4ccccc4c1c23,mutagenic
+5381-78-2,Cn1cnc2cc(ccc12)[N+](=O)[O-],non-mutagenic
+86-26-0,COc1ccccc1c2ccccc2,non-mutagenic
+108-83-8,CC(C)CC(=O)CC(C)C,non-mutagenic
+1774-66-9,Brc1ccc(\C=C\C(=O)c2ccccc2)cc1,non-mutagenic
+1635-63-8,CNP1(NC)NP(NC)(NC)NP(NC)(NC)N1,non-mutagenic
+13024-49-2,Nc1ccc(CCc2ccccc2)cc1,mutagenic
+79642-33-4,CCOC(=O)Nc1cccc2c3c[nH]ccc3nc12,non-mutagenic
+96563-11-0,CC1c2ccccc2c3ccc(F)cc13,mutagenic
+129-44-2,Nc1cccc2C(=O)c3c(N)cccc3C(=O)c12,mutagenic
+6109-97-3,CCn1c2ccccc2c3cc(N)ccc13,mutagenic
+125157-97-3,CC1C2C(=Nc3ccccc23)N(C)c4c(C)cccc14,mutagenic
+2475-46-9,CNc1ccc(NCCO)c2C(=O)c3ccccc3C(=O)c12,mutagenic
+51938-21-7,CCCCN(CCC(=O)OC)N=O,mutagenic
+1635-61-6,Nc1cc(Cl)ccc1[N+](=O)[O-],mutagenic
+10312-83-1,COCC=O,mutagenic
+53757-29-2,Cc1nc(cs1)c2oc(cc2)[N+](=O)[O-],mutagenic
+7227-92-1,CN(C)N=Nc1ccc(cc1)[N+](=O)[O-],mutagenic
+3096-64-8,Cc1ccc(C)c(NO)c1,mutagenic
+NOCAS_M281,N1[C@@H]2[C@H]1c3c(ccc4ccccc34)c5ccccc25,mutagenic
+101-25-7,O=NN1CN2CN(CN(C2)N=O)C1,mutagenic
+181256-48-4,NNc1nc2ccc3nc4ccccc4c(O)c3c2s1,mutagenic
+NOCAS_M74,OC(=O)[C@@H](Cl)Br,mutagenic
+5694-00-8,NC(=O)C1CO1,mutagenic
+21340-68-1,COC(=O)C(C)(C)Oc1ccc(cc1)c2ccc(Cl)cc2,non-mutagenic
+581-64-6,Nc1ccc2nc3ccc(N)cc3[s+]c2c1,mutagenic
+31551-45-8,[O-][N+](=O)c1ccc2c3ccc(cc3C(=O)c2c1)[N+](=O)[O-],mutagenic
+17413-41-1,COc1cccc2c1cc3N([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C(=O)c5cc6OCOc6c2c35,non-mutagenic
+616-91-1,CC(=O)N[C@@H](CS)C(=O)O,mutagenic
+160637-29-6,CC1=Cc2nc3c(ccc4ccccc34)c(C)c2C(O)C1O,mutagenic
+544-16-1,CCCCON=O,mutagenic
+1129-52-8,ClC[C@@H]1O[C@H](CCl)O[C@H](CCl)O1,mutagenic
+580-21-2,Fc1ccc2ccccc2n1,non-mutagenic
+92-54-6,C1CN(CCN1)c2ccccc2,non-mutagenic
+1634-04-4,COC(C)(C)C,non-mutagenic
+158729-31-8,CN(C)CCNS(=O)(=O)c1cccc2cccnc12,non-mutagenic
+548-83-4,OC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccccc3,non-mutagenic
+1806-29-7,Oc1ccccc1c2ccccc2O,non-mutagenic
+120-14-9,COc1ccc(C=O)cc1OC,non-mutagenic
+623-25-6,ClCc1ccc(CCl)cc1,non-mutagenic
+130005-62-8,Cc1cc(N)c(C)c2c3cc(O)ccc3[nH]c12,mutagenic
+155164-58-2,Cc1ccc(cc1)S(=O)(=O)N2N=CC(=C(Cl)C2=O)Cl,non-mutagenic
+36239-01-7,CN(COC(=O)C)[N+](=O)[O-],mutagenic
+389104-57-8,CC(C)c1c(N)ccc2c1Cc3ccccc23,mutagenic
+17057-98-6,CC1c2ccccc2c3cccc(C)c13,mutagenic
+55-63-0,[O-][N+](=O)OCC(CO[N+](=O)[O-])O[N+](=O)[O-],mutagenic
+115-90-2,CCOP(=S)(OCC)Oc1ccc(cc1)S(=O)C,non-mutagenic
+131229-60-2,CCCCON(OC(=O)C)C(=O)c1ccc(OC)cc1,mutagenic
+NOCAS_M423,Br[C@@H]1CC[C@H](Br)[C@H](Br)CC[C@@H](Br)[C@@H](Br)CC[C@H]1Br,non-mutagenic
+6755-13-1,CN(C)C(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+4533-39-5,CN(C)CCCNc1c2ccccc2nc3cccc(c13)[N+](=O)[O-],mutagenic
+15131-84-7,O1C2C1c3c(ccc4ccccc34)c5ccccc25,mutagenic
+13171-21-6,CCN(CC)C(=O)\C(=C(\C)/OP(=O)(OC)OC)\Cl,mutagenic
+87619-82-7,NC(CS\C(=C(/Cl)\C(=C(Cl)Cl)Cl)\Cl)C(=O)O,mutagenic
+114231-14-0,COc1cc(OC)c(Cl)c(c1)N2C(=CC(=O)C(=C2c3ccc(F)cc3)C)c4ccccc4,non-mutagenic
+194479-75-9,Cc1ccc2nc3ccc(C)cc3c(N)c2c1,mutagenic
+431-63-0,FC(F)C(F)C(F)(F)F,non-mutagenic
+149396-91-8,Cc1ccc(c(O)c1C(O)c2ncc([N+](=O)[O-])n2C)C(C)(C)C,non-mutagenic
+7220-79-3,CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C,mutagenic
+127072-58-6,CC\C=C\C=C\C=C\C=C\C=C\C=C\OCC(O)CO,mutagenic
+143922-99-0,CC(=O)Nc1cccc(N=Nc2cccc(NC(=O)C)c2C)c1C,non-mutagenic
+96-31-1,CNC(=O)NC,non-mutagenic
+NOCAS_M359,CCCC[C@@H](CC)COCCC#N,non-mutagenic
+173106-65-5,CC1(C)CC(C(=O)NCCCCCCCCCCCC(=O)O)C(C)(C)N1O,non-mutagenic
+27343-29-9,Cc1cc2C(=O)CCCc2c3ccc4ccccc4c13,mutagenic
+121-33-5,COc1cc(C=O)ccc1O,non-mutagenic
+80-39-7,CCNS(=O)(=O)c1ccc(C)cc1,non-mutagenic
+4553-62-2,C[C@H](CCC#N)C#N,mutagenic
+3340-94-1,Cc1c2ccccc2nc3c1ccc4ccccc34,mutagenic
+80734-02-7,CC1=C(COC(=O)C2N3C(SC2(C)C)C(NC(=O)C(N)c4ccccc4)C3=O)OC(=O)O1,non-mutagenic
+26091-73-6,CC1(C)OC1COc2c3C=CC(=O)Oc3cc4occc24,non-mutagenic
+50-47-5,CNCCCN1c2ccccc2CCc3ccccc13,non-mutagenic
+20983-67-9,[O-][N+](=O)c1ccc(Nc2ccc(Cl)cc2)cc1,mutagenic
+103124-62-5,CCOC(=O)C(=NNc1ccc(cc1)c2ccc(NN=C(C(=O)OCC)C(=O)OCC)cc2)C(=O)OCC,non-mutagenic
+488-23-3,Cc1ccc(C)c(C)c1C,non-mutagenic
+112725-15-2,CN(N=O)C(OC(=O)C)C(=O)C,mutagenic
+107673-66-5,[O-][N+](=O)C1=Cc2cc3cc4ccccc4cc3c5cccc1c25,mutagenic
+41267-76-9,CC1=CC(=O)Oc2c3CCCN4CCCc(cc12)c34,mutagenic
+3736-59-2,Oc1cc2C(=O)c3ccccc3C(=O)c2c(O)c1C=O,non-mutagenic
+55028-70-1,CCCCCC(C)(O)\C=C\C1C(O)CC(=O)C1C\C=C\CCCC(=O)O,non-mutagenic
+103-90-2,CC(=O)Nc1ccc(O)cc1,non-mutagenic
+509-14-8,[O-][N+](=O)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-],mutagenic
+108283-48-3,CC(C)(C)OC(=O)NC(CN=N#N)C(=O)OC(C)(C)C,mutagenic
+123447-62-1,CC1SC2=C(C(=O)O)C(=O)c3cc(F)c(cc3N12)N4CCN(CC5=C(C)OC(=O)O5)CC4,non-mutagenic
+1877-73-2,OC(=O)Cc1cccc(c1)[N+](=O)[O-],non-mutagenic
+527-53-7,Cc1cc(C)c(C)c(C)c1,non-mutagenic
+60-35-5,CC(=O)N,non-mutagenic
+215226-70-3,OC(=O)\C(=C(/CCl)\C=O)\Cl,mutagenic
+155164-63-9,CC(=O)N1N=CC(=C(Cl)C1=O)Cl,non-mutagenic
+98447-32-6,ClCC(=O)Nc1snc2cc(Cl)ccc12,mutagenic
+117-18-0,[O-][N+](=O)c1c(Cl)c(Cl)cc(Cl)c1Cl,non-mutagenic
+NOCAS_M61,CC(C)(C)c1ccc(OC[C@H]2CO2)cc1,mutagenic
+63408-86-6,ONc1cc2ccccc2[nH]1,mutagenic
+146177-61-9,Cc1cnc2c(n1)c(C)c(C)c3c2nc(N)n3C,mutagenic
+61034-40-0,CC1CN(CC(C)N1C(=O)c2ccccc2)N=O,non-mutagenic
+98-33-9,Cc1cc(ccc1N)S(=O)(=O)O,non-mutagenic
+478-06-8,OC(=O)c1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,non-mutagenic
+97629-64-6,Cc1cc(N)c(c(C)c1N)[N+](=O)[O-],non-mutagenic
+75-65-0,CC(C)(C)O,non-mutagenic
+91991-23-0,CC(C)CC(=O)Nc1snc2ccc(Cl)cc12,non-mutagenic
+NOCAS_M86,CC(=C[C@H]1[C@H](C(=O)OCN2C(=O)C3=C(CCCC3)C2=O)C1(C)C)C,mutagenic
+57166-92-4,NCN,mutagenic
+2550-75-6,ClCC1C(CCl)C2(Cl)C(=C(Cl)C1(Cl)C2(Cl)Cl)Cl,non-mutagenic
+643-22-1,CC[C@@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@@H](C)O2)[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O,non-mutagenic
+112-34-5,CCCCOCCOCCO,non-mutagenic
+32766-75-9,CCCCCCCCCCCCCC(=O)N(O)c1ccc2c(Cc3ccccc23)c1,mutagenic
+5412-25-9,OP(=O)(OCC(Br)CBr)OCC(Br)CBr,mutagenic
+67-47-0,OCc1oc(C=O)cc1,mutagenic
+114460-38-7,Cn1ccc2ccc3ccc4ccc(O)cc4c3c12,mutagenic
+6422-86-2,CCCCC(CC)COC(=O)c1ccc(cc1)C(=O)OCC(CC)CCCC,non-mutagenic
+NOCAS_M18,C[C@@H](O)CN,mutagenic
+81593-15-9,ClN1C2C1c3ccccc3c4ccccc24,mutagenic
+146-59-8,CCN(CCCl)CCCNc1c2ccc(Cl)cc2nc3ccc(OC)cc13,mutagenic
+957-52-8,ClCc1ccc2c3ccccc3c4cccc1c24,mutagenic
+82017-48-9,CC1(C)SSCC(NC1=O)C(=O)O,non-mutagenic
+86607-81-0,[O-][N+](=O)c1cccc2c1oc3ccccc23,mutagenic
+7220-81-7,COc1cc2OC3OCCC3c2c4OC(=O)C5=C(CCC5=O)c14,mutagenic
+122-04-3,[O-][N+](=O)c1ccc(cc1)C(=O)Cl,mutagenic
+57775-29-8,CC(C)NCC(O)COc1cccc2[nH]c3ccccc3c12,non-mutagenic
+143-50-0,ClC1(Cl)C2(Cl)C3(Cl)C4(Cl)C(=O)C5(Cl)C(Cl)(C1(Cl)C35Cl)C24Cl,non-mutagenic
+90-02-8,Oc1ccccc1C=O,non-mutagenic
+53797-18-5,OC[C@H]1O[C@@H](Oc2cccc3C(=O)c4cccc(O)c4C(=O)c23)[C@H](O)[C@@H](O)[C@@H]1O,mutagenic
+621-33-0,CCOc1cccc(N)c1,mutagenic
+NOCAS_M501,CCOC[C@@H](O)COc1ccc(NC(=O)CC[S+](C)C)cc1,non-mutagenic
+117-39-5,OC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)c(O)c3,mutagenic
+4513-36-4,CC(C)(C)COC(=O)C=C,non-mutagenic
+60564-31-0,Nc1cc2c(cc1[N+](=O)[O-])[nH]c3ccccc23,mutagenic
+129-15-7,Cc1ccc2C(=O)c3ccccc3C(=O)c2c1[N+](=O)[O-],mutagenic
+95-77-2,Oc1ccc(Cl)c(Cl)c1,non-mutagenic
+103-50-4,C(OCc1ccccc1)c2ccccc2,non-mutagenic
+NOCAS_M266,Cc1ccc(CC[C@H]2CO2)cc1,mutagenic
+132769-75-6,OC1C2OC2c3c(ccc4ccc5c6ccccc6ccc5c34)C1O,mutagenic
+552-30-7,OC(=O)c1ccc2C(=O)OC(=O)c2c1,non-mutagenic
+5776-38-5,C[n+]1c2ccccc2c(N)c3ccccc13,mutagenic
+117760-92-6,O[C@@H]1C=Cc2c([C@H]1O)c3ccc4ccccc4c3cc2[N+](=O)[O-],mutagenic
+4450-68-4,Cc1ccc(cc1)S(=O)(=O)OCc2ccc(cc2)[N+](=O)[O-],mutagenic
+90811-87-3,O=C(\C=C\c1ccc(Oc2ccccc2)cc1)c3ccccc3,non-mutagenic
+120-71-8,COc1ccc(C)cc1N,mutagenic
+592-41-6,CCCCC=C,non-mutagenic
+841-18-9,CC(=O)Nc1ccc(\C=C/c2ccccc2)cc1,mutagenic
+76-12-0,FC(Cl)(Cl)C(F)(Cl)Cl,mutagenic
+557-48-2,CC\C=C\CC\C=C\C=O,non-mutagenic
+114416-29-4,OC1C=Cc2c(ccc3ncccc23)C1O,non-mutagenic
+NOCAS_M169,CCCC[C@@H](CC)COC[C@H]1CO1,mutagenic
+479-13-0,Oc1ccc2c(OC(=O)c3c2oc4cc(O)ccc34)c1,non-mutagenic
+92-59-1,CCN(Cc1ccccc1)c2ccccc2,non-mutagenic
+72-43-5,COc1ccc(cc1)C(c2ccc(OC)cc2)C(Cl)(Cl)Cl,non-mutagenic
+NOCAS_M171,CCCCN(C[C@@H](O)C1=CC(=[N+]=[N-])C(=O)C=C1)N=O,mutagenic
+87-66-1,Oc1cccc(O)c1O,mutagenic
+77-78-1,COS(=O)(=O)OC,mutagenic
+18463-85-9,CN(C)c1ccc(cc1)N=Nc2ccc3ncsc3c2,mutagenic
+530-50-7,NN(c1ccccc1)c2ccccc2,non-mutagenic
+96337-40-5,CCN=[N+](C)[O-],non-mutagenic
+141511-30-0,[O-][N+](=O)c1ccc2c(CCc3cc4c(CCc5ccccc45)cc23)c1,mutagenic
+80-47-7,C[C@@H]1CC[C@H](CC1)C(C)(C)OO,mutagenic
+505-70-4,OC(=O)\C=C\C=C\C(=O)O,non-mutagenic
+109910-98-7,OC1C(O)c2cc3cc(ccc3cc2CC1=O)[N+](=O)[O-],non-mutagenic
+110-46-3,CC(C)CCON=O,mutagenic
+3081-61-6,CCNC(=O)CCC(N)C(=O)O,non-mutagenic
+25152-84-5,CCCCC\C=C/C=C\C=O,non-mutagenic
+816-57-9,CCCN(N=O)C(=O)N,mutagenic
+112-62-9,CCCCCCCC\C=C/CCCCCCCC(=O)OC,non-mutagenic
+367-25-9,Nc1ccc(F)cc1F,mutagenic
+393-75-9,[O-][N+](=O)c1cc(cc(c1Cl)[N+](=O)[O-])C(F)(F)F,non-mutagenic
+81789-85-7,CC(C)NCC(O)COc1cccc2CC=Cc12,non-mutagenic
+218-19-9,c1ccc2c(c1)ccc3c2ccc4cccnc34,mutagenic
+68267-98-1,CN(C(=O)CCl)c1snc2ccccc12,non-mutagenic
+120-62-7,CCCCCCCCS(=O)[C@H](C)Cc1ccc2OCOc2c1,non-mutagenic
+1070-66-2,CCCCC(=C)C=O,mutagenic
+139-65-1,Nc1ccc(Sc2ccc(N)cc2)cc1,mutagenic
+54150-69-5,COc1ccc(N)c(OC)c1,mutagenic
+127-19-5,CN(C)C(=O)C,non-mutagenic
+58209-98-6,COc1cc2O[C@H]3OC=C[C@H]3c2c4OC(=O)C5=C([C@@H](Cl)[C@@H](Cl)C5=O)c14,mutagenic
+114454-59-0,OC1C(O)c2ccc(c3c4ccccc4c5cccc1c5c23)[N+](=O)[O-],mutagenic
+82298-37-1,OC1C(Oc2cccc3c4ccc5cccc6ccc(cc23)c4c56)OC(C(O)C1O)C(=O)O,non-mutagenic
+27591-97-5,CCN(CC)CCOc1ccc2c(c1)C(=O)c3cc(OCCN(CC)CC)ccc23,mutagenic
+17455-13-9,C1COCCOCCOCCOCCOCCO1,non-mutagenic
+1634-78-2,CCOC(=O)C[C@@H](SP(=O)(OC)OC)C(=O)OCC,non-mutagenic
+8003-22-3,O=C1C(C(=O)c2ccccc12)c3ccc4ccccc4n3,mutagenic
+64-19-7,CC(=O)O,non-mutagenic
+119631-00-4,Cc1ccc(cc1N)N=Nc2ccc(C)c(N)c2,mutagenic
+77-47-4,ClC1=C(Cl)C(Cl)(Cl)C(=C1Cl)Cl,non-mutagenic
+121-44-8,CCN(CC)CC,non-mutagenic
+77061-07-5,BrCc1cccc2c3cccc4cccc(c12)c34,mutagenic
+133762-79-5,Nc1nc(N)c2ncn(CC(O)CN=N#N)c2n1,mutagenic
+3173-53-3,O=C=NC1CCCCC1,non-mutagenic
+13048-33-4,C=CC(=O)OCCCCCCOC(=O)C=C,non-mutagenic
+148193-38-8,O=C1N(CC2CO2)Sc3cc(OCC4CO4)ccc13,mutagenic
+94-20-2,CCCNC(=O)NS(=O)(=O)c1ccc(Cl)cc1,non-mutagenic
+123-08-0,Oc1ccc(C=O)cc1,non-mutagenic
+2179-59-1,CCCSSCC=C,non-mutagenic
+60905-56-8,OC(Nc1snc2ccccc12)C(Cl)(Cl)Cl,non-mutagenic
+28860-95-9,CC(Cc1ccc(O)c(O)c1)(NN)C(=O)O,mutagenic
+1163-19-5,Brc1c(Br)c(Br)c(Oc2c(Br)c(Br)c(Br)c(Br)c2Br)c(Br)c1Br,non-mutagenic
+88-23-3,Nc1cc(Cl)cc(c1O)S(=O)(=O)O,non-mutagenic
+193-40-8,c1ccc2c(c1)c3nc4ccccc4c5c6ccccc6nc2c35,non-mutagenic
+287-92-3,C1CCCC1,non-mutagenic
+76-01-7,ClC(Cl)C(Cl)(Cl)Cl,non-mutagenic
+70853-94-0,Cc1ccc(NO)c(C)c1,mutagenic
+624-92-0,CSSC,non-mutagenic
+524-15-2,COc1cccc2c(OC)c3ccoc3nc12,mutagenic
+526-73-8,Cc1cccc(C)c1C,mutagenic
+55256-49-0,Oc1cccc2Oc3cc4OC5OC=CC5c4c(O)c3C(=O)c12,non-mutagenic
+NOCAS_M368,N[C@H](Cc1ccc(F)cc1)C(=O)O,non-mutagenic
+126637-65-8,NC(CSC(F)(F)C(Br)Br)C(=O)O,mutagenic
+476-66-4,Oc1cc2C(=O)Oc3c(O)c(O)cc4C(=O)Oc(c1O)c2c34,non-mutagenic
+171866-15-2,C[C@@H]1O[C@@H](O[C@H]2C[C@](O)(CO)Cc3c(O)c4C(=O)c5ccccc5C(=O)c4c(O)c23)[C@H](I)[C@H](O)[C@@H]1O,mutagenic
+56525-94-1,COc1nncc2cccnc12,non-mutagenic
+54779-53-2,Cc1c2ccncc2c(C)c3c4cc(N)ccc4[nH]c13,mutagenic
+6449-35-0,COc1cc(ccc1N=Nc2cc(c3ccccc3c2O)S(=O)(=O)O)c4ccc(N=Nc5c(O)c6ccc(N)cc6cc5S(=O)(=O)O)c(OC)c4,mutagenic
+133762-85-3,CSc1ncnc2c1ncn2CC(O)CN=N#N,mutagenic
+61-25-6,COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC,non-mutagenic
+54-91-1,BrCCC(=O)N1CCN(CC1)C(=O)CCBr,mutagenic
+1141-35-1,Clc1ccc(cc1)c2oc3ccccc3n2,non-mutagenic
+108-93-0,OC1CCCCC1,non-mutagenic
+28166-06-5,[O-][N+](=O)c1cc(ccc1F)N=N#N,mutagenic
+475-80-9,OC(=O)c1cc2OCOc2c3c4ccccc4cc(c13)[N+](=O)[O-],mutagenic
+4444-68-2,CCCCN(CC)CC,non-mutagenic
+97-86-9,CC(C)COC(=O)C(=C)C,non-mutagenic
+13014-18-1,Clc1ccc(c(Cl)c1)C(Cl)(Cl)Cl,mutagenic
+56892-33-2,Oc1cc2c3ccccc3cc4ccc5cccc1c5c24,mutagenic
+122088-20-4,O[C@H]1C=Cc2ccc3nc4ccc5ccccc5c4cc3c2[C@@H]1O,mutagenic
+99152-10-0,CC(C)C(NC(=O)C)C(=O)N(CC(=O)O)N=O,mutagenic
+119-75-5,[O-][N+](=O)c1ccccc1Nc2ccccc2,non-mutagenic
+120-83-2,Oc1ccc(Cl)cc1Cl,non-mutagenic
+55556-88-2,C[C@@H]1CN(N=O)[C@@H](C)CN1N=O,mutagenic
+122-01-0,ClC(=O)c1ccc(Cl)cc1,non-mutagenic
+118-58-1,Oc1ccccc1C(=O)OCc2ccccc2,non-mutagenic
+56120-28-6,OS(=O)(=O)c1ccc(NN=Nc2ccc(cc2)S(=O)(=O)O)cc1,non-mutagenic
+645-45-4,ClC(=O)CCc1ccccc1,mutagenic
+951-80-4,Nc1ccc2c(N)c3ccccc3nc2c1,mutagenic
+7097-60-1,NCC(=O)NCC(=O)NCC(=O)NCC(=O)O,non-mutagenic
+56600-58-9,CCc1ccc2C(=O)c3ccccc3C(=O)c2c1[N+](=O)[O-],mutagenic
+431-89-0,FC(C(F)(F)F)C(F)(F)F,non-mutagenic
+10474-14-3,CC(Br)(CCl)CBr,non-mutagenic
+538-41-0,Nc1ccc(cc1)N=Nc2ccc(N)cc2,mutagenic
+102-01-2,CC(=O)CC(=O)Nc1ccccc1,non-mutagenic
+193-39-5,c1ccc2c(c1)c3ccc4ccc5cccc6cc2c3c4c56,mutagenic
+146795-37-1,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2F,mutagenic
+138835-33-3,[O-][N+](=O)c1ccc2ccc3c4c(ccc1c24)c5ccccc5[n+]3[O-],mutagenic
+146795-41-7,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccc(Br)cc2,mutagenic
+110-57-6,ClC\C=C\CCl,mutagenic
+53-94-1,ONc1ccc2c(Cc3ccccc23)c1,mutagenic
+95-46-5,Cc1ccccc1Br,non-mutagenic
+1517-05-1,OCCN=N#N,mutagenic
+624-18-0,Nc1ccc(N)cc1,mutagenic
+37850-99-0,CC(=O)c1c(O)cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c12,non-mutagenic
+885-82-5,Oc1ccc(cc1[N+](=O)[O-])c2ccccc2,non-mutagenic
+84174-24-3,CN(Cc1ccc(cc1)[N+](=O)[O-])N=O,mutagenic
+2475-45-8,Nc1ccc(N)c2C(=O)c3c(N)ccc(N)c3C(=O)c12,mutagenic
+576-24-9,Oc1cccc(Cl)c1Cl,non-mutagenic
+610-14-0,[O-][N+](=O)c1ccccc1C(=O)Cl,mutagenic
+57470-96-9,CCNC(=O)Nc1ccc(OCC(O)CNC(C)(C)C)c(c1)C(=O)C,non-mutagenic
+19952-47-7,Nc1nc2c(Cl)cccc2s1,non-mutagenic
+82856-97-1,CC(C)c1cc(N)c(cc1N)[N+](=O)[O-],mutagenic
+146795-40-6,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2Cl,mutagenic
+99601-30-6,CCn1c(N)nc2c3ncc(C)nc3ccc12,mutagenic
+35089-70-4,CCCCCCN(N=O)C(=N)N[N+](=O)[O-],mutagenic
+4629-58-7,Nc1ccc(\C=C\c2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+7040-57-5,CC(OP(=O)(C)Cl)C(C)(C)C,non-mutagenic
+3602-55-9,CC(C)(C)C1=CC(=O)C=CC1=O,mutagenic
+131229-63-5,CCCCON(OC(=O)C)C(=O)c1ccc(Br)cc1,mutagenic
+96563-08-5,CC1c2ccccc2c3c(C)cccc13,mutagenic
+86827-66-9,Cc1cc2ccccc2c3ccc4C(=O)C(=O)C=Cc4c13,mutagenic
+105-59-9,CN(CCO)CCO,non-mutagenic
+110-44-1,C\C=C/C=C\C(=O)O,non-mutagenic
+549-38-2,C[C@@H]1CCc2c1ccc3c2ccc4ccccc34,mutagenic
+583-39-1,Sc1nc2ccccc2[nH]1,non-mutagenic
+136196-46-8,[O-][N+](=O)c1ccc(N\N=C(\N=Nc2ccc(I)cc2)/c3ccccc3)cc1,non-mutagenic
+142044-39-1,[O-][n+]1cccc2C=CC3OC3c12,non-mutagenic
+57309-30-5,ON1c2ccccc2\C(=N/c3ccccc3)\C1(c4ccccc4)c5ccccc5,non-mutagenic
+139493-54-2,Cc1ccc2cc(C)c3c4C5OC5C(O)C(O)c4ccc3c2c1,mutagenic
+76144-81-5,C[N+](C)(C)NCCC(=O)O,non-mutagenic
+105052-38-8,[O-][N+](=O)C1=Cc2cccc3cccc(O1)c23,mutagenic
+23511-78-6,BrCCC(Br)Br,mutagenic
+137-18-8,CC1=CC(=O)C(=CC1=O)C,non-mutagenic
+3054-60-2,Cc1ccc(NC2OC[C@@H](O)[C@H](O)[C@H]2O)cc1,mutagenic
+127923-99-3,OC(CC(=O)OCCBr)C(=O)OCCBr,mutagenic
+2564-64-9,CC(=O)OCc1c2ccccc2c(C)c3ccc4ccccc4c13,mutagenic
+2941-64-2,CCSC(=O)Cl,non-mutagenic
+91-66-7,CCN(CC)c1ccccc1,non-mutagenic
+485-47-2,OC1(O)C(=O)c2ccccc2C1=O,non-mutagenic
+869-01-2,CCCCN(N=O)C(=O)N,mutagenic
+28289-54-5,CN1CCC(=CC1)c2ccccc2,non-mutagenic
+109143-17-1,[O-][N+](=O)c1oc2cc(ccc2c1)N(CCCl)CCCl,mutagenic
+33089-61-1,CN(\C=N\C=N\c1ccc(C)cc1C)c2ccc(C)cc2C,non-mutagenic
+60504-57-6,CCC1(O)CC(OC2CC(C(O)C(C)O2)N(C)C)c3c(O)c4C(=O)c5c(O)cccc5C(=O)c4cc3C1C(=O)OC,mutagenic
+6358-31-2,COc1ccccc1NC(=O)[C@H](N=Nc2ccc(cc2OC)[N+](=O)[O-])C(=O)C,non-mutagenic
+109897-78-1,OC1C=Cc2cc3ccc(cc3cc2C1O)[N+](=O)[O-],mutagenic
+89837-94-5,CC(=O)CN(COC(=O)C)N=O,mutagenic
+21739-91-3,COc1ccc(cc1)\C(=C/C(=O)O)\Br,mutagenic
+108-60-1,C[C@H](CCl)O[C@H](C)CCl,mutagenic
+98809-36-0,Cc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1,non-mutagenic
+99-75-2,COC(=O)c1ccc(C)cc1,non-mutagenic
+623-17-6,CC(=O)OCc1occc1,mutagenic
+25155-25-3,CC(C)(C)OOC(C)(C)c1cccc(c1)C(C)(C)OOC(C)(C)C,non-mutagenic
+1709-52-0,CNS(=O)(=O)c1ccc(N)cc1,non-mutagenic
+32740-01-5,Cc1cccc2c(C)c3ccc4ccccc4c3nc12,mutagenic
+578-54-1,CCc1ccccc1N,non-mutagenic
+132172-56-6,O1C=CC=Cc2c1c3ccccc3c4cc5ccccc5cc24,mutagenic
+17573-23-8,C1Cc2cc3ccc4cccc5ccc(c2C=C1)c3c45,mutagenic
+2491-52-3,[O-][N+](=O)c1ccc(cc1)N=Nc2ccccc2,mutagenic
+123-35-3,CC(=CCCC(=C)C=C)C,non-mutagenic
+99-12-7,Cc1cc(C)cc(c1)[N+](=O)[O-],mutagenic
+81-54-9,Oc1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O,mutagenic
+121-79-9,CCCOC(=O)c1cc(O)c(O)c(O)c1,non-mutagenic
+494-03-1,ClCCN(CCCl)c1ccc2ccccc2c1,mutagenic
+111858-68-5,Cc1ccc(cc1)N(CC2(O)OCC(O)C(O)C2O)N=O,mutagenic
+584-84-9,Cc1ccc(cc1N=C=O)N=C=O,mutagenic
+920-37-6,ClC(=C)C#N,non-mutagenic
+6027-98-1,COc1ccc2c3CCN=C(C)c3[nH]c2c1,non-mutagenic
+154028-32-7,COc1cccc(\C=C\c2ccc(N)cc2)c1,mutagenic
+13147-25-6,CCN(CCO)N=O,mutagenic
+103748-25-0,Cn1c(N)nc2cc(Cl)ccc12,mutagenic
+1975-50-4,Cc1c(cccc1[N+](=O)[O-])C(=O)O,mutagenic
+118995-83-8,NC(CCC(=O)NC(CSC(=O)NCCCCl)C(=O)NCC(=O)O)C(=O)O,mutagenic
+106449-56-3,Nc1nc(O)nc2c1ncn2C3CC(O)C(CO)O3,non-mutagenic
+491-36-1,Oc1ncnc2ccccc12,non-mutagenic
+14129-84-1,ClC(Cl)C(=C(Cl)Cl)C=O,mutagenic
+326-61-4,CC(=O)OCc1ccc2OCOc2c1,non-mutagenic
+126572-79-0,OC(=O)\C(=C(\C(Cl)Cl)/C(=O)O)\Cl,mutagenic
+481-72-1,OCc1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1,mutagenic
+53473-85-1,Nc1ccc2sncc2c1,mutagenic
+109875-50-5,Nc1[nH]c(nc2ncnc12)c3ccc(cc3)[N+](=O)[O-],mutagenic
+149-30-4,Sc1nc2ccccc2s1,non-mutagenic
+35691-65-7,BrC[C@](Br)(CCC#N)C#N,non-mutagenic
+1562-94-3,COc1ccc(cc1)N=[N+]([O-])c2ccc(OC)cc2,mutagenic
+122-14-5,COP(=S)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-],mutagenic
+100-29-8,CCOc1ccc(cc1)[N+](=O)[O-],mutagenic
+76547-98-3,NCCCC[C@H](N[C@@H](CCc1ccccc1)C(=O)O)C(=O)N2CCC[C@H]2C(=O)O,non-mutagenic
+15721-02-5,Nc1cc(Cl)c(cc1Cl)c2cc(Cl)c(N)cc2Cl,mutagenic
+13010-47-4,ClCCN(N=O)C(=O)NC1CCCCC1,mutagenic
+3731-39-3,CN(C)c1ccc(cc1)N=Nc2ccccc2C,non-mutagenic
+128714-75-0,[O-][N+](=O)c1ccc2ccc3c(c4ccccc4c5ccc1c2c35)[N+](=O)[O-],mutagenic
+71400-34-5,[O-][N+](=O)c1ccc2Oc3ccc(cc3Oc2c1)[N+](=O)[O-],mutagenic
+151378-34-6,O[C@@H]1[C@@H]2O[C@@H]2c3c(ccc4c5cccc6cccc(c34)c56)[C@H]1O,mutagenic
+84-68-4,Nc1ccc(c(Cl)c1)c2ccc(N)cc2Cl,mutagenic
+471-80-7,CC12CCCC(C)(C1CCC34CC(=C)C(O)(CCC23)C4)C(=O)O,mutagenic
+13676-54-5,O=C1C=CC(=O)N1c2ccc(Cc3ccc(cc3)N4C(=O)C=CC4=O)cc2,non-mutagenic
+NOCAS_M549,CCCC[C@H](CC)C(=O)O,non-mutagenic
+25155-23-1,Cc1ccc(OP(=O)(Oc2ccc(C)cc2C)Oc3ccc(C)cc3C)c(C)c1,non-mutagenic
+69458-17-9,CCCCCCCCCCCCCOC(=O)C[N+](CC)(CC)CC,non-mutagenic
+1571-08-0,COC(=O)c1ccc(C=O)cc1,non-mutagenic
+122547-49-3,CC(O)C1C2SC(=C(N2C1=O)C(=O)O)C3CCCO3,non-mutagenic
+88552-47-0,ClC1=CC(=O)C(Cl)(Cl)C1=O,mutagenic
+84807-61-4,CC1(C)CCCC2(C)C1CCC3(C)C2CC=C(C=O)C3C=O,non-mutagenic
+1516-73-0,Cn1c(N=N#N)nc2ccccc12,mutagenic
+57830-29-2,CN(C)CCN(Cc1ccc(O)cc1)c2ccccn2,non-mutagenic
+4825-86-9,CC1Cc2ccc(C(=O)NC(Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1,non-mutagenic
+77-92-9,OC(=O)CC(O)(CC(=O)O)C(=O)O,non-mutagenic
+58139-52-9,[O-][N+](=O)c1csc(c1)c2csc(NC=O)n2,mutagenic
+7779-30-8,CCC(=O)\C=C\C1C(=CCCC1(C)C)C,non-mutagenic
+122-66-7,N(Nc1ccccc1)c2ccccc2,mutagenic
+104485-01-0,CCCCCOc1cccc(NC(=O)OC2CCCCC2N3CCCC3)c1,non-mutagenic
+102-69-2,CCCN(CCC)CCC,non-mutagenic
+170660-62-5,ClC(=C1CC(=O)NC1=O)Cl,mutagenic
+516-06-3,CC(C)C(N)C(=O)O,non-mutagenic
+123-68-2,CCCCCC(=O)OCC=C,non-mutagenic
+98-16-8,Nc1cccc(c1)C(F)(F)F,non-mutagenic
+93-27-6,COc1cc(ccc1NC(=O)C)[N+](=O)[O-],mutagenic
+133331-34-7,CC(C)CCC[C@@H](C)[C@@H]1CC[C@@H]2[C@@H]3CC4([C@@H]5C[C@@H](Br)CC[C@]5(C)[C@@H]3CC[C@]12C)S(=O)(=O)CCS4(=O)=O,mutagenic
+6884-87-3,CNS(=O)(=O)c1ccc(NC(=O)C)cc1,non-mutagenic
+30516-87-1,CC1=CN([C@@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)C(=O)NC1=O,mutagenic
+120812-50-2,[O-][N+](=O)c1cc(c2c3CCCCc3c4cccc5ccc1c2c45)[N+](=O)[O-],mutagenic
+16219-99-1,CN(N=O)c1ccncc1,non-mutagenic
+115-53-7,COC1=C[C@@H]2[C@@H]3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O,non-mutagenic
+116-06-3,CNC(=O)O\N=C/C(C)(C)SC,non-mutagenic
+34250-70-9,CC(=O)Nc1snc2ccccc12,mutagenic
+106686-68-4,C=CCN(CC=C)C1C(N2C3C2c4ccccc4c5ccccc35)c6ccccc6c7ccccc17,non-mutagenic
+122587-20-6,CC(=O)c1oc(c(Cl)c1Cl)[N+](=O)[O-],mutagenic
+62960-69-4,CC(O)C(NC(=O)C(C)C(O)C(C)NC(=O)C(NC(=O)c1nc(nc(N)c1C)C(CC(=O)N)NCC(N)C(=O)N)C(OC2OC(CO)C(O)C(O)C2OC3OC(CO)C(O)C(OC(=O)N)C3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCc7c[nH]cn7,mutagenic
+146795-35-9,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccc(F)cc2,mutagenic
+215226-74-7,OC(=O)\C(=C(/CCl)\C(=O)O)\Cl,non-mutagenic
+708-42-9,CCCNc1snc2ccccc12,non-mutagenic
+141691-41-0,Cn1c(N)nc2cc(ccc12)C#N,mutagenic
+105427-02-9,O=C(NCc1ccccc1)C2CO2,mutagenic
+3034-42-2,Cn1cncc1[N+](=O)[O-],mutagenic
+1073-05-8,O=S1(=O)OCCCO1,mutagenic
+1878-66-6,OC(=O)Cc1ccc(Cl)cc1,non-mutagenic
+99-07-0,CN(C)c1cccc(O)c1,mutagenic
+779-03-3,Nc1c2ccccc2cc3ccccc13,mutagenic
+98-74-8,[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Cl,mutagenic
+579-66-8,CCc1cccc(CC)c1N,mutagenic
+1204-72-4,Cc1cc2ccccc2cc1[N+](=O)[O-],non-mutagenic
+109527-10-8,CC(=O)OC1COC(Nc2ccc(cc2)[N+](=O)[O-])C(OC(=O)C)C1OC(=O)C,mutagenic
+38966-21-1,CC1(CO)C(O)CCC2(C)C1CCC3CC4CC23CCC4(O)CO,non-mutagenic
+10264-12-7,CCC(=O)NCc1ccccc1,non-mutagenic
+NOCAS_M87,C[C@@H](Cl)CCl,mutagenic
+NOCAS_M343,OC(=O)[C@H]1[C@@H](C(=O)O)[C@@]2(Cl)C(=C(Cl)[C@]1(Cl)C2(Cl)Cl)Cl,non-mutagenic
+101328-96-5,ClC1(Cl)C(=O)C=CC1=O,mutagenic
+24966-35-6,CNC(=O)N(O)C(=O)NC,non-mutagenic
+590-17-0,BrCC#N,non-mutagenic
+58139-48-3,[O-][N+](=O)c1ccc(s1)c2nc(N3CCOCC3)c4ccccc4n2,mutagenic
+107-29-9,C\C=N/O,mutagenic
+126420-92-6,Fc1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,mutagenic
+2224-15-9,C(COCC1CO1)OCC2CO2,mutagenic
+3567-66-6,Nc1cc(cc2cc(c(N=Nc3ccccc3)c(O)c12)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+836-30-6,[O-][N+](=O)c1ccc(Nc2ccccc2)cc1,non-mutagenic
+2304-83-8,O=C1C=Cc2c(ccc3c2ccc4ccccc34)C1=O,non-mutagenic
+6098-45-9,CC(=O)N(OC(=O)c1ccccc1)c2ccc3c(Cc4ccccc34)c2,mutagenic
+82085-94-7,NC[C@@H]1CC[C@H](CC1)C(=O)c2ccc(CCC(=O)O)cc2,non-mutagenic
+92557-61-4,Cn1cc(CC2(O)C(=O)CC3C(O)COC23O)c4ccccc14,mutagenic
+4437-51-8,CCC(=O)C(=O)CC,mutagenic
+505-60-2,ClCCSCCCl,mutagenic
+110021-94-8,CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc4ccc(cc24)N=N#N)cc1,mutagenic
+13593-03-8,CCOP(=S)(OCC)Oc1cnc2ccccc2n1,non-mutagenic
+93-79-8,CCCCOC(=O)COc1cc(Cl)c(Cl)cc1Cl,non-mutagenic
+NOCAS_M315,CCCC(=O)Nc1ccc(OC[C@H](O)CNC(C)C)c(c1)C(=O)C,non-mutagenic
+51042-51-4,[O-][N+](=O)c1ccc(\C=C\c2cccc(c2)[N+](=O)[O-])cc1,mutagenic
+54992-23-3,OC(=O)c1ccc(\C=C\c2oc(cc2)[N+](=O)[O-])cc1,mutagenic
+132-86-5,Oc1cc(O)c2ccccc2c1,mutagenic
+101-39-3,C\C(=C\c1ccccc1)\C=O,non-mutagenic
+114460-40-1,Cc1cc2[nH]c(C)nc2c3c1ccc4ccc(O)cc34,mutagenic
+476-43-7,Cc1cc(O)c2C(=O)c3c(O)ccc(O)c3C(=O)c2c1O,mutagenic
+22204-53-1,COc1ccc2cc(ccc2c1)C(C)C(=O)O,non-mutagenic
+118-08-1,COc1ccc2[C@H](OC(=O)c2c1OC)[C@@H]3N(C)CCc4cc5OCOc5cc34,non-mutagenic
+161708-24-3,C\C(=C(\Cl)/C(=O)O)\C(=O)O,non-mutagenic
+1570-64-5,Cc1cc(Cl)ccc1O,non-mutagenic
+570-74-1,CC(C)CCCC(C)C1CCC2C3CC=C4CCCCC4(C)C3CCC12C,non-mutagenic
+31272-21-6,Cc1nn(C)c(N)c1C(=O)c2ccccc2F,mutagenic
+943-93-1,C1C\C=C\CCC2OC2CC\C=C/1,non-mutagenic
+700-02-7,Nc1c2[nH]cnc2nc[n+]1[O-],mutagenic
+565-20-8,CC(=O)Nc1ccc(cc1)S(=O)(=O)c2ccc(N)cc2,non-mutagenic
+60223-52-1,COc1ccc2c(c1)c3cc(OC)ccc3c4c5ccc(OC)cc5c6cc(OC)ccc6c24,mutagenic
+554-00-7,Nc1ccc(Cl)cc1Cl,mutagenic
+557-61-9,CCCCCCCCCCCCCCCCCCCCCCCCCCCCO,non-mutagenic
+126-98-7,CC(=C)C#N,non-mutagenic
+74-89-5,CN,non-mutagenic
+343-94-2,NCCc1c[nH]c2ccccc12,non-mutagenic
+1640-39-7,CC1=Nc2ccccc2C1(C)C,non-mutagenic
+64894-90-2,CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc4cc(ccc24)N=N#N)cc1,mutagenic
+821-06-7,BrC\C=C/CBr,mutagenic
+64188-66-5,CCCCN1C2C1c3ccccc3c4ccccc24,mutagenic
+700-86-7,Nc1snc2cc(Cl)ccc12,mutagenic
+113359-04-9,CO\N=C(/C(=O)NC1C2SCC(=C(N2C1=O)C(=O)O)C[n+]3ccn4ncccc34)\c5nsc(N)n5,non-mutagenic
+NOCAS_M1,CC[C@@H](C)ON=O,mutagenic
+4406-41-1,CC(C)C(=O)Nc1ccccc1,non-mutagenic
+235760-36-8,Cc1cc(C)c2nsnc2c1[N+](=O)[O-],mutagenic
+95-82-9,Nc1cc(Cl)ccc1Cl,non-mutagenic
+50385-24-5,[O-][N+](=O)c1ccccc1\C=C\c2ccccn2,mutagenic
+98033-25-1,Cc1nc2c(ccc3ccc4ccc(O)cc4c23)n1C,mutagenic
+46817-91-8,CCOc1ccccc1OCC2CNCCO2,non-mutagenic
+119525-97-2,CCC\C=C\C(=O)OC1C(C)(C)CC2C1(O)C=C(C=O)C34CC23C(=O)OC4O,mutagenic
+61740-00-9,COc1cc2O[C@H]3OC=C[C@H]3c2c4OC(=O)C5=C(CC[C@@H]5O)c14,mutagenic
+35281-25-5,C1c2ccccc2Cc3c1c4ccccc4c5ccccc35,mutagenic
+104527-49-3,OCC12COC(N1C(OC2)c3ccc(cc3)[N+](=O)[O-])c4ccc(cc4)[N+](=O)[O-],mutagenic
+85068-73-1,CCN(CCO[N+](=O)[O-])[N+](=O)[O-],mutagenic
+528-74-5,CN(Cc1cnc2nc(N)nc(N)c2n1)c3c(Cl)cc(cc3Cl)C(=O)N[C@@H](CCC(=O)O)C(=O)O,non-mutagenic
+62625-14-3,Nc1cc(cc(Cl)c1O)[N+](=O)[O-],mutagenic
+641-90-7,Cc1cc2C(=O)c3cc(O)cc(O)c3C(=O)c2c(O)c1O,mutagenic
+2381-31-9,Cc1cccc2cc3c(ccc4ccccc34)cc12,mutagenic
+24684-41-1,Cc1cc2CCCc2c3ccc4ccccc4c13,non-mutagenic
+3060-89-7,CON(C)C(=O)Nc1ccc(Br)cc1,non-mutagenic
+125579-40-0,CC(=O)c1cc(NC(=O)Nc2ccc(OCC(O)CNC(C)(C)C)c(c2)C(=O)C)ccc1OCC(O)CNC(C)(C)C,non-mutagenic
+121-87-9,Nc1ccc(cc1Cl)[N+](=O)[O-],mutagenic
+27093-62-5,Cn1c2ccc3ccccc3c2c4c5ccccc5ccc14,mutagenic
+612-59-9,Clc1cnc2ccccc2c1,non-mutagenic
+298-00-0,COP(=S)(OC)Oc1ccc(cc1)[N+](=O)[O-],mutagenic
+7125-53-3,C1CCC2CC3(CCC2C1)CO3,non-mutagenic
+71461-13-7,Oc1ccc(cc1)C2Oc3ccc4cc3C2C(=O)N5CCCCNCCCNC4CC(=O)NCCC5,mutagenic
+932-53-6,Cc1nnc(O)nc1O,non-mutagenic
+134959-57-2,Clc1ccc(COC(=O)c2cccc3cccnc23)c(Cl)c1,non-mutagenic
+50-99-7,OCC(O)C(O)C(O)C(O)C=O,non-mutagenic
+484-17-3,Oc1cc2ccccc2c3ccccc13,mutagenic
+2855-13-2,CC1(C)CC(N)CC(C)(CN)C1,non-mutagenic
+111-20-6,OC(=O)CCCCCCCCC(=O)O,non-mutagenic
+137-09-7,Nc1ccc(O)c(N)c1,mutagenic
+94470-50-5,OC1CCC(O)(CN(N=O)C(C(=O)O)C(=O)O)C(O)C1O,non-mutagenic
+87480-50-0,OC1C(O)c2c(Br)c3ccccc3cc2c4ccccc14,non-mutagenic
+91549-70-1,CN(C)CCNC(=O)c1ccc2nc3ccccc3c(N)c2c1,non-mutagenic
+6285-68-3,Cc1ccc2[nH]c(N)nc2c1,mutagenic
+60719-84-8,Nc1cc(cnc1O)c2ccncc2,non-mutagenic
+309-00-2,ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@H]4C[C@H](C=C4)[C@@H]3[C@]1(Cl)C2(Cl)Cl,non-mutagenic
+17096-47-8,CN(CCO[N+](=O)[O-])[N+](=O)[O-],mutagenic
+59230-81-8,Cc1c2ccccc2c(CBr)c3c1ccc4ccccc34,mutagenic
+22349-59-3,Cc1ccc(C)c2c1ccc3ccccc23,mutagenic
+105467-77-4,C1CCc2c(C1)ccc3nc4ccc5ccccc5c4cc23,mutagenic
+NOCAS_M540,CC(=O)[C@@H](N=Nc1ccc(cc1Cl)c2ccc(N=N[C@H](C(=O)C)C(=O)Nc3ccccc3)c(Cl)c2)C(=O)Nc4ccccc4,non-mutagenic
+18691-97-9,CNC(=O)N(C)c1nc2ccccc2s1,non-mutagenic
+1728-32-1,COC1=CC=CC=CC1,mutagenic
+25057-89-0,CC(C)N1C(=O)c2ccccc2NS1(=O)=O,non-mutagenic
+74669-74-2,CC(CN=N#N)c1ccccc1,mutagenic
+10159-53-2,NP(=O)(O)N(CCCl)CCCl,mutagenic
+55610-00-9,O=C1Nc2cc3ccccc3c4c5OCOc5cc1c24,mutagenic
+6237-24-7,CN(C)CCCNc1c2ccccc2nc3cc(ccc13)[N+](=O)[O-],mutagenic
+115066-03-0,CCc1cccc2c3CCOC(C)(CC)c3[nH]c12,non-mutagenic
+529-20-4,Cc1ccccc1C=O,non-mutagenic
+90-33-5,CC1=CC(=O)Oc2cc(O)ccc12,non-mutagenic
+67-71-0,CS(=O)(=O)C,non-mutagenic
+7090-25-7,CN(N=O)C(=O)Oc1cccc2ccccc12,mutagenic
+51461-16-6,Cc1ccc2C(=O)c3c(cccc3[N+](=O)[O-])C(=O)c2c1[N+](=O)[O-],mutagenic
+28657-80-9,CCN1N=C(C(=O)O)C(=O)c2cc3OCOc3cc12,mutagenic
+6219-89-2,Cc1cc(N)ccc1c2ccc(O)cc2,mutagenic
+134959-56-1,Clc1ccc(COC(=O)c2cccc3cccnc23)cc1,non-mutagenic
+25148-26-9,Cc1c2ccccc2c(CCl)c3ccccc13,mutagenic
+27975-19-5,C[C@@]12CCC3[C@@](CCC4[C@@]3(C)CCC[C@@]4(C)C(=O)O)(CC1=O)C2,non-mutagenic
+5385-75-1,c1ccc2c(c1)c3cc4ccccc4c5cc6ccccc6c2c35,mutagenic
+143922-98-9,CC(=O)Nc1cccc(N=[N+]([O-])c2cccc(NC(=O)C)c2C)c1C,non-mutagenic
+97136-66-8,Cc1ccc(\C=C\c2ccc(N)cc2)cc1,mutagenic
+619-15-8,Cc1cc(ccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+116-29-0,Clc1ccc(cc1)S(=O)(=O)c2cc(Cl)c(Cl)cc2Cl,non-mutagenic
+105837-00-1,[O-][N+](=O)c1ccc2nc3ccc(cc3nc2c1)[N+](=O)[O-],mutagenic
+506-77-4,ClC#N,non-mutagenic
+214-17-5,c1ccc2cc3c(ccc4c5ccccc5ccc34)cc2c1,non-mutagenic
+70140-82-8,CC(C)COP(=S)(OCC(C)C)SCCl,non-mutagenic
+96918-17-1,[O-][N+](=O)c1oc2c(c1)cc3ccc4cccc5ccc2c3c45,mutagenic
+680-31-9,CN(C)P(=O)(N(C)C)N(C)C,non-mutagenic
+88598-60-1,OC1C=Cc2cc3ccc4ccc(c5ccc(c2C1O)c3c45)[N+](=O)[O-],mutagenic
+17573-21-6,Oc1ccc2cc3ccc4cccc5ccc(c2c1)c3c45,mutagenic
+623-15-4,CC(=O)\C=C\c1occc1,non-mutagenic
+2489-77-2,CNC(=S)N(C)C,non-mutagenic
+83621-06-1,C\C(=C(\OCCOc1ccc(Cl)cc1)/c2ccc(Cl)cc2Cl)\n3ccnc3,non-mutagenic
+160637-30-9,Cc1ccc2c(C)c3ccc4C(O)C(O)C=Cc4c3nc2c1,mutagenic
+84-61-7,O=C(OC1CCCCC1)c2ccccc2C(=O)OC3CCCCC3,non-mutagenic
+82389-37-5,O=C(C1OC1c2ccccc2)c3ccc(cc3)c4ccccc4,non-mutagenic
+61166-05-0,Cn1c2ccccc2c3cc(ccc13)[N+](=O)[O-],mutagenic
+1818-71-9,Nc1nc(O)nc2c1ncn2C3OC(CO)C(O)C3O,non-mutagenic
+612-60-2,Cc1ccc2cccnc2c1,mutagenic
+104-03-0,OC(=O)Cc1ccc(cc1)[N+](=O)[O-],mutagenic
+134523-00-5,CC(C)c1c(C(=O)Nc2ccccc2)c(c3ccccc3)c(c4ccc(F)cc4)n1CCC(O)CC(O)CC(=O)O,non-mutagenic
+135086-96-3,CC(=O)Nc1ccc(\C=N\n2nnc3ccnc3c2O)cc1,mutagenic
+NOCAS_M113,CC(=O)c1cc(NC(=O)N)ccc1OC[C@H](O)CNC(C)(C)C,mutagenic
+111858-64-1,OC1COC(C(O)C1O)N(N=O)c2ccc(cc2)C(=O)O,mutagenic
+56362-05-1,CCOP(=O)(NC(C)CC)Oc1cc(C)ccc1[N+](=O)[O-],non-mutagenic
+1199-18-4,NCCc1cc(O)c(O)cc1O,mutagenic
+122-59-8,OC(=O)COc1ccccc1,non-mutagenic
+591-87-7,CC(=O)OCC=C,mutagenic
+577-19-5,[O-][N+](=O)c1ccccc1Br,mutagenic
+2212-67-1,CCSC(=O)N1CCCCCC1,non-mutagenic
+21829-25-4,COC(=C1C(C(=C(C)N=C1C)C(=O)OC)c2ccccc2[N+](=O)[O-])O,non-mutagenic
+109875-45-8,Nc1nc(nc2c1ncn2C3CC(O)C(CO)O3)c4ccc(cc4)[N+](=O)[O-],mutagenic
+874-86-2,ClCc1ccc(cc1)C#N,non-mutagenic
+140-08-9,ClCCOP(OCCCl)OCCCl,mutagenic
+90-94-8,CN(C)c1ccc(cc1)C(=O)c2ccc(cc2)N(C)C,mutagenic
+139953-76-7,Oc1ccc(\C=N\n2nnc3c4ccccc4nc3c2O)cc1,mutagenic
+2118-39-0,Nc1cc2c(O)c(N=Nc3ccc(N=Nc4ccc(cc4)S(=O)(=O)O)c5ccc(cc35)S(=O)(=O)O)c(cc2cc1S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+301-12-2,CCS(=O)CCSP(=O)(OC)OC,mutagenic
+2540-82-1,COP(=S)(OC)SCC(=O)N(C)C=O,non-mutagenic
+520-36-5,Oc1ccc(cc1)C2=CC(=O)c3c(O)cc(O)cc3O2,non-mutagenic
+1975-52-6,Cc1ccc(cc1C(=O)O)[N+](=O)[O-],mutagenic
+109897-79-2,OC1C=Cc2cc3cc(ccc3cc2C1O)[N+](=O)[O-],mutagenic
+13306-69-9,COP(=S)(OC)Oc1ccc(N)c(C)c1,mutagenic
+25590-58-3,C[CH-][N+](=O)[O-],non-mutagenic
+97461-39-7,CC(C)(C)OC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+123-11-5,COc1ccc(C=O)cc1,non-mutagenic
+313-80-4,c1cc2ccc3ccnc4ccc(c1)c2c34,mutagenic
+961-11-5,COP(=O)(OC)O\C(=C/Cl)\c1cc(Cl)c(Cl)cc1Cl,non-mutagenic
+612-58-8,Cc1cnc2ccccc2c1,mutagenic
+3544-23-8,COc1cc(ccc1N)N=Nc2ccccc2,mutagenic
+881-03-8,Cc1ccc2ccccc2c1[N+](=O)[O-],mutagenic
+52-51-7,OCC(Br)(CO)[N+](=O)[O-],non-mutagenic
+6281-23-8,OC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+90-00-6,CCc1ccccc1O,non-mutagenic
+52559-52-1,CCc1cccc(CC)c1NC(=O)CO,mutagenic
+90421-79-7,C(Oc1nsc2ccccc12)C3CO3,mutagenic
+89213-87-6,CC[C@H](C)[C@@H]1NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](CCC(=O)N)NC(=O)[C@@H](C)NC(=O)CNC1=O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@H](Cc3ccccc3)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc4ccc(O)cc4)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO,non-mutagenic
+503-30-0,C1COC1,mutagenic
+50283-78-8,CCN(CC)CCNc1ccc(COC(=O)c2occc2)c3Sc4ccccc4C(=O)c13,mutagenic
+78-88-6,ClCC(=C)Cl,mutagenic
+87633-43-0,COCC1CN(C)C2Cc3cn(C)c4cccc(C2=C1)c34,mutagenic
+NOCAS_M358,C[C@@H](CCN(C)C)N(C)C,non-mutagenic
+53219-95-7,OC(=O)CCC(=O)Nc1cc(Cl)cc(Cl)c1,non-mutagenic
+6164-98-3,CN(C)\C=N\c1ccc(Cl)cc1C,non-mutagenic
+143922-95-6,Cc1c(cccc1[N+](=O)[O-])N=O,non-mutagenic
+6271-79-0,Nc1ccc(cc1[N+](=O)[O-])c2ccc(N)c(c2)[N+](=O)[O-],mutagenic
+57576-44-0,CCC1(O)CC(OC2CC(C(OC3CC(O)C(OC4CCC(=O)C(C)O4)C(C)O3)C(C)O2)N(C)C)c5c(O)c6C(=O)c7c(O)cccc7C(=O)c6cc5C1C(=O)OC,mutagenic
+1455-77-2,Nc1n[nH]c(N)n1,non-mutagenic
+581-29-3,Nc1ccc2cc3ccccc3nc2c1,mutagenic
+14698-29-4,CCN1C=C(C(=O)O)C(=O)c2cc3OCOc3cc12,mutagenic
+135086-90-7,Oc1c2nc3ccccc3c2nnn1\N=C\c4ccc(cc4)c5ccccc5,non-mutagenic
+124-18-5,CCCCCCCCCC,non-mutagenic
+6237-22-5,CN(C)CCCNc1c2ccccc2nc3ccc(cc13)[N+](=O)[O-],mutagenic
+NOCAS_M71,COc1cc(N[C@H](C)CCCN)c2ncccc2c1,mutagenic
+74550-97-3,O=C1CN(CCN2CC(=O)N(CN3CCOCC3)C(=O)C2)CC(=O)N1CN4CCOCC4,mutagenic
+87-84-3,ClC1C(Br)C(Br)C(Br)C(Br)C1Br,non-mutagenic
+4067-16-7,NCCNCCNCCNCCNCCN,mutagenic
+502-44-3,O=C1CCCCCO1,non-mutagenic
+108-43-0,Oc1cccc(Cl)c1,non-mutagenic
+39834-38-3,Cc1c2C3OC3c4ccccc4c2c(C)c5ccccc15,mutagenic
+73077-95-9,Oc1cc2OCOc2cc1N=O,mutagenic
+103-85-5,NC(=S)Nc1ccccc1,non-mutagenic
+1477-55-0,NCc1cccc(CN)c1,non-mutagenic
+539-48-0,NCc1ccc(CN)cc1,non-mutagenic
+122-40-7,CCCCC\C(=C\c1ccccc1)\C=O,non-mutagenic
+80556-89-4,OCCN(CC(=O)O)N=O,mutagenic
+129286-37-9,Fc1cccc2c3c(ccc12)c4cccc5cccc3c45,mutagenic
+113-92-8,CN(C)CCC(c1ccc(Cl)cc1)c2ccccn2,non-mutagenic
+65089-17-0,Cc1cccc(C)c1Nc2cc(Cl)nc(SCC(=O)NCCO)n2,non-mutagenic
+1126-61-0,Oc1ccc(CC=C)cc1O,mutagenic
+105-48-6,CC(C)OC(=O)CCl,non-mutagenic
+2818-69-1,Cc1nc2cc(Cl)ccc2[nH]1,mutagenic
+108-95-2,Oc1ccccc1,non-mutagenic
+NOCAS_M489,CC[C@@H]([C@@H](C)O)[N+](=O)[O-],non-mutagenic
+3296-90-0,OCC(CO)(CBr)CBr,mutagenic
+6285-57-0,Nc1nc2ccc(cc2s1)[N+](=O)[O-],mutagenic
+19387-91-8,CCS(=O)(=O)CCn1c(C)ncc1[N+](=O)[O-],mutagenic
+58152-03-7,CNC1C(O)C(CCC1(C)O)OC2C(O)C(OC3CC(CN)C(O)C(O)C3O)C(N)CC2NC(=O)C(O)CN,non-mutagenic
+36712-34-2,[O-][N+](=O)c1ccc(cc1)c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-],mutagenic
+5857-92-1,Cc1ccc(cc1N)N=[N+]([O-])c2ccc(C)c(N)c2,mutagenic
+874-89-5,OCc1ccc(cc1)C#N,non-mutagenic
+104-90-5,CCc1ccc(C)nc1,non-mutagenic
+60877-99-8,[O-][N+](=O)c1ccc(\C=N\c2snc3ccccc23)cc1,mutagenic
+159092-70-3,[O-][N+](=O)c1ccc2c(c1)cc(c3ccccc23)[N+](=O)[O-],mutagenic
+477-84-9,COc1c(C=O)c(O)cc2C(=O)c3ccccc3C(=O)c12,non-mutagenic
+102-96-5,[O-][N+](=O)\C=C\c1ccccc1,mutagenic
+2244-16-8,CC(=C)[C@@H]1CC=C(C)C(=O)C1,non-mutagenic
+522-40-7,CC\C(=C(\CC)/c1ccc(OP(=O)(O)O)cc1)\c2ccc(OP(=O)(O)O)cc2,non-mutagenic
+568-75-2,Cc1c2ccccc2c(CO)c3ccc4ccccc4c13,mutagenic
+163275-57-8,Fc1cnc2c(ccc3ccccc23)c1,non-mutagenic
+1874-12-0,CCOC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+114480-41-0,CC(=O)Nc1nc2c3cccnc3cc(C)c2n1C,mutagenic
+96-23-1,OC(CCl)CCl,mutagenic
+100490-36-6,NC1CCN(C1)c2nc3N(C=C(C(=O)O)C(=O)c3cc2F)c4ccc(F)cc4F,mutagenic
+5002-47-1,CCCCCCCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1,non-mutagenic
+141-75-3,CCCC(=O)Cl,mutagenic
+1456-55-9,COc1c(Cl)cc2c(N(C)C3N4C(=O)C5(C)SSC4(C(O)C23O)C(=O)N5C)c1OC,non-mutagenic
+1928-43-4,CCCCC(CC)COC(=O)COc1ccc(Cl)cc1Cl,non-mutagenic
+2349-67-9,Nc1nnc(S)s1,non-mutagenic
+70634-28-5,CC(C)(C)c1cc(ccc1[N+](=O)[O-])c2ccccc2,non-mutagenic
+83-07-8,CN1N(C(=O)C(=C1C)N)c2ccccc2,non-mutagenic
+302-17-0,OC(O)C(Cl)(Cl)Cl,mutagenic
+73-31-4,COc1ccc2[nH]cc(CCNC(=O)C)c2c1,non-mutagenic
+60599-38-4,CC(=O)CN(CC(=O)C)N=O,mutagenic
+126371-00-4,[O-][N+](=O)c1ccc(CN2C3C2c4ccccc4c5ccccc35)cc1,mutagenic
+91991-19-4,ClCC(=O)Nc1snc2ccc(Cl)cc12,mutagenic
+60-56-0,Cn1ccnc1S,non-mutagenic
+120302-30-9,OCCc1c[nH]c2cc(ccc12)[N+](=O)[O-],mutagenic
+110-65-6,OCC#CCO,non-mutagenic
+501-52-0,OC(=O)CCc1ccccc1,non-mutagenic
+86674-51-3,O=Nc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+90866-04-9,Cc1ccc(NCC2(O)OCC(O)C(O)C2O)cc1,non-mutagenic
+10595-95-6,CCN(C)N=O,mutagenic
+141-04-8,CC(C)COC(=O)CCCCC(=O)OCC(C)C,non-mutagenic
+65-86-1,OC(=O)c1cc(O)nc(O)n1,non-mutagenic
+NOCAS_M70,C(CCOC[C@H]1CO1)COC[C@H]2CO2,mutagenic
+148193-34-4,COc1nsc2ccc(OCC3CO3)cc12,mutagenic
+16301-26-1,CCN=[N+]([O-])CC,non-mutagenic
+91991-21-8,CCCC(=O)Nc1snc2ccc(Cl)cc12,non-mutagenic
+98-15-7,FC(F)(F)c1cccc(Cl)c1,non-mutagenic
+155379-81-0,CC(C)c1cc(N)cc(c1N)[N+](=O)[O-],non-mutagenic
+121-90-4,[O-][N+](=O)c1cccc(c1)C(=O)Cl,mutagenic
+607-91-0,COc1cc(CC=C)cc2OCOc12,non-mutagenic
+57491-68-6,Nc1ccccc1SCSc2ccccc2N,mutagenic
+16219-98-0,CN(N=O)c1ccccn1,mutagenic
+6344-66-7,Nc1ccc2Cc3ccccc3c2c1,mutagenic
+136587-13-8,NCCCNCCCCN(CCCN)N(O)N=O,mutagenic
+4003-94-5,[O-][N+](=O)c1ccc(\C=C\c2ccccc2)cc1,mutagenic
+513-37-1,CC(=CCl)C,mutagenic
+78914-74-6,CN(C)c1ccc(cc1)N=Nc2ccccc2COC(=O)C,mutagenic
+462-95-3,CCOCOCC,non-mutagenic
+NOCAS_M366,C[C@@H]1CC[C@H]2[C@@H](C)[C@H]3[C@@H](C[C@H]4[C@H]5CC=C6C[C@H](CC[C@]6(C)[C@@H]5CC[C@]34C)O[C@@H]7O[C@H](CO)[C@@H](O[C@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O[C@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)[C@H](O)[C@H]7O)N2C1,non-mutagenic
+59865-13-3,CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C,non-mutagenic
+101-02-0,O(P(Oc1ccccc1)Oc2ccccc2)c3ccccc3,non-mutagenic
+123-28-4,CCCCCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCC,non-mutagenic
+92-55-7,CC(=O)OC(OC(=O)C)c1oc(cc1)[N+](=O)[O-],mutagenic
+2160-93-2,CC(C)(C)N(CCO)CCO,non-mutagenic
+199536-64-6,OC1OC(=O)C(=C1CBr)Br,mutagenic
+220168-41-2,COc1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,mutagenic
+85-60-9,CCCC(c1cc(c(O)cc1C)C(C)(C)C)c2cc(c(O)cc2C)C(C)(C)C,non-mutagenic
+120693-41-6,CCc1c2ccccc2cc3c4C5OC5C(O)C(O)c4ccc13,mutagenic
+125-33-7,CCC1(C(=O)NCNC1=O)c2ccccc2,mutagenic
+138835-34-4,[O-][N+](=O)c1ccc2ccc3c4ccccc4[n+]([O-])c5ccc1c2c35,mutagenic
+89786-04-9,CC1(Cn2ccnn2)C(N3C(CC3=O)S1(=O)=O)C(=O)O,non-mutagenic
+13603-07-1,C[C@H]1CCCN(C1)N=O,mutagenic
+1947-37-1,CSCCC(NC(=O)C(N)Cc1c[nH]c2ccccc12)C(=O)NC(CC(=O)O)C(=O)NC(Cc3ccccc3)C(=O)N,non-mutagenic
+637-92-3,CCOC(C)(C)C,non-mutagenic
+33372-39-3,OCCN(CCO)c1nc(nc2ccccc12)c3ccc(s3)[N+](=O)[O-],mutagenic
+103-80-0,ClC(=O)Cc1ccccc1,mutagenic
+101901-08-0,CCC1(CC(=O)O)OCCc2c1[nH]c3c(cccc23)C(C)O,non-mutagenic
+70-11-1,BrCC(=O)c1ccccc1,non-mutagenic
+54755-21-4,Cc1ccc2cccc(c2c1)[N+](=O)[O-],mutagenic
+611-22-3,Cc1ccccc1NO,mutagenic
+1135-24-6,COc1cc(\C=C\C(=O)O)ccc1O,non-mutagenic
+21416-67-1,CC(CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2,non-mutagenic
+77996-03-3,CN1c2ccccc2C(=O)c3c(O)cc4OC(Cc4c13)C5(C)CO5,mutagenic
+112575-91-4,O=C1C=C2c3cc4ccccc4cc3c5cccc(C1=O)c25,mutagenic
+57-63-6,CC12CCC3C(CCc4cc(O)ccc34)C1CCC2(O)C#C,non-mutagenic
+75-83-2,CCC(C)(C)C,non-mutagenic
+213-46-7,c1ccc2c(c1)ccc3c2ccc4c5ccccc5ccc34,mutagenic
+159092-76-9,[O-][N+](=O)c1cccc2c1cc(c3cccc(c23)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+NOCAS_M21,C[C@@H](O)CN(C[C@H](O)CO)N=O,mutagenic
+7779-77-3,CC(C)COC(=O)c1ccccc1N,non-mutagenic
+357204-49-0,COc1cccc(c1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,mutagenic
+509-93-3,CC1CCC2C(OC(=O)C2=C)C3(C)C1C=CC3=O,non-mutagenic
+70021-98-6,[O-][N+](=O)c1ccc2ccc3c4ccccc4cc5ccc1c2c35,mutagenic
+139347-89-0,Cc1c(C)c2c3C4OC4C(O)C(O)c3ccc2c5ccccc15,mutagenic
+120812-48-8,[O-][N+](=O)c1ccc2c3ccccc3c4c(ccc5ccc1c2c45)[N+](=O)[O-],mutagenic
+23434-96-0,COC(=O)C(N)Cc1ccc(Cl)cc1,non-mutagenic
+NOCAS_M290,N1[C@@H]2[C@H]1c3c(c4ccccc24)c5ccccc5c6ccccc36,mutagenic
+61434-48-8,COc1cc2C(=O)c3ccccc3C(=O)c2c(OC)c1CO,non-mutagenic
+114460-39-8,Cc1nc2ccc3ccc4ccc(O)cc4c3c2n1C,mutagenic
+42924-53-8,COc1ccc2cc(CCC(=O)C)ccc2c1,non-mutagenic
+16156-53-9,CC(C)COS(=O)(=O)C,mutagenic
+528-45-0,OC(=O)c1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+89784-39-4,CC(=O)N[C@@H](CS\C(=C(/Cl)\C(=C(Cl)Cl)Cl)\Cl)C(=O)O,mutagenic
+2381-21-7,Cc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+4164-28-7,CN(C)[N+](=O)[O-],mutagenic
+101-14-4,Nc1ccc(Cc2ccc(N)c(Cl)c2)cc1Cl,mutagenic
+88847-41-0,OC1C2OC2c3c(ccc4c3ccc5ccc(O)cc45)C1O,mutagenic
+153117-10-3,CCCCN(CC(CO)OCc1ccccc1)N=O,mutagenic
+146795-29-1,Cc1ccc(NC(=O)c2csc(c2)[N+](=O)[O-])cc1,mutagenic
+64920-31-6,O[C@@H]1C=Cc2c(ccc3c2ccc4ccccc34)[C@H]1O,mutagenic
+2892-51-5,OC1=C(O)C(=O)C1=O,non-mutagenic
+107534-94-1,C[C@]12CC[C@H]3[C@@H](CC=C4NC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2OC(=O)CCCc5ccc(cc5)N(CCCl)CCCl,mutagenic
+20846-00-8,CC(=[N+]([O-])[O-])C,mutagenic
+60883-97-8,Cc1ccc(cc1)S(=O)(=O)N2C3C2c4ccccc4c5ccccc35,mutagenic
+4637-56-3,ONc1cc[n+]([O-])c2ccccc12,mutagenic
+138580-46-8,CC1=CC(=O)c2[nH]c(C)c3c4ccccc4nc3c2C1=O,mutagenic
+159092-72-5,[O-][N+](=O)c1ccc2ccc3cccc(c3c2c1)[N+](=O)[O-],mutagenic
+510-15-6,CCOC(=O)C(O)(c1ccc(Cl)cc1)c2ccc(Cl)cc2,non-mutagenic
+109380-31-6,CCOC(=O)C(C#N)c1snc2c(cccc12)[N+](=O)[O-],mutagenic
+66789-80-8,OC(=O)CC(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C(=O)O,non-mutagenic
+4251-89-2,CCN(CCCl)CCCNc1c2ccccc2nc3c1ccc4ccccc34,mutagenic
+1194-65-6,Clc1cccc(Cl)c1C#N,non-mutagenic
+57835-92-4,[O-][N+](=O)c1cc2cccc3ccc4cccc1c4c23,mutagenic
+65445-60-5,Cl[C@H]1CCCN(C1)N=O,mutagenic
+30489-67-9,Cn1c(N)nc2cc3ccccc3cc12,mutagenic
+192705-54-7,CC(=O)Nc1ccc2c3cc(O)ccc3c4cccc1c24,mutagenic
+13195-64-7,CC(C)OC(=O)CC(=O)OC(C)C,non-mutagenic
+1193-24-4,Oc1cc(O)ncn1,non-mutagenic
+84434-45-7,Cc1ccccc1N=Nc2ccc(N)c(C)c2N,mutagenic
+35203-91-9,NS(=O)(=O)c1cccc2cccnc12,non-mutagenic
+349-95-1,OCc1ccc(cc1)C(F)(F)F,non-mutagenic
+634-90-2,Clc1cc(Cl)c(Cl)c(Cl)c1,non-mutagenic
+6112-76-1,Sc1[nH]cnc2ncnc12,mutagenic
+139627-44-4,Cc1cccc2c1cc(C)c3c4C5OC5C(O)C(O)c4ccc23,mutagenic
+645-00-1,[O-][N+](=O)c1cccc(I)c1,non-mutagenic
+120-61-6,COC(=O)c1ccc(cc1)C(=O)OC,non-mutagenic
+20970-16-5,NNc1nncc2ncccc12,mutagenic
+860-22-0,Oc1c([nH]c2ccc(cc12)S(=O)(=O)O)C3=Nc4ccc(cc4C3=O)S(=O)(=O)O,non-mutagenic
+56413-75-3,NNc1ccccc1[N+](=O)[O-],mutagenic
+87-60-5,Cc1c(N)cccc1Cl,non-mutagenic
+107-87-9,CCCC(=O)C,non-mutagenic
+160543-02-2,Cc1c2ccc3ccccc3c2nc4ccc(CO)cc14,mutagenic
+1195-92-2,CC(=C)C1CCC2(C)OC2C1,non-mutagenic
+51-12-7,O=C(CCNNC(=O)c1ccncc1)NCc2ccccc2,mutagenic
+134874-62-7,[O-][N+](=O)c1cc(c2c3ccccc3c4cccc5ccc1c2c45)[N+](=O)[O-],mutagenic
+120-58-1,C\C=C\c1ccc2OCOc2c1,non-mutagenic
+80984-67-4,N1C2C1c3cc4c(cc3c5ccccc25)C6NC6c7ccccc47,mutagenic
+80-56-8,CC1=CC[C@H]2C[C@@H]1C2(C)C,non-mutagenic
+119143-41-8,OC1C=Cc2ccc3ncccc3c2C1O,non-mutagenic
+18708-70-8,[O-][N+](=O)c1c(Cl)cc(Cl)cc1Cl,non-mutagenic
+16069-36-6,C1CCC2OCCOCCOC3CCCCC3OCCOCCOC2C1,non-mutagenic
+136911-37-0,CN1CCN=N1,mutagenic
+5332-73-0,COCCCN,non-mutagenic
+612-62-4,Clc1ccc2ccccc2n1,non-mutagenic
+105777-13-7,OC1C=CC2=C(C1O)c3cccc4cccc2c34,mutagenic
+67019-21-0,CCCC(=O)Nc1snc2ccccc12,non-mutagenic
+5989-27-5,CC(=C)[C@H]1CCC(=CC1)C,non-mutagenic
+134-81-6,O=C(C(=O)c1ccccc1)c2ccccc2,non-mutagenic
+13177-27-0,Nc1cccc2c3cccc4cccc(c12)c34,mutagenic
+139259-96-4,CC(=O)ON(OCc1ccc(Cl)cc1)C(=O)c2ccccc2,mutagenic
+120-23-0,OC(=O)COc1ccc2ccccc2c1,non-mutagenic
+2177-18-6,C=COC(=O)C=C,non-mutagenic
+119-64-2,C1CCc2ccccc2C1,non-mutagenic
+7235-40-7,C\C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C)\C=C\C=C(/C)\C=C\C2=C(C)CCCC2(C)C,mutagenic
+24602-86-6,CCCCCCCCCCCCCN1CC(C)OC(C)C1,non-mutagenic
+580-19-8,Nc1ccc2cccnc2c1,mutagenic
+772-43-0,N\C(=N/O)\c1oc(cc1)[N+](=O)[O-],mutagenic
+191-24-2,c1cc2ccc3ccc4ccc5cccc6c(c1)c2c3c4c56,mutagenic
+126831-76-3,BrCc1ccc2c3cccc4cccc(c2c1)c34,mutagenic
+106-94-5,CCCBr,non-mutagenic
+61-57-4,[O-][N+](=O)c1cnc(s1)N2CCNC2=O,mutagenic
+633-96-5,Oc1ccc2ccccc2c1N=Nc3ccc(cc3)S(=O)(=O)O,non-mutagenic
+NOCAS_M587,CCCC[C@@H](CC)COC(=O)c1ccccc1C(=O)OC[C@H](CC)CCCC,non-mutagenic
+141-43-5,NCCO,non-mutagenic
+143-27-1,CCCCCCCCCCCCCCCCN,non-mutagenic
+16169-17-8,ONc1ccccc1c2ccccc2,mutagenic
+125239-65-8,COc1cc2nc3cc(N)ccc3nc2cc1N,mutagenic
+16757-82-7,Cc1cc2ccc3cc4ccccc4c5ccc(c1)c2c35,mutagenic
+50474-48-1,ONc1ncnc2c1ncn2Cc3ccccc3,mutagenic
+141890-75-7,Nc1nc2c(ccc3ncccc23)s1,mutagenic
+220168-56-9,CC(C)(C)c1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,mutagenic
+125276-71-3,OC1C2OC2c3c(ccc4nc5c(ccc6ccccc56)cc34)C1O,non-mutagenic
+476-57-3,COc1cc(O)c2C(=O)c3c(O)cc(C)c(O)c3C(=O)c2c1,mutagenic
+84-75-3,CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCC,non-mutagenic
+3351-31-3,Cc1ccc2ccc3c4ccccc4ccc3c2c1,mutagenic
+113163-22-7,OC1C2OC2c3c(ccc4cccnc34)C1O,mutagenic
+126572-78-9,OC\C(=C(\Cl)/C(=O)O)\C(Cl)Cl,mutagenic
+51-18-3,C1CN1c2nc(nc(n2)N3CC3)N4CC4,mutagenic
+146795-48-4,CN(C(=O)c1csc(c1)[N+](=O)[O-])c2ccccc2,mutagenic
+111-14-8,CCCCCCC(=O)O,non-mutagenic
+3468-63-1,Oc1ccc2ccccc2c1N=Nc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-],mutagenic
+102421-85-2,OC1=C(O)C23CCCCC2(O3)c4cc5ccc6ccccc6c5nc14,non-mutagenic
+90-46-0,OC1c2ccccc2Oc3ccccc13,mutagenic
+25953-06-4,CCN(CC)c1ccc(N=O)c(O)c1,non-mutagenic
+64099-25-8,COc1nsc2c(cccc12)[N+](=O)[O-],mutagenic
+115688-97-6,CN1CCC=C2C1CCc3sc(N)nc23,mutagenic
+NOCAS_M487,CC(C)(N)[C@@H]1CC[C@](C)(N)CC1,non-mutagenic
+132742-03-1,[O-][N+](=O)c1ccc2ccc3cc4CCC=Cc4c5ccc1c2c35,mutagenic
+29964-84-9,CC(C)CCCCCCCOC(=O)C(=C)C,non-mutagenic
+129-03-3,CN1CCC(=C2c3ccccc3C=Cc4ccccc24)CC1,non-mutagenic
+99-57-0,Nc1cc(ccc1O)[N+](=O)[O-],mutagenic
+106626-55-5,CN(C)CCNC(=O)c1cccc2nc3ccccc3cc12,mutagenic
+75-12-7,NC=O,non-mutagenic
+3025-42-1,CCN(CC)c1ccc(cc1)N=Nc2ccc(cc2Cl)[N+](=O)[O-],mutagenic
+52-52-8,NC1(CCCC1)C(=O)O,non-mutagenic
+207-08-9,c1ccc2cc3c(cc2c1)c4cccc5cccc3c45,mutagenic
+5737-13-3,O=C1c2cccc3ccc4cccc1c4c23,mutagenic
+19727-83-4,[O-][N+](=O)c1ccc2CCNc2c1,mutagenic
+135086-94-1,COc1ccc(\C=N\n2nnc3c4ccccc4nc3c2O)cc1,mutagenic
+109-99-9,C1CCOC1,non-mutagenic
+72755-25-0,CC1C(C)C(C)(O)C(=O)OCC2=CCN3CCC(OC(=O)C1=C)C23,non-mutagenic
+104226-21-3,Cc1cc(ccc1N=Nc2ccc(N)cc2)N(CCO)CCO,non-mutagenic
+99-73-0,BrCC(=O)c1ccc(Br)cc1,non-mutagenic
+99523-61-2,CCCC(=O)Nc1snc2ccc(C)cc12,non-mutagenic
+33956-49-9,C\C=C\C=C\CCCCCCCO,non-mutagenic
+111712-48-2,CC(C)(Br)C(Br)COP(=O)(OCC(Br)C(C)(C)Br)OCC(Br)C(C)(C)Br,non-mutagenic
+62966-21-6,CC(=O)CC(=O)\C=C\C(=O)O,non-mutagenic
+19900-72-2,CCc1cc(Cc2cc(C)c(N)c(CC)c2)cc(C)c1N,non-mutagenic
+NOCAS_M267,CC(=C[C@H]1[C@H](C(=O)O[C@@H]2CC(=O)C(=C2C)CC=C)C1(C)C)C,mutagenic
+95-50-1,Clc1ccccc1Cl,non-mutagenic
+94-62-2,O=C(\C=C\C=C\c1ccc2OCOc2c1)N3CCCCC3,non-mutagenic
+67019-19-6,ClCC(=O)Nc1snc2ccccc12,mutagenic
+107-99-3,CN(C)CCCl,mutagenic
+109-77-3,N#CCC#N,non-mutagenic
+99585-29-2,Oc1cccc2Cc3cc(ccc3c12)[N+](=O)[O-],mutagenic
+3671-71-4,ON(C(=O)c1ccccc1)c2ccc3c(Cc4ccccc34)c2,mutagenic
+111-46-6,OCCOCCO,non-mutagenic
+64-77-7,CCCCNC(=O)NS(=O)(=O)c1ccc(C)cc1,non-mutagenic
+462-06-6,Fc1ccccc1,mutagenic
+2371-42-8,CC1(C)C2CCC1(C)C(C)(O)C2,non-mutagenic
+115781-40-3,Cc1cnc2ccc3c(nc(NS(=O)(=O)O)n3C)c2n1,non-mutagenic
+4074-88-8,C=CC(=O)OCCOCCOC(=O)C=C,non-mutagenic
+122-97-4,OCCCc1ccccc1,non-mutagenic
+70249-46-6,OCc1ccc2c3ccccc3c4cccc1c24,non-mutagenic
+610-88-8,CCC(C)C1NC(=O)C(=C1O)C(=O)C,non-mutagenic
+16757-80-5,Cc1cc2cccc3ccc4cc5ccccc5c1c4c23,mutagenic
+759-94-4,CCCN(CCC)C(=O)SCC,non-mutagenic
+684-93-5,CN(N=O)C(=O)N,mutagenic
+NOCAS_M142,C=CC(=O)N(C[C@H]1CO1)C[C@H]2CO2,mutagenic
+NOCAS_M285,C[C@@H]1CNC[C@@H](C)O1,mutagenic
+100-47-0,N#Cc1ccccc1,non-mutagenic
+106636-50-4,Cc1ccc(cc1)c2nc3SCCn3c2[N+](=O)[O-],mutagenic
+159092-78-1,[O-][N+](=O)c1ccc2c(cc3c(cccc3c2c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+123-30-8,Nc1ccc(O)cc1,non-mutagenic
+104-83-6,ClCc1ccc(Cl)cc1,non-mutagenic
+79455-30-4,CC(CNC(=O)c1cccnc1)NC(=O)c2cccnc2,non-mutagenic
+1070-11-7,CC[C@H](CO)NCCN[C@H](CC)CO,non-mutagenic
+7467-29-0,Cc1ccccc1N=Nc2cc(C)c(N)cc2N,mutagenic
+122-19-0,CCCCCCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1,non-mutagenic
+36508-80-2,CN1C(CCC1=O)c2ccc[n+]([O-])c2,non-mutagenic
+2997-92-4,CC(C)(N=NC(C)(C)C(=N)N)C(=N)N,mutagenic
+155164-66-2,ClC1=C(Cl)C(=O)N(N=C1)C(=O)c2ccccc2,non-mutagenic
+2608-48-2,[O-][N+](=O)c1ccc(\C=C\C=C\C=O)cc1,mutagenic
+880-93-3,Cc1ccc(c2ccccc12)[N+](=O)[O-],mutagenic
+93-15-2,COc1ccc(CC=C)cc1OC,non-mutagenic
+23045-35-4,Nc1c2ccccc2nc3ccc(cc13)[N+](=O)[O-],mutagenic
+86-73-7,C1c2ccccc2c3ccccc13,non-mutagenic
+151455-09-3,COc1cc(OC)c2cc(c3c(cc4OCOc4c3c2c1)C(=O)O)[N+](=O)[O-],non-mutagenic
+2782-57-2,Oc1nc(Cl)nc(Cl)n1,non-mutagenic
+22338-69-8,CC12CCCC(C)(C1CCC34CC(CCC23)C(=C)C4O)C(=O)O,non-mutagenic
+28564-83-2,CC1=C(O)C(=O)C(O)CO1,mutagenic
+95-78-3,Cc1ccc(C)c(N)c1,mutagenic
+13558-31-1,Nc1ccc2c(c3ccccc3C(=O)O)c4ccc(N)cc4[o+]c2c1,non-mutagenic
+38914-96-4,ClCCNCCCNc1c2ccccc2nc3ccccc13,mutagenic
+155164-57-1,ClC1=C(Cl)C(=O)N(N=C1)S(=O)(=O)c2ccccc2,non-mutagenic
+74407-28-6,CSCC(NC(=O)C(C)(C)SC)C(=O)O,non-mutagenic
+68688-87-9,Cc1ccc2cc3c4C=C[C@@H](O)[C@H](O)c4ccc3c5CCc1c25,mutagenic
+77121-90-5,COC1C(N)CC(OC2CC(O)(Cc3c(O)c4C(=O)c5cccc(OC)c5C(=O)c4c(O)c23)C(=O)CO)OC1C,mutagenic
+33069-62-4,CC(=O)O[C@@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(=O)C)[C@H]2[C@H](OC(=O)c4ccccc4)[C@@]5(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c6ccccc6)c7ccccc7)C(=C1C5(C)C)C,non-mutagenic
+35212-22-7,CC(C)Oc1ccc2C(=O)C(=COc2c1)c3ccccc3,non-mutagenic
+16156-54-0,CCC(C)OS(=O)(=O)C,mutagenic
+594-42-3,ClSC(Cl)(Cl)Cl,mutagenic
+581-47-5,c1ccc(nc1)c2ccncc2,mutagenic
+94-36-0,O=C(OOC(=O)c1ccccc1)c2ccccc2,non-mutagenic
+99-61-6,[O-][N+](=O)c1cccc(C=O)c1,mutagenic
+98-51-1,Cc1ccc(cc1)C(C)(C)C,non-mutagenic
+NOCAS_M237,C[C@@H]1CCCCN1CCCNCC(=O)Nc2c(C(=O)c3ccccc3F)c(C)nn2C,mutagenic
+64-86-8,COC1=CC=C2C(=CC1=O)[C@@H](CCc3cc(OC)c(OC)c(OC)c23)NC(=O)C,non-mutagenic
+70403-81-5,COc1ccc2c(c1)C(=O)c3nccc4cc(OC)c(OC)c2c34,mutagenic
+52517-34-7,CN1CC(CBr)CC2C1Cc3c[nH]c4cccc2c34,mutagenic
+81316-80-5,[O-][N+](=O)c1ccc2c3cc4ccccc4cc3c5cccc1c25,mutagenic
+145531-24-4,COc1cc(NS(=O)(=O)C)ccc1Nc2c3ccccc3nc4ccc(cc24)N=N#N,mutagenic
+NOCAS_M273,C[C@@H](O)c1cc2ccc3cccc4ccc(c1)c2c34,mutagenic
+839-90-7,OCCN1C(=O)N(CCO)C(=O)N(CCO)C1=O,non-mutagenic
+78-95-5,CC(=O)CCl,non-mutagenic
+101-20-2,Clc1ccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)cc1,non-mutagenic
+99-08-1,Cc1cccc(c1)[N+](=O)[O-],non-mutagenic
+50-48-6,CN(C)CCC=C1c2ccccc2CCc3ccccc13,non-mutagenic
+105836-99-5,[O-][N+](=O)c1ccc2nc3c(cccc3nc2c1)[N+](=O)[O-],mutagenic
+199536-62-4,BrCC1=C(Br)C(=O)OC1,mutagenic
+98046-73-2,ONc1cnc2c(c1)nc3ccccn23,mutagenic
+38514-71-5,Nc1nc(cs1)c2oc(cc2)[N+](=O)[O-],mutagenic
+16529-56-9,CC(C=C)C#N,non-mutagenic
+72-48-0,Oc1ccc2C(=O)c3ccccc3C(=O)c2c1O,mutagenic
+111574-85-7,N[C@@H](CCC(=O)N[C@@H](CSC(=C(Cl)Cl)Cl)C(=O)NCC(=O)O)C(=O)O,mutagenic
+17423-48-2,Nc1cccc2ccc3ccccc3c12,non-mutagenic
+523-44-4,Oc1ccc(N=Nc2ccc(cc2)S(=O)(=O)O)c3ccccc13,non-mutagenic
+303-34-4,CO[C@@H](C)[C@](O)(C(=O)OCC1=CCN2CC[C@H](OC(=O)\C(=C/C)\C)[C@@H]12)C(C)(C)O,mutagenic
+92072-09-8,[O-][N+](=O)c1ccc2c3cccc4ccc(c(c5cccc1c25)c34)[N+](=O)[O-],mutagenic
+118174-26-8,CC(C)(C)OC(=O)N\N=C\C1=CN(O)c2ccccc2N1O,mutagenic
+119-47-1,Cc1cc(Cc2cc(C)cc(c2O)C(C)(C)C)c(O)c(c1)C(C)(C)C,non-mutagenic
+95933-72-5,N\C(=N/O)\c1ccc(O)c(O)c1,mutagenic
+81-77-6,Oc1c2ccccc2c(O)c3c1ccc4nc5c6C(=O)c7ccccc7C(=O)c6ccc5nc34,non-mutagenic
+6375-16-2,CC(=O)Nc1ccc(C)c(N)c1,mutagenic
+130536-46-8,C1Cc2cccnc2C3OC13,non-mutagenic
+70140-81-7,CCOP(=S)(OCC(C)C)SCCl,non-mutagenic
+1071-83-6,OC(=O)CNCP(=O)(O)O,non-mutagenic
+1126-76-7,C(Cc1ccccc1)C2CO2,mutagenic
+99-94-5,Cc1ccc(cc1)C(=O)O,non-mutagenic
+50935-04-1,CC1OC(CC(N)C1O)OC2CC(O)(Cc3c(O)c4C(=O)c5cccc(O)c5C(=O)c4c(O)c23)C(=O)C,mutagenic
+108963-23-1,ClCCC(Br)CBr,non-mutagenic
+64432-06-0,CC1OC(OC2C(O)C(O)C(CO)OC2OC34CCC5C6(C)CCCC(C)(C6CCC5(CC3=C)C4)C(=O)OC7OC(CO)C(O)C(O)C7O)C(O)C(O)C1O,non-mutagenic
+68162-38-9,COC(=O)\C(=C\c1oc(Br)cc1)\[N+](=O)[O-],non-mutagenic
+3420-97-1,CCOc1ccc(cc1)N=O,mutagenic
+128879-32-3,CN(C)CCN1C=CN(C)C1\C=N\O,non-mutagenic
+NOCAS_M300,ClC[C@H](Cl)CBr,mutagenic
+585-71-7,CC(Br)c1ccccc1,non-mutagenic
+89-98-5,Clc1ccccc1C=O,non-mutagenic
+55090-44-3,CCCCCCCCCCCCN(C)N=O,mutagenic
+18434-08-7,CCCCCCC(CCCC)COc1ccc(cc1)c2ccc(cc2)c3ccc(cc3)c4ccc(OCC(CCCC)CCCCCC)cc4,non-mutagenic
+119-32-4,Cc1ccc(N)cc1[N+](=O)[O-],mutagenic
+NOCAS_M268,ClC[C@H]1CO1,mutagenic
+1326-03-0,CCN(CC)c1ccc2C(=C3C=CC(=[N+](CC)CC)C=C3Oc2c1)c4ccccc4C(=O)O,non-mutagenic
+150366-18-0,COCC1CN(C(=O)O1)c2ccc3nc(sc3c2)C(O)CCC#N,non-mutagenic
+80-63-7,COC(=O)C(=C)Cl,mutagenic
+24954-53-8,CNC(=O)ON(C(=O)NC)C(=O)NC,non-mutagenic
+133740-20-2,COc1cc(O)c2c(O)c3C(=O)OC(=Cc3c(OC)c2c1)C,mutagenic
+2564-83-2,CC1(C)CCCC(C)(C)N1O,non-mutagenic
+119143-42-9,C1Cc2c(ccc3ncccc23)C4OC14,non-mutagenic
+789-47-9,Nc1ccc2c(ccc3c4ccccc4ccc23)c1,mutagenic
+111-76-2,CCCCOCCO,non-mutagenic
+103124-59-0,CCOC(=O)C(=NNc1ccc(cc1OC)c2ccc(NN=C(C(=O)OCC)C(=O)OCC)c(OC)c2)C(=O)OCC,non-mutagenic
+1248-18-6,Oc1ccc2ccccc2c1N=Nc3ccc4ccccc4c3S(=O)(=O)O,non-mutagenic
+86-59-9,OC(=O)c1cccc2cccnc12,non-mutagenic
+83-95-4,COc1ccc2c(OC)c3CCOc3nc2c1OC,mutagenic
+303-45-7,CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)c3c(C)cc4c(C(C)C)c(O)c(O)c(C=O)c4c3O,non-mutagenic
+41934-47-8,CCN(CC)c1ccc2C(=CC(=O)Oc2c1)C(F)(F)F,non-mutagenic
+192705-53-6,CC(=O)Nc1ccc2c3ccc(O)cc3c4cccc1c24,mutagenic
+106636-49-1,[O-][N+](=O)c1c(nc2SCCn12)c3ccc(Cl)cc3,mutagenic
+34801-16-6,Nc1nc(cs1)c2ccc(s2)[N+](=O)[O-],mutagenic
+66-97-7,O=C1Oc2cc3occc3cc2C=C1,non-mutagenic
+122587-22-8,COC(=O)c1oc(c(Cl)c1Cl)[N+](=O)[O-],mutagenic
+14064-55-2,[O-][N+](=O)c1ccc(\C=C\c2ccc(Cl)cc2)cc1,mutagenic
+NOCAS_M110,COC(=O)[C@]12O[C@@]1(C)[C@@](C)(O)OC2=O,mutagenic
+924-16-3,CCCCN(CCCC)N=O,mutagenic
+74494-65-8,COc1cc(O)c2C(=O)c3c(OC)cc4OC5OCCC5c4c3Oc2c1OC,non-mutagenic
+9005-65-6,CCCCCCCC\C=C\CCCCCCCC(=O)OCCOCC1(OCCOC)OCC(OCCOC)C1OCCOC,non-mutagenic
+101-61-1,CN(C)c1ccc(Cc2ccc(cc2)N(C)C)cc1,mutagenic
+584-48-5,[O-][N+](=O)c1ccc(Br)c(c1)[N+](=O)[O-],mutagenic
+32861-85-1,COc1cc(Oc2ccc(Cl)cc2Cl)cc(c1)[N+](=O)[O-],non-mutagenic
+2185-92-4,Nc1ccccc1c2ccccc2,mutagenic
+622-96-8,CCc1ccc(C)cc1,non-mutagenic
+188970-83-4,Oc1cccc2c1c(cc3[nH]c4ccc5ccccc5c4c23)[N+](=O)[O-],mutagenic
+163275-61-4,Fc1ccc2ccc3cccnc3c2c1,mutagenic
+145627-68-5,OC1C=Cc2c(ccc3c4CCCc4ccc23)C1O,mutagenic
+106323-85-7,[O-][N+](=O)c1ccc(c2ccc(c(c2)[N+](=O)[O-])[N+](=O)[O-])c(c1)[N+](=O)[O-],mutagenic
+NOCAS_M64,CC(=C[C@H]1[C@H](C(=O)OCc2oc(CC#C)cc2)C1(C)C)C,mutagenic
+133762-81-9,Nc1nc(Cl)c2ncn(CC(O)CN=N#N)c2n1,mutagenic
+86-95-3,Oc1cc(O)c2ccccc2n1,mutagenic
+102-07-8,O=C(Nc1ccccc1)Nc2ccccc2,non-mutagenic
+39860-12-3,Cc1ccc2c(c1)nc(N)n2C,mutagenic
+121-39-1,CCOC(=O)[C@@H]1O[C@H]1c2ccccc2,non-mutagenic
+79-08-3,OC(=O)CBr,mutagenic
+158729-29-4,Clc1cc(Cl)cc(NS(=O)(=O)c2cccc3cccnc23)c1,non-mutagenic
+109-78-4,OCCC#N,non-mutagenic
+159092-67-8,[O-][N+](=O)c1ccc2ccc3c(cccc3c2c1)[N+](=O)[O-],mutagenic
+79-44-7,CN(C)C(=O)Cl,mutagenic
+166546-19-6,CN1CCN(CC1)c2ccc3[nH]c(nc3c2)c4ccc5[nH]c(nc5c4)c6ccc(cc6)N(CCCl)CCCl,non-mutagenic
+52-86-8,OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c3ccc(Cl)cc3,non-mutagenic
+70458-92-3,CCN1C=C(C(=O)O)C(=O)c2cc(F)c(cc12)N3CCN(C)CC3,mutagenic
+18636-89-0,[O-][n+]1cc2ccccc2cn1,non-mutagenic
+77-65-6,CCC(Br)(CC)C(=O)NC(=O)N,non-mutagenic
+69658-14-6,CCOC(=O)CSc1ccc2c3ccccc3C(=O)c4cccc1c24,mutagenic
+NOCAS_M33,CC(=O)Nc1ccc(cc1)[C@H]2O[C@H]2C(=O)c3ccccc3,mutagenic
+61734-88-1,CCN(CCCO)N=O,mutagenic
+133762-86-4,NC1=NC(=O)N(CC(O)CN=N#N)C=C1,mutagenic
+25013-15-4,Cc1ccc(C=C)cc1,non-mutagenic
+108893-54-5,CC(=O)OC1C2CC(C)(C)CC2=C(C=O)C3(CC13C)C=O,non-mutagenic
+3989-90-0,[O-][N+](=O)c1ccc2c(ccc3c4ccccc4ccc23)c1,mutagenic
+7704-40-7,Nc1ccc2nc3ccc(N)cc3nc2c1,mutagenic
+NOCAS_M79,C[C@@H]1c2ccccc2c3ccc(C)cc13,mutagenic
+26946-33-8,Nc1ccc(Cc2ccc(N)cc2[N+](=O)[O-])c(c1)[N+](=O)[O-],mutagenic
+53-86-1,COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c3ccc(Cl)cc3,non-mutagenic
+69533-68-2,[O-][N+](=O)c1ccc2c(CCc3cc(ccc23)[N+](=O)[O-])c1,mutagenic
+150446-04-1,Cc1c(Cn2ccnc2)c3cc(ccc3n1Cc4ccccc4)[N+](=O)[O-],mutagenic
+146795-45-1,[O-][N+](=O)c1cccc(NC(=O)c2csc(c2)[N+](=O)[O-])c1,mutagenic
+627-18-9,OCCCBr,mutagenic
+2210-28-8,CCCOC(=O)C(=C)C,non-mutagenic
+105467-67-2,Oc1cccc2c1ccc3nc4ccc5ccccc5c4cc23,non-mutagenic
+NOCAS_M390,CCCC[C@@H](CC)COP(OC[C@H](CC)CCCC)OC[C@H](CC)CCCC,non-mutagenic
+117929-12-1,[O-][N+](=O)c1cc2CCc3cc(cc4ccc(c1)c2c34)[N+](=O)[O-],mutagenic
+80-46-6,CCC(C)(C)c1ccc(O)cc1,non-mutagenic
+127-18-4,ClC(=C(Cl)Cl)Cl,non-mutagenic
+114717-14-5,NC(Cn1ccnc1)C(=O)O,mutagenic
+28108-99-8,CC(C)c1ccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)cc1,non-mutagenic
+37574-47-3,O1C2C1c3cc4ccccc4c5ccc6cccc2c6c35,mutagenic
+779-02-2,Cc1c2ccccc2cc3ccccc13,mutagenic
+109-43-3,CCCCOC(=O)CCCCCCCCC(=O)OCCCC,non-mutagenic
+50648-96-9,CC(NC(=O)COc1ccc(Cl)cc1Cl)C(=O)O,non-mutagenic
+35281-34-6,C1Cc2ccc3cc4CCCc5ccc6cc(C1)c2c3c6c45,mutagenic
+27113-22-0,CCCCCCCC(=O)CCc1ccc(O)c(OC)c1,non-mutagenic
+3311-98-6,[O-][N+](=O)c1cnc(NC(=O)NCCCl)s1,mutagenic
+84-64-0,CCCCOC(=O)c1ccccc1C(=O)OC2CCCCC2,non-mutagenic
+114460-41-2,CCc1nc2c(ccc3ccc4ccc(O)cc4c23)[nH]1,mutagenic
+88-95-9,ClC(=O)c1ccccc1C(=O)Cl,mutagenic
+19655-56-2,CCc1cccc2cccnc12,mutagenic
+330-54-1,CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1,mutagenic
+95-74-9,Cc1ccc(N)cc1Cl,mutagenic
+602-87-9,[O-][N+](=O)c1ccc2CCc3cccc1c23,mutagenic
+952-23-8,Nc1ccc2cc3ccc(N)cc3nc2c1,mutagenic
+24143-08-6,CC(=O)NC1=NC(=NOC1)c2oc(cc2)[N+](=O)[O-],mutagenic
+2255-50-7,COc1c2ccoc2nc3c(O)cccc13,mutagenic
+75453-80-4,OC1C=CC=CC1O,mutagenic
+599-64-4,CC(C)(c1ccccc1)c2ccc(O)cc2,non-mutagenic
+138835-36-6,[O-][N+](=O)c1ccc2ccc3c4ccccc4nc5ccc1c2c35,mutagenic
+130-26-7,Oc1c(I)cc(Cl)c2cccnc12,non-mutagenic
+1513-65-1,Fc1cccc(F)n1,non-mutagenic
+149022-16-2,Cc1nccc2c3ccc(O)cc3[nH]c12,mutagenic
+59-50-7,Cc1cc(O)ccc1Cl,non-mutagenic
+61734-90-5,CCCCN(CC(=O)CC)N=O,mutagenic
+92-88-6,Oc1ccc(cc1)c2ccc(O)cc2,non-mutagenic
+7144-65-2,C(Oc1ccccc1c2ccccc2)C3CO3,mutagenic
+24280-93-1,COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)\CCC(=O)O,mutagenic
+873-75-6,OCc1ccc(Br)cc1,non-mutagenic
+54292-59-0,OCCN(CCO)c1ccc(cc1)N=Nc2cccnc2,non-mutagenic
+129541-01-1,COC(=O)CNC(=O)C(CSCCCl)NC(=O)CCC(N)C(=O)O,mutagenic
+86-40-8,C[n+]1c2cc(N)ccc2cc3ccc(N)cc13,mutagenic
+98033-24-0,Cc1oc2c(ccc3ccc4ccc(O)cc4c23)n1,mutagenic
+72848-48-7,[O-][N+](=O)c1ccc2nc3cc(ccc3nc2c1)[N+](=O)[O-],mutagenic
+83504-80-7,O=Nc1ccc(Sc2ccccc2)cc1,mutagenic
+92-24-0,c1ccc2cc3cc4ccccc4cc3cc2c1,mutagenic
+115-77-5,OCC(CO)(CO)CO,non-mutagenic
+63166-73-4,CC1COC2(CC1OC(=O)\C=C\c3ccccc3)OC4CC(CCC4C25CO5)C(=O)OC6OC(C)C(O)C(OC(=O)C)C6OC7OC(C)C(O)C(OC(=O)C)C7O,non-mutagenic
+108-11-2,CC(C)CC(C)O,non-mutagenic
+126420-95-9,Cc1cc(C)c(CN2C3C2c4ccccc4c5ccccc35)c(C)c1,mutagenic
+188107-71-3,Cc1cc(c(C)c2c3ccccc3n(C)c12)[N+](=O)[O-],mutagenic
+484-08-2,COc1cc2nc3occc3c(OC)c2cc1OC,mutagenic
+6068-96-8,CCCOO,mutagenic
+24099-25-0,COc1c(OCC2OC2(C)C)ccc3c(OC)c4ccoc4nc13,non-mutagenic
+51938-16-0,CN(CCCCO)N=O,mutagenic
+112022-09-0,CN(C)CCNC(=O)C1=CC=CN2C(=O)c3ccccc3N=C12,mutagenic
+38965-71-8,OC(=O)c1cc2OCOc2c3c4cccc(O)c4cc(c13)[N+](=O)[O-],mutagenic
+89-83-8,CC(C)c1ccc(C)cc1O,non-mutagenic
+17479-19-5,CC(C)C1(NC(=O)C2CC3C(Cc4c[nH]c5cccc3c45)N(C)C2)OC6(O)C7CCCN7C(=O)C(Cc8ccccc8)N6C1=O,non-mutagenic
+92911-19-8,CNc1ccc(cc1)N=Nc2ccc3ncsc3c2,mutagenic
+91642-47-6,CCCCCOC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+304-20-1,NNc1nncc2ccccc12,mutagenic
+2206-89-5,ClCCOC(=O)C=C,mutagenic
+5910-89-4,Cc1nccnc1C,non-mutagenic
+25148-68-9,CNc1ccccc1N,mutagenic
+141511-29-7,[O-][N+](=O)c1ccc2c(CCc3c4CCCCc4ccc23)c1,mutagenic
+127924-00-9,OC(CC(=O)OCCBr)(CC(=O)OCCBr)C(=O)OCCBr,mutagenic
+3778-73-2,ClCCN[P@]1(=O)OCCCN1CCCl,mutagenic
+15088-70-7,CCOC(=O)CNC(=O)CBr,non-mutagenic
+526-75-0,Cc1cccc(O)c1C,non-mutagenic
+NOCAS_M354,CC[C@H](O)CN,non-mutagenic
+36519-91-2,Clc1ccc(CC2CO2)cc1,mutagenic
+105-45-3,COC(=O)CC(=O)C,non-mutagenic
+17886-23-6,CCN1CCN=N1,mutagenic
+16048-37-6,O=C1c2ccccc2C(=O)c3c(cccc13)[N+]#N,mutagenic
+99520-64-6,O1C2C1c3ccc4c5ccccc5c6cc7cccc2c7c3c46,mutagenic
+94-82-6,OC(=O)CCCOc1ccc(Cl)cc1Cl,non-mutagenic
+59-02-9,CC(C)CCCC(C)CCCC(C)CCCC1(C)CCc2c(C)c(O)c(C)c(C)c2O1,non-mutagenic
+1748-81-8,CC(=O)CCC1C2CC3C(CC12C)OC(=O)C3=C,non-mutagenic
+148-65-2,CN(C)CCN(Cc1ccc(Cl)s1)c2ccccn2,non-mutagenic
+594-71-8,CC(C)(Cl)[N+](=O)[O-],mutagenic
+4457-41-4,[O-][N+](=O)c1ccc(COC(=O)c2ccccc2)cc1,mutagenic
+555-66-8,CCCCC\C=C\C(=O)CCc1ccc(O)c(OC)c1,mutagenic
+63-74-1,Nc1ccc(cc1)S(=O)(=O)N,non-mutagenic
+504-29-0,Nc1ccccn1,non-mutagenic
+24549-06-2,CCc1cccc(C)c1N,mutagenic
+619-89-6,OC(=O)\C=C\c1ccc(cc1)[N+](=O)[O-],mutagenic
+6795-23-9,COc1cc2OC3OC=CC3(O)c2c4OC(=O)C5=C(CCC5=O)c14,mutagenic
+38915-14-9,CCN(CCCl)CCCNc1c2ccccc2nc3c(OC)cccc13,mutagenic
+612-64-6,CCN(N=O)c1ccccc1,non-mutagenic
+39208-00-9,CN(C)c1ccc(cc1)N=Nc2ccc(C=O)cc2,mutagenic
+75607-61-3,NC(CCC(=O)NC(CSCCCl)NC(=O)CC(=O)O)C(=O)O,mutagenic
+47165-04-8,NC(=N)c1ccc(cc1)c2cc3ccc(cc3[nH]2)C(=N)N,non-mutagenic
+97-24-5,Oc1ccc(Cl)cc1Sc2cc(Cl)ccc2O,non-mutagenic
+78914-75-7,CN(C)c1ccc(cc1)N=Nc2ccc(COC(=O)C)cc2,mutagenic
+55676-18-1,CC(=O)Nc1ccc2[nH]c3c(C)c4ccncc4c(C)c3c2c1,non-mutagenic
+106532-60-9,CC(=O)\N=C\1/SN(C(=O)C)c2ccc(cc12)[N+](=O)[O-],mutagenic
+148749-29-5,CC(=O)OC1(CCC2C3C(CCC12C)C4(C)C5CC5C(=O)C=C4C6(Cl)CC36)C(=O)C,non-mutagenic
+100924-64-9,OS(=O)(=O)OCc1cc2ccccc2c3ccc4ccccc4c13,mutagenic
+31297-82-2,OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2ccc3C(=O)c4ccccc4C(=O)c3c2O,mutagenic
+139259-91-9,COc1ccc(CON(OC(=O)C)C(=O)c2ccccc2)cc1,mutagenic
+33703-08-1,CC(C)CCCCCCOC(=O)CCCCC(=O)OCCCCCCC(C)C,non-mutagenic
+533-30-2,Nc1ccc2ncsc2c1,mutagenic
+311-45-5,CCOP(=O)(OCC)Oc1ccc(cc1)[N+](=O)[O-],mutagenic
+135294-99-4,OCc1cccc2c3cccc4cccc(c12)c34,non-mutagenic
+108278-72-4,NC(=O)N(CCCC(=O)O)N=O,mutagenic
+272-16-2,c1ccc2sncc2c1,non-mutagenic
+118745-11-2,ON(C=O)c1ccc(\C=C\c2ccccc2)cc1,mutagenic
+NOCAS_M324,CN1CC[C@@H](CN2c3ccccc3Sc4ccccc24)C1,non-mutagenic
+33953-73-0,Oc1c2ccccc2c3ccc4cccc5ccc1c3c45,mutagenic
+51938-15-9,CCCCN(CC(=O)C)N=O,mutagenic
+56-40-6,NCC(=O)O,non-mutagenic
+593-08-8,CCCCCCCCCCCC(=O)C,non-mutagenic
+151910-74-6,OC1C=Cc2c(ccc3cc4c5C=CC(O)C(O)c5ccc4cc23)C1O,non-mutagenic
+4273-73-8,COC(=O)\C(=C\C=C\C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C)\C)\C,non-mutagenic
+108354-48-9,Cc1cc2nccnc2c3nc(N)n(C)c13,mutagenic
+89-25-8,CC1=NN(C(=O)C1)c2ccccc2,non-mutagenic
+NOCAS_M102,C[C@@H]1COc2c(N3CCN(C)CC3)c(F)c(C(=O)O)c4C(=O)C=CN1c24,mutagenic
+51-98-9,CC(=O)OC1(CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C)C#C,non-mutagenic
+32425-83-5,O=C1CCc2ccc3c(ccc4ccccc34)c12,mutagenic
+131862-17-4,CN(C)CCNC(=O)c1cc2ccccc2c3cccnc13,mutagenic
+138805-30-8,Cc1ccc(N)cc1N=[N+]([O-])c2cc(N)ccc2C,mutagenic
+110-83-8,C1CCC=CC1,non-mutagenic
+105427-00-7,CC1(CO1)C(=O)NCc2ccccc2,mutagenic
+129286-36-8,Fc1ccc2c3c(ccc4ccccc34)c5cccc1c25,mutagenic
+2415-85-2,CC(=O)CC(=O)Nc1ccc(C)cc1,non-mutagenic
+35287-69-5,COC(=O)C12Oc3ccc(c(O)c3C(=C1C(=O)CC(C)C2O)O)c4ccc5OC6(C(O)C(C)CC(=O)C6=C(O)c5c4O)C(=O)OC,non-mutagenic
+NOCAS_M569,C[C@H]1C[C@H](CC(C)(C)C1)OC(=O)c2ccccc2O,non-mutagenic
+999-55-3,C=CCOC(=O)C=C,non-mutagenic
+393-52-2,Fc1ccccc1C(=O)Cl,mutagenic
+1025-15-6,C=CCN1C(=O)N(CC=C)C(=O)N(CC=C)C1=O,non-mutagenic
+127183-64-6,Nc1ccc2c(no[n+]2[O-])n1,mutagenic
+150445-99-1,[O-][N+](=O)c1cccc(CO\N=C\c2nc3cc(ccc3n2Cc4ccc(F)cc4)[N+](=O)[O-])c1,non-mutagenic
+94223-87-7,Cc1ccc2nc3c(cc2c1)c4cccc5cccc3c45,non-mutagenic
+NOCAS_M538,CCC[C@](C)(COC(=O)N)COC(=O)NC(C)C,non-mutagenic
+27354-18-3,CC(C)Nc1cccc2C(=O)c3ccccc3C(=O)c12,mutagenic
+68-12-2,CN(C)C=O,non-mutagenic
+26328-53-0,[O-][N+](=O)c1ccc(Nc2ccc(cc2)N=C=S)cc1,non-mutagenic
+91254-97-6,Oc1cc2ccc(c3ccc4cccc1c4c23)[N+](=O)[O-],mutagenic
+133960-21-1,COC(=O)c1oc(NOC(=O)C)c(c2ccccc2)c1c3ccccc3,non-mutagenic
+149996-82-7,CCN(C=O)N=O,mutagenic
+80-13-7,OC(=O)c1ccc(cc1)S(=O)(=O)N(Cl)Cl,mutagenic
+3333-62-8,O=C1Oc2cc(ccc2C=C1c3ccccc3)n4nc5ccc6ccccc6c5n4,non-mutagenic
+50649-06-4,OC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)COc3ccc(Cl)cc3Cl,non-mutagenic
+98-83-9,CC(=C)c1ccccc1,non-mutagenic
+1010-93-1,Cc1ncc([N+](=O)[O-])n1CC(=O)O,mutagenic
+19077-98-6,CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2ccccn2,non-mutagenic
+97-88-1,CCCCOC(=O)C(=C)C,non-mutagenic
+7241-98-7,COc1cc2OC3OCCC3c2c4OC(=O)C5=C(CCOC5=O)c14,non-mutagenic
+553-97-9,CC1=CC(=O)C=CC1=O,non-mutagenic
+NOCAS_M63,O[C@@H]1OC(=O)C(=C1C(Cl)Cl)Cl,mutagenic
+130-01-8,C\C=C\1/CC(C)C(C)(O)C(=O)OCC2=CCN3CCC(OC1=O)C23,non-mutagenic
+507-70-0,CC1(C)C2CCC1(C)C(O)C2,non-mutagenic
+99523-57-6,Cc1ccc2nsc(NC(=O)CCl)c2c1,mutagenic
+166546-18-5,CCN(CCCl)c1ccc(cc1)c2nc3cc(ccc3[nH]2)c4nc5cc(ccc5[nH]4)N6CCN(C)CC6,non-mutagenic
+141899-13-0,COc1cc2OC3(C)OC4OC4C3(C)c2c5OC(=O)C6=C(CCC6=O)c15,non-mutagenic
+NOCAS_M551,CCCC[C@@H](CC)COC(=O)c1ccc(C(=O)OC[C@H](CC)CCCC)c(c1)C(=O)OC[C@H](CC)CCCC,non-mutagenic
+69658-16-8,OS(=O)(=O)c1ccc(Oc2ccc3c4ccccc4C(=O)c5cccc2c35)cc1,mutagenic
+131-12-4,COc1c(OC)c2occc2c3OC(=O)C=Cc13,non-mutagenic
+51330-27-9,CC1OC(OC2C(O)C(O)C(CO)OC2OC3C(O)C(O)C(OC3OC4CCC5(C)C(CCC6(C)C5CC=C7C8CC(C)(C)CC(O)C8(C)CCC67C)C4(C)CO)C(=O)O)C(O)C(O)C1O,non-mutagenic
+4671-93-6,N#C[Se]Cc1ccccc1,mutagenic
+940-14-7,[O-][N+](=O)c1ccc(OC=C)cc1,mutagenic
+118745-13-4,CCC(=O)N(O)c1ccc2ccccc2c1,mutagenic
+107-31-3,COC=O,non-mutagenic
+33779-70-3,C[n+]1c(c2ccc(N)cc2)c3cc(N)ccc3c4ccc(N)cc14,mutagenic
+60768-66-3,[O-][N+](=O)c1ccc2sncc2c1,mutagenic
+687-47-8,CCOC(=O)[C@H](C)O,non-mutagenic
+1162-65-8,COc1cc2O[C@H]3OC=C[C@H]3c2c4OC(=O)C5=C(CCC5=O)c14,mutagenic
+557-11-9,NC(=O)NCC=C,mutagenic
+64532-97-4,CCCCCCCCCc1ccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)cc1,non-mutagenic
+98-87-3,ClC(Cl)c1ccccc1,mutagenic
+111990-50-2,C(Cc1cccc2ccccc12)C3CO3,mutagenic
+55556-91-7,O=NN1CCC(=O)CC1,mutagenic
+491-35-0,Cc1ccnc2ccccc12,mutagenic
+138835-35-5,[O-][N+](=O)c1ccc2ccc3nc4ccccc4c5ccc1c2c35,mutagenic
+140-64-7,NC(=N)c1ccc(OCCCCCOc2ccc(cc2)C(=N)N)cc1,non-mutagenic
+989-38-8,CCNc1cc2OC3=CC(=NCC)C(=CC3=C(c4ccccc4C(=O)OCC)c2cc1C)C,non-mutagenic
+23165-19-7,C[N+]1(C)CCOCC1,non-mutagenic
+2650-18-2,CCN(Cc1cccc(c1)S(=O)(=O)O)c2ccc(cc2)C(=C3C=CC(=[N+](CC)Cc4cccc(c4)S(=O)(=O)O)C=C3)c5ccccc5S(=O)(=O)O,mutagenic
+141-46-8,OCC=O,non-mutagenic
+66212-60-0,O[C@@H]1[C@H]2O[C@H]2c3cc4ccc5cccc6ccc(c3[C@@H]1O)c4c56,mutagenic
+98911-23-0,CC(=O)N(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c2ccc(Oc3ccc(Cl)cc3)cc2,mutagenic
+41037-13-2,Cc1cc(cc2ccccc12)[N+](=O)[O-],mutagenic
+1107-26-2,C\C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C)/C)\C=O,non-mutagenic
+102822-04-8,[O-][N+](=O)c1ccc2C(=O)C(=O)c3cccc4ccc1c2c34,mutagenic
+72869-86-4,CC(CCNC(=O)OCCOC(=O)C(=C)C)CC(C)(C)CNC(=O)OCCOC(=O)C(=C)C,non-mutagenic
+598-78-7,CC(Cl)C(=O)O,non-mutagenic
+2397-76-4,CC(=C)C(=O)OCC(C)(C)C,non-mutagenic
+120812-47-7,[O-][N+](=O)c1ccc2c3CCCCc3c4cccc5ccc1c2c45,mutagenic
+188699-17-4,COc1nc2cc(cc(CBr)c2nc1OC)[N+](=O)[O-],mutagenic
+60872-63-1,C\C=C/1\CC(C)C(C)(OC(=O)C)C(=O)OCC2=CCN(C)CCC(OC1=O)C2=O,mutagenic
+1669-70-1,CC1(CO1)c2ccc(Cl)cc2,mutagenic
+84-17-3,C\C=C(\C(=C\C)\c1ccc(O)cc1)/c2ccc(O)cc2,non-mutagenic
+746-53-2,[O-][N+](=O)c1cc2C(=O)c3cc(cc(c3c2c(c1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+NOCAS_M561,CCCC[C@@H](CC)CNC[C@H](CC)CCCC,non-mutagenic
+NOCAS_M403,CCOC(=O)[C@@H]1O[C@]1(C)c2ccccc2,non-mutagenic
+61756-39-6,CC(=O)C1=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C,non-mutagenic
+99333-90-1,Oc1c(cc2ccc3cccc4ccc1c2c34)[N+](=O)[O-],mutagenic
+9002-92-0,CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCO,non-mutagenic
+18640-74-9,CC(C)Cc1nccs1,mutagenic
+109415-89-6,CCOC(=O)C(C)(C#N)c1snc2ccc(cc12)[N+](=O)[O-],mutagenic
+5326-87-4,BrCC(=O)Nc1ccccc1,non-mutagenic
+452-06-2,Nc1nc2ncnc2c[nH]1,non-mutagenic
+1565-94-2,CC(=C)C(=O)OCC(O)COc1ccc(cc1)C(C)(C)c2ccc(OCC(O)COC(=O)C(=C)C)cc2,non-mutagenic
+61421-82-7,COc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,mutagenic
+68299-98-9,OCC(=O)N(O)c1ccc(Cl)cc1,non-mutagenic
+1874-22-2,[O-][N+](=O)c1oc(\C=C\C=O)cc1,mutagenic
+28361-96-8,NC(CSCCCl)C(=O)O,mutagenic
+98151-92-9,Nc1ccc2ccc3c4ccccc4cc5ccc1c2c35,mutagenic
+16053-71-7,Cc1c2C(O)C(O)c3ccccc3c2cc4ccccc14,mutagenic
+22056-82-2,CCOCC=O,non-mutagenic
+540-49-8,Br\C=C\Br,mutagenic
+2113-57-7,Brc1cccc(c1)c2ccccc2,non-mutagenic
+36504-66-2,O1[C@@H]2C=Cc3cc4ccc5cccc6ccc(c3[C@H]12)c4c56,mutagenic
+NOCAS_M517,O[C@@H]1CO[C@@H]2[C@@H](CO[C@H]12)O[N+](=O)[O-],non-mutagenic
+1734-79-8,[O-][N+](=O)c1ccc(\C=C\C=O)cc1,mutagenic
+106671-90-3,[O-][N+](=O)c1ccc(cc1)c2nc3sccn3c2N=O,mutagenic
+10061-01-5,ClC\C=C/Cl,mutagenic
+64224-21-1,CC1=C(SSC1=S)c2cnccn2,non-mutagenic
+125372-28-3,Cn1c(N=N#N)nc2ccc3ncccc3c12,mutagenic
+126-07-8,COC1=CC(=O)C[C@@H](C)[C@]12Oc3c(Cl)c(OC)cc(OC)c3C2=O,non-mutagenic
+28995-89-3,[O-][N+](=O)c1cc(c2c(cc(cc2c1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+NOCAS_M394,CCC[C@@H](C)C[C@@H](OC(=O)C[C@@H](CC(=O)O)C(=O)O)[C@@H](C[C@H](C)CCCCCC[C@H](O)C[C@H](O)[C@@H](C)N)OC(=O)C[C@@H](CC(=O)O)C(=O)O,non-mutagenic
+134998-72-4,CCC(CCC(=O)C)COC(=O)CCCCC(=O)O,non-mutagenic
+5598-53-8,NC(CC(=O)O)C(=O)O,non-mutagenic
+109-64-8,BrCCCBr,non-mutagenic
+78-94-4,CC(=O)C=C,mutagenic
+591-12-8,CC1=CCC(=O)O1,non-mutagenic
+26049-70-7,NNc1nc(cs1)c2ccc(cc2)[N+](=O)[O-],mutagenic
+99-55-8,Cc1ccc(cc1N)[N+](=O)[O-],mutagenic
+302-84-1,NC(CO)C(=O)O,non-mutagenic
+79-14-1,OCC(=O)O,non-mutagenic
+2429-71-2,COc1cc(ccc1N=Nc2cc(c3ccccc3c2O)S(=O)(=O)O)c4ccc(N=Nc5cc(c6ccccc6c5O)S(=O)(=O)O)c(OC)c4,non-mutagenic
+505-22-6,C1COCOC1,mutagenic
+123-32-0,Cc1cnc(C)cn1,non-mutagenic
+947-72-8,Clc1cc2ccccc2c3ccccc13,mutagenic
+NOCAS_M56,N1[C@@H]2[C@H]1c3ccccc3c4c2ccc5ccccc45,mutagenic
+104-46-1,COc1ccc(\C=C\C)cc1,non-mutagenic
+54235-20-0,Oc1cc2c3ccccc3c4cccc(c1[N+](=O)[O-])c24,mutagenic
+478-45-5,OC(=O)c1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1,non-mutagenic
+102408-27-5,CN(C)c1nc2c3cccnc3ccc2n1C,mutagenic
+50-49-7,CN(C)CCCN1c2ccccc2CCc3ccccc13,non-mutagenic
+13436-58-3,Cn1cc2cccc(c2n1)[N+](=O)[O-],mutagenic
+192-97-2,c1ccc2c(c1)c3cccc4ccc5cccc2c5c34,mutagenic
+13171-00-1,CC(=O)c1cc(cc2c1CCC2(C)C)C(C)(C)C,non-mutagenic
+29590-42-9,CC(C)CCCCCOC(=O)C=C,non-mutagenic
+89-40-7,[O-][N+](=O)c1ccc2C(=O)NC(=O)c2c1,mutagenic
+2531-84-2,Cc1ccc2c(ccc3ccccc23)c1,mutagenic
+78468-34-5,Nc1cc(ccc1CO)[N+](=O)[O-],mutagenic
+1649-18-9,Fc1ccc(cc1)C(=O)CCCN2CCN(CC2)c3ccccn3,non-mutagenic
+143343-83-3,COc1ccc(CNCC(O)COc2ccc3nc(O)ccc3c2)cc1OC,non-mutagenic
+9002-86-2,CCC(Cl)CC(Cl)CC(C)Cl,non-mutagenic
+64507-38-6,OC(=O)c1cc(Br)cc2cccnc12,non-mutagenic
+13010-10-1,CCCCCN(N=O)C(=N)N[N+](=O)[O-],mutagenic
+116374-67-5,CN(C)CCCNc1c2ccccc2nc3c(ccc(c13)[N+](=O)[O-])N(C)C,mutagenic
+18774-09-9,CC1(OO)c2ccccc2c3ccccc13,mutagenic
+2213-63-0,Clc1nc2ccccc2nc1Cl,non-mutagenic
+64920-33-8,OC1C(O)c2ccc3c(ccc4ccccc34)c2C5OC15,mutagenic
+5405-53-8,[O-][N+](=O)c1ccc2c(Cc3cc(ccc23)[N+](=O)[O-])c1,mutagenic
+610-28-6,OC(=O)c1cc(ccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+2400-17-1,CNc1snc2ccccc12,non-mutagenic
+121808-62-6,OC(=O)C1CSCN1C(=O)C2CCC(=O)N2,non-mutagenic
+55691-69-5,[O-][N+](=O)c1ccc2c3ccccc3c4ccc(c1c24)[N+](=O)[O-],mutagenic
+83053-58-1,CCCOc1cc2C(=O)CCc2c3ccc4ccccc4c13,non-mutagenic
+145438-96-6,CNC(=O)c1c(ncn1C)N(C)N=O,non-mutagenic
+33419-42-0,COc1cc(cc(OC)c1O)C2C3C(COC3=O)C(OC4OC5COC(C)OC5C(O)C4O)c6cc7OCOc7cc26,non-mutagenic
+499-12-7,OC(=O)C\C(=C\C(=O)O)\C(=O)O,non-mutagenic
+130536-40-2,OC1C=Cc2cccnc2C1O,non-mutagenic
+95840-05-4,OC1C=CC2OC2C1O,mutagenic
+10373-78-1,CC1(C)C2CCC1(C)C(=O)C2=O,non-mutagenic
+135086-93-0,Oc1c2nc3ccccc3c2nnn1\N=C\c4ccc(Cl)cc4,mutagenic
+147151-61-9,CC12CCC3C(CCC4CC(CCC34C)OC(=O)\C=C\c5cccc(c5)N(CCCl)CCCl)C1CCC(=O)N2,mutagenic
+513-88-2,CC(=O)C(Cl)Cl,mutagenic
+NOCAS_M35,C[C@@H](O)CN(C[C@@H](C)O)N=O,mutagenic
+80789-74-8,OS(=O)(=O)c1ccc2NC(=O)C(=O)c2c1,mutagenic
+119613-13-7,CCCC(=O)OCc1cccc(c1)[N+](=O)[O-],non-mutagenic
+112022-05-6,CN(C)CCNC(=O)c1cccc2cc3ccccc3cc12,mutagenic
+112309-61-2,CC1=C(Cl)C(=O)OC1O,mutagenic
+244-63-3,c1ccc2c(c1)[nH]c3cnccc23,mutagenic
+NOCAS_M270,N[C@H](CS)C(=O)O,mutagenic
+619-23-8,[O-][N+](=O)c1cccc(CCl)c1,mutagenic
+NOCAS_M157,CCN(CC)CCC[C@@H](C)Nc1cc(OC)cc2cccnc12,mutagenic
+80-54-6,CC(CC=O)c1ccc(cc1)C(C)(C)C,non-mutagenic
+120388-69-4,O=Nc1ccc2ccc3c4ccccc4cc5ccc1c2c35,mutagenic
+58-14-0,CCc1nc(N)nc(N)c1c2ccc(Cl)cc2,non-mutagenic
+5443-49-2,Br\C(=C/c1ccccc1)\C=O,mutagenic
+627-93-0,COC(=O)CCCCC(=O)OC,non-mutagenic
+61996-71-2,OS(=O)(=O)Oc1ccc2ccc3c4ccccc4cc5ccc1c2c35,non-mutagenic
+2465-27-2,CN(C)c1ccc(cc1)C(=N)c2ccc(cc2)N(C)C,mutagenic
+4097-53-4,Oc1c(cc(cc1[N+](=O)[O-])c2ccccc2)[N+](=O)[O-],mutagenic
+65945-06-4,Oc1ccc2c(ccc3c4ccccc4ccc23)c1,mutagenic
+279242-17-0,CC(C)(C)c1ccc(cc1)c2ccc(cc2)N=O,mutagenic
+77094-11-2,Cc1cc2ncccc2c3nc(N)n(C)c13,mutagenic
+3764-01-0,Clc1cc(Cl)nc(Cl)n1,non-mutagenic
+1064-48-8,Nc1c(N=Nc2ccc(cc2)[N+](=O)[O-])c(cc3cc(c(N=Nc4ccccc4)c(O)c13)S(=O)(=O)O)S(=O)(=O)O,mutagenic
+610-67-3,CCOc1ccccc1[N+](=O)[O-],mutagenic
+71382-44-0,N1C2C1c3cc4ccccc4cc3c5ccccc25,mutagenic
+NOCAS_M159,C=C[C@H]1CO1,mutagenic
+1212-29-9,S=C(NC1CCCCC1)NC2CCCCC2,non-mutagenic
+5633-20-5,CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)c2ccccc2,non-mutagenic
+106532-61-0,CCC(=O)\N=C\1/SN(C(=O)CC)c2ccc(cc12)[N+](=O)[O-],mutagenic
+98-37-3,Nc1cc(ccc1O)S(=O)(=O)O,non-mutagenic
+2082-79-3,CCCCCCCCCCCCCCCCCCOC(=O)CCc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C,non-mutagenic
+35001-52-6,CCOc1ccc(cc1NC(=O)C(=O)Nc2ccccc2CC)C(C)(C)C,non-mutagenic
+75-17-2,ON=C,non-mutagenic
+773-76-2,Oc1c(Cl)cc(Cl)c2cccnc12,non-mutagenic
+95186-19-9,Nc1nc(c(CCO)c2ncnn12)c3ccccc3,non-mutagenic
+37853-59-1,Brc1cc(Br)c(OCCOc2c(Br)cc(Br)cc2Br)c(Br)c1,non-mutagenic
+142534-71-2,CC1(C(Cl)Cl)C2C(Cl)C(Cl)C1(C(Cl)Cl)C(Cl)C2Cl,non-mutagenic
+67410-22-4,Nc1ccc2ccc3ccccc3c2n1,mutagenic
+31555-54-1,ClC(=C1OC(=O)C(=C1Cl)Cl)Cl,mutagenic
+6730-83-2,CC12CCCC(C)(C1CCC34CC(CCC23)C(=C)C4)C(=O)O,non-mutagenic
+141691-42-1,Cn1c(N)nc2ccc(cc12)C#N,mutagenic
+1689-84-5,Oc1c(Br)cc(cc1Br)C#N,non-mutagenic
+921-14-2,CC(C)N(N)C(C)C,mutagenic
+119914-60-2,CC1CN(CCN1)c2cc3N(C=C(C(=O)O)C(=O)c3c(C)c2F)C4CC4,non-mutagenic
+674-82-8,C=C1CC(=O)O1,non-mutagenic
+172374-58-2,CC(=O)Nc1ccc(Oc2ccc(cc2)N(O)C(=O)C)cc1,mutagenic
+NOCAS_M452,CCCC[C@@H](CC)COCCCN,non-mutagenic
+NOCAS_M299,Cn1c(ncc1[N+](=O)[O-])[C@H]2NC(CO)(CO)CO2,mutagenic
+145439-03-8,CNc1ncn(C)c1C(=O)N(C)N=O,mutagenic
+1066-40-6,C[Si](C)(C)O,non-mutagenic
+329-71-5,Oc1cc(ccc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+119-90-4,COc1cc(ccc1N)c2ccc(N)c(OC)c2,mutagenic
+5862-77-1,CCOc1ccc(N)cc1N,mutagenic
+159092-68-9,[O-][N+](=O)c1cccc2c3ccccc3cc(c12)[N+](=O)[O-],mutagenic
+106428-28-8,CC12CCCC(C)(C1CCC34CC(O)(CCC23)C(=C)C4=O)C(=O)O,mutagenic
+157730-36-4,Cn1c(N)nc2nc3ccncc3cc12,non-mutagenic
+581-50-0,c1ccc(nc1)c2cccnc2,mutagenic
+88133-11-3,CCOCCc1c(nc(N)n2ncnc12)c3ccccc3,non-mutagenic
+98736-51-7,COC(=O)c1ccc(CN(C)N=O)cc1,non-mutagenic
+107759-11-5,CCOC(=O)N(N=O)C(CCC=O)c1cccnc1,mutagenic
+486-56-6,CN1C(CCC1=O)c2cccnc2,non-mutagenic
+14170-43-5,Nc1cc(c2cccc(c2c1)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+150-90-3,OC(=O)CCC(=O)O,non-mutagenic
+634-91-3,Nc1cc(Cl)c(Cl)c(Cl)c1,non-mutagenic
+129927-37-3,CCNCC#CC(C)(C)OC(=O)C(O)(C1CCCCC1)c2ccccc2,non-mutagenic
+106-58-1,CN1CCN(C)CC1,non-mutagenic
+95933-74-7,N\C(=N/O)\c1cc(O)c(O)c(O)c1,mutagenic
+124-40-3,CNC,non-mutagenic
+87-83-2,Cc1c(Br)c(Br)c(Br)c(Br)c1Br,non-mutagenic
+NOCAS_M44,O[C@@H]1c2ccccc2c3ccc(cc13)[N+](=O)[O-],mutagenic
+98114-61-5,OCCCN=N,mutagenic
+75-07-0,CC=O,non-mutagenic
+335-76-2,OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,non-mutagenic
+93673-34-8,O1C2C1c3cc4cc5ccccc5cc4c6cccc2c36,mutagenic
+107-19-7,OCC#C,mutagenic
+117929-13-2,[O-][N+](=O)c1cc2CCc3cc(cc4CCc(c1)c2c34)[N+](=O)[O-],mutagenic
+62018-89-7,OCCCCN(CCO)N=O,mutagenic
+60878-02-6,[O-][N+](=O)c1oc(\C=N\c2snc3ccccc23)cc1,mutagenic
+173216-45-0,OCC(CN=N#N)Cc1ccccc1,mutagenic
+118326-90-2,Brc1ccc2C3CCCCC3C=Cc2c1,non-mutagenic
+52547-00-9,Cc1cc(N)sn1,mutagenic
+330-55-2,CON(C)C(=O)Nc1ccc(Cl)c(Cl)c1,mutagenic
+87009-12-9,OC(CN=N#N)CN1C=CC(=O)NC1=O,mutagenic
+86-30-6,O=NN(c1ccccc1)c2ccccc2,non-mutagenic
+33813-20-6,S=C1SSC2=NCCN12,non-mutagenic
+NOCAS_M347,COC(=O)[C@H]([C@H]1CCCCN1)c2ccccc2,non-mutagenic
+18458-01-0,Cc1ccc(CC2CO2)cc1,mutagenic
+105-60-2,O=C1CCCCCN1,non-mutagenic
+76180-96-6,Cn1c(N)nc2c3cccnc3ccc12,mutagenic
+NOCAS_M16,C[C@@H](O)CN(C)N=O,mutagenic
+91254-96-5,Oc1cc2cccc3ccc4c(ccc1c4c23)[N+](=O)[O-],mutagenic
+115085-17-1,O1C=CC=Cc2c1c3cc4ccccc4cc3c5ccccc25,mutagenic
+82789-18-2,OC(=O)C1Cc2c([nH]c3ccccc23)C(N1)c4ccccc4,non-mutagenic
+91575-29-0,CC(=O)Nc1ccc(Cc2ccc(NC(=O)C)c(Cl)c2)cc1Cl,mutagenic
+84987-77-9,ClCCOC\C(=C/Cl)\Cl,mutagenic
+1204-60-0,O=Cc1cccc(c1)c2ccccc2,non-mutagenic
+104535-31-1,CC(O)Cc1cc(N)cc(c1N)[N+](=O)[O-],non-mutagenic
+23564-05-8,COC(=O)NC(=S)Nc1ccccc1NC(=S)NC(=O)OC,mutagenic
+108-59-8,COC(=O)CC(=O)OC,non-mutagenic
+95-85-2,Nc1cc(Cl)ccc1O,mutagenic
+29927-08-0,Cc1cc2nc(N)sc2cc1C,mutagenic
+65002-17-7,CC(C)(S)C(=O)NC(CS)C(=O)O,non-mutagenic
+194-69-4,c1ccc2c(c1)ccc3c2ccc4ccc5ccccc5c34,mutagenic
+158729-28-3,Clc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1Cl,non-mutagenic
+92180-79-5,Cc1nc2ccc3c(nc(N)n3C)c2nc1C,mutagenic
+88-74-4,Nc1ccccc1[N+](=O)[O-],non-mutagenic
+109-97-7,c1cc[nH]c1,non-mutagenic
+2314-97-8,FC(F)(F)I,mutagenic
+161697-03-6,Cc1nc2ccc(N)c(C)c2nc1C,mutagenic
+2940-63-8,COC1=CC(=O)C(=O)C(=C1)C(C)(C)C,non-mutagenic
+59229-75-3,Cc1c(N)cc(cc1N)[N+](=O)[O-],mutagenic
+68107-25-5,C[C@H]1C[C@H]2OC(=O)[C@H](C)[C@H]2C[C@@]3(C)[C@H](O)C[C@H](O)C[C@H]13,mutagenic
+78415-72-2,Cc1nc(O)c(cc1c2ccncc2)C#N,non-mutagenic
+75321-20-9,[O-][N+](=O)c1cc(c2ccc3cccc4ccc1c2c34)[N+](=O)[O-],mutagenic
+65734-38-5,CC(=O)NNc1ccc(CO)cc1,mutagenic
+2234-13-1,Clc1c(Cl)c(Cl)c2c(Cl)c(Cl)c(Cl)c(Cl)c2c1Cl,non-mutagenic
+105708-67-6,CC(=O)OC1Cc2cc3cccc4ccc5ccc1c2c5c34,mutagenic
+6637-88-3,Cc1cc(c(N)c(N=Nc2ccc(cc2C)c3ccc(N=Nc4ccc(O)c(c4)C(=O)O)c(C)c3)c1N)S(=O)(=O)O,mutagenic
+100-16-3,NNc1ccc(cc1)[N+](=O)[O-],mutagenic
+NOCAS_M397,CC[C@@H](C)[C@H](C)CO,non-mutagenic
+19866-61-6,[O-][n+]1cc2cccnc2cn1,non-mutagenic
+63390-12-5,Nc1ccc(cc1Cl)c2cc(Cl)c(N)c(Cl)c2,mutagenic
+142044-38-0,[O-][n+]1cccc2C3OC3C=Cc12,non-mutagenic
+156-59-2,Cl\C=C/Cl,non-mutagenic
+621-42-1,CC(=O)Nc1cccc(O)c1,non-mutagenic
+24305-27-9,NC(=O)C1CCCN1C(=O)C(Cc2c[nH]cn2)NC(=O)C3CCC(=O)N3,non-mutagenic
+60877-92-1,Oc1ccc(\C=N\c2snc3ccccc23)cc1,mutagenic
+31125-05-0,CC(=O)c1ccc(cc1)N=O,mutagenic
+NOCAS_M280,CC(C)NC[C@@H]1CCc2cc(CO)c(cc2N1)[N+](=O)[O-],mutagenic
+80-15-9,CC(C)(OO)c1ccccc1,mutagenic
+82-33-7,Nc1ccc(N)c2C(=O)c3c(cccc3[N+](=O)[O-])C(=O)c12,mutagenic
+139-13-9,OC(=O)CN(CC(=O)O)CC(=O)O,non-mutagenic
+303-98-0,COC1=C(OC)C(=O)C(=C(C)C1=O)C\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CC\C=C(/C)\CCC=C(C)C,non-mutagenic
+9003-53-6,C[C@H](CCc1ccccc1)c2ccccc2,non-mutagenic
+119631-01-5,Cc1ccc2nc3cc(C)c(N)cc3nc2c1N,mutagenic
+67-68-5,CS(=O)C,non-mutagenic
+613-93-4,CNC(=O)c1ccccc1,non-mutagenic
+3570-75-0,[O-][N+](=O)c1oc(cc1)c2csc(NNC=O)n2,mutagenic
+110-71-4,COCCOC,mutagenic
+78448-09-6,Oc1cccc2c1ccc3[nH]c4ccc5ccccc5c4c23,mutagenic
+812-00-0,COP(=O)(O)O,non-mutagenic
+123-86-4,CCCCOC(=O)C,non-mutagenic
+2227-17-0,ClC1=C(Cl)C(Cl)(C(=C1Cl)Cl)C2(Cl)C(=C(Cl)C(=C2Cl)Cl)Cl,mutagenic
+88598-57-6,[O-][N+](=O)c1ccc2ccc3c4CCCCc4cc5ccc1c2c35,mutagenic
+530-78-9,OC(=O)c1ccccc1Nc2cccc(c2)C(F)(F)F,non-mutagenic
+824-94-2,COc1ccc(CCl)cc1,non-mutagenic
+632-21-3,ClC(Cl)C(=O)C(Cl)Cl,mutagenic
+109897-80-5,OC1C(O)c2cc3ccc(cc3cc2CC1=O)[N+](=O)[O-],non-mutagenic
+NOCAS_M112,CC[C@H]1CO1,mutagenic
+146177-62-0,Cc1nc2c(C)c(C)c3c(nc(N)n3C)c2nc1C,mutagenic
+16783-47-4,C=CN=Nc1ccccc1,mutagenic
+NOCAS_M328,CN1C[C@@H](c2ccccc2)c3cccc(N)c3C1,non-mutagenic
+55804-66-5,CCOC(=O)C1=Cc2cc3CCCN4CCCc(c2OC1=O)c34,non-mutagenic
+20426-12-4,Oc1ccc(\C=C\C(=O)c2ccccc2)cc1,non-mutagenic
+35144-55-9,OC(=O)CC(NC(=O)COc1ccc(Cl)cc1Cl)C(=O)O,non-mutagenic
+533-73-3,Oc1ccc(O)c(O)c1,mutagenic
+123-39-7,CNC=O,non-mutagenic
+163275-60-3,Fc1cccc2c1ccc3cccnc23,mutagenic
+52278-77-0,NC1=NC(=O)N(C=C1O)C2CC(O)C(CO)O2,non-mutagenic
+102791-34-4,[O-][N+](=O)c1ccc2ccc3cccc4C(=O)Oc1c2c34,mutagenic
+142713-67-5,CC(NCc1ccccc1)C(=O)NCc2ccccc2,non-mutagenic
+83-26-1,CC(C)(C)C(=O)C1C(=O)c2ccccc2C1=O,non-mutagenic
+99-51-4,Cc1ccc(cc1C)[N+](=O)[O-],mutagenic
+4803-27-4,Cc1ccc2C(=O)N3C=C(CC3C(O)Nc2c1O)\C=C\C(=O)N,mutagenic
+NOCAS_M451,COC(=C1[C@H](C(=C(C)N=C1C)C(=O)OCC(=O)C)c2ccccc2[N+](=O)[O-])O,non-mutagenic
+110004-65-4,CS(=O)(=O)Nc1ccc(Nc2c3ccc(cc3nc4cc(ccc24)N=N#N)N=N#N)cc1,mutagenic
+606-31-5,[O-][N+](=O)c1cccc(c1C=O)[N+](=O)[O-],mutagenic
+88488-97-5,Oc1ccc2c(c1)c3ccccc3c4cc5ccccc5cc24,mutagenic
+60032-80-6,C1CCc2c(C1)cc3c4ccccc4cc5c6ccccc6c2c35,mutagenic
+117549-85-6,N\C(=N/OC1OC(C(O)C(O)C1O)C(=O)O)\c2ccccc2,non-mutagenic
+66357-59-3,CN\C(=C\[N+](=O)[O-])\NCCSCc1oc(CN(C)C)cc1,non-mutagenic
+118745-15-6,O=Nc1c2ccccc2c3ccc4cccc5ccc1c3c45,mutagenic
+50-79-3,OC(=O)c1cc(Cl)ccc1Cl,non-mutagenic
+83435-67-0,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N(CC(=O)O)C2Cc3ccccc3C2,non-mutagenic
+13177-31-6,[O-][N+](=O)c1cccc2c3cccc4cccc(c12)c34,mutagenic
+39720-27-9,CC(=O)Oc1ccc(CCl)cc1,mutagenic
+315-30-0,Oc1[nH]cnc2nncc12,non-mutagenic
+95-55-6,Nc1ccccc1O,mutagenic
+26541-51-5,O=NN1CCSCC1,mutagenic
+1838-94-4,CC1(CO1)C=C,non-mutagenic
+33448-26-9,CNC1Cc2cccc3cccc(C1)c23,mutagenic
+75586-69-5,C[n+]1c2ccccc2cc3cc(N)ccc13,mutagenic
+84498-34-0,Oc1cc2ccccc2c3ccc4ccccc4c13,non-mutagenic
+91897-48-2,CN1CC(=C[C@@H]2[C@H]1Cc3cn(CC=C)c4cccc2c34)CO,mutagenic
+4261-14-7,Nc1ncnc2c1ncn2Cc3ccccc3,mutagenic
+25834-80-4,Nc1ccc(Cc2ccc(N)c(Cc3ccc(N)cc3)c2)cc1,mutagenic
+542-56-3,CC(C)CON=O,mutagenic
+106871-13-0,Cc1ccc(cc1N(CCCl)CCCl)C(O)(P(=O)(O)O)P(=O)(O)O,mutagenic
+7492-66-2,CCOC(OCC)\C=C(\C)/CCC=C(C)C,non-mutagenic
+94-58-6,CCCc1ccc2OCOc2c1,non-mutagenic
+93957-55-2,CC(C)n1c(\C=C\[C@H](O)C[C@@H](O)CC(=O)O)c(c2ccc(F)cc2)c3ccccc13,non-mutagenic
+53340-16-2,CC[N+](=C1C=CC2=Nc3c(OC2=C1)cc(N)c4ccccc34)CC,mutagenic
+2243-61-0,Nc1ccc(N)c2ccccc12,mutagenic
+20589-85-9,Cl\C=C(/Cl)\C(Cl)Cl,mutagenic
+637-07-0,CCOC(=O)C(C)(C)Oc1ccc(Cl)cc1,non-mutagenic
+54749-90-5,OCC(O)C(O)C(O)C(NC(=O)N(CCCl)N=O)C=O,mutagenic
+20324-66-7,Cc1cc(O)c2C(=O)c3c(O)cc(O)c(O)c3C(=O)c2c1,mutagenic
+108-46-3,Oc1cccc(O)c1,non-mutagenic
+17526-24-8,CC(=O)OCc1c2ccccc2cc3c1ccc4ccccc34,mutagenic
+54827-17-7,Cc1cc(cc(C)c1N)c2cc(C)c(N)c(C)c2,non-mutagenic
+85-33-6,CC(=C)c1ccc(C)c2ccc(C=O)c2c1,mutagenic
+144425-09-2,COc1ccc2cc(c3C=CC(=O)Oc3c2c1)[N+](=O)[O-],mutagenic
+109237-00-5,CC(=O)C1=CCC2C3=CCC4=CC(O)C(O)CC4(C)C3CC(O)C12C,non-mutagenic
+50-30-6,OC(=O)c1c(Cl)cccc1Cl,non-mutagenic
+118995-84-9,CC(C)(C)NC(=O)SCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O,non-mutagenic
+556-08-1,CC(=O)Nc1ccc(cc1)C(=O)O,non-mutagenic
+78-11-5,[O-][N+](=O)OCC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-],non-mutagenic
+699-18-3,[O-][N+](=O)\C=C\c1occc1,non-mutagenic
+2880-58-2,COC1=CC(=O)C=CC1=O,non-mutagenic
+115459-65-9,[O-][N+](=O)c1ccc(cc1)C(=O)OC[C@H]2CO2,mutagenic
+55936-77-1,CN(OC(=O)C)c1ccc(cc1)N=Nc2ccccc2,mutagenic
+17627-75-7,COc1ccc(\C=C\C)c(OC)c1,non-mutagenic
+199536-65-7,ClC1=C(CBr)COC1=O,mutagenic
+116530-07-5,Cc1cccc2ccc(cc12)[N+](=O)[O-],mutagenic
+NOCAS_M172,O[C@@H]1CCO[P@](=O)(N1)N(CCCl)CCCl,mutagenic
+931-97-5,OC1(CCCCC1)C#N,non-mutagenic
+69839-83-4,ONC(=O)c1ccc(O)c(O)c1,mutagenic
+5845-67-0,CC(C)CC1NC(=O)CNC1=O,non-mutagenic
+103-30-0,C(=C\c1ccccc1)/c2ccccc2,non-mutagenic
+51857-25-1,Cc1c(cc(cc1[N+](=O)[O-])N=[N+]([O-])c2cc(c(C)c(c2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+136112-70-4,Nc1nc(nc2c1ncn2c3ccc(cc3)[N+](=O)[O-])c4ccc(cc4)[N+](=O)[O-],mutagenic
+608-71-9,Oc1c(Br)c(Br)c(Br)c(Br)c1Br,non-mutagenic
+57018-52-7,C[C@@H](O)COC(C)(C)C,mutagenic
+50-76-0,CC(C)[C@@H]1NC(=O)[C@@H](NC(=O)C2=C(N)C(=O)C(=C3Oc4c(C)ccc(C(=O)N[C@H]5[C@@H](C)OC(=O)[C@@H](C(C)C)N(C)C(=O)CN(C)C(=O)[C@@H]6CCCN6C(=O)[C@@H](NC5=O)C(C)C)c4N=C23)C)[C@H](C)OC(=O)[C@H](C(C)C)N(C)C(=O)CN(C)C(=O)[C@@H]7CCCN7C1=O,non-mutagenic
+20917-49-1,O=NN1CCCCCCC1,mutagenic
+80-09-1,Oc1ccc(cc1)S(=O)(=O)c2ccc(O)cc2,non-mutagenic
+3237-50-1,OC1(O)C(=O)NC(=O)NC1=O,non-mutagenic
+53716-49-7,CC(C(=O)O)c1ccc2c(c1)[nH]c3ccc(Cl)cc23,non-mutagenic
+NOCAS_M557,CC[C@@H](CO)[N+](=O)[O-],non-mutagenic
+116505-53-4,OC(=O)CCCc1ccc(NCCCl)cc1,mutagenic
+106-43-4,Cc1ccc(Cl)cc1,non-mutagenic
+15826-37-6,OC(COc1cccc2OC(=CC(=O)c12)C(=O)O)COc3cccc4OC(=CC(=O)c34)C(=O)O,non-mutagenic
+191861-19-5,Fc1cc2cccnc2c3ncccc13,mutagenic
+235760-37-9,Cc1cc(C)c2nsnc2c1N,mutagenic
+105361-85-1,ONc1cccc(c1)c2ccccc2,non-mutagenic
+81-16-3,Nc1ccc2ccccc2c1S(=O)(=O)O,mutagenic
+15307-79-6,OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl,non-mutagenic
+133-32-4,OC(=O)CCCc1c[nH]c2ccccc12,non-mutagenic
+106589-49-5,C1Cc2ccc3nc4ccc5ccccc5c4cc3c2C=C1,mutagenic
+91254-93-2,Oc1cc2c(ccc3ccc4cccc1c4c23)[N+](=O)[O-],mutagenic
+88-06-2,Oc1c(Cl)cc(Cl)cc1Cl,non-mutagenic
+534-22-5,Cc1occc1,non-mutagenic
+124-02-7,C=CCNCC=C,non-mutagenic
+534-52-1,Cc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+10396-68-6,OC1COC(Nc2ccc(cc2)C(=O)O)C(O)C1O,non-mutagenic
+129833-03-0,CC(=O)C1(C)OC12C(=O)C=Cc3ccccc23,non-mutagenic
+16354-52-2,CCc1c2ccccc2c(CC)c3c1ccc4ccccc34,non-mutagenic
+1072-83-9,CC(=O)c1ccc[nH]1,mutagenic
+17626-02-7,COc1cc(N)c(OC)cc1N,mutagenic
+262-20-4,O1c2ccccc2Sc3ccccc13,non-mutagenic
+257948-44-0,[O-][N+](=O)c1ccc2c(c1)c3nc4ccccc4c5c6ccccc6nc2c35,mutagenic
+7213-59-4,COc1cc2C(=O)c3cc(C)cc(O)c3C(=O)c2c(O)c1O,mutagenic
+1121-55-7,C=Cc1cccnc1,non-mutagenic
+113-98-4,CC1(C)S[C@@H]2[C@@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O,non-mutagenic
+1606-67-3,Nc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+5323-95-5,CCCCCC[C@H](O)C\C=C/CCCCCCCC(=O)O,non-mutagenic
+67616-44-8,OCCSN=O,mutagenic
+3844-63-1,O=NN1CCNC1=O,mutagenic
+41340-25-4,CCc1cccc2c3CCOC(CC)(CC(=O)O)c3[nH]c12,non-mutagenic
+590-21-6,C\C=C\Cl,mutagenic
+573-58-0,Nc1c(cc(c2ccccc12)S(=O)(=O)O)N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)S(=O)(=O)O,mutagenic
+NOCAS_M253,[O-][N+](=O)c1ccc(OC[C@H]2CO2)cc1,mutagenic
+239-35-0,c1ccc2c(c1)ccc3c4ccccc4sc23,mutagenic
+6358-23-2,Oc1ccccc1Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-],mutagenic
+61695-74-7,C1O[C@@H]1c2ccc3ccc4cccc5ccc2c3c45,mutagenic
+79-46-9,CC(C)[N+](=O)[O-],mutagenic
+1319-69-3,OCC(O)COP(=O)(O)O,non-mutagenic
+1401-55-4,Oc1cc(cc(O)c1O)C(=O)OCC2OC(OC(=O)c3cc(O)c(OC(=O)c4cc(O)c(O)c(O)c4)c(O)c3)C(OC(=O)c5cc(O)c(O)c(O)c5)C(OC(=O)c6cc(O)c(O)c(O)c6)C2OC(=O)c7cc(O)c(O)c(O)c7,non-mutagenic
+55-18-5,CCN(CC)N=O,mutagenic
+100-19-6,CC(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+69866-21-3,COc1c(O)c2N(CCc2c3cc([nH]c13)C(=O)N4CCc5c4c(O)c(OC)c6[nH]c(cc56)C(=O)N7CC8CC89C7=CC(=O)c%10[nH]cc(C)c9%10)C(=O)N,non-mutagenic
+128753-82-2,COC12OOC1(C)Oc3ccccc23,mutagenic
+2208-41-5,COc1cc2c(CCNC(=O)C)c[nH]c2cc1O,non-mutagenic
+39482-21-8,C[Si](C)(C)CN(N=O)C(=O)N,mutagenic
+51483-40-0,ClC(CBr)CBr,mutagenic
+620-89-3,Cc1ccc(Nc2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+NOCAS_M555,CC(C)OC(=O)C[C@@](O)(CC(=O)O)C(=O)O,non-mutagenic
+134-03-2,OC[C@H](O)[C@H]1OC(=C(O)C1=O)O,non-mutagenic
+NOCAS_M27,O[C@H]1C=C2c3ccc4ccccc4c3c5cccc([C@@H]1O)c25,mutagenic
+55738-54-0,CN(C)CNc1oc(\C=C\c2oc(cc2)[N+](=O)[O-])nn1,mutagenic
+57-57-8,O=C1CCO1,mutagenic
+65-45-2,NC(=O)c1ccccc1O,non-mutagenic
+15104-03-7,CC1CCN(CC1)N=O,mutagenic
+18715-54-3,C[Si](C)(CCCOCC1CO1)c2ccc(cc2)[Si](C)(C)CCCOCC3CO3,mutagenic
+NOCAS_M205,CC(C)(C)OC[C@H]1CO1,mutagenic
+89-75-8,ClC(=O)c1ccc(Cl)cc1Cl,mutagenic
+105-67-9,Cc1ccc(O)c(C)c1,mutagenic
+6098-44-8,CC(=O)ON(C(=O)C)c1ccc2c(Cc3ccccc23)c1,mutagenic
+2432-99-7,NCCCCCCCCCCC(=O)O,non-mutagenic
+689-98-5,NCCCl,mutagenic
+1127-45-3,Oc1cccc2ccc[n+]([O-])c12,non-mutagenic
+26227-73-6,CCCCc1ccc(cc1)\N=C/c2ccc(OC)cc2,mutagenic
+83-67-0,CN1C(=O)NC(=O)c2c1ncn2C,non-mutagenic
+19213-09-3,CC(O)CC(=O)Nc1ccc(O)cc1,non-mutagenic
+62-23-7,OC(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+5711-16-0,CC1CC23CCC4C(C)(CCCC4(C)C(=O)O)C2CCC1(O)C3,non-mutagenic
+765-87-7,O=C1CCCCC1=O,mutagenic
+6728-26-3,CCC\C=C\C=O,mutagenic
+158729-25-0,[O-][N+](=O)c1cccc(NS(=O)(=O)c2cccc3cccnc23)c1,non-mutagenic
+565-64-0,OC(=O)C(Cl)CCl,non-mutagenic
+107-02-8,C=CC=O,mutagenic
+146795-43-9,[O-][N+](=O)c1cc(cs1)C(=O)Nc2ccccc2Br,mutagenic
+137-66-6,CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(=C(O)C1=O)O,non-mutagenic
+107793-72-6,CC(=O)N(CC(O)CO)c1c(I)c(C(=O)NCCO)c(I)c(C(=O)NCC(O)CO)c1I,non-mutagenic
+68641-49-6,ClP(=O)(N1CCOC1=O)N2CCOC2=O,mutagenic
+62674-12-8,ClC1=C(Cl)C(=O)OC1,mutagenic
+71721-78-3,[O-][N+](=O)c1ccc2Oc3cc(Cl)c(Cl)cc3Oc2c1,mutagenic
+98640-41-6,NC(CSC(F)(F)C(F)(F)C(F)F)C(=O)O,non-mutagenic
+7700-17-6,COP(=O)(OC)O\C(=C/C(=O)O[C@@H](C)c1ccccc1)\C,non-mutagenic
+611-13-2,COC(=O)c1occc1,non-mutagenic
+623-05-2,OCc1ccc(O)cc1,non-mutagenic
+NOCAS_M542,CCCC[C@@H](CC)COP(=O)(Oc1ccccc1)Oc2ccccc2,non-mutagenic
+1148-79-4,c1ccc(nc1)c2cccc(n2)c3ccccn3,mutagenic
+93535-04-7,Nc1ccc(\C=C\c2cccc(Cl)c2)cc1,mutagenic
+98-57-7,CS(=O)(=O)c1ccc(Cl)cc1,non-mutagenic
+101-26-8,CN(C)C(=O)Oc1ccc[n+](C)c1,non-mutagenic
+500-38-9,CC(Cc1ccc(O)c(O)c1)C(C)Cc2ccc(O)c(O)c2,non-mutagenic
+195-27-7,c1ccc2c(c1)ncc3cnc4ccccc4c23,non-mutagenic
+107-13-1,C=CC#N,mutagenic
+22769-68-2,COC(=O)Nc1nc2cc(O)ccc2[nH]1,non-mutagenic
+3414-62-8,OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(NO)ncnc23,mutagenic
+2481-94-9,CCN(CC)c1ccc(cc1)N=Nc2ccccc2,non-mutagenic
+104-28-9,CCOCCOC(=O)\C=C/c1ccc(OC)cc1,non-mutagenic
+934-32-7,Nc1nc2ccccc2[nH]1,non-mutagenic
+73-22-3,N[C@H](Cc1c[nH]c2ccccc12)C(=O)O,non-mutagenic
+6367-36-8,CC(C)(C)OC(=O)CN=N#N,mutagenic
+3442-62-4,[O-][N+](=O)c1ccc2nc3ccccc3nc2c1,mutagenic
+3694-52-8,Nc1cccc(c1N)[N+](=O)[O-],mutagenic
+99240-66-1,CCN(C(=O)C)c1ccc2c(Cc3ccccc23)c1,mutagenic
+NOCAS_M303,C[C@H](I)[C@@H]1OC[C@@H](CO)O1,mutagenic
+133591-33-0,Cc1cc(c(C)c2c3ccccc3[nH]c12)[N+](=O)[O-],mutagenic
+105579-74-6,Oc1ccc2C3C4OC4C(=O)c5c(O)ccc(C6C7OC7C(=O)c1c26)c35,mutagenic
+142-09-6,CCCCCCOC(=O)C(=C)C,non-mutagenic
+61439-60-9,CS(=O)(=O)OCCc1ccc(OCc2ccccc2)cc1,mutagenic
+5956-39-8,CC1(C)CCCC2(C)C1CC=C(C=O)C2C=O,non-mutagenic
+106-40-1,Nc1ccc(Br)cc1,non-mutagenic
+1718-34-9,OC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)[N+](=O)[O-],mutagenic
+160543-16-8,Cc1ccc2nc3c4ccccc4C(O)C(O)c3c(C)c2c1,non-mutagenic
+2642-98-0,Nc1cc2c3ccccc3ccc2c4ccccc14,mutagenic
+131229-64-6,CCCCON(OC(=O)C)C(=O)c1ccc(cc1)[N+](=O)[O-],mutagenic
+75005-80-0,NC(CSc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl)C(=O)O,non-mutagenic
+109-06-8,Cc1ccccn1,non-mutagenic
+158729-27-2,Clc1ccc(NS(=O)(=O)c2cccc3cccnc23)c(Cl)c1,non-mutagenic
+31566-31-1,CCCCCCCCCCCCCCCCCC(=O)OCC(O)CO,non-mutagenic
+105650-23-5,Cn1c(N)nc2ncc(cc12)c3ccccc3,mutagenic
+7230-71-9,Cc1ccc2cc3ccc4ccccc4c3nc2c1,mutagenic
+1119-48-8,CNCCCC(=O)O,non-mutagenic
+14371-10-9,O=C\C=C/c1ccccc1,mutagenic
+56-23-5,ClC(Cl)(Cl)Cl,non-mutagenic
+104-54-1,OC\C=C\c1ccccc1,non-mutagenic
+96-48-0,O=C1CCCO1,non-mutagenic
+66291-31-4,Cc1ccc2ccc3ccccc3c2c1C,non-mutagenic
+42200-33-9,CC(C)(C)NCC(O)COc1cccc2CC(O)C(O)Cc12,non-mutagenic
+133762-84-2,COC1=NC(=O)N(CC(O)CN=N#N)C=C1C,mutagenic
+598-57-2,CN[N+](=O)[O-],non-mutagenic
+2520-60-7,CC(=CCC1CCCC1=O)C,non-mutagenic
+225366-91-6,Fc1ccc2ncccc2c1F,mutagenic
+6201-87-2,Nc1cc(C(=O)O)c(O)c(c1)S(=O)(=O)O,non-mutagenic
+80-05-7,CC(C)(c1ccc(O)cc1)c2ccc(O)cc2,non-mutagenic
+71711-58-5,Cc1c(C)c2c(N)c3ccccc3nc2c4ccccc14,mutagenic
+53527-28-9,CC(=O)OC1CC2C3(C)CCCC(C)(C)C3CCC2(C)C4CC=C(C=O)C(C=O)C14C,non-mutagenic
+4332-51-8,ClCCSCc1ccccc1,mutagenic
+68395-77-7,Cc1cc(C)cc(NO)c1,mutagenic
+155014-05-4,Nc1cccc2ncc(F)cc12,mutagenic
+125486-24-0,CCN(CCCl)c1ccc(CCCNc2c3ccccc3nc4ccccc24)cc1,mutagenic
+110-91-8,C1COCCN1,non-mutagenic
+6756-41-8,Cc1ccc(cc1)N=Nc2c(O)ccc3ccccc23,non-mutagenic
+113202-71-4,O=Nc1cc2c3ccccc3ccc2c4ccccc14,mutagenic
+551-06-4,S=C=Nc1cccc2ccccc12,mutagenic
+109032-48-6,CNC(=O)Oc1cc2ccccc2c3ccccc13,mutagenic
+517-28-2,Oc1cc2C[C@@]3(O)COc4c(O)c(O)ccc4[C@@H]3c2cc1O,non-mutagenic
+215-58-7,c1ccc2cc3c4ccccc4c5ccccc5c3cc2c1,mutagenic
+155164-62-8,ClC1=C(Cl)C(=O)N(N=C1)S(=O)(=O)c2ccc(Cl)cc2Cl,non-mutagenic
+6673-35-4,CC(C)NCC(O)COc1ccc(NC(=O)C)cc1,non-mutagenic
+1985-51-9,CC(=C)C(=O)OCC(C)(C)COC(=O)C(=C)C,non-mutagenic
+125761-28-6,CC(=O)OC1C(O)C(OC(=O)\C=C\c2ccc(O)cc2)C(CO)OC1OC34CC(C)(C)C(=O)C3C(C)(O)C5(CC5)C(=C4)C,mutagenic
+90-65-3,CO\C(=C/C(=O)O)\C(=O)C(=C)C,mutagenic
+110336-19-1,O=C1CCc2ccc3ccc4ccccc4c3c12,non-mutagenic
+142-96-1,CCCCOCCCC,non-mutagenic
+63885-23-4,CCNC(=N)N(N=O)[N+](=O)[O-],mutagenic
+161697-02-5,CNc1ccc2ncc(nc2c1C)c3ccccc3,mutagenic
+78-51-3,CCCCOCCOP(=O)(OCCOCCCC)OCCOCCCC,non-mutagenic
+58-08-2,CN1C(=O)N(C)c2ncn(C)c2C1=O,non-mutagenic
+3175-89-1,CN1CCc2cc3OCOc3c4c5ccccc5C(O)C1c24,mutagenic
+115-11-7,CC(=C)C,non-mutagenic
+129833-00-7,CC1=CC(=O)Oc2c3OC4(C)OOC4(C)c3ccc12,mutagenic
+104-88-1,Clc1ccc(C=O)cc1,non-mutagenic
+35300-54-0,CCCC(=O)OCc1ccc(cc1)[N+](=O)[O-],mutagenic
+142713-66-4,CC(Br)C(=O)NC(C)(C)C,non-mutagenic
+80-78-4,CC1CCC2C(C)C3C(CC4C5CC=C6CC(O)CCC6(C)C5CCC34C)N2C1,non-mutagenic
+188970-84-5,Oc1cccc2c1ccc3[nH]c4cc(c5ccccc5c4c23)[N+](=O)[O-],mutagenic
+74339-98-3,OC1C=Cc2c(cc3c4ccccc4cc5c6ccccc6c2c35)C1O,mutagenic
+56892-30-9,Oc1cc2ccc3cc4ccccc4c5ccc(c1)c2c35,mutagenic
+99520-67-9,Oc1c2c3ccccc3c4ccc5ccc6cccc1c6c5c24,non-mutagenic
+110963-29-6,NNC(=O)c1[nH]c2ccccc2c1N,mutagenic
+138154-39-9,CCN(CC)CCNc1ccc2ncn3c4ccc(O)cc4C(=O)c1c23,mutagenic
+17928-28-8,C[Si](C)(C)O[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C,non-mutagenic
+56548-64-2,CCN(CC)c1cc(NC(=O)C)c(cc1OC)N=Nc2c(Br)cc(cc2[N+](=O)[O-])[N+](=O)[O-],mutagenic
+2270-40-8,CC(=O)OCC12CCC(=CC1OC3C(O)C(OC(=O)C)C2(C)C34CO4)C,non-mutagenic
+33237-74-0,CCN(CC)CCCN(C1Cc2ccccc2C1)c3ccccc3,non-mutagenic
+56-72-4,CCOP(=S)(OCC)Oc1ccc2C(=C(Cl)C(=O)Oc2c1)C,non-mutagenic
+95-94-3,Clc1cc(Cl)c(Cl)cc1Cl,non-mutagenic
+4539-51-9,Nc1ccc2c(c1)[nH]c3ccccc23,mutagenic
+7177-48-2,CC1(C)S[C@@H]2[C@@H](NC(=O)[C@@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O,non-mutagenic
+141511-31-1,[O-][N+](=O)c1ccc2c(ccc3cc4c(ccc5ccccc45)cc23)c1,mutagenic
+7437-61-8,CC(=C)C1CO1,non-mutagenic
+74011-58-8,CCN1C=C(C(=O)O)C(=O)c2cc(F)c(nc12)N3CCNCC3,mutagenic
+479-79-8,O=C1c2ccccc2c3ccc4ccccc4c13,non-mutagenic
+470-82-6,C[C@@]12CC[C@@H](CC1)C(C)(C)O2,non-mutagenic
+97-77-8,CCN(CC)C(=S)SSC(=S)N(CC)CC,non-mutagenic
+1622-62-4,CN1C(=O)CN=C(c2ccccc2F)c3cc(ccc13)[N+](=O)[O-],mutagenic
+162050-09-1,[O-][N+](=O)c1oc(C(=O)CBr)c(Cl)c1Cl,mutagenic
+641-38-3,Cc1cc(O)cc2OC(=O)c3c(O)cc(O)cc3c12,non-mutagenic
+938-55-6,CN(C)c1[nH]cnc2ncnc12,mutagenic
+422-56-0,FC(F)(F)C(F)(F)C(Cl)Cl,non-mutagenic
+1156-19-0,Cc1ccc(cc1)S(=O)(=O)NC(=O)NN2CCCCCC2,non-mutagenic
+16582-03-9,Nc1cccc2nc3c(N)cccc3nc12,mutagenic
+42471-28-3,Cc1ncc(CNC(=O)N(CCCl)N=O)c(N)n1,mutagenic
+22755-15-3,CC(=O)Nc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+NOCAS_M330,C1C=C[C@@H]2[C@@H]3C[C@@H](C=C3)[C@H]12,non-mutagenic
+112-49-2,COCCOCCOCCOC,mutagenic
+54522-52-0,COC1(CCC(C)COC2OC(CO)C(O)C(O)C2O)OC3CC4C5CC=C6CC(CCC6(C)C5CCC4(C)C3C1C)OC7OC(CO)C(OC8OC(C)C(O)C(O)C8O)C(O)C7OC9OC(C)C(O)C(O)C9O,non-mutagenic
+88169-60-2,COC(=O)C(N)CSCCCl,mutagenic
+103-33-3,c1ccc(cc1)N=Nc2ccccc2,mutagenic
+95-51-2,Nc1ccccc1Cl,non-mutagenic
+115-96-8,ClCCOP(=O)(OCCCl)OCCCl,non-mutagenic
+77-06-5,C[C@]12[C@@H](O)C=C[C@@]3(OC1=O)[C@H]4CC[C@]5(O)C[C@]4(CC5=C)[C@H]([C@H]23)C(=O)O,non-mutagenic
+4914-30-1,CCC1=C(CC2NCCc3cc(OC)c(OC)cc23)CC4N(CCc5cc(OC)c(OC)cc45)C1,non-mutagenic
+51230-49-0,Clc1ccc2oc3ccccc3c2c1,mutagenic
+94-75-7,OC(=O)COc1ccc(Cl)cc1Cl,non-mutagenic
+389-08-2,CCN1C=C(C(=O)O)C(=O)c2ccc(C)nc12,non-mutagenic
+2493-84-7,CCCCCCCCOc1ccc(cc1)C(=O)O,non-mutagenic
+75-09-2,ClCCl,mutagenic
+159714-84-8,Cc1cccc2C3NC3c4cc5ccccc5cc4c12,mutagenic
+97672-08-7,O=Nn1cc(CC#N)c2ccccc12,mutagenic
+108-10-1,CC(C)CC(=O)C,non-mutagenic
+122-88-3,OC(=O)COc1ccc(Cl)cc1,non-mutagenic
+1728-96-7,COc1ccc(cc1)c2nc(c3ccc(OC)cc3)c([nH]2)c4ccc(OC)cc4,mutagenic
+100-20-9,ClC(=O)c1ccc(cc1)C(=O)Cl,mutagenic
+7493-72-3,CCCCCCCCC(=O)OCC=C,non-mutagenic
+106532-73-4,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3cccc(Cl)c3)\c2c1)C(=O)c4cccc(Cl)c4,mutagenic
+548-93-6,Nc1c(O)cccc1C(=O)O,non-mutagenic
+149922-82-7,ClC1c2cccc3ccc4c5ccccc5cc1c4c23,mutagenic
+104145-44-0,COC(=O)c1cc2c3ccccc3[nH]c2c(n1)c4ccc5C(=O)C=CC(=O)c5n4,mutagenic
+85-02-9,c1ccc2c(c1)ccc3ncccc23,mutagenic
+38915-28-5,CCN(CCCl)CCCNc1c2ccc(Cl)cc2nc3ccc(OC)nc13,mutagenic
+NOCAS_M582,C[C@@H](O)C[N+](C)(C)NC(=O)C(=C)C,non-mutagenic
+13674-87-8,ClCC(CCl)OP(=O)(OC(CCl)CCl)OC(CCl)CCl,mutagenic
+85-81-4,COc1cc(c2ncccc2c1)[N+](=O)[O-],mutagenic
+129251-09-8,CCC(CCOCN1C=CN(C)C1\C=N\O)[N+](=O)[O-],non-mutagenic
+958-93-0,CN(C)CCN(Cc1ccsc1)c2ccccn2,non-mutagenic
+617-35-6,CCOC(=O)C(=O)C,non-mutagenic
+106-39-8,Clc1ccc(Br)cc1,non-mutagenic
+78-93-3,CCC(=O)C,non-mutagenic
+63710-10-1,CCC1(O)CC(OC2CC(C(OC3CC(O)C(OC4CC(O)C(O)C(C)O4)C(C)O3)C(C)O2)N(C)C)c5c(O)c6C(=O)c7c(O)ccc(O)c7C(=O)c6cc5C1C(=O)OC,mutagenic
+119-84-6,O=C1CCc2ccccc2O1,non-mutagenic
+764-42-1,N#C\C=C/C#N,non-mutagenic
+32157-71-4,Brc1ccc(cc1)C(=O)C2OC2c3ccccc3,non-mutagenic
+NOCAS_M265,OC[C@H](O)CI,mutagenic
+NOCAS_M342,CCCCC[C@@H](CC)OC(=O)c1cccc(c1)C(=O)O[C@H](CC)CCCCC,non-mutagenic
+NOCAS_M304,COC(=O)[C@@]1(O[C@@]1(C)[C@H](O)C(C)C)C(=O)N,mutagenic
+158729-21-6,Cc1cccc(NS(=O)(=O)c2cccc3cccnc23)c1,non-mutagenic
+262-12-4,O1c2ccccc2Oc3ccccc13,non-mutagenic
+99-35-4,[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+832-69-9,Cc1cccc2c1ccc3ccccc23,mutagenic
+3761-53-3,Cc1ccc(N=Nc2c(O)c(cc3cc(ccc23)S(=O)(=O)O)S(=O)(=O)O)c(C)c1,mutagenic
+38716-10-8,OCC1OC(CC1O)N2C=C(COO)C(=O)NC2=O,mutagenic
+160543-00-0,Cc1ccc2nc3c(ccc4ccccc34)c(CO)c2c1,mutagenic
+118-92-3,Nc1ccccc1C(=O)O,non-mutagenic
+63521-85-7,COc1cccc2C(=O)c3c(O)c4CC(O)(CC(OC5CC(N)CC(C)O5)c4c(O)c3C(=O)c12)C(=O)CO,mutagenic
+603-87-2,Nc1cccc(c1O)[N+](=O)[O-],non-mutagenic
+3153-55-7,COc1c(O)cc2CCN(C)C3Cc4ccccc4c1c23,mutagenic
+1686-14-2,CC1(C)C2CC3OC3(C)C1C2,non-mutagenic
+188107-70-2,Cn1c2ccccc2c3ccc(cc13)[N+](=O)[O-],mutagenic
+22433-76-7,CC(=O)Nc1ccc2ncccc2c1,mutagenic
+117-12-4,Oc1cccc2C(=O)c3c(O)cccc3C(=O)c12,mutagenic
+2154-68-9,CC1(C)CC(C(=O)O)C(C)(C)N1O,non-mutagenic
+150147-09-4,OCCN(CCO)c1ccc(cc1)N=Nc2ccc(nc2)N(CCO)CCO,non-mutagenic
+621-77-2,CCCCCN(CCCCC)CCCCC,non-mutagenic
+135105-90-7,COc1cc(OC)c2C3C(OC4OC34)Oc2c1,mutagenic
+23590-59-2,Clc1nncc2cccnc12,mutagenic
+27554-26-3,CC(C)CCCCCOC(=O)c1ccccc1C(=O)OCCCCCC(C)C,non-mutagenic
+108-38-3,Cc1cccc(C)c1,non-mutagenic
+525-66-6,CC(C)NC[C@@H](O)COc1cccc2ccccc12,non-mutagenic
+160543-10-2,OCc1ccc2c(CO)c3ccc4ccccc4c3nc2c1,non-mutagenic
+89-63-4,Nc1ccc(Cl)cc1[N+](=O)[O-],mutagenic
+97461-42-2,CCCCCNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+623-24-5,BrCc1ccc(CBr)cc1,non-mutagenic
+53552-01-5,Clc1ccc(Oc2ccc(NC=O)cc2)c(Cl)c1,mutagenic
+50-02-2,C[C@@H]1CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,non-mutagenic
+2062-78-4,Oc1nc2ccccc2n1C3CCN(CCCC(c4ccc(F)cc4)c5ccc(F)cc5)CC3,non-mutagenic
+162022-93-7,Clc1nncc2ccncc12,non-mutagenic
+108-98-5,Sc1ccccc1,non-mutagenic
+626-60-8,Clc1cccnc1,non-mutagenic
+103-17-3,Clc1ccc(CSc2ccc(Cl)cc2)cc1,non-mutagenic
+57-71-6,CC(=O)\C(=N/O)\C,non-mutagenic
+74-95-3,BrCBr,mutagenic
+104-78-9,CCN(CC)CCCN,non-mutagenic
+128350-04-9,CC(\C=C(/C#N)\c1ccc(F)cc1)C(C(C#N)c2ccc(F)cc2)c3ccccc3,non-mutagenic
+2438-88-2,COc1c(Cl)c(Cl)c(c(Cl)c1Cl)[N+](=O)[O-],non-mutagenic
+114656-96-1,Cc1[nH]c2C(=O)C=C(N3CC3)C(=O)c2c4nc5ccccc5c14,mutagenic
+97166-13-7,CC(Cl)C(Br)CBr,mutagenic
+82-71-3,Oc1c(cc(c(O)c1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+645-05-6,CN(C)c1nc(nc(n1)N(C)C)N(C)C,non-mutagenic
+110-82-7,C1CCCCC1,non-mutagenic
+92134-94-6,OCC(O)C(O)C(O)C1SCCN1N=O,non-mutagenic
+NOCAS_M327,CN(C)CCO[C@@](C)(c1ccccc1)c2ccccn2,non-mutagenic
+67976-98-1,O1C2C1c3nc4ccc5ccccc5c4cc3c6ccccc26,mutagenic
+7203-89-6,CN(C)N=Nc1ccc(C)cc1,mutagenic
+NOCAS_M384,CC(=CCC[C@](C)(OC(=O)c1ccccc1N)C=C)C,non-mutagenic
+1767-28-8,Oc1ccc2ccc3c(ccc4ccc1c2c34)[N+](=O)[O-],mutagenic
+98736-49-3,CN(Cc1cccc(c1)C#N)N=O,mutagenic
+288-47-1,c1cscn1,mutagenic
+95741-57-4,Cc1cc2c3cc4ccccc4cc3c5cccc(c1)c25,mutagenic
+7379-35-3,Clc1ccncc1,non-mutagenic
+NOCAS_M369,C[C@@H](O)COC[C@@H](C)O,non-mutagenic
+99240-67-2,CC(=O)Nc1ccc2c(Cc3ccccc23)c1OC(=O)c4ccccc4,non-mutagenic
+894-52-0,Cc1c(C)c2c(ccc3ccccc23)c4CCC(=O)c14,mutagenic
+NOCAS_M457,C[C@@H](N)CN,non-mutagenic
+58-54-8,CCC(=C)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl,non-mutagenic
+87425-69-2,OC1C=Cc2cc3c(ccc4ccccc34)c(Br)c2C1O,non-mutagenic
+54-31-9,NS(=O)(=O)c1cc(C(=O)O)c(NCc2occc2)cc1Cl,non-mutagenic
+115165-01-0,Oc1cccc2c3ccccc3c4cc5ccccc5cc4c12,non-mutagenic
+69227-45-8,CC(O)C(NC(=O)C(C)C(O)C(C)NC(=O)C(NC(=O)c1nc(nc(N)c1C)C(CNCC(N)C(=O)N)C(=O)N)C(OC2OC(CO)C(O)C(O)C2OC3OC(CO)C(O)C(OC(=O)N)C3O)c4c[nH]cn4)C(=O)NCCc5nc(cs5)c6nc(cs6)C(=O)NCCCN(C)CCCNC(=N)CC7CCC(Cl)CC7,mutagenic
+2353-45-9,CCN(Cc1cccc(c1)S(=O)(=O)O)c2ccc(cc2)C(=C3C=CC(=[N+](CC)Cc4cccc(c4)S(=O)(=O)O)C=C3)c5ccc(O)cc5S(=O)(=O)O,non-mutagenic
+394-69-4,Fc1cccc2ncccc12,mutagenic
+95-79-4,Cc1ccc(Cl)cc1N,non-mutagenic
+33089-36-0,C1COCCOCCOCCOCCOCCOCCO1,non-mutagenic
+38363-41-6,CC(C)(C)NCC(O)COc1ccccc1C2CCCC2,mutagenic
+420-12-2,C1CS1,mutagenic
+497-23-4,O=C1OCC=C1,non-mutagenic
+111858-66-3,OC1COC(C(O)C1O)N(CCc2c[nH]c3ccccc23)N=O,mutagenic
+100850-37-1,CN(CC(=O)NN)c1ccc2ccccc2c1,non-mutagenic
+148193-32-2,COc1nsc2cc(ccc12)[N+](=O)[O-],mutagenic
+115767-74-3,CC\C(=C(\c1ccc(OCCN(C)C)cc1)/c2ccc(OP(=O)(O)O)cc2)\c3ccc(cc3)C(C)C,non-mutagenic
+15961-88-3,[O-][N+](=Nc1ccc2c(Cc3ccccc23)c1)c4ccc5c(Cc6ccccc56)c4,non-mutagenic
+600-14-6,CCC(=O)C(=O)C,non-mutagenic
+110-59-8,CCCCC#N,non-mutagenic
+67274-48-0,CC(=O)N(O)c1ccc(Br)cc1,non-mutagenic
+3096-63-7,Cc1cccc(C)c1NO,mutagenic
+4418-26-2,CC(=O)C1=C(O)C=C(C)OC1=O,non-mutagenic
+NOCAS_M140,O1[C@@H]2[C@H]1c3ccccc3c4c2ccc5ccccc45,mutagenic
+NOCAS_M458,CC(C)C[C@@H](C)Nc1ccc(Nc2ccccc2)cc1,non-mutagenic
+24961-39-5,BrCc1c2ccccc2cc3c1ccc4ccccc34,mutagenic
+482-66-6,C1Cc2ccc3c(ccc4ccccc34)c2C1,non-mutagenic
+2815-45-4,CC(C)(C)C1CCC2(CC1)CO2,non-mutagenic
+105752-67-8,Cc1cccc2cc(ccc12)[N+](=O)[O-],mutagenic
+13060-14-5,COc1cc(cc(OC)c1OC)C2OCC3C2COC3c4cc(OC)c(OC)c(OC)c4,non-mutagenic
+40321-99-1,CCC(CCC(C)O)COC(=O)c1ccccc1C(=O)O,non-mutagenic
+96563-06-3,CC1c2ccccc2c3cc(C)c(C)cc13,mutagenic
+781-43-1,Cc1c2ccccc2c(C)c3ccccc13,mutagenic
+54-16-0,OC(=O)Cc1c[nH]c2ccc(O)cc12,non-mutagenic
+6317-18-6,N#CSCSC#N,non-mutagenic
+62450-06-0,Cc1nc(N)c(C)c2[nH]c3ccccc3c12,mutagenic
+36848-41-6,[O-][N+](=O)c1cccc2nc3c(cccc3nc12)[N+](=O)[O-],non-mutagenic
+NOCAS_M59,Nc1ncnc2c1ncn2C[C@H](O)CN=[N+]=[N-],mutagenic
+7570-37-8,COc1ccc(\C=C\c2ccc(N)cc2)cc1,mutagenic
+60262-85-3,OC1C(Oc2c3ccccc3c4ccc5cccc6ccc2c4c56)OC(C(O)C1O)C(=O)O,non-mutagenic
+188970-88-9,Oc1ccc2ccc3[nH]c4cc(c5ccccc5c4c3c2c1)[N+](=O)[O-],mutagenic
+120-52-5,O=C(ON=C1C=CC(=NOC(=O)c2ccccc2)C=C1)c3ccccc3,mutagenic
+475-75-2,O=C1c2ccccc2c3c4OCOc4cc5ccnc1c35,mutagenic
+106-96-7,BrCC#C,mutagenic
+108-89-4,Cc1ccncc1,non-mutagenic
+590-88-5,CC(N)CCN,non-mutagenic
+99-66-1,CCCC(CCC)C(=O)O,non-mutagenic
+99217-04-6,CC(=O)Oc1cc(c2ccc3cccc4ccc1c2c34)[N+](=O)[O-],mutagenic
+8022-00-2,CCSCCOP(=S)(OC)OC,non-mutagenic
+24698-43-9,CC(C)COS(=O)(=O)c1ccccc1,mutagenic
+173216-44-9,N#N=NCCC(c1ccccc1)c2ccccc2,mutagenic
+581-89-5,[O-][N+](=O)c1ccc2ccccc2c1,mutagenic
+115550-35-1,CN1CCN(CC1)c2c(F)cc3C(=O)C(=CN4N(C)COc2c34)C(=O)O,mutagenic
+105-55-5,CCNC(=S)NCC,non-mutagenic
+NOCAS_M382,CCCC[C@@H](CC)CO,non-mutagenic
+23788-22-9,Oc1ccc(OP2(NP(NP(N2)(Oc3ccc(O)cc3)Oc4ccc(O)cc4)(Oc5ccc(O)cc5)Oc6ccc(O)cc6)Oc7ccc(O)cc7)cc1,non-mutagenic
+104789-46-0,ClCCNC(=O)Sc1[nH]cnc2ncnc12,mutagenic
+1120-36-1,CCCCCCCCCCCCC=C,non-mutagenic
+51325-91-8,CN(C)c1ccc(\C=C\C2=CC(=C(C#N)C#N)C=C(C)O2)cc1,mutagenic
+135086-99-6,Nc1c([nH]c2ccccc12)C(=O)N\N=C\c3ccccc3,non-mutagenic
+61845-52-1,CCOC1=CC(N(O)c2ccccc12)(c3ccccc3)c4ccccc4,non-mutagenic
+24400-01-9,CN(C)CCCNc1c2ccccc2nc3c(C)ccc(c13)[N+](=O)[O-],mutagenic
+31438-22-9,[O-][N+](=O)c1cccc2c3ccccc3[nH]c12,mutagenic
+124617-83-0,CCON(OC(=O)C)C(=O)c1ccccc1,mutagenic
+578-06-3,Nc1cccc2nc3ccccc3cc12,mutagenic
+71432-00-3,O=C1Oc2cccc3ccc4c5ccccc5cc1c4c23,mutagenic
+87-10-5,Oc1c(Br)cc(Br)cc1C(=O)Nc2ccc(Br)cc2,non-mutagenic
+100-52-7,O=Cc1ccccc1,non-mutagenic
+2437-56-1,CCCCCCCCCCCC=C,non-mutagenic
+102-60-3,CC(O)CN(CCN(CC(C)O)CC(C)O)CC(C)O,non-mutagenic
+68302-57-8,CC(C)c1ccc2Oc3nc(N)c(cc3C(=O)c2c1)C(=O)O,non-mutagenic
+140-11-4,CC(=O)OCc1ccccc1,non-mutagenic
+120404-26-4,OCCNc1ccc(cc1)N=Nc2ccc(NCCO)cc2,mutagenic
+3009-50-5,COc1ccc(cc1)N=Nc2ccc(cc2)N(C)C,mutagenic
+131-11-3,COC(=O)c1ccccc1C(=O)OC,non-mutagenic
+626-15-3,BrCc1cccc(CBr)c1,non-mutagenic
+1666-13-3,[Se]([Se]c1ccccc1)c2ccccc2,mutagenic
+87-65-0,Oc1c(Cl)cccc1Cl,non-mutagenic
+2319-96-2,Cc1cc2cc3ccccc3cc2c4ccccc14,mutagenic
+92569-05-6,[O-][N+](=O)c1cnc(s1)N2CCN(C(=O)C(Cl)Cl)C2=O,mutagenic
+73018-98-1,OCC(O)CN=N#N,mutagenic
+19406-51-0,Cc1c(cc(N)cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+20496-16-6,CCc1ccc2c3ccccc3c4cccc1c24,non-mutagenic
+144730-01-8,FC(F)(F)c1cc2C(=O)CCc2c3ccc4ccccc4c13,mutagenic
+NOCAS_M543,O=C1NC(=O)[C@H]2CC=CC[C@@H]12,non-mutagenic
+54-11-5,CN1CCC[C@@H]1c2cccnc2,non-mutagenic
+529-49-7,Oc1ccc2Oc3cc(O)cc(O)c3C(=O)c2c1,mutagenic
+1918-13-4,NC(=S)c1c(Cl)cccc1Cl,mutagenic
+67019-30-1,CN(C(=O)C)c1snc2ccccc12,non-mutagenic
+60877-86-3,C(=N\c1snc2ccccc12)/c3ccccc3,non-mutagenic
+148193-29-7,C(Oc1cccc2cnsc12)C3CO3,mutagenic
+140-95-4,OCNC(=O)NCO,mutagenic
+111955-19-2,Cc1ccc(cc1)N(N=O)C2OCC(O)C(O)C2O,mutagenic
+479-45-8,CN(c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+109-89-7,CCNCC,non-mutagenic
+NOCAS_M62,O=C[C@H]1CO1,mutagenic
+51837-64-0,COc1cc(NC(=O)C)ccc1NC(=O)C,non-mutagenic
+NOCAS_M194,CC(C)(c1ccc(OC[C@H]2CO2)cc1)c3ccc(OC[C@H]4CO4)cc3,mutagenic
+107673-64-3,[O-][N+](=O)c1ccc2c(c1)c3cc4ccccc4c5cccc2c35,mutagenic
+NOCAS_M321,CN(C)[C@@H]1[C@@H]2[C@H](O)[C@H]3C(=C(O)[C@@]2(O)C(=C(C(=O)N)C1=O)O)C(=O)c4c(O)cccc4[C@]3(C)O,non-mutagenic
+6341-85-1,CC1(CO1)C2CO2,mutagenic
+104-82-5,Cc1ccc(CCl)cc1,non-mutagenic
+90625-53-9,COC1=CC(=O)C=C/C/1=N\c2c3ccccc3nc4ccccc24,non-mutagenic
+60102-37-6,CC1CC2(OC2C)C(=O)OC3CCN(C)CC=C(COC(=O)C1(C)O)C3=O,mutagenic
+80-43-3,CC(C)(OOC(C)(C)c1ccccc1)c2ccccc2,non-mutagenic
+NOCAS_M20,OC[C@H](Br)CBr,mutagenic
+16292-86-7,Nc1ccc(c(O)c1)[N+](=O)[O-],mutagenic
+103395-25-1,ClCc1ccc2cccc3c4ccccc4c1c23,mutagenic
+3626-28-6,Nc1c(N=Nc2ccc(cc2)c3ccc(cc3)N=Nc4ccc(O)cc4)c(cc5cc(c(N=Nc6ccccc6)c(O)c15)S(=O)(=O)O)S(=O)(=O)O,mutagenic
+2876-23-5,Nc1ccc2nc3ccccc3nc2c1,mutagenic
+119-53-9,O[C@H](C(=O)c1ccccc1)c2ccccc2,non-mutagenic
+818-61-1,OCCOC(=O)C=C,non-mutagenic
+110-13-4,CC(=O)CCC(=O)C,non-mutagenic
+91137-27-8,Cc1cccc2c(cccc12)[N+](=O)[O-],mutagenic
+16830-15-2,C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O,non-mutagenic
+5336-53-8,O=NN(Cc1ccccc1)Cc2ccccc2,non-mutagenic
+39156-41-7,COc1ccc(NOS(=O)(=O)O)cc1N,mutagenic
+102-77-2,C1CN(CCO1)Sc2nc3ccccc3s2,non-mutagenic
+NOCAS_M388,CC[C@@]1(CC(=O)O)OCCc2c1n(C)c3ccccc23,non-mutagenic
+52-67-5,CC(C)(S)C(N)C(=O)O,mutagenic
+NOCAS_M413,CC(C)NC[C@@H](O)COc1cccc2C[C@@H](COc12)O[N+](=O)[O-],non-mutagenic
+108-94-1,O=C1CCCCC1,non-mutagenic
+154-93-8,ClCCNC(=O)N(CCCl)N=O,mutagenic
+153260-27-6,C1Cc2scnc2c3cccnc13,non-mutagenic
+56719-41-6,COC(=O)\C(=C(/OP(=O)(OC)OC)\c1ccc(Cl)cc1Cl)\Br,non-mutagenic
+3671-78-1,O=C(Nc1ccc2c(Cc3ccccc23)c1)c4ccccc4,mutagenic
+38661-82-4,CC(Cl)c1ccccc1,non-mutagenic
+112022-13-6,CN(C)CCNC(=O)c1cccc2Oc3ccccc3Nc12,mutagenic
+91-21-4,C1Cc2ccccc2CN1,non-mutagenic
+720-39-8,CCCCc1cc(C)cc(CCCC)c1O,non-mutagenic
+20480-67-5,C1CCC2C(C1)CCc3ccccc23,non-mutagenic
+28540-82-1,CC(C)CC1NC(=O)C(C)N(C)C(=O)CNC(=O)\C(=C/c2ccccc2)\N(C)C1=O,non-mutagenic
+109621-20-7,COC(=O)C(CSCC(C)Br)NC(=O)C,mutagenic
+54292-61-4,Cc1cc(ccc1N=Nc2cccnc2)N(CCO)CCO,non-mutagenic
+89459-43-8,CN(C)CCNC(=O)c1cccc2c(N)c3ccccc3nc12,mutagenic
+43192-03-6,Cc1ccc(NO)cc1[N+](=O)[O-],non-mutagenic
+7786-61-0,COc1cc(C=C)ccc1O,non-mutagenic
+NOCAS_M385,CCc1cccc2cc(oc12)[C@H](O)CNC(C)(C)C,non-mutagenic
+122021-01-6,CCCCC(CC)COC(=O)c1ccc(cc1)N(C)N=O,non-mutagenic
+813-78-5,COP(=O)(O)OC,non-mutagenic
+577-59-3,CC(=O)c1ccccc1[N+](=O)[O-],non-mutagenic
+92-36-4,Cc1ccc2nc(sc2c1)c3ccc(N)cc3,mutagenic
+13506-76-8,Cc1cccc(c1C(O)O)[N+](=O)[O-],mutagenic
+439-14-5,CN1C(=O)CN=C(c2ccccc2)c3cc(Cl)ccc13,non-mutagenic
+7364-25-2,Oc1[nH]nc2ccccc12,non-mutagenic
+109-01-3,CN1CCNCC1,non-mutagenic
+4424-06-0,O=C1c2ccc3c4nc5ccccc5n4C(=O)c6ccc(c7nc8ccccc8n17)c2c36,mutagenic
+218-02-0,c1ccc2c(c1)ccc3c4ccncc4ccc23,mutagenic
+131-73-7,[O-][N+](=O)c1cc(c(Nc2c(cc(cc2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])c(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+1321-94-4,Cc1ccc2ccccc2c1,non-mutagenic
+5329-87-3,[O-][N+](=O)c1ccc2c(CCc3ccccc23)c1,mutagenic
+63224-44-2,CCCCCCCCCCCCCC(=O)ON(C(=O)C)c1ccc2c(Cc3ccccc23)c1,mutagenic
+85-68-7,CCCCOC(=O)c1ccccc1C(=O)OCc2ccccc2,non-mutagenic
+98114-62-6,OCN=N,mutagenic
+75-50-3,CN(C)C,non-mutagenic
+108-91-8,NC1CCCCC1,non-mutagenic
+72-56-0,CCc1ccc(cc1)C(C(Cl)Cl)c2ccc(CC)cc2,mutagenic
+128505-52-2,CCN(CC)C(=S)SSCC(NC(=O)C)C(=O)O,non-mutagenic
+738-70-5,COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC,non-mutagenic
+131-92-0,O=C(Nc1cccc2C(=O)c3c(ccc4c5cc(NC(=O)c6ccccc6)c7C(=O)c8ccccc8C(=O)c7c5[nH]c34)C(=O)c12)c9ccccc9,non-mutagenic
+1888-89-7,C(CC1CO1)C2CO2,mutagenic
+61734-86-9,CCCCCN(CCCCO)N=O,mutagenic
+104-04-1,CC(=O)Nc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+17135-78-3,Clc1ccc2cc3ccccc3cc2c1,mutagenic
+34430-26-7,CCCC[CH-][N+](=O)[O-],non-mutagenic
+68006-83-7,Cc1cc2c3ccccc3[nH]c2nc1N,mutagenic
+63-56-9,COc1ccc(CN(CCN(C)C)c2ncccn2)cc1,non-mutagenic
+5875-25-2,CC(Br)C(=O)N,mutagenic
+1732-23-6,Nc1cc2ccc3cccc4ccc(c1)c2c34,mutagenic
+50-01-1,NC(=N)N,non-mutagenic
+88598-59-8,OC1C=Cc2c(cc3ccc4ccc(c5ccc2c3c45)[N+](=O)[O-])C1O,mutagenic
+144-48-9,NC(=O)CI,non-mutagenic
+6629-29-4,Cc1c(N)cc(N)cc1[N+](=O)[O-],mutagenic
+89811-25-6,CC(C)CNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+98931-06-7,CCCn1cc2CC3C(CC(C)CN3C#N)c4cccc1c24,mutagenic
+620-26-8,Cc1cccc(c1)N=O,non-mutagenic
+31431-39-7,COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3ccccc3,mutagenic
+96910-70-2,CC1(C)C[C@H]2C=C(CO)[C@]3(C[C@@]3(C)[C@@H]2C1)C=O,mutagenic
+54607-64-6,OC(=O)c1occ(c2ccccc2)c1c3ccccc3,non-mutagenic
+67019-28-7,O=C(Nc1snc2ccccc12)c3ccccc3,mutagenic
+620-88-2,[O-][N+](=O)c1ccc(Oc2ccccc2)cc1,mutagenic
+93-72-1,CC(Oc1cc(Cl)c(Cl)cc1Cl)C(=O)O,non-mutagenic
+41840-28-2,Cc1cc(C)nc(SC(=O)OC(C)(C)C)n1,non-mutagenic
+163275-64-7,Fc1ccc(F)c2c1ccc3cccnc23,mutagenic
+105-36-2,CCOC(=O)CBr,mutagenic
+106-44-5,Cc1ccc(O)cc1,non-mutagenic
+606-35-9,COc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+2498-77-3,Cc1cccc2ccc3cc4ccccc4cc3c12,mutagenic
+136112-73-7,Nc1ncnc2c1ncn2c3ccc(cc3[N+](=O)[O-])[N+](=O)[O-],mutagenic
+66842-42-0,Cc1c2ccccc2c([C@@H]3CO3)c4ccccc14,mutagenic
+99-98-9,CN(C)c1ccc(N)cc1,mutagenic
+25125-72-8,N1[C@@H]([C@H]1c2ccccc2)c3ccccc3,mutagenic
+25799-70-6,COc1ccc(c2c(NCCCN(C)C)c3ccccc3nc12)[N+](=O)[O-],mutagenic
+96014-36-7,Nc1ccc2[nH]c3ccccc3c2c1[N+](=O)[O-],mutagenic
+51938-14-8,CCCCN(CCO)N=O,mutagenic
+107-22-2,O=CC=O,mutagenic
+74877-25-1,O=C1C=Cc2c(ccc3cc4ccccc4cc23)C1=O,non-mutagenic
+144-62-7,OC(=O)C(=O)O,non-mutagenic
+NOCAS_M450,CC[C@@H](C)Nc1ccc(N[C@H](C)CC)cc1,non-mutagenic
+892-17-1,Cc1cc2C(=O)CCc2c3ccc4ccccc4c13,mutagenic
+111-30-8,O=CCCCC=O,mutagenic
+64314-52-9,C[C@@H]1O[C@H](C[C@H](N)[C@H]1O)O[C@H]2C[C@@](O)(Cc3c(O)c4C(=O)c5ccccc5C(=O)c4c(O)c23)C(=O)CO,mutagenic
+7681-76-7,Cn1c(COC(=O)N)ncc1[N+](=O)[O-],mutagenic
+85431-61-4,CC1C(O)CCC2=CC(=O)C3(OC3C12C)C4(CO)CO4,mutagenic
+55-86-7,CN(CCCl)CCCl,mutagenic
+130-15-4,O=C1C=CC(=O)c2ccccc12,mutagenic
+86-87-3,OC(=O)Cc1cccc2ccccc12,non-mutagenic
+67392-87-4,CC12CCC(=O)C=C1C3CC3C4C2CCC5(C)C4C6CC6C57CCC(=O)O7,non-mutagenic
+92116-67-1,CNc1ccc2ncc(C)nc2c1N,non-mutagenic
+137-26-8,CN(C)C(=S)SSC(=S)N(C)C,mutagenic
+100-51-6,OCc1ccccc1,non-mutagenic
+184582-58-9,Oc1c2ccccc2nc3ccc4OCCOc4c13,mutagenic
+81-13-0,CC(C)(CO)C(O)C(=O)NCCCO,non-mutagenic
+630-17-1,CC(C)(C)CBr,non-mutagenic
+56986-35-7,CCCCN(N=O)[C@@H](CCC)OC(=O)C,mutagenic
+142078-76-0,OC1C(O)c2cccnc2C3OC13,non-mutagenic
+68884-32-2,C(C1CO1)c2cccc3ccccc23,mutagenic
+5417-50-5,CC(=O)Nc1cnc2ccccc2c1,non-mutagenic
+155164-64-0,CCC(=O)N1N=CC(=C(Cl)C1=O)Cl,non-mutagenic
+5784-45-2,Clc1nncc2ccccc12,non-mutagenic
+89-62-3,Cc1ccc(N)c(c1)[N+](=O)[O-],mutagenic
+93-05-0,CCN(CC)c1ccc(N)cc1,mutagenic
+96-37-7,CC1CCCC1,non-mutagenic
+28164-57-0,Cc1cc(O)c2C(=O)C=C(C(=O)c2c1)c3c(C)cc4C(=O)C=CC(=O)c4c3O,non-mutagenic
+98151-91-8,O[C@H]1C=Cc2cc3ccc4c(ccc5ccc(c2[C@@H]1O)c3c45)[N+](=O)[O-],mutagenic
+205-82-3,c1ccc2c3c(ccc2c1)c4cccc5cccc3c45,mutagenic
+127072-59-7,CC\C=C\C=C\C=C\C=C\C=C\SCC(O)CO,non-mutagenic
+5496-41-3,COc1ccc(cc1OC)c2nc(c3ccccc3)c([nH]2)c4ccccc4,mutagenic
+92134-95-7,CC(O)C(O)C(O)C(O)C1SCCN1N=O,non-mutagenic
+1929-73-3,CCCCOCCOC(=O)COc1ccc(Cl)cc1Cl,non-mutagenic
+10453-89-1,CC(=CC1C(C(=O)O)C1(C)C)C,non-mutagenic
+935-95-5,Oc1c(Cl)c(Cl)cc(Cl)c1Cl,non-mutagenic
+30560-19-1,COP(=O)(NC(=O)C)SC,non-mutagenic
+230-46-6,c1cnc2c(c1)ccc3ncccc23,mutagenic
+1928-38-7,COC(=O)COc1ccc(Cl)cc1Cl,non-mutagenic
+480-22-8,Oc1cccc2cc3cccc(O)c3c(O)c12,non-mutagenic
+4394-00-7,OC(=O)c1cccnc1Nc2cccc(c2)C(F)(F)F,non-mutagenic
+5632-47-3,O=NN1CCNCC1,mutagenic
+135294-98-3,BrCc1ccc2c3ccccc3c4cccc1c24,mutagenic
+75-34-3,CC(Cl)Cl,non-mutagenic
+75888-03-8,[O-][N+](=O)c1oc(\C=N\N2CCCNC2=O)cc1,mutagenic
+1504-74-1,COc1ccccc1\C=C/C=O,mutagenic
+703-83-3,CCNc1snc2ccccc12,non-mutagenic
+70092-13-6,Cc1c2ccccc2c(C)c3c4C=CC(=O)C(=O)c4ccc13,non-mutagenic
+3930-20-9,CC(C)NCC(O)c1ccc(NS(=O)(=O)C)cc1,non-mutagenic
+75996-85-9,CCOC(=O)Cc1c(C(=O)O)c2ccccc2n1C,non-mutagenic
+61691-82-5,COc1ccc(cc1)[C@H](OC(=O)C)C=C,mutagenic
+10088-95-6,C\C=C\C1=CC2=C(C(=O)O1)C(=O)C(O)C(C)O2,non-mutagenic
+431-03-8,CC(=O)C(=O)C,mutagenic
+92433-40-4,CC(=O)Nc1cc2Cc3ccccc3c2cc1Cl,mutagenic
+110-16-7,OC(=O)\C=C/C(=O)O,non-mutagenic
+33704-61-9,CC1C(C)(C)C2=C(C(=O)CCC2)C1(C)C,non-mutagenic
+109-70-6,ClCCCBr,mutagenic
+60-80-0,CN1N(C(=O)C=C1C)c2ccccc2,non-mutagenic
+68688-84-6,CC1(O)C=Cc2cc3c(ccc4ccccc34)c5CCC1(O)c25,mutagenic
+108-68-9,Cc1cc(C)cc(O)c1,non-mutagenic
+91626-52-7,CS(=O)(=O)N1N=CC(=C(Cl)C1=O)Cl,mutagenic
+95-33-0,C1CCC(CC1)NSc2nc3ccccc3s2,non-mutagenic
+73198-02-4,OCC1NC(Cc2c1[nH]c3ccccc23)C(=O)O,non-mutagenic
+60971-98-4,COC(=O)C1=C(C)C(C)(O)OC1=O,non-mutagenic
+16239-84-2,Nc1nc(\C=C/c2oc(cc2)[N+](=O)[O-])cs1,mutagenic
+89459-25-6,CN(C)CCNC(=O)c1cccc2cc3ccccc3nc12,mutagenic
+108-70-3,Clc1cc(Cl)cc(Cl)c1,non-mutagenic
+24934-91-6,CCOP(=S)(OCC)SCCl,non-mutagenic
+580-18-7,Oc1cnc2ccccc2c1,non-mutagenic
+71-41-0,CCCCCO,non-mutagenic
+160543-14-6,Cc1c2ccc3C(O)C(O)C=Cc3c2nc4ccc(CO)cc14,mutagenic
+1953-54-4,Oc1ccc2[nH]ccc2c1,non-mutagenic
+15012-61-0,CCC1=C(OC)C(=O)c2c(O)c(OC)c(OC)c(O)c2C1=O,non-mutagenic
+144-80-9,CC(=O)NS(=O)(=O)c1ccc(N)cc1,non-mutagenic
+24085-03-8,CC(C)(C)N(CC(O)c1ccc(O)c(CO)c1)Cc2ccccc2,mutagenic
+1769-41-1,O\N=C\C(=O)Nc1ccccc1,non-mutagenic
+6653-71-0,CC(Br)C(=O)NCc1ccccc1,mutagenic
+198-55-0,c1cc2cccc3c4cccc5cccc(c(c1)c23)c45,mutagenic
+578-95-0,Oc1c2ccccc2nc3ccccc13,non-mutagenic
+138805-33-1,CC(=O)Nc1ccc(C)c(c1)N=Nc2cc(NC(=O)C)ccc2C,non-mutagenic
+24684-56-8,Cc1cc2C(=O)[C@@H](O)Cc2c3ccc4ccccc4c13,mutagenic
+119-34-6,Nc1ccc(O)c(c1)[N+](=O)[O-],mutagenic
+75-05-8,CC#N,non-mutagenic
+2304-85-0,O=C1C=Cc2ccc3C=CC(=O)c4ccc1c2c34,mutagenic
+84-88-8,Oc1ccc(c2cccnc12)S(=O)(=O)O,mutagenic
+110417-88-4,CCC(C)C(C(CC(=O)N1CCCC1C(OC)C(C)C(=O)NC(Cc2ccccc2)c3nccs3)OC)N(C)C(=O)C(NC(=O)C(C(C)C)N(C)C)C(C)C,non-mutagenic
+112368-27-1,Clc1ccc(N2C(=O)CCC2=O)c(Cl)c1Cl,non-mutagenic
+29975-16-4,Clc1ccc2c(c1)C(=NCc3nncn23)c4ccccc4,non-mutagenic
+96614-59-4,NC(CCC(=O)NC(CS\C(=C\Cl)\Cl)C(=O)NCC(=O)O)C(=O)O,mutagenic
+25168-26-7,CC(C)CCCCCOC(=O)Cc1ccc(Cl)cc1Cl,non-mutagenic
+4436-24-2,C(C1CO1)c2ccccc2,mutagenic
+NOCAS_M123,N[C@@H](CS\C(=C\Cl)\Cl)C(=O)O,mutagenic
+131-17-9,C=CCOC(=O)c1ccccc1C(=O)OCC=C,non-mutagenic
+709-98-8,CCC(=O)Nc1ccc(Cl)c(Cl)c1,non-mutagenic
+3351-30-2,Cc1cccc2ccc3c4ccccc4ccc3c12,mutagenic
+7350-43-8,CC(=O)Nc1nc(\C=C/c2oc(cc2)[N+](=O)[O-])cs1,mutagenic
+86-86-2,NC(=O)Cc1cccc2ccccc12,mutagenic
+21314-05-6,Nc1ncnc2c1ncn2c3ccc(cc3)[N+](=O)[O-],mutagenic
+146177-57-3,Cc1cc2c(nc(N)n2C)c3nccnc13,mutagenic
+15545-48-9,CN(C)C(=O)Nc1ccc(C)c(Cl)c1,non-mutagenic
+NOCAS_M219,O[C@H]1C=Cc2cc3c(cc2[C@@H]1O)c4cccc5cccc3c45,mutagenic
+16709-86-7,C[Si](C)(CCl)C=C,non-mutagenic
+60448-19-3,O1[C@@H]2[C@H]1c3cccc4ccc5cc6ccccc6c2c5c34,mutagenic
+620-25-7,Cc1cccc(NO)c1,mutagenic
+122-34-9,CCNc1nc(Cl)nc(NCC)n1,non-mutagenic
+121958-18-7,C1CC2CCc3ccccc3C24OC4C1,non-mutagenic
+1943-79-9,CNC(=O)Oc1ccccc1,non-mutagenic
+77-09-8,Oc1ccc(cc1)C2(OC(=O)c3ccccc23)c4ccc(O)cc4,non-mutagenic
+1198-61-4,Fc1c(F)c(Cl)c(F)c(Cl)c1F,non-mutagenic
+1520-21-4,Nc1ccc(C=C)cc1,mutagenic
+50-55-5,CO[C@H]1[C@@H](C[C@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)c6cc(OC)c(OC)c(OC)c6,non-mutagenic
+920-66-1,OC(C(F)(F)F)C(F)(F)F,non-mutagenic
+136112-72-6,[O-][N+](=O)c1ccc(Nc2ncnc3c2ncn3c4ccc(cc4)[N+](=O)[O-])cc1,mutagenic
+3032-55-1,CC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-],non-mutagenic
+27969-93-3,Cc1cccc(C)c1N=Nc2c(O)ccc3ccccc23,non-mutagenic
+28921-94-0,C\C=C\C1OC(=O)C=CC1O,non-mutagenic
+610-30-0,OC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+505-23-7,C1CSCSC1,mutagenic
+1552-42-7,CN(C)c1ccc(cc1)C2(OC(=O)c3cc(ccc23)N(C)C)c4ccc(cc4)N(C)C,non-mutagenic
+530-52-9,Oc1c2ccoc2nc3ccccc13,non-mutagenic
+107027-12-3,CN(C)CCNC(=O)c1cccc2ccc(nc12)c3ccccc3,mutagenic
+158321-20-1,Nc1ccc2c3ccccc3[nH]c2c1[N+](=O)[O-],mutagenic
+622-20-8,C(CSc1ccccc1)Sc2ccccc2,non-mutagenic
+723-46-6,Cc1onc(NS(=O)(=O)c2ccc(N)cc2)c1,non-mutagenic
+50880-65-4,Oc1c(N=Nc2ccc(cc2)S(=O)(=O)O)c3ccc(cc3cc1S(=O)(=O)O)S(=O)(=O)O,mutagenic
+5401-94-5,[O-][N+](=O)c1ccc2[nH]ncc2c1,mutagenic
+28920-43-6,ClC(=O)OCC1c2ccccc2c3ccccc13,mutagenic
+81851-68-5,Cc1cc2ccccc2c3ccc4C(O)C(O)C5OC5c4c13,mutagenic
+76014-81-8,CN(CCCC(O)c1cccnc1)N=O,mutagenic
+32588-76-4,Brc1c(Br)c(Br)c2C(=O)N(CCN3C(=O)c4c(Br)c(Br)c(Br)c(Br)c4C3=O)C(=O)c2c1Br,non-mutagenic
+60129-60-4,CC12CCCC(C)(C1CCC34CC(=C)C(CCC23)(C4)OC5OC(CO)C(O)C(O)C5O)C(=O)O,mutagenic
+55556-94-0,C[C@H]1CN(CCN1N=O)N=O,mutagenic
+110-86-1,c1ccncc1,non-mutagenic
+107-04-0,ClCCBr,mutagenic
+191-07-1,c1cc2ccc3ccc4ccc5ccc6ccc1c7c6c5c4c3c27,mutagenic
+99-33-2,[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Cl,mutagenic
+610-66-2,[O-][N+](=O)c1ccccc1CC#N,mutagenic
+34866-46-1,CC(C)(C)NCC(O)c1ccc(O)c(NC(=O)N)c1,non-mutagenic
+106-22-9,CC(CCO)CCC=C(C)C,non-mutagenic
+478-08-0,OCc1c(O)cc2C(=O)c3ccccc3C(=O)c2c1O,mutagenic
+141-78-6,CCOC(=O)C,non-mutagenic
+5461-85-8,CC(C)CN(N=O)C(=N)N[N+](=O)[O-],mutagenic
+87-51-4,OC(=O)Cc1c[nH]c2ccccc12,non-mutagenic
+695-99-8,ClC1=CC(=O)C=CC1=O,non-mutagenic
+100-14-1,[O-][N+](=O)c1ccc(CCl)cc1,mutagenic
+107-12-0,CCC#N,non-mutagenic
+153260-26-5,CC(=O)Nc1nc2C3=CCCN(CC=C)C3CCc2s1,non-mutagenic
+52748-31-9,O1C=CC2OC2C=C1,non-mutagenic
+147293-13-8,Cn1c(N)nc2c3ncccc3ccc12,mutagenic
+24815-24-5,CO[C@H]1[C@@H](C[C@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)\C=C\c6cc(OC)c(OC)c(OC)c6,non-mutagenic
+56211-40-6,CC(C)NC(=O)NS(=O)(=O)c1cnccc1Nc2cccc(C)c2,non-mutagenic
+4741-24-6,O1OC2c3ccccc3C1c4ccccc24,non-mutagenic
+94500-46-6,ClCc1cc2cc3ccccc3c4ccc5cccc1c5c24,mutagenic
+110-69-0,CCC\C=N/O,mutagenic
+15403-45-9,COC(=O)c1cc(ccc1N)c2ccc(N)c(c2)C(=O)OC,mutagenic
+1646-75-9,CSC(C)(C)\C=N/O,non-mutagenic
+16400-63-8,ClCC(=C)Br,mutagenic
+216-48-8,C1=Cc2cc3c4ccccc4ccc3c5cccc1c25,mutagenic
+NOCAS_M367,BrC[C@@H](Br)[C@@H]1CC[C@@H](Br)[C@@H](Br)C1,non-mutagenic
+95-16-9,c1ccc2scnc2c1,non-mutagenic
+117-82-8,COCCOC(=O)c1ccccc1C(=O)OCCOC,mutagenic
+26196-04-3,COC1OC1(C)C,mutagenic
+85048-96-0,OCC1OC(O)C(O)C(Op2(OC3C(O)C(O)OC(CO)C3O)np(OC4C(O)C(O)OC(CO)C4O)(OC5C(O)C(O)OC(CO)C5O)np(OC6C(O)C(O)OC(CO)C6O)(OC7C(O)C(O)OC(CO)C7O)n2)C1O,non-mutagenic
+98640-42-7,CC(=O)NC(CS\C(=C(/F)\C(F)(F)F)\F)C(=O)O,non-mutagenic
+29814-12-8,CC(C)OC1OC(=O)C(=C1Cl)Cl,mutagenic
+1874-24-4,COC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+88652-48-6,CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCC(C)O,non-mutagenic
+21232-47-3,[O-][N+](=Nc1ccc(Cl)c(Cl)c1)c2ccc(Cl)c(Cl)c2,non-mutagenic
+NOCAS_M395,O[C@@H]1CO[C@@](O)(CN(CC(=O)O)N=O)[C@H](O)[C@@H]1O,non-mutagenic
+127-69-5,Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C,non-mutagenic
+3958-57-4,[O-][N+](=O)c1cccc(CBr)c1,non-mutagenic
+20861-99-8,C1O[C@@H]1c2ccc3ccccc3c2,mutagenic
+40297-54-9,OCC1OC(C(O)C1O)n2cnc3c(NCc4ccc(cc4)[N+](=O)[O-])ncnc23,mutagenic
+78865-83-5,CCCCCCCCCCSCn1cc[n+](C)c1,mutagenic
+142741-10-4,Cc1nc(cc2c3cc(cc(c3[nH]c12)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-],mutagenic
+131-14-6,Nc1ccc2C(=O)c3cc(N)ccc3C(=O)c2c1,mutagenic
+108043-88-5,Cn1c(N)nc2c3ccc(O)nc3ccc12,mutagenic
+5598-13-0,COP(=S)(OC)Oc1nc(Cl)c(Cl)cc1Cl,non-mutagenic
+507-19-7,CC(C)(C)Br,mutagenic
+124340-47-2,CN(C)CCNC(=O)c1cccc2[nH]c(nc12)c3ccccc3,mutagenic
+129833-02-9,CC(=O)C1(C)OC12C=Cc3ccccc3C2=O,non-mutagenic
+959-33-1,COc1ccc(\C=C\C(=O)c2ccccc2)cc1,non-mutagenic
+100772-18-7,CC(CCC(=O)O)C1CCC2C3CCc4cc(O)ccc4C3CCC12C,non-mutagenic
+109-55-7,CN(C)CCCN,non-mutagenic
+31688-71-8,CC(=O)OCc1c2ccccc2c(C)c3ccccc13,mutagenic
+60262-82-0,OC1C(Oc2ccc3ccc4cc5ccccc5c6ccc2c3c46)OC(C(O)C1O)C(=O)O,non-mutagenic
+41044-12-6,CCN(CC)c1ccc2C=C(C(=O)Oc2c1)c3nc4ccccc4n3C,non-mutagenic
+20153-98-4,COc1cc(cc(OC)c1OC)C(=O)OCCCN2CCCN(CCCOC(=O)c3cc(OC)c(OC)c(OC)c3)CC2,non-mutagenic
+24424-99-5,CC(C)(C)OC(=O)OC(=O)OC(C)(C)C,non-mutagenic
+24554-26-5,[O-][N+](=O)c1oc(cc1)c2csc(NC=O)n2,mutagenic
+23452-05-3,COc1cc(O)c2C(=O)Oc3cc(O)cc(C)c3c2c1,non-mutagenic
+125-46-2,CC(=O)C1C(=O)C=C2Oc3c(C(=O)C)c(O)c(C)c(O)c3C2(C)C1=O,non-mutagenic
+25635-22-7,CCOC(=O)c1cccc2cccnc12,non-mutagenic
+120-22-9,CCN(CC)c1ccc(cc1)N=O,mutagenic
+52101-40-3,OC(=O)c1oc(c(c2ccccc2)c1c3ccccc3)[N+](=O)[O-],mutagenic
+528-29-0,[O-][N+](=O)c1ccccc1[N+](=O)[O-],mutagenic
+4337-65-9,CCCC[C@@H](CC)COC(=O)CCCCC(=O)O,non-mutagenic
+9003-39-8,C=CN1CCCC1=O,non-mutagenic
+118-71-8,CC1=C(O)C(=O)C=CO1,mutagenic
+580-22-3,Nc1ccc2ccccc2n1,mutagenic
+94-59-7,C=CCc1ccc2OCOc2c1,non-mutagenic
+123-91-1,C1COCCO1,non-mutagenic
+110933-34-1,Cc1c2ccccc2c(COS(=O)(=O)O)c3ccc4ccccc4c13,mutagenic
+120-36-5,CC(Oc1ccc(Cl)cc1Cl)C(=O)O,non-mutagenic
+76215-00-4,CC(=O)OCN(CCCl)N=O,mutagenic
+35483-50-2,COC(=O)CC1Cc2cc3cc(OC)c(c(O)c3c(O)c2C(=O)O1)c4c(O)c5c(O)c6C(=O)OC(CC(=O)OC)Cc6cc5cc4OC,non-mutagenic
+33942-93-7,Cc1ccc2nc3c(ccc4ccccc34)cc2c1,mutagenic
+612-83-9,Nc1ccc(cc1Cl)c2ccc(N)c(Cl)c2,mutagenic
+79243-67-7,CCCC1(O)CCC2C3CCC4CC(=O)CC(C)C4(C)C3CCC12C,non-mutagenic
+80-40-0,CCOS(=O)(=O)c1ccc(C)cc1,mutagenic
+108-24-7,CC(=O)OC(=O)C,non-mutagenic
+7132-67-4,Nc1c2ccccc2nc3ccc(O)cc13,mutagenic
+15176-29-1,CCC1=CN(C2CC(O)C(CO)O2)C(=O)NC1=O,non-mutagenic
+2453-44-3,O=C(\C=C\c1ccccc1)c2ccc(cc2)c3ccccc3,non-mutagenic
+24684-49-9,COc1cc2c3CCC(=O)c3cc(C)c2c4ccccc14,mutagenic
+533-31-3,Oc1ccc2OCOc2c1,non-mutagenic
+91-22-5,c1ccc2ncccc2c1,mutagenic
+21919-05-1,NC(=O)c1cc(N2CC2)c(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+NOCAS_M209,CC(=C)C(=O)OC[C@H](Br)CBr,mutagenic
+NOCAS_M425,CC\C=C\[C@@H](CC)C=O,non-mutagenic
+49852-84-8,ClCc1c2ccccc2c3ccc4cccc5ccc1c3c45,non-mutagenic
+101-83-7,C1CCC(CC1)NC2CCCCC2,non-mutagenic
+99026-65-0,CC(=O)Nc1cc(O)c2ccc3cccc4ccc1c2c34,mutagenic
+619-67-0,NNc1ccc(cc1)C(=O)O,non-mutagenic
+81593-13-7,CCOP(=O)(OCC)N1C2C1c3ccccc3c4ccccc24,mutagenic
+2363-23-7,CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+29122-68-7,CC(C)NCC(O)COc1ccc(CC(=O)N)cc1,non-mutagenic
+620-22-4,Cc1cccc(c1)C#N,non-mutagenic
+506-21-8,CCCCC\C=C\C\C=C\CCCCCCCC(=O)O,non-mutagenic
+96-34-4,COC(=O)CCl,non-mutagenic
+535-80-8,OC(=O)c1cccc(Cl)c1,non-mutagenic
+106-46-7,Clc1ccc(Cl)cc1,non-mutagenic
+146724-31-4,OCc1cc2ccc3cccnc3c2[nH]1,non-mutagenic
+23255-93-8,CCN(CC)CCNc1ccc(COS(=O)(=O)C)c2Sc3ccccc3C(=O)c12,mutagenic
+153654-35-4,Oc1ccc2c3ccccc3[nH]c2c1[N+](=O)[O-],non-mutagenic
+874-42-0,Clc1ccc(C=O)c(Cl)c1,non-mutagenic
+74339-99-4,Oc1ccc2c(c1)c3cc4ccccc4c5cc6ccccc6c2c35,mutagenic
+609-65-4,ClC(=O)c1ccccc1Cl,mutagenic
+312304-87-3,CC(=O)OCN(CCCCl)N=O,mutagenic
+NOCAS_M38,COc1cc(O)c2C(=O)c3c(OC)cc4O[C@@H]5OC=C[C@H]5c4c3Oc2c1OC,mutagenic
+77784-21-5,COc1ccc2c(cc3N(C)C(=O)C(=O)c4cc5OCOc5c2c34)c1OC,mutagenic
+56803-37-3,CC(C)(C)c1ccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)cc1,non-mutagenic
+NOCAS_M236,C[C@@H](Br)CBr,mutagenic
+4569-77-1,Nc1cc2nc3ccccc3nc2cc1O,mutagenic
+6111-78-0,Cc1cccc2cc3ccc4ccccc4c3cc12,mutagenic
+34549-30-9,OCC(CO)(CCBr)CCBr,mutagenic
+76-03-9,OC(=O)C(Cl)(Cl)Cl,non-mutagenic
+130965-73-0,OS(=O)(=O)OCc1ccc2ccc3cccc4ccc1c2c34,mutagenic
+7473-93-0,[O-][N+](=O)c1ccccc1\C=C\C(=O)c2ccccc2,non-mutagenic
+2429-73-4,Nc1ccc2cc(c(N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5c(O)c6c(N)cc(cc6cc5S(=O)(=O)O)S(=O)(=O)O)c(O)c2c1)S(=O)(=O)O,mutagenic
+NOCAS_M563,CCCCCCCCCC[C@H]1CO1,non-mutagenic
+129176-04-1,ClC1OC1CBr,mutagenic
+28804-88-8,Cc1ccc2ccccc2c1C,non-mutagenic
+119-93-7,Cc1cc(ccc1N)c2ccc(N)c(C)c2,mutagenic
+50-06-6,CCC1(C(=O)NC(=O)NC1=O)c2ccccc2,mutagenic
+5397-37-5,[O-][N+](=O)c1ccc2Cc3ccccc3c2c1,mutagenic
+4809-35-2,CC(C)(c1ccc(OCC(O)CCl)cc1)c2ccc(OCC(O)CCl)cc2,non-mutagenic
+786-66-3,O=C1CCc2c1ccc3c2ccc4ccccc34,mutagenic
+484-47-9,c1ccc(cc1)c2nc(c3ccccc3)c([nH]2)c4ccccc4,mutagenic
+111380-09-7,Cn1cnc(N=O)c1c2ccccc2,mutagenic
+95307-47-4,CC12CCCC(C)(C1CCC34CC(O)(CCC23)C(=C)C4O)C(=O)O,non-mutagenic
+18031-40-8,CC(=C)C1CCC(=CC1)C=O,non-mutagenic
+87-86-5,Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,non-mutagenic
+139953-96-1,CC\C=C\C=C\C=C\C=C\C=C\OCCCO,mutagenic
+774-15-2,CC(C)Nc1snc2ccccc12,non-mutagenic
+51410-45-8,COc1ccc(CC2CO2)cc1,mutagenic
+23590-73-0,NNc1nncc2cccnc12,mutagenic
+91-68-9,CCN(CC)c1cccc(O)c1,mutagenic
+924-42-5,OCNC(=O)C=C,non-mutagenic
+125239-64-7,COc1cc2nc3cc(N)c(OC)cc3nc2cc1N,mutagenic
+98046-74-3,Cc1cccn2c1nc3c(C)c(cnc23)[N+](=O)[O-],mutagenic
+4291-30-9,Oc1c(cccc1[N+](=O)[O-])c2ccccc2,non-mutagenic
+619-73-8,OCc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+68906-23-0,Clc1cc(Cl)c(Oc2ccc(NC=O)cc2)c(Cl)c1,mutagenic
+113124-69-9,COC1=CC(=O)c2c([nH]cc3c4CCCCc4nc23)C1=O,mutagenic
+90147-18-5,CCCOC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+1070-13-9,CCCC(=C)C=O,mutagenic
+75-31-0,CC(C)N,non-mutagenic
+82486-82-6,CCCCN(CCO[N+](=O)[O-])[N+](=O)[O-],mutagenic
+4698-96-8,C(Oc1ccc(cc1)c2ccccc2)C3CO3,mutagenic
+1477-42-5,Cc1cccc2sc(N)nc12,non-mutagenic
+14625-58-2,Cc1cccc(c1)c2oc3ccccc3n2,non-mutagenic
+99601-31-7,CCn1c(N)nc2c3nc(C)cnc3ccc12,mutagenic
+NOCAS_M108,O=C1N(C[C@H]2CO2)C(=O)N(C[C@H]3CO3)C(=O)N1C[C@H]4CO4,mutagenic
+86853-91-0,O=C1c2cccc3ccc4c5ccccc5cc1c4c23,mutagenic
+7059-24-7,COC(C1Cc2cc3cc(OC4CC(OC5CC(O)C(OC)C(C)O5)C(OC(=O)C)C(C)O4)c(C)c(O)c3c(O)c2C(=O)C1OC6CC(OC7CC(OC8CC(C)(O)C(OC(=O)C)C(C)O8)C(O)C(C)O7)C(O)C(C)O6)C(=O)C(O)C(C)O,non-mutagenic
+99601-33-9,CCn1c(N)nc2c3cccnc3ccc12,mutagenic
+13838-16-9,FC(F)OC(F)(F)C(F)Cl,non-mutagenic
+29086-39-3,Cl\C=C(/Cl)\c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,non-mutagenic
+90509-02-7,COC(=O)Nc1nc2cc(OS(=O)(=O)c3ccc(F)cc3)ccc2[nH]1,non-mutagenic
+110783-84-1,COc1cc(N)cc(OC)c1N,non-mutagenic
+148174-24-7,ClCCCC(=O)\N=C\1/SN(C(=O)CCCCl)c2ccccc12,non-mutagenic
+594-20-7,CC(C)(Cl)Cl,non-mutagenic
+NOCAS_M15,CCOC(=O)[C@@H](C)C[C@](C)(C[C@H](C[C@@](C)(C[C@@H](C[C@](C)(CC)C(=O)O)C(=O)OCC)C(=O)O)C(=O)OCC)C(=O)O,mutagenic
+13014-24-9,Clc1ccc(cc1Cl)C(Cl)(Cl)Cl,mutagenic
+540-80-7,CC(C)(C)ON=O,mutagenic
+104-91-6,Oc1ccc(cc1)N=O,mutagenic
+62450-07-1,CC1=NC(=C[C@H]2[C@@H]1Nc3ccccc23)N,mutagenic
+2318-18-5,C\C=C\1/CC(C)C(C)(O)C(=O)OCC2=CC[N+]3(C)CCC(OC1=O)C23O,mutagenic
+84-79-7,CC(=CCC1=C(O)C(=O)c2ccccc2C1=O)C,non-mutagenic
+481-73-2,OCc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1,mutagenic
+26306-61-6,Nc1ccc(Oc2c(Cl)cc(Cl)cc2Cl)cc1,mutagenic
+132898-07-8,Cc1cc2nc(C)c(C)nc2c3nc(N)n(C)c13,mutagenic
+99240-68-3,CC(=O)Nc1cc2Cc3ccccc3c2cc1OC(=O)c4ccccc4,non-mutagenic
+26078-25-1,CCNc1cc2OC(=O)C=C(C)c2cc1C,non-mutagenic
+88381-44-6,OC(=O)C1CSCN1N=O,non-mutagenic
+1122-58-3,CN(C)c1ccncc1,non-mutagenic
+61421-83-8,Oc1ccc(Nc2c3ccccc3nc4ccccc24)cc1,mutagenic
+50330-59-1,CN(C)C(=O)c1nc2CN=C(c3ccccc3Cl)c4cc(Cl)ccc4n2n1,non-mutagenic
+68-11-1,OC(=O)CS,non-mutagenic
+538-23-8,CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCC,mutagenic
+5466-84-2,[O-][N+](=O)c1ccc2C(=O)OC(=O)c2c1,mutagenic
+NOCAS_M2,NC(=O)C[C@H]1CO1,mutagenic
+19408-84-5,COc1cc(CNC(=O)CCCCCCC(C)C)ccc1O,mutagenic
+NOCAS_M496,O[C@H](C#N)c1ccccc1,non-mutagenic
+50502-17-5,CC(=O)Nc1ccc2ccccc2n1,non-mutagenic
+80-71-7,CC1=C(O)C(=O)CC1,non-mutagenic
+110-30-5,CCCCCCCCCCCCCCCCCC(=O)NCCNC(=O)CCCCCCCCCCCCCCCCC,non-mutagenic
+56-05-3,Nc1nc(Cl)cc(Cl)n1,non-mutagenic
+41533-75-9,[O-][N+](=O)c1cccc2c(Cl)nsc12,mutagenic
+173450-37-8,CCN(CC)C(=O)c1cc(Cc2ccc(N)c(c2)C(=O)N(CC)CC)ccc1N,non-mutagenic
+24752-66-7,CC(Cl)C(=O)NCc1ccccc1,non-mutagenic
+67-99-2,CN1C(=O)C23CC4=CC=CC(O)C4N2C(=O)C1(CO)SS3,non-mutagenic
+632-99-5,Cc1cc(ccc1N)C(=C2C=CC(N)C=C2)c3ccc(N)cc3,mutagenic
+7330-46-3,Nc1ccc(Cc2ccc(N)c(c2)C(=O)O)cc1C(=O)O,non-mutagenic
+34627-78-6,CC(=O)O[C@H](C=C)c1ccc2OCOc2c1,mutagenic
+100527-20-6,[O-][N+](=O)c1ccc2ccc3ccc(cc3c2c1)[N+](=O)[O-],mutagenic
+119169-78-7,CC(C)(C)NC(=O)C1CCC2C3CC=C4C=C(CCC4(C)C3CCC12C)C(=O)O,non-mutagenic
+100325-51-7,CCN1C=C(C(=O)O)C(=O)c2cc(F)c(c(F)c12)c3ccncc3,non-mutagenic
+94500-43-3,OCc1cc2c3ccccc3cc4ccc5cccc1c5c24,non-mutagenic
+583-78-8,Oc1cc(Cl)ccc1Cl,non-mutagenic
+16311-38-9,[O-][N+](=O)c1ccc(cc1)c2nc3sccn3c2[N+](=O)[O-],mutagenic
+16561-29-8,CCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](C)[C@]2(O)[C@@H](C=C(CO)C[C@]3(O)[C@H]2C=C(C)C3=O)[C@H]4C(C)(C)[C@@]14OC(=O)C,non-mutagenic
+136379-59-4,CCCCC(C)C(OC(=O)CC(CC(=O)O)C(=O)O)C(CC(C)CC(O)CCCCCCC(O)C(C)N)OC(=O)CC(CC(=O)O)C(=O)O,non-mutagenic
+19057-60-4,CC1CCC2(OC1)OC3CC4C5CC=C6CC(CCC6(C)C5CCC4(C)C3C2C)OC7OC(CO)C(OC8OC(C)C(O)C(O)C8O)C(O)C7OC9OC(C)C(O)C(O)C9O,non-mutagenic
+286-75-9,C1CC2OC2CCC3OC13,non-mutagenic
+38707-70-9,O=Cc1cccc2cccnc12,mutagenic
+1817-73-8,Nc1c(Br)cc(cc1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+3387-36-8,OC1C(O)C(OC1COP(=O)(O)O)N2C=CC(=O)NC2=O,non-mutagenic
+4568-36-9,Oc1c(Cl)cc(Cl)cc1S(=O)(=O)c2cc(Cl)cc(Cl)c2O,non-mutagenic
+133762-80-8,CC1=CN(CC(O)CN=N#N)C(=O)NC1=O,mutagenic
+95-64-7,Cc1ccc(N)cc1C,mutagenic
+71-58-9,CC1CC2C(CCC3(C)C2CCC3(OC(=O)C)C(=O)C)C4(C)CCC(=O)C=C14,non-mutagenic
+492-27-3,OC(=O)c1cc(O)c2ccccc2n1,non-mutagenic
+138245-73-5,OC(CN=N#N)C(O)C(O)C(O)C(=O)O,mutagenic
+117135-59-8,CCCCN=NC(C)(C)OO,mutagenic
+304-81-4,[O-][n+]1c2ccccc2nc3ccccc13,mutagenic
+110419-21-1,[O-][N+](=O)c1cc(c2cccc3c4ccccc4c1c23)[N+](=O)[O-],mutagenic
+NOCAS_M262,CN1c2ccccc2C(=O)c3c(O)cc4O[C@H](Cc4c13)C(=C)C,mutagenic
+3930-19-6,COC1=C(N)C(=O)c2nc(ccc2C1=O)c3nc(C(=O)O)c(C)c(c3N)c4ccc(OC)c(OC)c4O,mutagenic
+17233-93-1,CC(C)[C@@](O)([C@@H](C)O)C(=O)O,non-mutagenic
+NOCAS_M322,OC(=O)C1=NN(C(=O)[C@H]1N=Nc2ccc(cc2)S(=O)(=O)O)c3ccc(cc3)S(=O)(=O)O,non-mutagenic
+142438-61-7,NC(=O)C12OC1C(O)(NC2=O)c3ccccc3,non-mutagenic
+2814-77-9,Oc1ccc2ccccc2c1N=Nc3ccc(cc3Cl)[N+](=O)[O-],mutagenic
+91598-92-4,CC(=O)Nc1ccc2ccc3ccc(O)c4ccc1c2c34,mutagenic
+92-94-4,c1ccc(cc1)c2ccc(cc2)c3ccccc3,non-mutagenic
+NOCAS_M348,CCCC[C@@H](CC)COS(=O)(=O)O,non-mutagenic
+110-00-9,o1cccc1,non-mutagenic
+71382-50-8,N1C2C1c3cc4ccccc4c5ccc6cccc2c6c35,mutagenic
+123392-56-3,NC(CCC(=O)NC(CSC(=O)NCCO)C(=O)NCC(=O)O)C(=O)O,non-mutagenic
+68743-68-0,CCOC(=O)N(CCCC(=O)c1cccnc1)N=O,mutagenic
+7213-98-1,CC(=O)Nc1cc2Cc3ccccc3c2cc1OC(=O)C,non-mutagenic
+89930-59-6,CCCn1cc2CC3C(C=C(C)CN3C)c4cccc1c24,mutagenic
+2980-32-7,Oc1cc(O)c2C(=O)c3c(O)ccc(O)c3Oc2c1,mutagenic
+631-64-1,OC(=O)C(Br)Br,mutagenic
+38412-38-3,Cc1ccc(cc1S(=O)(=O)O)N=Nc2c(O)c(cc3ccccc23)C(=O)O,non-mutagenic
+38915-49-0,NCCN(CCCl)c1c2ccccc2nc3c1ccc4ccccc34,mutagenic
+62641-66-1,O=NN1CCCNC1=O,mutagenic
+102-08-9,S=C(Nc1ccccc1)Nc2ccccc2,non-mutagenic
+1421-63-2,CCCC(=O)c1cc(O)c(O)cc1O,mutagenic
+112022-08-9,CN(C)CCNC(=O)c1cccc2C(=O)c3ccccc3Oc12,mutagenic
+604-35-3,CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C,non-mutagenic
+79-81-2,CCCCCCCCCCCCCCCC(=O)OC\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C,non-mutagenic
+111238-10-9,Cc1c2ccccc2cc3ccc4C(=O)C(=O)C=Cc4c13,mutagenic
+121111-61-3,COc1ccc(cc1OC)c2nc(c3ccc(C)cc3)c([nH]2)c4ccc(C)cc4,mutagenic
+66931-57-5,C(OCc1cccc2ccccc12)C3CO3,mutagenic
+504-88-1,OC(=O)CC[N+](=O)[O-],mutagenic
+63041-90-7,[O-][N+](=O)c1c2ccccc2c3ccc4cccc5ccc1c3c45,mutagenic
+90421-84-4,O=C1N(CC2CO2)Sc3ccccc13,non-mutagenic
+6957-71-7,O=CNc1ccc2c(Cc3ccccc23)c1,mutagenic
+133502-50-8,CN(C)c1ccc(cc1)C(=C2C=CC(=N)C=C2)c3ccc(cc3)N(C)C,non-mutagenic
+25917-89-9,Cc1cc(N)c(cc1N)[N+](=O)[O-],mutagenic
+1198-27-2,Nc1c(O)ccc2ccccc12,non-mutagenic
+35142-05-3,COc1cccc2c1ccc3c(cc4OCOc4c23)C(=O)O,mutagenic
+87919-37-7,CN(CCO)C(=O)Nc1ccc(Cl)c(Cl)c1,non-mutagenic
+99601-32-8,CCn1c(N)nc2c3cccnc3cc(C)c12,mutagenic
+75605-59-3,C[n+]1c2ccccc2cc3c(N)cccc13,mutagenic
+147151-67-5,C[C@]12CC[C@H]3[C@@H](CC=C4C[C@H](CC[C@]34C)OC(=O)\C=C\c5cccc(c5)N(CCCl)CCCl)[C@@H]1CCC(=O)N2,mutagenic
+131862-18-5,CN(C)CCNC(=O)c1ccc2ccc3cccnc3c2n1,mutagenic
+85-48-3,OS(=O)(=O)c1cccc2cccnc12,non-mutagenic
+24903-46-6,c1ccc2c(c1)ccc3cc4ccc5ccncc5c4cc23,mutagenic
+70-54-2,NCCCCC(N)C(=O)O,mutagenic
+10549-22-1,[O-][N+](=O)c1cc2CCc3cccc4CCc(c1)c2c34,mutagenic
+18873-03-5,COc1ccc(cc1)C(=O)C2OC2c3ccccc3,non-mutagenic
+507-55-1,FC(Cl)C(F)(F)C(F)(F)Cl,non-mutagenic
+52819-96-2,COc1cc2OC3OC=CC3c2c4OC(=O)C5=C(C(O)CC5=O)c14,mutagenic
+56299-00-4,CC1C(OC(=O)C)C2OC2C3=CC(=O)C4(CC13C)OC4(C)C=O,mutagenic
+121111-59-9,Cc1ccc(cc1)c2nc([nH]c2c3ccc(C)cc3)c4ccc(C)cc4C,mutagenic
+86674-49-9,Oc1cc(c2ccc3cccc4ccc1c2c34)[N+](=O)[O-],mutagenic
+7068-83-9,CCCCN(C)N=O,mutagenic
+39093-14-6,COc1cc(C)cc2C(=O)C(=CC(=O)c12)c3c(C)cc4C(=O)C=CC(=O)c4c3OC,non-mutagenic
+98-01-1,O=Cc1occc1,mutagenic
+4245-77-6,CCN(N=O)C(=N)N[N+](=O)[O-],mutagenic
+90301-92-1,Cl\C=C\c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,non-mutagenic
+609-19-8,Oc1cc(Cl)c(Cl)c(Cl)c1,non-mutagenic
+23184-66-9,CCCCOCN(C(=O)CCl)c1c(CC)cccc1CC,mutagenic
+2244-21-5,ON1CN(Cl)CN(Cl)C1,non-mutagenic
+NOCAS_M509,CCCC[C@@H](CC)C=O,non-mutagenic
+55557-02-3,COC(=O)C1=CCCN(C1)N=O,mutagenic
+36097-31-1,CN(CCO)C(=O)Nc1ccccc1,non-mutagenic
+640-15-3,CCSCCSP(=S)(OC)OC,non-mutagenic
+71989-02-1,Cc1c2ccccc2cc3c4C=CC(=O)C(=O)c4ccc13,mutagenic
+13523-86-9,CC(C)NCC(O)COc1cccc2[nH]ccc12,non-mutagenic
+60657-25-2,OC1C=Cc2c(cc3ccc4cccc5ccc2c3c45)C1O,mutagenic
+10540-29-1,CC\C(=C(\c1ccccc1)/c2ccc(OCCN(C)C)cc2)\c3ccccc3,non-mutagenic
+548-39-0,O=C1C=Cc2cccc3cccc1c23,mutagenic
+18774-85-1,CCCCCCN(N=O)C(=O)N,mutagenic
+97-63-2,CCOC(=O)C(=C)C,non-mutagenic
+26780-96-1,CC1C(C)(C)Nc2ccccc2C1(C)C3C(C)(C)Nc4ccccc4C3(C)C,non-mutagenic
+2687-40-3,CC(=O)Nc1ccc(Oc2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+57-47-6,CNC(=O)Oc1ccc2N(C)C3N(C)CCC3(C)c2c1,non-mutagenic
+619-72-7,[O-][N+](=O)c1ccc(cc1)C#N,non-mutagenic
+768-52-5,CC(C)Nc1ccccc1,non-mutagenic
+113698-23-0,Cc1nc2C(=O)C(=CC(=O)c2c3[nH]c4ccccc4c13)N5CC5,mutagenic
+2466-76-4,CC(=O)n1ccnc1,non-mutagenic
+NOCAS_M573,CC1(C)C[C@H](C[C@](C)(CN=C=O)C1)N=C=O,non-mutagenic
+147293-15-0,Cn1c(N)nc2c3ccncc3ccc12,mutagenic
+5392-40-5,CC(=CCC\C(=C/C=O)\C)C,non-mutagenic
+114899-77-3,COc1cc2c(CCN[C@]23CSC4[C@H]5[C@@H]6N(C)[C@@H](Cc7cc(C)c(OC)c(O)c67)[C@H](O)N5[C@@H](COC3=O)c8c9OCOc9c(C)c(OC(=O)C)c48)cc1O,mutagenic
+962-32-3,O1C2C1c3cc4ccccc4cc3c5ccccc25,mutagenic
+199536-79-3,BrC(Br)C1=C(Br)C(=O)OC1,mutagenic
+89925-00-8,CC1(CO1)C(=O)N,mutagenic
+122-39-4,N(c1ccccc1)c2ccccc2,non-mutagenic
+105708-80-3,OCc1c2ccccc2cc3c1ccc4ccccc34,mutagenic
+67151-57-9,Cc1ccc(cc1N=[N+]([O-])c2cc(ccc2C)[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+NOCAS_M132,C[C@@H]1CNC(=O)N1c2ncc(s2)[N+](=O)[O-],mutagenic
+NOCAS_M571,CCCC[C@@H](CC)COP(=O)(OC[C@H](CC)CCCC)OC[C@H](CC)CCCC,non-mutagenic
+105-11-3,ONc1ccc(cc1)N=O,mutagenic
+51489-62-4,Clc1ccc(Oc2ccc(NC=O)cc2)cc1,mutagenic
+125974-08-5,OC1OC(=O)C(=C1CCl)Cl,mutagenic
+82-62-2,Oc1c(Cl)cc(Cl)c(Cl)c1[N+](=O)[O-],non-mutagenic
+550-60-7,Oc1ccc2ccccc2c1[N+](=O)[O-],mutagenic
+56-38-2,CCOP(=S)(OCC)Oc1ccc(cc1)[N+](=O)[O-],non-mutagenic
+79642-27-6,Nc1[nH]ccc2nc3ccccc3c12,mutagenic
+64091-91-4,CN(CCCC(=O)c1cccnc1)N=O,mutagenic
+609-15-4,CCOC(=O)C(Cl)C(=O)C,non-mutagenic
+129812-26-6,CC1=CC(=O)Oc2ccc3OC4(C)OOC4(C)c3c12,mutagenic
+538-75-0,C1CCC(CC1)N=C=NC2CCCCC2,non-mutagenic
+473-55-2,CC1CCC2CC1C2(C)C,non-mutagenic
+132934-48-6,[O-][N+](=O)c1cccc2c1ncc3cnc4ccccc4c23,mutagenic
+91-53-2,CCOc1ccc2NC(C)(C)C=C(C)c2c1,non-mutagenic
+42373-04-6,C[n+]1ccsc1N=Nc2c(c3ccccc3)n(C)c4ccccc24,mutagenic
+50-33-9,CCCCC1C(=O)N(N(C1=O)c2ccccc2)c3ccccc3,non-mutagenic
+34237-98-4,Nc1ccc(cc1Br)c2ccc(N)c(Br)c2,mutagenic
+15687-27-1,CC(C)Cc1ccc(cc1)C(C)C(=O)O,non-mutagenic
+16354-55-5,CCc1c2ccccc2c(C)c3ccc4ccccc4c13,non-mutagenic
+1836-75-5,[O-][N+](=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1,mutagenic
+51-43-4,CNCC(O)c1ccc(O)c(O)c1,non-mutagenic
+109-08-0,Cc1cnccn1,non-mutagenic
+61695-73-6,C1O[C@@H]1c2c3ccccc3cc4ccccc24,mutagenic
+230-27-3,c1ccc2c(c1)ccc3cccnc23,mutagenic
+135-88-6,N(c1ccccc1)c2ccc3ccccc3c2,non-mutagenic
+58329-89-8,Cc1ccc(cc1)N=Nc2ccc(cc2)N(CCO)CCO,non-mutagenic
+106807-80-1,CNC(=O)N(O)C(=O)C,mutagenic
+50-27-1,CC12CCC3C(CCc4cc(O)ccc34)C1CC(O)C2O,non-mutagenic
+994-05-8,CCC(C)(C)OC,non-mutagenic
+1576-87-0,CC\C=C\C=O,mutagenic
+589-18-4,Cc1ccc(CO)cc1,non-mutagenic
+131229-62-4,CCCCON(OC(=O)C)C(=O)c1ccc(Cl)cc1,mutagenic
+155603-50-2,CCCCC(CC)COC(=O)c1ccc(cc1)C(=O)O,non-mutagenic
+NOCAS_M305,CO[C@@H]1C[C@](C)(O)Cc2cc3C(=O)c4c5O[C@@H]6O[C@@](C)([C@H](O)[C@H]([C@H]6O)N(C)C)c5cc(O)c4C(=O)c3c(O)c12,mutagenic
+121-32-4,CCOc1cc(C=O)ccc1O,non-mutagenic
+62902-12-9,CNc1ccc(cc1)C(=C2C=CC(=NC)C=C2)c3ccc(cc3)N(C)C,non-mutagenic
+103554-58-1,CN(C)CCNC(=O)c1cccc2c(O)c3ccccc3nc12,mutagenic
+42579-28-2,O=NN1CC(=O)NC1=O,mutagenic
+95152-79-7,Cc1cn2c(c(nc2s1)c3ccc(cc3)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+124-04-9,OC(=O)CCCCC(=O)O,non-mutagenic
+57-06-7,C=CCN=C=S,mutagenic
+518-28-5,COc1cc(cc(OC)c1OC)C2C3C(COC3=O)C(O)c4cc5OCOc5cc24,non-mutagenic
+106-65-0,COC(=O)CCC(=O)OC,non-mutagenic
+959-23-9,COc1ccc(cc1)C(=O)\C=C\c2ccccc2,non-mutagenic
+28911-01-5,Cc1nnc2CN=C(c3ccccc3Cl)c4cc(Cl)ccc4n12,non-mutagenic
+149127-56-0,CN=NC(C)(C)OO,mutagenic
+93-68-5,CC(=O)CC(=O)Nc1ccccc1C,non-mutagenic
+155506-70-0,CCOC(=O)C1=C(C)N=C(C)C(=C(O)OCC2COC3(CCCC3)O2)C1c4cccc(Cl)c4,non-mutagenic
+158470-95-2,CC1C2C(=Nc3ccc(C)cc23)N(C)c4ccc(C)cc14,mutagenic
+139953-98-3,CC\C=C\C=C\C=C\C=C\C=C\OCC(O)c1ccccc1,mutagenic
+77-90-7,CCCCOC(=O)CC(CC(=O)OCCCC)(OC(=O)C)C(=O)OCCCC,non-mutagenic
+389104-62-5,CC(C)c1cc(cc(C(C)C)c1N)c2ccccc2,non-mutagenic
+142022-84-2,O=S1(=O)c2cccc3ccc4c5ccccc5cc1c4c23,mutagenic
+220168-47-8,O=Cc1ccc(cc1)C(=O)ON(OCc2ccccc2)C(=O)c3ccccc3,mutagenic
+108893-58-9,CC1(C)CC2=C(C=O)C3(CC3(C)C(O)C2(O)C1)C=O,mutagenic
+585-79-5,[O-][N+](=O)c1cccc(Br)c1,mutagenic
+155144-64-2,Cc1cc(cc(C)n1)c2cc3N(C4CC4)C5=CC(=O)N(O)C(=O)N5c3cc2F,mutagenic
+166546-23-2,CN1CCN(CC1)c2ccc3[nH]c(CCCCCCc4ccc5[nH]c(nc5c4)c6ccc(cc6)N(CCCl)CCCl)nc3c2,non-mutagenic
+157730-37-5,Cn1c(N)nc2nc3cccnc3cc12,non-mutagenic
+25990-37-8,COC(=O)C[C@H]1[C@@]2(C)[C@H](OC3C[C@H](C(=C23)C)c4cocc4)[C@@H]5OC(=O)[C@]6(C)C=CC(=O)[C@@]1(C)C56,non-mutagenic
+52315-07-8,CC1(C)C(C=C(Cl)Cl)C1C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2,non-mutagenic
+94339-55-6,OC1CC=Cc2c1cc3ccc4cccc5ccc2c3c45,mutagenic
+51410-44-7,COc1ccc(cc1)C(O)C=C,non-mutagenic
+73391-96-5,CN(Cc1ccccc1)C(=O)CBr,non-mutagenic
+580-16-5,Oc1ccc2ncccc2c1,non-mutagenic
+75-15-0,S=C=S,non-mutagenic
+2031-67-6,CCO[Si](C)(OCC)OCC,non-mutagenic
+78281-06-8,ON(C=O)c1ccc(cc1)c2ccccc2,mutagenic
+480-85-3,OCC1=CCN2CC[C@@H](O)[C@@H]12,non-mutagenic
+143603-72-9,CCOC(=O)c1[nH]c2ccccc2c1\N=C\c3ccc(cc3)[N+](=O)[O-],mutagenic
+111955-24-9,CC(=O)OC1COC(Nc2ccc(cc2)C(=O)O)C(OC(=O)C)C1OC(=O)C,non-mutagenic
+759-73-9,CCN(N=O)C(=O)N,mutagenic
+188970-77-6,[O-][N+](=O)c1cc2[nH]c3cc(c4ccccc4c3c2c5ccccc15)[N+](=O)[O-],mutagenic
+13911-90-5,Cc1cccc2nc3c(ccc4ccccc34)cc12,mutagenic
+55400-87-8,O1C2C1c3cc4c(cc3c5ccccc25)C6OC6c7ccccc47,mutagenic
+464-10-8,[O-][N+](=O)C(Br)(Br)Br,mutagenic
+68498-25-9,OCC1OC(CC1O)n2cnc3c2ncn4ccnc34,non-mutagenic
+109-16-0,CC(=C)C(=O)OCCOCCOCCOC(=O)C(=C)C,non-mutagenic
+82617-23-0,NC(=O)OC1CO1,mutagenic
+158729-23-8,Clc1cccc(NS(=O)(=O)c2cccc3cccnc23)c1,non-mutagenic
+551-92-8,Cc1ncc([N+](=O)[O-])n1C,mutagenic
+17026-81-2,CCOc1ccc(NC(=O)C)cc1N,mutagenic
+103-83-3,CN(C)Cc1ccccc1,non-mutagenic
+518-75-2,C[C@H]1OC=C2C(=C(C(=O)O)C(=O)C(=C2[C@@H]1C)C)O,non-mutagenic
+NOCAS_M441,CCCCCCCCCC\C=C\[C@H]1CC(=O)OC1=O,non-mutagenic
+27032-78-6,O=C1NCNC(=O)N1,mutagenic
+60-57-1,ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@H]4C[C@H]([C@H]5O[C@@H]45)[C@@H]3[C@]1(Cl)C2(Cl)Cl,non-mutagenic
+161697-00-3,CNc1ccc2nc(C)c(C)nc2c1C,mutagenic
+111205-70-0,COC(=O)c1oc(NO)c(c2ccccc2)c1c3ccccc3,non-mutagenic
+143924-52-1,OC1c2cccc3ccc4c5ccccc5cc1c4c23,mutagenic
+122587-23-9,COC(=O)c1oc(N)c(Cl)c1Cl,non-mutagenic
+67902-33-4,C1CC2=CC3OC3C=C(C1)O2,non-mutagenic
+97869-39-1,CC[N+](=NC)[O-],non-mutagenic
+97534-21-9,O=C(Nc1ccccc1)C2C(=O)NC(=S)NC2=O,non-mutagenic
+99346-51-7,CCCNc1c(C(=O)O)c(Cl)ccc1[N+](=O)[O-],non-mutagenic
+217-59-4,c1ccc2c3ccccc3c4ccccc4c2c1,mutagenic
+74014-51-0,CCCC(=O)OC1C(C)OC(CC1(C)OC(=O)CC)OC2C(C)OC(OC3C(CC=O)CC(C)C(O)\C=C/C=C\CC(C)OC(=O)CC(O)C3OC)C(O)C2N(C)C,non-mutagenic
+98451-51-5,Nc1cccc(c1CO)[N+](=O)[O-],non-mutagenic
+66-56-8,Oc1cccc(c1[N+](=O)[O-])[N+](=O)[O-],mutagenic
+111-44-4,ClCCOCCCl,mutagenic
+64201-68-9,[O-][N+](=O)c1ccc(cc1)c2csc(NC=O)n2,mutagenic
+2381-40-0,Cc1ccc2c(C)c3ccc4ccccc4c3nc2c1,mutagenic
+24246-00-2,[O-][N+](=O)c1cccc2csnc12,mutagenic
+616-69-3,Cc1cc(cc(c1C)[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+78-89-7,CC(Cl)CO,mutagenic
+111467-88-0,CC\C=C\C=C\C=C\C=C\C=C\OC,mutagenic
+91540-29-3,CCCCCN1C2C1c3ccccc3c4ccccc24,mutagenic
+61734-89-2,CCCCN(CCC(=O)C)N=O,mutagenic
+40568-90-9,Cc1ccc2ccc3cc4ccccc4c5ccc1c2c35,mutagenic
+114656-95-0,COC1=CC(=O)c2[nH]c(C)c3c4ccccc4nc3c2C1=O,mutagenic
+102859-52-9,[O-][N+](=O)C1=Cc2ccc3ccc4cccc5cc1c2c3c45,mutagenic
+158729-32-9,ONS(=O)(=O)c1cccc2cccnc12,non-mutagenic
+55256-55-8,COc1c2[C@@H]3C=CO[C@H]3Oc2cc4Oc5c(CCC(C)(C)O)ccc(O)c5C(=O)c14,mutagenic
+1758-68-5,Nc1ccc2C(=O)c3ccccc3C(=O)c2c1N,mutagenic
+7247-89-4,C[C@@H]1CCCCN1N=O,mutagenic
+50-65-7,Oc1ccc(Cl)cc1C(=O)Nc2ccc(cc2Cl)[N+](=O)[O-],mutagenic
+39007-51-7,OCC1OC(C(O)C1O)n2cnc3c2ncn4ccnc34,non-mutagenic
+95860-07-4,Cc1ccc(cc1NO)[N+](=O)[O-],non-mutagenic
+29385-43-1,Cc1cccc2[nH]nnc12,non-mutagenic
+85060-01-1,CC(O)C(C)[N+](=O)[O-],non-mutagenic
+108-22-5,CC(=C)OC(=O)C,non-mutagenic
+103878-84-8,NCCNC(=O)c1ccc(Cl)cn1,non-mutagenic
+64-75-5,CN(C)[C@H]1[C@H]2C[C@H]3C(=C(O)[C@]2(O)C(=C(C(=O)N)C1=O)O)C(=O)c4c(O)cccc4[C@@]3(C)O,non-mutagenic
+211-91-6,C1=Cc2c3c1cccc3cc4ccc5ccccc5c24,mutagenic
+28322-02-3,CC(=O)Nc1cccc2Cc3ccccc3c12,mutagenic
+36059-21-9,Cc1c(C)c(Br)c(Br)c(Br)c1Br,non-mutagenic
+109143-18-2,COc1ccc(N(CCCl)CCCl)c2oc(cc12)[N+](=O)[O-],mutagenic
+172374-57-1,CC(=O)Nc1ccc(Oc2ccc(NO)cc2)cc1,mutagenic
+19200-30-7,CCN(CC)C(=S)SC1OC(CO)C(O)C(O)C1O,non-mutagenic
+31335-69-0,ON(C=O)c1ccccc1,non-mutagenic
+1191-41-9,CCOC(=O)CCCCCCC\C=C/C\C=C/C\C=C/CC,mutagenic
+22316-47-8,CN1C(=O)CC(=O)N(c2ccccc2)c3cc(Cl)ccc13,non-mutagenic
+57781-14-3,CC(=O)OCC(=O)[C@]1(CC[C@H]2[C@@H]3C[C@@H](F)C4=CC(=O)C(=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)Br)OC(=O)C,non-mutagenic
+868-77-9,CC(=C)C(=O)OCCO,non-mutagenic
+86247-86-1,CC(C)NCC(O)COc1cccc2CC(O)COc12,non-mutagenic
+7481-89-2,NC1=NC(=O)N(C=C1)[C@@H]2CC[C@H](CO)O2,mutagenic
+22868-29-7,Clc1cccc(c1)c2oc3ccccc3n2,non-mutagenic
+591-27-5,Nc1cccc(O)c1,mutagenic
+515-46-8,CCOS(=O)(=O)c1ccccc1,mutagenic
+6471-49-4,COc1ccc(cc1N=Nc2c(O)c(cc3ccccc23)C(=O)Nc4cccc(c4)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+163275-59-0,Fc1cc2cccnc2c3ccccc13,mutagenic
+NOCAS_M5,N\N=C\1/N=NC=C2C=CC=C[C@H]12,mutagenic
+88-88-0,[O-][N+](=O)c1cc(c(Cl)c(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+78-78-4,CCC(C)C,non-mutagenic
+120143-20-6,NC(CCN=[N+]=[N-])C(=O)O,mutagenic
+53956-04-0,CC1(C)C(CCC2(C)C1CCC3(C)C2C(=O)C=C4C5CC(C)(CCC5(C)CCC34C)C(=O)O)OC6OC(C(O)C(O)C6OC7OC(C(O)C(O)C7O)C(=O)O)C(=O)O,non-mutagenic
+162022-88-0,NNc1nncc2cnccc12,mutagenic
+99-65-0,[O-][N+](=O)c1cccc(c1)[N+](=O)[O-],mutagenic
+82-45-1,Nc1cccc2C(=O)c3ccccc3C(=O)c12,mutagenic
+106532-76-7,[O-][N+](=O)c1ccc2N(S\C(=N/C(=O)c3ccccc3[N+](=O)[O-])\c2c1)C(=O)c4ccccc4[N+](=O)[O-],mutagenic
+21466-07-9,Oc1c(Br)cc(Br)cc1c2cc(Br)cc(Br)c2OP(=O)(O)O,non-mutagenic
+51787-42-9,Cc1cc(C)c2nc3c(ccc4ccccc34)c(C)c2c1,mutagenic
+NOCAS_M512,CCCC[C@@H](CC)COC(=O)C(=C(c1ccccc1)c2ccccc2)C#N,non-mutagenic
+59405-70-8,COc1ccc(cn1)N=Nc2ccc(cc2)N(C)C,mutagenic
+23702-49-0,O=C1Oc2cccc3ccc4cccc1c4c23,non-mutagenic
+2150-55-2,NC1=N[C@@H](CS1)C(=O)O,non-mutagenic
+709-49-9,[O-][N+](=O)c1ccc(I)c(c1)[N+](=O)[O-],mutagenic
+115689-52-6,Nc1nc2c(CCc3ncccc23)s1,mutagenic
+2835-97-4,Cc1cccc(O)c1N,non-mutagenic
+92758-43-5,Nc1ccc2ccc3cc4ccccc4c5ccc1c2c35,mutagenic
+142741-09-1,[O-][N+](=O)c1cc(c2[nH]c3cnc(cc3c2c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+112-27-6,OCCOCCOCCO,mutagenic
+1806-54-8,CCCCCCCCOP(=O)(OCCCCCCCC)OCCCCCCCC,non-mutagenic
+119-06-2,CCCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCCCC,non-mutagenic
+142-78-9,CCCCCCCCCCCC(=O)NCCO,non-mutagenic
+514-10-3,CC(C)C1=CC2=CCC3C(C)(CCCC3(C)C(=O)O)C2CC1,non-mutagenic
+63104-32-5,Cc1cccc2cc3ccc4cccc5ccc(c12)c3c45,mutagenic
+621-90-9,CNc1ccc(cc1)N=Nc2ccccc2,mutagenic
+155379-83-2,Cc1cc(N)c(C)c(c1N)[N+](=O)[O-],mutagenic
+150-68-5,CN(C)C(=O)Nc1ccc(Cl)cc1,non-mutagenic
+NOCAS_M329,[O-][N+](=O)O[C@H]1CO[C@@H]2[C@@H](CO[C@H]12)O[N+](=O)[O-],non-mutagenic
+87679-37-6,CCOC(=O)C(CCc1ccccc1)NC(C)C(=O)N2C3CCCCC3CC2C(=O)O,non-mutagenic
+72-54-8,ClC(Cl)C(c1ccc(Cl)cc1)c2ccc(Cl)cc2,non-mutagenic
+NOCAS_M431,C(C(C1CCCCC1)C2CCCCC2)[C@H]3CCCCN3,non-mutagenic
+15743-13-2,ClC1=C(Cl)C(=O)C(Cl)(Cl)C1=O,non-mutagenic
+103124-60-3,CCOC(=O)C(=NNc1ccc(cc1Cl)c2ccc(NN=C(C(=O)OCC)C(=O)OCC)c(Cl)c2)C(=O)OCC,non-mutagenic
+838-95-9,CN(C)c1ccc(\C=C\c2ccccc2)cc1,mutagenic
+118430-74-3,Cn1nc(cc1N)C2CC2,mutagenic
+7085-19-0,C[C@@H](Oc1ccc(Cl)cc1C)C(=O)O,non-mutagenic
+54897-62-0,CCN(CCCCO)N=O,mutagenic
+968-81-0,CC(=O)c1ccc(cc1)S(=O)(=O)NC(=O)NC2CCCCC2,non-mutagenic
+NOCAS_M203,[O-][N+](=O)c1ccc2[C@H]3O[C@H]3c4cccc5c6ccccc6c1c2c45,mutagenic
+7085-85-0,CCOC(=O)C(=C)C#N,non-mutagenic
+33389-36-5,OCCNc1nc(nc2ccccc12)c3ccc(s3)[N+](=O)[O-],mutagenic
+60259-80-5,Cc1ccc(NN=NCc2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+693-13-0,CC(C)N=C=NC(C)C,non-mutagenic
+7570-36-7,Nc1ccc(\C=C\c2ccc(Cl)cc2)cc1,mutagenic
+90-30-2,N(c1ccccc1)c2cccc3ccccc23,non-mutagenic
+24316-91-4,NC(=O)c1[nH]cnc1[N+]#N,mutagenic
+2461-42-9,C(Oc1cccc2ccccc12)C3CO3,mutagenic
+99007-32-6,Cc1ccc(cc1S(=O)(=O)O)N=Nc2c(O)ccc3ccccc23,non-mutagenic
+102234-07-1,O=C1NC2(CCCCC2)C(=O)N1CCN3CC3,mutagenic
+119239-63-3,OC1C2OC2c3c(ccc4ncccc34)C1O,non-mutagenic
+NOCAS_M210,OC[C@H](O)CCl,mutagenic
+18296-44-1,CC(C)CC(=O)O[C@@H]1OC=C(COC(=O)C)C2=C[C@H](OC(=O)CC(C)C)[C@]3(CO3)[C@@H]12,mutagenic
+13608-87-2,CC(=O)c1ccc(Cl)c(Cl)c1Cl,mutagenic
+1622-57-7,Cn1c(N)nc2ccccc12,mutagenic
+26676-89-1,OC1COC2(O)C1OC(=O)C2(O)Cc3c[nH]c4ccccc34,non-mutagenic
+201-06-9,C1=Cc2cc3ccccc3c4cccc1c24,mutagenic
+120-57-0,O=Cc1ccc2OCOc2c1,non-mutagenic
+23740-25-2,COc1ccc2c(c1)C(=O)c3nccc4cc5OCOc5c2c34,mutagenic
+59405-62-8,CN(C)c1ccc(N=Nc2cccnc2)c(NC(=O)C)c1,non-mutagenic
+1172-18-5,CCN(CC)CCN1C(=O)CN=C(c2ccccc2F)c3cc(Cl)ccc13,non-mutagenic
+17696-11-6,OC(=O)CCCCCCCBr,mutagenic
+448-97-5,Nc1ccc(cc1F)c2ccc(N)c(F)c2,mutagenic
+133-18-6,Nc1ccccc1C(=O)OCCc2ccccc2,non-mutagenic
+17418-58-5,Nc1c(Oc2ccccc2)cc(O)c3C(=O)c4ccccc4C(=O)c13,mutagenic
+3118-97-6,Cc1ccc(N=Nc2c(O)ccc3ccccc23)c(C)c1,mutagenic
+21247-98-3,OCc1c2ccccc2c3ccc4cccc5ccc1c3c45,mutagenic
+98601-00-4,Cc1cc2ccccc2c3cc4C=CC(O)C(O)c4cc13,mutagenic
+4559-64-2,Nc1cc2nc3ccc(Cl)cc3nc2cc1N,mutagenic
+14047-09-7,Clc1ccc(cc1Cl)N=Nc2ccc(Cl)c(Cl)c2,non-mutagenic
+148193-31-1,Nc1cccc2c(Cl)nsc12,mutagenic
+5234-06-0,C(Oc1ccc2ccccc2c1)C3CO3,mutagenic
+23834-30-2,CN(C)CCN(C)N=O,mutagenic
+2851-80-1,Cc1ccc2c(Cc3cc(C)ccc23)c1,non-mutagenic
+93-58-3,COC(=O)c1ccccc1,non-mutagenic
+98736-48-2,CN(Cc1cccc(c1)C(F)(F)F)N=O,mutagenic
+6334-18-5,Clc1cccc(C=O)c1Cl,non-mutagenic
+150-69-6,CCOc1ccc(NC(=O)N)cc1,non-mutagenic
+22996-17-4,Nc1ccc(CO)c(c1)[N+](=O)[O-],mutagenic
+53950-62-2,ON(C=O)c1ccc(Cl)c(Cl)c1,non-mutagenic
+4403-90-1,Cc1ccc(Nc2ccc(N)c3C(=O)c4ccccc4C(=O)c23)c(c1)S(=O)(=O)O,mutagenic
+1732-29-2,Oc1ccc2ccc3ccc(c4ccc1c2c34)[N+](=O)[O-],mutagenic
+96301-34-7,CC1=CC(=O)C=C2CCC3C4CCC(=O)C4(C)CCC3C12C,non-mutagenic
+133762-83-1,OC(CN=N#N)Cn1cnc2c(Cl)ncnc12,mutagenic
+128-66-5,O=C1c2ccccc2c3ccc4C(=O)c5ccccc5c6ccc1c3c46,non-mutagenic
+160543-08-8,Cc1c2ccc(CO)cc2nc3c1ccc4ccccc34,mutagenic
+133591-38-5,Cc1ccc(C)c2c3cc(ccc3[nH]c12)[N+](=O)[O-],mutagenic
+155164-68-4,COc1ccc(cc1)C(=O)N2N=CC(=C(Cl)C2=O)Cl,non-mutagenic
+69140-51-8,CCC1OC1c2ccccc2,non-mutagenic
+101-73-5,CC(C)Oc1ccc(Nc2ccccc2)cc1,non-mutagenic
+111070-55-4,[O-][N+](=O)c1oc(\C=N\n2cccn2)cc1,mutagenic
+NOCAS_M163,O[C@@H]1CC(=O)c2c(O)ccc3c4ccc(O)c5C(=O)CC[C@H](c45)[C@@]1(O)c23,mutagenic
+107673-63-2,[O-][N+](=O)C1=Cc2c3ccc4ccccc4c3cc5cccc1c25,mutagenic
+102-32-9,OC(=O)Cc1ccc(O)c(O)c1,mutagenic
+1499-54-3,ONC(=O)CNC(=O)c1ccccc1,mutagenic
+6792-33-2,FC(=C(F)Cl)F,non-mutagenic
+NOCAS_M567,CN1[C@@H](CSCC(F)(F)F)Nc2cc(Cl)c(cc2S1(=O)=O)S(=O)(=O)N,non-mutagenic
+91828-72-7,O[C@@H]1C=Cc2c(ccc3c4ccccc4c(cc23)[N+](=O)[O-])[C@H]1O,mutagenic
+103-34-4,C1CN(CCO1)SSN2CCOCC2,non-mutagenic
+14385-22-9,CC(C)C(=O)N(O)c1ccc(Cl)cc1,mutagenic
+58139-47-2,OCCN(CCO)c1nc(nc2ccccc12)c3cccs3,non-mutagenic
+148317-76-4,OCCNCCN1C(=O)c2ccccc2C3=C1c4ccccc4C3=O,non-mutagenic
+999-29-1,CCOC(=O)CNC(=O)C=[N+]=[N-],mutagenic
+3366-65-2,Nc1ccc2c(ccc3ccccc23)c1,mutagenic
+2386-90-5,C1C[C@@H]2O[C@@H]2[C@H]1O[C@H]3CC[C@@H]4O[C@H]34,non-mutagenic
+139-59-3,Nc1ccc(Oc2ccccc2)cc1,mutagenic
+7209-38-3,NCCCN1CCN(CCCN)CC1,non-mutagenic
+687-48-9,CCOC(=O)N(C)C,mutagenic
+554-14-3,Cc1cccs1,non-mutagenic
+10026-04-7,Cl[Si](Cl)(Cl)Cl,non-mutagenic
+67-56-1,CO,non-mutagenic
+320-51-4,Nc1ccc(Cl)c(c1)C(F)(F)F,non-mutagenic
+115-07-1,CC=C,mutagenic
+5343-65-7,Cc1ccc(NC(=O)CBr)cc1,non-mutagenic
+1951-56-0,CC(C)NC(=O)\C=C/c1oc(cc1)[N+](=O)[O-],mutagenic
+142713-65-3,COc1ccc(CNC(=O)C(C)Br)cc1OC,mutagenic
+93673-39-3,Oc1cccc2c1ccc3c4C=Cc5cccc(cc23)c45,mutagenic
+108342-09-2,N[C@H](CN=[N+]=[N-])C(=O)O,mutagenic
+78859-43-5,CC(=C\C(=N\Nc1nncc2ccccc12)\C)C,mutagenic
+58337-49-8,CC(=O)NC(CSCCCl)C(=O)O,mutagenic
+22506-53-2,[O-][N+](=O)c1ccc2c(c1)c3ccc(c4cccc2c34)[N+](=O)[O-],mutagenic
+4568-28-9,CCCCCCCCCCCCCCCCCC(=O)O,non-mutagenic
+100-32-3,[O-][N+](=O)c1ccc(SSc2ccc(cc2)[N+](=O)[O-])cc1,mutagenic
+3208-16-0,CCc1occc1,non-mutagenic
+111959-96-7,ClC(=C(Cl)\C(=C(/Cl)\SCc1ccccc1)\Cl)Cl,mutagenic
+10285-07-1,CC(C)C(O)(C(C)O)C(=O)OCC1=CCN2CCC(O)C12,non-mutagenic
+93-46-9,N(c1ccc(Nc2ccc3ccccc3c2)cc1)c4ccc5ccccc5c4,mutagenic
+2698-41-1,Clc1ccccc1C=C(C#N)C#N,mutagenic
+27730-00-3,Brc1ccc(cc1)C2OC2C(=O)c3ccccc3,non-mutagenic
+27046-19-1,ClCCN(CCCl)P1(=O)NC(=O)CCO1,mutagenic
+93-52-7,BrCC(Br)c1ccccc1,mutagenic
+17455-21-9,C1CCC2OCCOCCOC3CCCCC3OCCOCCOCCOC2C1,non-mutagenic
+81-15-2,Cc1c(c(C)c(c(c1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-])[N+](=O)[O-],non-mutagenic
+3102-87-2,Cc1c(C)c(N)c(C)c(C)c1N,non-mutagenic
+288-32-4,c1c[nH]cn1,non-mutagenic
+158729-20-5,Cc1ccccc1NS(=O)(=O)c2cccc3cccnc23,non-mutagenic
+2564-65-0,OCc1c2ccccc2c(CO)c3c1ccc4ccccc34,mutagenic
+5000-65-7,COc1cccc(c1)C(=O)CBr,non-mutagenic
+68688-86-8,Cc1ccc2cc3c4[C@H](O)[C@H](O)C=Cc4ccc3c5CCc1c25,mutagenic
+155014-06-5,CC(=O)Nc1cccc2cc(F)cnc12,mutagenic
+79305-82-1,Nc1ccc(\C=C\c2cccc(N)c2)cc1,mutagenic
+90147-21-0,CC(C)OC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+83-72-7,OC1=CC(=O)C(=O)c2ccccc12,mutagenic
+4080-31-3,Cl\C=C/C[N+]12CN3CN(CN(C3)C1)C2,mutagenic
+96-98-0,Cc1ccc(cc1[N+](=O)[O-])C(=O)O,mutagenic
+43000-65-3,C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](CC[C@]34C)OC(=O)Cc5ccc(cc5)N(CCCl)CCCl)[C@@H]1CCC(=O)N2,mutagenic
+2592-95-2,On1nnc2ccccc12,non-mutagenic
+85-22-3,CCc1c(Br)c(Br)c(Br)c(Br)c1Br,non-mutagenic
+106-51-4,O=C1C=CC(=O)C=C1,non-mutagenic
+7782-50-5,ClCl,non-mutagenic
+90-15-3,Oc1cccc2ccccc12,non-mutagenic
+2589-39-1,Cc1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O,mutagenic
+67910-07-0,CC(C)CC(=O)OCc1cocc2c(C=O)ccc12,mutagenic
+151378-32-4,O[C@@H]1[C@@H](O)c2cccc3c4c(ccc5ccccc45)[C@]6(O[C@H]16)c23,mutagenic
+51-03-6,CCCCOCCOCCOCc1cc2OCOc2cc1CCC,non-mutagenic
+563-04-2,Cc1cccc(OP(=O)(Oc2cccc(C)c2)Oc3cccc(C)c3)c1,non-mutagenic
+3228-99-7,ClCC(CCl)(CCl)CCl,non-mutagenic
+125847-45-2,OC1C=Cc2ccc3c4ccccc4sc3c2C1O,non-mutagenic
+100-43-6,C=Cc1ccncc1,non-mutagenic
+26638-28-8,CCCCCCCCC(Cl)CCC(Cl)CC(Cl)C(Cl)C(Cl)CC(=O)OC,non-mutagenic
+2255-17-6,COP(=O)(OC)Oc1ccc(c(C)c1)[N+](=O)[O-],mutagenic
+51-02-5,CC(C)NCC(O)c1ccc2ccccc2c1,non-mutagenic
+3114-70-3,N[C@@H]1CC[C@@H](N)CC1,non-mutagenic
+7269-57-0,Nc1nc(NO)c2[nH]cnc2n1,mutagenic
+51640-90-5,[O-][N+](=O)c1cccc2c1OC(=O)c3ccccc23,mutagenic
+2385-85-5,ClC1(Cl)[C@@]2(Cl)[C@]3(Cl)[C@@]4(Cl)C(Cl)(Cl)[C@]5(Cl)[C@@](Cl)([C@@]1(Cl)[C@]35Cl)[C@@]24Cl,non-mutagenic
+19246-18-5,NC(CS)C(=O)NCC(=O)O,mutagenic
+104671-59-2,CNC(=O)ONC(=O)C,mutagenic
+578-46-1,Cc1ccc(c(N)c1)[N+](=O)[O-],non-mutagenic
+78400-41-6,Cc1ccc2cc3c4ccccc4C5NC5c3c6CCc1c26,mutagenic
+394-70-7,Fc1ccnc2ccccc12,mutagenic
+479-50-5,CCN(CC)CCNc1ccc(C)c2Sc3ccccc3C(=O)c12,mutagenic
+576-26-1,Cc1cccc(C)c1O,non-mutagenic
+109-87-5,COCOC,non-mutagenic
+145531-23-3,NCCCS(=O)(=O)Nc1ccc(Nc2c3ccc(cc3nc4cc(ccc24)N=N#N)N=N#N)cc1,mutagenic
+105427-04-1,CCOC(=O)CNC(=O)C(C)(C)Br,non-mutagenic
+123-33-1,Oc1ccc(O)nn1,non-mutagenic
+87-59-2,Cc1cccc(N)c1C,mutagenic
+577-71-9,Oc1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-],mutagenic
+529-19-1,Cc1ccccc1C#N,non-mutagenic
+140-67-0,COc1ccc(CC=C)cc1,non-mutagenic
+54083-22-6,COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)\C(=N\NC(=O)c6ccccc6)\C,mutagenic
+3778-76-5,CCOC(=O)NNc1nncc2ccccc12,mutagenic
+91182-09-1,CCCCNC(=O)\C=C\c1oc(cc1)[N+](=O)[O-],mutagenic
+427-51-0,CC(=O)OC1(CCC2C3C=C(Cl)C4=CC(=O)C5CC5C4(C)C3CCC12C)C(=O)C,non-mutagenic
+56-81-5,OCC(O)CO,non-mutagenic
+99803-60-8,COP(=S)(OC)Oc1ccc(N=O)c(C)c1,mutagenic
+128233-25-0,CN1C=CN(COCCC(C)(C)[N+](=O)[O-])C1\C=N\O,non-mutagenic
+86711-50-4,O=C(C1OC1c2ccc(Oc3ccccc3)cc2)c4ccccc4,non-mutagenic
+7203-90-9,CN(C)N=Nc1ccc(Cl)cc1,mutagenic
+112-95-8,CCCCCCCCCCCCCCCCCCCC,non-mutagenic
+118-91-2,OC(=O)c1ccccc1Cl,non-mutagenic
+85815-37-8,CN(C)C(=O)c1nc(CNC(=O)CN)n(n1)c2ccc(Cl)cc2C(=O)c3ccccc3Cl,non-mutagenic
+115091-98-0,CCCC\C=C\C=C\C=C\C=C\C=C\OC,mutagenic
+1912-32-9,CCCCOS(=O)(=O)C,mutagenic
+3807-77-0,[O-][N+](=O)c1ccc2cccc3CCc1c23,mutagenic
+142-04-1,Nc1ccccc1,non-mutagenic
+69658-17-9,Oc1ccc2C(=O)c3cccc4c(O)ccc(c2c1)c34,mutagenic
+84-58-2,ClC1=C(Cl)C(=O)C(=C(C#N)C1=O)C#N,non-mutagenic
+51-79-6,CCOC(=O)N,mutagenic
+17886-25-8,C(N1CCN=N1)c2ccccc2,mutagenic
+131431-60-2,CN1C=CN(CCS(=O)(=O)C)C1\C=N\O,non-mutagenic
+320-67-2,NC1=NC(=O)N(C=N1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O,mutagenic
+3252-43-5,BrC(Br)C#N,mutagenic
+106671-89-0,[O-][N+](=O)c1c(nc2sccn12)c3ccc(Cl)cc3,mutagenic
+51940-44-4,CCN1C=C(C(=O)O)C(=O)c2cnc(nc12)N3CCNCC3,mutagenic
+932-83-2,O=NN1CCCCCC1,mutagenic
+30269-02-4,Nc1ccc2ccc3ccc(c4ccc1c2c34)[N+](=O)[O-],mutagenic
+98-56-6,FC(F)(F)c1ccc(Cl)cc1,non-mutagenic
+78-98-8,CC(=O)C=O,mutagenic
+611-06-3,[O-][N+](=O)c1ccc(Cl)cc1Cl,mutagenic
+3087-16-9,CN(C)c1ccc(cc1)C(=C2C=CC(=[N+](C)C)C=C2)c3c(O)c(cc4cc(ccc34)S(=O)(=O)O)S(=O)(=O)O,non-mutagenic
+134998-78-0,CC(=O)Oc1c(OC(=O)C)c2c(ccc3c4ccccc4c5cccc1c5c23)[N+](=O)[O-],mutagenic
+123-01-3,CCCCCCCCCCCCc1ccccc1,non-mutagenic
+56681-55-1,CCc1cccc(CC)c1N(COC)C(=O)CO,non-mutagenic
+103667-52-3,CC1CC2=C(C3C(C=C(C)C2=O)C(CCC3=C)C(=C)C)C1=O,non-mutagenic
+121-73-3,[O-][N+](=O)c1cccc(Cl)c1,non-mutagenic
+501-30-4,OCC1=CC(=O)C(=CO1)O,mutagenic
+106-48-9,Oc1ccc(Cl)cc1,non-mutagenic
+7570-86-7,O=C([C@H]1O[C@@H]1c2ccccc2)c3ccccc3,mutagenic
+823-86-9,ONc1ccc(Cl)cc1,non-mutagenic
+1982-49-6,C[C@@H]1CCCC[C@H]1NC(=O)Nc2ccccc2,non-mutagenic
+74992-96-4,Clc1cccc2c1oc3ccccc23,non-mutagenic
+20098-48-0,[O-][N+](=O)c1cc(Cl)c(Cl)c(Cl)c1,mutagenic
+363-49-5,CC(=O)Nc1ccc2c(Cc3cc(O)ccc23)c1,mutagenic
+37319-17-8,COC1COC(COCC2COC(OC)C(OS(=O)(=O)O)C2OS(=O)(=O)O)C(OS(=O)(=O)O)C1OS(=O)(=O)O,non-mutagenic
+117333-21-8,OC(Cc1cn(N=O)c2ccccc12)C(=O)O,mutagenic
+10605-21-7,COC(=O)Nc1nc2ccccc2[nH]1,mutagenic
+103393-71-1,ClCc1cccc2c3cccc4cccc(c12)c34,mutagenic
+621-64-7,CCCN(CCC)N=O,mutagenic
diff --git a/lib/download.rb b/lib/download.rb
index 9e30790..2f6b4f1 100644
--- a/lib/download.rb
+++ b/lib/download.rb
@@ -2,6 +2,8 @@ module OpenTox
 
   class Download
 
+    DATA = File.join(File.dirname(__FILE__),"..","data")
+
     def self.pubchem_classification aid: , active: , inactive: , species: , endpoint:, qmrf: nil
       aid_url = File.join PUBCHEM_URI, "assay/aid/#{aid}"
       
@@ -19,9 +21,9 @@ module OpenTox
         start += 10000
       end
       warnings = []
-      name = endpoint+"-"+species
+      name = endpoint.gsub(" ","_")+"-"+species.gsub(" ","_")
       table = [["SID","SMILES",name]]
-      csv.each_slice(100) do |slice| # get SMILES in chunks
+      csv.each_slice(100) do |slice| # get SMILES in chunks, size limit is 100
         cids = slice.collect{|s| s[2]}
         pubchem_cids = []
         JSON.parse(RestClientWrapper.get(File.join(PUBCHEM_URI,"compound/cid/#{cids.join(",")}/property/CanonicalSMILES/JSON")).to_s)["PropertyTable"]["Properties"].each do |prop|
@@ -50,6 +52,82 @@ module OpenTox
       File.open(File.join(File.dirname(__FILE__),"..","data",name+".json"),"w+"){|f| f.puts meta.to_json}
     end
 
-  end
+    def self.mutagenicity
+      # TODO add download/conversion programs to lazar dependencies
+      hansen_url = "http://doc.ml.tu-berlin.de/toxbenchmark/Mutagenicity_N6512.csv"
+      kazius_url = "http://cheminformatics.org/datasets/bursi/cas_4337.zip"
+      efsa_url = "https://data.europa.eu/euodp/data/storage/f/2017-07-19T142131/GENOTOX data and dictionary.xls"
+      
+      parts = File.join(DATA, "parts")
+      FileUtils.mkdir_p parts
+      Dir[File.join(parts,"hansen.*")].each{|f| FileUtils.rm f }
+      Dir[File.join(parts,"cas_4337.*")].each{|f| FileUtils.rm f }
+      Dir[File.join(parts,"efsa.*")].each{|f| FileUtils.rm f }
+      File.open(File.join(parts,"hansen-original.csv"),"w+"){|f| f.puts RestClientWrapper.get(hansen_url).to_s }
+
+      # convert hansen
+      hansen = CSV.read File.join(parts,"hansen-original.csv")
+      hansen.shift
+      map = {"0" => "non-mutagenic","1" => "mutagenic"}
+      File.open(File.join(parts,"hansen.csv"),"w+") do |f|
+        f.puts "ID,SMILES,Mutagenicity"
+        hansen.each do |row|
+          f.puts [row[0],row[5],map[row[2]]].join "," 
+        end
+      end
+      File.open(File.join(parts,"cas_4337.zip"),"w+"){|f| f.puts RestClientWrapper.get(kazius_url).to_s }
+      `cd #{parts} && unzip cas_4337.zip`
+      `cd #{parts} && wget #{URI.escape efsa_url} -O efsa.xls`
+      `cd #{parts} && xls2csv -s cp1252 -d utf-8 -x -c "	" efsa.xls > efsa.tsv`
 
+      # convert EFSA data to mutagenicity classifications
+      i = 0
+      db = {}
+      CSV.foreach(File.join(parts,"efsa.tsv"), :encoding => "UTF-8", :col_sep => "\t", :liberal_parsing => true) do |row|
+        if i > 0 and row[11] and !row[11].empty? and row[24].match(/Salmonella/i) and ( row[25].match("TA 98") or row[25].match("TA 100") ) and row[33]
+          begin
+            c = OpenTox::Compound.from_smiles(row[11].gsub('"','')).smiles
+          rescue
+            c = OpenTox::Compound.from_inchi(row[12]).smiles # some smiles (row[11]) contain non-parseable characters
+          end
+          db[c] ||= {}
+          db[c][:id] ||= row[2]
+          if row[33].match(/Positiv/i)
+            db[c][:value] = "mutagenic" # at least one positive result in TA 98 or TA 100
+          elsif row[33].match(/Negativ/i)
+            db[c][:value] ||= "non-mutagenic"
+          end
+        end
+        i += 1
+      end
+      File.open(File.join(parts,"efsa.csv"),"w+") do |f|
+        f.puts "ID,SMILES,Mutagenicity"
+        db.each do |s,v|
+          f.puts [v[:id],s,v[:value]].join ","
+        end
+      end
+
+      # merge datasets
+      hansen = Dataset.from_csv_file File.join(parts,"hansen.csv")
+      efsa = Dataset.from_csv_file File.join(parts,"efsa.csv")
+      kazius = Dataset.from_sdf_file File.join(parts,"cas_4337.sdf")
+      datasets = [hansen,efsa,kazius]
+      map = {"mutagen" => "mutagenic", "nonmutagen" => "non-mutagenic"}
+      dataset = Dataset.merge datasets: datasets, features: datasets.collect{|d| d.bioactivity_features.first}, value_maps: [nil,nil,map], keep_original_features: false, remove_duplicates: true
+      dataset.merged_features.first.name = "Mutagenicity"
+      File.open(File.join(DATA,"Mutagenicity-Salmonella_typhimurium.csv"),"w+"){|f| f.puts dataset.to_csv}
+      meta = {
+        :species => "Salmonella typhimurium",
+        :endpoint => "Mutagenicity",
+        :source => [kazius_url,hansen_url,efsa_url].join(", "),
+        :qmrf => { "group": "QMRF 4.10. Mutagenicity", "name": "OECD 471 Bacterial Reverse Mutation Test"},
+      }
+      File.open(File.join(File.dirname(__FILE__),"..","data","Mutagenicity-Salmonella_typhimurium.json"),"w+"){|f| f.puts meta.to_json}
+      
+      # cleanup
+      datasets << dataset
+      datasets.each{|d| d.delete }
+    end
+
+  end
 end
diff --git a/test/use_cases.rb b/test/use_cases.rb
index 59677cb..ab01269 100644
--- a/test/use_cases.rb
+++ b/test/use_cases.rb
@@ -50,6 +50,8 @@ class UseCasesTest < MiniTest::Test
   end
 
   def test_public_models
+    Download.mutagenicity
+    exit
     #skip
     # TODO clean mongo
     # PubChem Classification
@@ -71,8 +73,9 @@ class UseCasesTest < MiniTest::Test
         :qmrf => {:group => "QMRF 4.12. Carcinogenicity", :name => "OECD 451 Carcinogenicity Studies"}
       }
     ].each do |assay|
-      Download.pubchem_classification aid: assay[:aid], species: assay[:species], endpoint: assay[:endpoint], active: "carcinogen", inactive: "non-carcinogen", qmrf: qmrf
+      Download.pubchem_classification aid: assay[:aid], species: assay[:species], endpoint: assay[:endpoint], active: "carcinogen", inactive: "non-carcinogen", qmrf: assay[:qmrf]
     end
+    
 
 =begin
     # Mutagenicity